----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 22:11:48]------------------------- 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 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.138647150600034 0.000000000000000 0.000000000000000 b 0.000000000000000 6.098275119999998 0.000000000000000 c -3.049378661090168 0.000000000000000 5.433506774399064 Atomic positions (fractional): *1 Li 0.70783841733608 0.65553088708661 0.93443919062038 6.941 2 Li 0.29216158266392 0.15553088708661 0.56556080937962 6.941 3 Li 0.29216158266392 0.34446911291339 0.06556080937962 6.941 4 Li 0.70783841733608 0.84446911291339 0.43443919062038 6.941 *5 O 0.54629249659876 0.39155685836600 0.73619521412272 15.999 *6 O 0.01217373963693 0.17289219701764 0.84677272850169 15.999 7 O 0.45370750340124 0.89155685836600 0.76380478587728 15.999 8 O 0.45370750340124 0.60844314163400 0.26380478587728 15.999 9 O 0.98782626036307 0.82710780298236 0.15322727149831 15.999 10 O 0.98782626036307 0.67289219701764 0.65322727149831 15.999 11 O 0.01217373963693 0.32710780298236 0.34677272850169 15.999 12 O 0.54629249659876 0.10844314163400 0.23619521412272 15.999 *13 Y 0.76682819872735 0.13087313950370 0.02221376389952 88.906 14 Y 0.76682819872735 0.36912686049630 0.52221376389952 88.906 15 Y 0.23317180127265 0.86912686049630 0.97778623610048 88.906 16 Y 0.23317180127265 0.63087313950370 0.47778623610048 88.906 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.138647150600034 0.000000000000000 0.000000000000000 b 0.000000000000000 6.098275119999998 0.000000000000000 c -3.049378661090168 0.000000000000000 5.433506774399064 Atomic positions (fractional): *1 Li 0.70783841733608 0.65553088708661 0.93443919062038 6.941 > 1 2 Li 0.29216158266392 0.15553088708661 0.56556080937962 6.941 > 2 3 Li 0.29216158266392 0.34446911291339 0.06556080937962 6.941 > 3 4 Li 0.70783841733608 0.84446911291339 0.43443919062038 6.941 > 4 *5 O 0.54629249659876 0.39155685836600 0.73619521412272 15.999 > 5 *6 O 0.01217373963693 0.17289219701764 0.84677272850169 15.999 > 6 7 O 0.45370750340124 0.89155685836600 0.76380478587728 15.999 > 7 8 O 0.45370750340124 0.60844314163400 0.26380478587728 15.999 > 8 9 O 0.98782626036307 0.82710780298236 0.15322727149831 15.999 > 9 10 O 0.98782626036307 0.67289219701764 0.65322727149831 15.999 > 10 11 O 0.01217373963693 0.32710780298236 0.34677272850169 15.999 > 11 12 O 0.54629249659876 0.10844314163400 0.23619521412272 15.999 > 12 *13 Y 0.76682819872735 0.13087313950370 0.02221376389952 88.906 > 13 14 Y 0.76682819872735 0.36912686049630 0.52221376389952 88.906 > 14 15 Y 0.23317180127265 0.86912686049630 0.97778623610048 88.906 > 15 16 Y 0.23317180127265 0.63087313950370 0.47778623610048 88.906 > 16 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.277294301200069 0.000000000000000 0.000000000000000 b 0.000000000000000 12.196550239999995 0.000000000000000 c -6.098757322180336 0.000000000000000 10.867013548798129 Atomic positions (fractional): *1 Li 0.35391920866804 0.32776544354330 0.46721959531019 6.941 > 1 2 Li 0.85391920866804 0.32776544354330 0.46721959531019 6.941 > 1 3 Li 0.35391920866804 0.82776544354330 0.46721959531019 6.941 > 1 4 Li 0.85391920866804 0.82776544354330 0.46721959531019 6.941 > 1 5 Li 0.35391920866804 0.32776544354330 0.96721959531019 6.941 > 1 6 Li 0.85391920866804 0.32776544354330 0.96721959531019 6.941 > 1 7 Li 0.35391920866804 0.82776544354330 0.96721959531019 6.941 > 1 8 Li 0.85391920866804 0.82776544354330 0.96721959531019 6.941 > 1 9 Li 0.14608079133196 0.07776544354330 0.28278040468981 6.941 > 2 10 Li 0.64608079133196 0.07776544354330 0.28278040468981 6.941 > 2 11 Li 0.14608079133196 0.57776544354330 0.28278040468981 6.941 > 2 12 Li 0.64608079133196 0.57776544354330 0.28278040468981 6.941 > 2 13 Li 0.14608079133196 0.07776544354330 0.78278040468981 6.941 > 2 14 Li 0.64608079133196 0.07776544354330 0.78278040468981 6.941 > 2 15 Li 0.14608079133196 0.57776544354330 0.78278040468981 6.941 > 2 16 Li 0.64608079133196 0.57776544354330 0.78278040468981 6.941 > 2 17 Li 0.14608079133196 0.17223455645670 0.03278040468981 6.941 > 3 18 Li 0.64608079133196 0.17223455645670 0.03278040468981 6.941 > 3 19 Li 0.14608079133196 0.67223455645670 0.03278040468981 6.941 > 3 20 Li 0.64608079133196 0.67223455645670 0.03278040468981 6.941 > 3 21 Li 0.14608079133196 0.17223455645670 0.53278040468981 6.941 > 3 22 Li 0.64608079133196 0.17223455645670 0.53278040468981 6.941 > 3 23 Li 0.14608079133196 0.67223455645670 0.53278040468981 6.941 > 3 24 Li 0.64608079133196 0.67223455645670 0.53278040468981 6.941 > 3 25 Li 0.35391920866804 0.42223455645670 0.21721959531019 6.941 > 4 26 Li 0.85391920866804 0.42223455645670 0.21721959531019 6.941 > 4 27 Li 0.35391920866804 0.92223455645670 0.21721959531019 6.941 > 4 28 Li 0.85391920866804 0.92223455645670 0.21721959531019 6.941 > 4 29 Li 0.35391920866804 0.42223455645670 0.71721959531019 6.941 > 4 30 Li 0.85391920866804 0.42223455645670 0.71721959531019 6.941 > 4 31 Li 0.35391920866804 0.92223455645670 0.71721959531019 6.941 > 4 32 Li 0.85391920866804 0.92223455645670 0.71721959531019 6.941 > 4 *33 O 0.27314624829938 0.19577842918300 0.36809760706136 15.999 > 5 34 O 0.77314624829938 0.19577842918300 0.36809760706136 15.999 > 5 35 O 0.27314624829938 0.69577842918300 0.36809760706136 15.999 > 5 36 O 0.77314624829938 0.69577842918300 0.36809760706136 15.999 > 5 37 O 0.27314624829938 0.19577842918300 0.86809760706136 15.999 > 5 38 O 0.77314624829938 0.19577842918300 0.86809760706136 15.999 > 5 39 O 0.27314624829938 0.69577842918300 0.86809760706136 15.999 > 5 40 O 0.77314624829938 0.69577842918300 0.86809760706136 15.999 > 5 *41 O 0.00608686981847 0.08644609850882 0.42338636425084 15.999 > 6 42 O 0.50608686981847 0.08644609850882 0.42338636425084 15.999 > 6 43 O 0.00608686981847 0.58644609850882 0.42338636425084 15.999 > 6 44 O 0.50608686981847 0.58644609850882 0.42338636425084 15.999 > 6 45 O 0.00608686981847 0.08644609850882 0.92338636425084 15.999 > 6 46 O 0.50608686981847 0.08644609850882 0.92338636425084 15.999 > 6 47 O 0.00608686981847 0.58644609850882 0.92338636425084 15.999 > 6 48 O 0.50608686981847 0.58644609850882 0.92338636425084 15.999 > 6 49 O 0.22685375170062 0.44577842918300 0.38190239293864 15.999 > 7 50 O 0.72685375170062 0.44577842918300 0.38190239293864 15.999 > 7 51 O 0.22685375170062 0.94577842918300 0.38190239293864 15.999 > 7 52 O 0.72685375170062 0.94577842918300 0.38190239293864 15.999 > 7 53 O 0.22685375170062 0.44577842918300 0.88190239293864 15.999 > 7 54 O 0.72685375170062 0.44577842918300 0.88190239293864 15.999 > 7 55 O 0.22685375170062 0.94577842918300 0.88190239293864 15.999 > 7 56 O 0.72685375170062 0.94577842918300 0.88190239293864 15.999 > 7 57 O 0.22685375170062 0.30422157081700 0.13190239293864 15.999 > 8 58 O 0.72685375170062 0.30422157081700 0.13190239293864 15.999 > 8 59 O 0.22685375170062 0.80422157081700 0.13190239293864 15.999 > 8 60 O 0.72685375170062 0.80422157081700 0.13190239293864 15.999 > 8 61 O 0.22685375170062 0.30422157081700 0.63190239293864 15.999 > 8 62 O 0.72685375170062 0.30422157081700 0.63190239293864 15.999 > 8 63 O 0.22685375170062 0.80422157081700 0.63190239293864 15.999 > 8 64 O 0.72685375170062 0.80422157081700 0.63190239293864 15.999 > 8 65 O 0.49391313018153 0.41355390149118 0.07661363574916 15.999 > 9 66 O 0.99391313018153 0.41355390149118 0.07661363574916 15.999 > 9 67 O 0.49391313018153 0.91355390149118 0.07661363574916 15.999 > 9 68 O 0.99391313018153 0.91355390149118 0.07661363574916 15.999 > 9 69 O 0.49391313018153 0.41355390149118 0.57661363574916 15.999 > 9 70 O 0.99391313018153 0.41355390149118 0.57661363574916 15.999 > 9 71 O 0.49391313018153 0.91355390149118 0.57661363574916 15.999 > 9 72 O 0.99391313018153 0.91355390149118 0.57661363574916 15.999 > 9 73 O 0.49391313018153 0.33644609850882 0.32661363574916 15.999 > 10 74 O 0.99391313018153 0.33644609850882 0.32661363574916 15.999 > 10 75 O 0.49391313018153 0.83644609850882 0.32661363574916 15.999 > 10 76 O 0.99391313018153 0.83644609850882 0.32661363574916 15.999 > 10 77 O 0.49391313018153 0.33644609850882 0.82661363574916 15.999 > 10 78 O 0.99391313018153 0.33644609850882 0.82661363574916 15.999 > 10 79 O 0.49391313018153 0.83644609850882 0.82661363574916 15.999 > 10 80 O 0.99391313018153 0.83644609850882 0.82661363574916 15.999 > 10 81 O 0.00608686981847 0.16355390149118 0.17338636425084 15.999 > 11 82 O 0.50608686981847 0.16355390149118 0.17338636425084 15.999 > 11 83 O 0.00608686981847 0.66355390149118 0.17338636425084 15.999 > 11 84 O 0.50608686981847 0.66355390149118 0.17338636425084 15.999 > 11 85 O 0.00608686981847 0.16355390149118 0.67338636425084 15.999 > 11 86 O 0.50608686981847 0.16355390149118 0.67338636425084 15.999 > 11 87 O 0.00608686981847 0.66355390149118 0.67338636425084 15.999 > 11 88 O 0.50608686981847 0.66355390149118 0.67338636425084 15.999 > 11 89 O 0.27314624829938 0.05422157081700 0.11809760706136 15.999 > 12 90 O 0.77314624829938 0.05422157081700 0.11809760706136 15.999 > 12 91 O 0.27314624829938 0.55422157081700 0.11809760706136 15.999 > 12 92 O 0.77314624829938 0.55422157081700 0.11809760706136 15.999 > 12 93 O 0.27314624829938 0.05422157081700 0.61809760706136 15.999 > 12 94 O 0.77314624829938 0.05422157081700 0.61809760706136 15.999 > 12 95 O 0.27314624829938 0.55422157081700 0.61809760706136 15.999 > 12 96 O 0.77314624829938 0.55422157081700 0.61809760706136 15.999 > 12 *97 Y 0.38341409936368 0.06543656975185 0.01110688194976 88.906 > 13 98 Y 0.88341409936368 0.06543656975185 0.01110688194976 88.906 > 13 99 Y 0.38341409936368 0.56543656975185 0.01110688194976 88.906 > 13 100 Y 0.88341409936368 0.56543656975185 0.01110688194976 88.906 > 13 101 Y 0.38341409936368 0.06543656975185 0.51110688194976 88.906 > 13 102 Y 0.88341409936368 0.06543656975185 0.51110688194976 88.906 > 13 103 Y 0.38341409936368 0.56543656975185 0.51110688194976 88.906 > 13 104 Y 0.88341409936368 0.56543656975185 0.51110688194976 88.906 > 13 105 Y 0.38341409936368 0.18456343024815 0.26110688194976 88.906 > 14 106 Y 0.88341409936368 0.18456343024815 0.26110688194976 88.906 > 14 107 Y 0.38341409936368 0.68456343024815 0.26110688194976 88.906 > 14 108 Y 0.88341409936368 0.68456343024815 0.26110688194976 88.906 > 14 109 Y 0.38341409936368 0.18456343024815 0.76110688194976 88.906 > 14 110 Y 0.88341409936368 0.18456343024815 0.76110688194976 88.906 > 14 111 Y 0.38341409936368 0.68456343024815 0.76110688194976 88.906 > 14 112 Y 0.88341409936368 0.68456343024815 0.76110688194976 88.906 > 14 113 Y 0.11658590063632 0.43456343024815 0.48889311805024 88.906 > 15 114 Y 0.61658590063632 0.43456343024815 0.48889311805024 88.906 > 15 115 Y 0.11658590063632 0.93456343024815 0.48889311805024 88.906 > 15 116 Y 0.61658590063632 0.93456343024815 0.48889311805024 88.906 > 15 117 Y 0.11658590063632 0.43456343024815 0.98889311805024 88.906 > 15 118 Y 0.61658590063632 0.43456343024815 0.98889311805024 88.906 > 15 119 Y 0.11658590063632 0.93456343024815 0.98889311805024 88.906 > 15 120 Y 0.61658590063632 0.93456343024815 0.98889311805024 88.906 > 15 121 Y 0.11658590063632 0.31543656975185 0.23889311805024 88.906 > 16 122 Y 0.61658590063632 0.31543656975185 0.23889311805024 88.906 > 16 123 Y 0.11658590063632 0.81543656975185 0.23889311805024 88.906 > 16 124 Y 0.61658590063632 0.81543656975185 0.23889311805024 88.906 > 16 125 Y 0.11658590063632 0.31543656975185 0.73889311805024 88.906 > 16 126 Y 0.61658590063632 0.31543656975185 0.73889311805024 88.906 > 16 127 Y 0.11658590063632 0.81543656975185 0.73889311805024 88.906 > 16 128 Y 0.61658590063632 0.81543656975185 0.73889311805024 88.906 > 16 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.7928630 0.0000000 -0.0442818 0.0000000 3.7145177 0.0000000 -0.0442819 0.0000000 3.7800327 -------------------------- Born effective charges -------------------------- 1 Li 1.0096383 -0.0156860 0.0369674 -0.0064775 1.0313928 0.0736982 0.0371124 0.0605012 0.9988487 2 Li 1.0096383 0.0156860 0.0369674 0.0064775 1.0313928 -0.0736982 0.0371124 -0.0605012 0.9988487 3 Li 1.0096383 -0.0156860 0.0369674 -0.0064775 1.0313928 0.0736982 0.0371124 0.0605012 0.9988487 4 Li 1.0096383 0.0156860 0.0369674 0.0064775 1.0313928 -0.0736982 0.0371124 -0.0605012 0.9988487 5 O -2.2643293 0.3511926 -0.0798064 0.3577757 -2.2627649 0.7158637 -0.0713226 0.6455369 -2.3426648 6 O -2.3418236 0.4009646 -0.0297166 0.4035131 -2.3914822 0.7339874 -0.0143106 0.8311706 -2.3121911 7 O -2.2643293 -0.3511926 -0.0798064 -0.3577757 -2.2627649 -0.7158637 -0.0713226 -0.6455369 -2.3426648 8 O -2.2643293 0.3511926 -0.0798064 0.3577757 -2.2627649 0.7158637 -0.0713226 0.6455369 -2.3426648 9 O -2.3418236 0.4009646 -0.0297166 0.4035131 -2.3914822 0.7339874 -0.0143106 0.8311706 -2.3121911 10 O -2.3418236 -0.4009646 -0.0297166 -0.4035131 -2.3914822 -0.7339874 -0.0143106 -0.8311706 -2.3121911 11 O -2.3418236 -0.4009646 -0.0297166 -0.4035131 -2.3914822 -0.7339874 -0.0143106 -0.8311706 -2.3121911 12 O -2.2643293 -0.3511926 -0.0798064 -0.3577757 -2.2627649 -0.7158637 -0.0713226 -0.6455369 -2.3426648 13 Y 3.5965147 -0.0569568 0.0725556 0.0201096 3.6228543 0.1742619 0.0485208 -0.1114085 3.6560072 14 Y 3.5965147 0.0569568 0.0725556 -0.0201096 3.6228543 -0.1742619 0.0485208 0.1114085 3.6560072 15 Y 3.5965147 -0.0569568 0.0725556 0.0201096 3.6228543 0.1742619 0.0485208 -0.1114085 3.6560072 16 Y 3.5965147 0.0569568 0.0725556 -0.0201096 3.6228543 -0.1742619 0.0485208 0.1114085 3.6560072 ---------------------------------------------------------------------------- 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: 384/384 Permutation basis: 9696/9696 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2400 Number of blocks in projector: 2400 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: 512 Use submatrix version of eigh solver. (1) Block: 512 / 512 (2) Block: 250 / 512 (2) 242 eigenvectors found. (2) Block: 512 / 512 (2) 255 eigenvectors found. (2) Complementary block size: 15 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 504 eigenvectors found. (1) Complementary block size: 8 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 512 Use submatrix version of eigh solver. (1) Block: 512 / 512 (2) Block: 250 / 512 (2) 243 eigenvectors found. (2) Block: 512 / 512 (2) 257 eigenvectors found. (2) Complementary block size: 12 (2) Compute compressed projector. (2) Use standard solver. (2) 5 eigenvectors found. (1) 505 eigenvectors found. (1) Complementary block size: 6 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 512 Use submatrix version of eigh solver. (1) Block: 512 / 512 (2) Block: 250 / 512 (2) 242 eigenvectors found. (2) Block: 512 / 512 (2) 255 eigenvectors found. (2) Complementary block size: 15 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 504 eigenvectors found. (1) Complementary block size: 8 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 288 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 288 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 288 Use standard eigh solver. Tree of FC basis block matrices: - (2400, 2365), data: False |-- (288, 284), data: True |-- (288, 284), data: True |-- (288, 284), data: True |-- (512, 504), data: False |-- (512, 504), data: False |-- (512, 7), data: (512, 15) @ (15, 7) |-- (262, 255), data: True |-- (250, 242), data: True |-- (512, 505), data: False |-- (512, 505), data: False |-- (512, 5), data: (512, 12) @ (12, 5) |-- (262, 257), data: True |-- (250, 243), data: True |-- (512, 504), data: False |-- (512, 504), data: False |-- (512, 7), data: (512, 15) @ (15, 7) |-- (262, 255), data: True |-- (250, 242), data: True ----- Solver_atoms: 1 -- 128 / 128 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 480 - Time: 0.936 Solver_block: 200 / 480 - Time: 0.851 Solver_block: 300 / 480 - Time: 0.857 Solver_block: 400 / 480 - Time: 0.743 Solver_block: 480 / 480 - Time: 0.679 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 4.421 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 384/384 Permutation basis: 9696/9696 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2400 Number of blocks in projector: 2400 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: 512 Use submatrix version of eigh solver. (1) Block: 512 / 512 (2) Block: 250 / 512 (2) 242 eigenvectors found. (2) Block: 512 / 512 (2) 255 eigenvectors found. (2) Complementary block size: 15 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 504 eigenvectors found. (1) Complementary block size: 8 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 512 Use submatrix version of eigh solver. (1) Block: 512 / 512 (2) Block: 250 / 512 (2) 243 eigenvectors found. (2) Block: 512 / 512 (2) 257 eigenvectors found. (2) Complementary block size: 12 (2) Compute compressed projector. (2) Use standard solver. (2) 5 eigenvectors found. (1) 505 eigenvectors found. (1) Complementary block size: 6 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 512 Use submatrix version of eigh solver. (1) Block: 512 / 512 (2) Block: 250 / 512 (2) 242 eigenvectors found. (2) Block: 512 / 512 (2) 255 eigenvectors found. (2) Complementary block size: 15 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 504 eigenvectors found. (1) Complementary block size: 8 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 288 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 288 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 288 Use standard eigh solver. Tree of FC basis block matrices: - (2400, 2365), data: False |-- (288, 284), data: True |-- (288, 284), data: True |-- (288, 284), data: True |-- (512, 504), data: False |-- (512, 504), data: False |-- (512, 7), data: (512, 15) @ (15, 7) |-- (262, 255), data: True |-- (250, 242), data: True |-- (512, 505), data: False |-- (512, 505), data: False |-- (512, 5), data: (512, 12) @ (12, 5) |-- (262, 257), data: True |-- (250, 243), data: True |-- (512, 504), data: False |-- (512, 504), data: False |-- (512, 7), data: (512, 15) @ (15, 7) |-- (262, 255), data: True |-- (250, 242), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-07 22:12:24]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 22:12:25]------------------------- 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 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.138647150600034 0.000000000000000 0.000000000000000 b 0.000000000000000 6.098275119999998 0.000000000000000 c -3.049378661090168 0.000000000000000 5.433506774399064 Atomic positions (fractional): 1 Li 0.70783841733608 0.65553088708661 0.93443919062038 6.941 2 Li 0.29216158266392 0.15553088708661 0.56556080937962 6.941 3 Li 0.29216158266392 0.34446911291339 0.06556080937962 6.941 4 Li 0.70783841733608 0.84446911291339 0.43443919062038 6.941 5 O 0.54629249659876 0.39155685836600 0.73619521412272 15.999 6 O 0.01217373963693 0.17289219701764 0.84677272850169 15.999 7 O 0.45370750340124 0.89155685836600 0.76380478587728 15.999 8 O 0.45370750340124 0.60844314163400 0.26380478587728 15.999 9 O 0.98782626036307 0.82710780298236 0.15322727149831 15.999 10 O 0.98782626036307 0.67289219701764 0.65322727149831 15.999 11 O 0.01217373963693 0.32710780298236 0.34677272850169 15.999 12 O 0.54629249659876 0.10844314163400 0.23619521412272 15.999 13 Y 0.76682819872735 0.13087313950370 0.02221376389952 88.906 14 Y 0.76682819872735 0.36912686049630 0.52221376389952 88.906 15 Y 0.23317180127265 0.86912686049630 0.97778623610048 88.906 16 Y 0.23317180127265 0.63087313950370 0.47778623610048 88.906 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.277294301200069 0.000000000000000 0.000000000000000 b 0.000000000000000 12.196550239999995 0.000000000000000 c -6.098757322180336 0.000000000000000 10.867013548798129 Atomic positions (fractional): 1 Li 0.35391920866804 0.32776544354330 0.46721959531019 6.941 > 1 2 Li 0.85391920866804 0.32776544354330 0.46721959531019 6.941 > 1 3 Li 0.35391920866804 0.82776544354330 0.46721959531019 6.941 > 1 4 Li 0.85391920866804 0.82776544354330 0.46721959531019 6.941 > 1 5 Li 0.35391920866804 0.32776544354330 0.96721959531019 6.941 > 1 6 Li 0.85391920866804 0.32776544354330 0.96721959531019 6.941 > 1 7 Li 0.35391920866804 0.82776544354330 0.96721959531019 6.941 > 1 8 Li 0.85391920866804 0.82776544354330 0.96721959531019 6.941 > 1 9 Li 0.14608079133196 0.07776544354330 0.28278040468981 6.941 > 9 10 Li 0.64608079133196 0.07776544354330 0.28278040468981 6.941 > 9 11 Li 0.14608079133196 0.57776544354330 0.28278040468981 6.941 > 9 12 Li 0.64608079133196 0.57776544354330 0.28278040468981 6.941 > 9 13 Li 0.14608079133196 0.07776544354330 0.78278040468981 6.941 > 9 14 Li 0.64608079133196 0.07776544354330 0.78278040468981 6.941 > 9 15 Li 0.14608079133196 0.57776544354330 0.78278040468981 6.941 > 9 16 Li 0.64608079133196 0.57776544354330 0.78278040468981 6.941 > 9 17 Li 0.14608079133196 0.17223455645670 0.03278040468981 6.941 > 17 18 Li 0.64608079133196 0.17223455645670 0.03278040468981 6.941 > 17 19 Li 0.14608079133196 0.67223455645670 0.03278040468981 6.941 > 17 20 Li 0.64608079133196 0.67223455645670 0.03278040468981 6.941 > 17 21 Li 0.14608079133196 0.17223455645670 0.53278040468981 6.941 > 17 22 Li 0.64608079133196 0.17223455645670 0.53278040468981 6.941 > 17 23 Li 0.14608079133196 0.67223455645670 0.53278040468981 6.941 > 17 24 Li 0.64608079133196 0.67223455645670 0.53278040468981 6.941 > 17 25 Li 0.35391920866804 0.42223455645670 0.21721959531019 6.941 > 25 26 Li 0.85391920866804 0.42223455645670 0.21721959531019 6.941 > 25 27 Li 0.35391920866804 0.92223455645670 0.21721959531019 6.941 > 25 28 Li 0.85391920866804 0.92223455645670 0.21721959531019 6.941 > 25 29 Li 0.35391920866804 0.42223455645670 0.71721959531019 6.941 > 25 30 Li 0.85391920866804 0.42223455645670 0.71721959531019 6.941 > 25 31 Li 0.35391920866804 0.92223455645670 0.71721959531019 6.941 > 25 32 Li 0.85391920866804 0.92223455645670 0.71721959531019 6.941 > 25 33 O 0.27314624829938 0.19577842918300 0.36809760706136 15.999 > 33 34 O 0.77314624829938 0.19577842918300 0.36809760706136 15.999 > 33 35 O 0.27314624829938 0.69577842918300 0.36809760706136 15.999 > 33 36 O 0.77314624829938 0.69577842918300 0.36809760706136 15.999 > 33 37 O 0.27314624829938 0.19577842918300 0.86809760706136 15.999 > 33 38 O 0.77314624829938 0.19577842918300 0.86809760706136 15.999 > 33 39 O 0.27314624829938 0.69577842918300 0.86809760706136 15.999 > 33 40 O 0.77314624829938 0.69577842918300 0.86809760706136 15.999 > 33 41 O 0.00608686981847 0.08644609850882 0.42338636425084 15.999 > 41 42 O 0.50608686981847 0.08644609850882 0.42338636425084 15.999 > 41 43 O 0.00608686981847 0.58644609850882 0.42338636425084 15.999 > 41 44 O 0.50608686981847 0.58644609850882 0.42338636425084 15.999 > 41 45 O 0.00608686981847 0.08644609850882 0.92338636425084 15.999 > 41 46 O 0.50608686981847 0.08644609850882 0.92338636425084 15.999 > 41 47 O 0.00608686981847 0.58644609850882 0.92338636425084 15.999 > 41 48 O 0.50608686981847 0.58644609850882 0.92338636425084 15.999 > 41 49 O 0.22685375170062 0.44577842918300 0.38190239293864 15.999 > 49 50 O 0.72685375170062 0.44577842918300 0.38190239293864 15.999 > 49 51 O 0.22685375170062 0.94577842918300 0.38190239293864 15.999 > 49 52 O 0.72685375170062 0.94577842918300 0.38190239293864 15.999 > 49 53 O 0.22685375170062 0.44577842918300 0.88190239293864 15.999 > 49 54 O 0.72685375170062 0.44577842918300 0.88190239293864 15.999 > 49 55 O 0.22685375170062 0.94577842918300 0.88190239293864 15.999 > 49 56 O 0.72685375170062 0.94577842918300 0.88190239293864 15.999 > 49 57 O 0.22685375170062 0.30422157081700 0.13190239293864 15.999 > 57 58 O 0.72685375170062 0.30422157081700 0.13190239293864 15.999 > 57 59 O 0.22685375170062 0.80422157081700 0.13190239293864 15.999 > 57 60 O 0.72685375170062 0.80422157081700 0.13190239293864 15.999 > 57 61 O 0.22685375170062 0.30422157081700 0.63190239293864 15.999 > 57 62 O 0.72685375170062 0.30422157081700 0.63190239293864 15.999 > 57 63 O 0.22685375170062 0.80422157081700 0.63190239293864 15.999 > 57 64 O 0.72685375170062 0.80422157081700 0.63190239293864 15.999 > 57 65 O 0.49391313018153 0.41355390149118 0.07661363574916 15.999 > 65 66 O 0.99391313018153 0.41355390149118 0.07661363574916 15.999 > 65 67 O 0.49391313018153 0.91355390149118 0.07661363574916 15.999 > 65 68 O 0.99391313018153 0.91355390149118 0.07661363574916 15.999 > 65 69 O 0.49391313018153 0.41355390149118 0.57661363574916 15.999 > 65 70 O 0.99391313018153 0.41355390149118 0.57661363574916 15.999 > 65 71 O 0.49391313018153 0.91355390149118 0.57661363574916 15.999 > 65 72 O 0.99391313018153 0.91355390149118 0.57661363574916 15.999 > 65 73 O 0.49391313018153 0.33644609850882 0.32661363574916 15.999 > 73 74 O 0.99391313018153 0.33644609850882 0.32661363574916 15.999 > 73 75 O 0.49391313018153 0.83644609850882 0.32661363574916 15.999 > 73 76 O 0.99391313018153 0.83644609850882 0.32661363574916 15.999 > 73 77 O 0.49391313018153 0.33644609850882 0.82661363574916 15.999 > 73 78 O 0.99391313018153 0.33644609850882 0.82661363574916 15.999 > 73 79 O 0.49391313018153 0.83644609850882 0.82661363574916 15.999 > 73 80 O 0.99391313018153 0.83644609850882 0.82661363574916 15.999 > 73 81 O 0.00608686981847 0.16355390149118 0.17338636425084 15.999 > 81 82 O 0.50608686981847 0.16355390149118 0.17338636425084 15.999 > 81 83 O 0.00608686981847 0.66355390149118 0.17338636425084 15.999 > 81 84 O 0.50608686981847 0.66355390149118 0.17338636425084 15.999 > 81 85 O 0.00608686981847 0.16355390149118 0.67338636425084 15.999 > 81 86 O 0.50608686981847 0.16355390149118 0.67338636425084 15.999 > 81 87 O 0.00608686981847 0.66355390149118 0.67338636425084 15.999 > 81 88 O 0.50608686981847 0.66355390149118 0.67338636425084 15.999 > 81 89 O 0.27314624829938 0.05422157081700 0.11809760706136 15.999 > 89 90 O 0.77314624829938 0.05422157081700 0.11809760706136 15.999 > 89 91 O 0.27314624829938 0.55422157081700 0.11809760706136 15.999 > 89 92 O 0.77314624829938 0.55422157081700 0.11809760706136 15.999 > 89 93 O 0.27314624829938 0.05422157081700 0.61809760706136 15.999 > 89 94 O 0.77314624829938 0.05422157081700 0.61809760706136 15.999 > 89 95 O 0.27314624829938 0.55422157081700 0.61809760706136 15.999 > 89 96 O 0.77314624829938 0.55422157081700 0.61809760706136 15.999 > 89 97 Y 0.38341409936368 0.06543656975185 0.01110688194976 88.906 > 97 98 Y 0.88341409936368 0.06543656975185 0.01110688194976 88.906 > 97 99 Y 0.38341409936368 0.56543656975185 0.01110688194976 88.906 > 97 100 Y 0.88341409936368 0.56543656975185 0.01110688194976 88.906 > 97 101 Y 0.38341409936368 0.06543656975185 0.51110688194976 88.906 > 97 102 Y 0.88341409936368 0.06543656975185 0.51110688194976 88.906 > 97 103 Y 0.38341409936368 0.56543656975185 0.51110688194976 88.906 > 97 104 Y 0.88341409936368 0.56543656975185 0.51110688194976 88.906 > 97 105 Y 0.38341409936368 0.18456343024815 0.26110688194976 88.906 > 105 106 Y 0.88341409936368 0.18456343024815 0.26110688194976 88.906 > 105 107 Y 0.38341409936368 0.68456343024815 0.26110688194976 88.906 > 105 108 Y 0.88341409936368 0.68456343024815 0.26110688194976 88.906 > 105 109 Y 0.38341409936368 0.18456343024815 0.76110688194976 88.906 > 105 110 Y 0.88341409936368 0.18456343024815 0.76110688194976 88.906 > 105 111 Y 0.38341409936368 0.68456343024815 0.76110688194976 88.906 > 105 112 Y 0.88341409936368 0.68456343024815 0.76110688194976 88.906 > 105 113 Y 0.11658590063632 0.43456343024815 0.48889311805024 88.906 > 113 114 Y 0.61658590063632 0.43456343024815 0.48889311805024 88.906 > 113 115 Y 0.11658590063632 0.93456343024815 0.48889311805024 88.906 > 113 116 Y 0.61658590063632 0.93456343024815 0.48889311805024 88.906 > 113 117 Y 0.11658590063632 0.43456343024815 0.98889311805024 88.906 > 113 118 Y 0.61658590063632 0.43456343024815 0.98889311805024 88.906 > 113 119 Y 0.11658590063632 0.93456343024815 0.98889311805024 88.906 > 113 120 Y 0.61658590063632 0.93456343024815 0.98889311805024 88.906 > 113 121 Y 0.11658590063632 0.31543656975185 0.23889311805024 88.906 > 121 122 Y 0.61658590063632 0.31543656975185 0.23889311805024 88.906 > 121 123 Y 0.11658590063632 0.81543656975185 0.23889311805024 88.906 > 121 124 Y 0.61658590063632 0.81543656975185 0.23889311805024 88.906 > 121 125 Y 0.11658590063632 0.31543656975185 0.73889311805024 88.906 > 121 126 Y 0.61658590063632 0.31543656975185 0.73889311805024 88.906 > 121 127 Y 0.11658590063632 0.81543656975185 0.73889311805024 88.906 > 121 128 Y 0.61658590063632 0.81543656975185 0.73889311805024 88.906 > 121 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.7928630 0.0000000 -0.0442818 0.0000000 3.7145177 0.0000000 -0.0442819 0.0000000 3.7800327 -------------------------- Born effective charges -------------------------- 1 Li 1.0096383 -0.0156860 0.0369674 -0.0064775 1.0313928 0.0736982 0.0371124 0.0605012 0.9988487 2 Li 1.0096383 0.0156860 0.0369674 0.0064775 1.0313928 -0.0736982 0.0371124 -0.0605012 0.9988487 3 Li 1.0096383 -0.0156860 0.0369674 -0.0064775 1.0313928 0.0736982 0.0371124 0.0605012 0.9988487 4 Li 1.0096383 0.0156860 0.0369674 0.0064775 1.0313928 -0.0736982 0.0371124 -0.0605012 0.9988487 5 O -2.2643293 0.3511926 -0.0798064 0.3577757 -2.2627649 0.7158637 -0.0713226 0.6455369 -2.3426648 6 O -2.3418236 0.4009646 -0.0297166 0.4035131 -2.3914822 0.7339874 -0.0143106 0.8311706 -2.3121911 7 O -2.2643293 -0.3511926 -0.0798064 -0.3577757 -2.2627649 -0.7158637 -0.0713226 -0.6455369 -2.3426648 8 O -2.2643293 0.3511926 -0.0798064 0.3577757 -2.2627649 0.7158637 -0.0713226 0.6455369 -2.3426648 9 O -2.3418236 0.4009646 -0.0297166 0.4035131 -2.3914822 0.7339874 -0.0143106 0.8311706 -2.3121911 10 O -2.3418236 -0.4009646 -0.0297166 -0.4035131 -2.3914822 -0.7339874 -0.0143106 -0.8311706 -2.3121911 11 O -2.3418236 -0.4009646 -0.0297166 -0.4035131 -2.3914822 -0.7339874 -0.0143106 -0.8311706 -2.3121911 12 O -2.2643293 -0.3511926 -0.0798064 -0.3577757 -2.2627649 -0.7158637 -0.0713226 -0.6455369 -2.3426648 13 Y 3.5965147 -0.0569568 0.0725556 0.0201096 3.6228543 0.1742619 0.0485208 -0.1114085 3.6560072 14 Y 3.5965147 0.0569568 0.0725556 -0.0201096 3.6228543 -0.1742619 0.0485208 0.1114085 3.6560072 15 Y 3.5965147 -0.0569568 0.0725556 0.0201096 3.6228543 0.1742619 0.0485208 -0.1114085 3.6560072 16 Y 3.5965147 0.0569568 0.0725556 -0.0201096 3.6228543 -0.1742619 0.0485208 0.1114085 3.6560072 ---------------------------------------------------------------------------- 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] [-0.0049 0.0000 0.0087] [ 0.0049 0.0000 -0.0087] 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] [-0.0049 0.0000 0.0087] [ 0.0049 0.0000 -0.0087] 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] [-0.0049 0.0000 0.0087] [ 0.0049 0.0000 -0.0087] Computing fc3[ 97, 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] [-0.0049 0.0000 0.0087] [ 0.0049 0.0000 -0.0087] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000003 (zxz) 0.00000003 (zxz) 0.00000003 (zzx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000004 (xy) 0.00000004 (xy) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 22:12:49]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 22:12:50]------------------------- 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 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.138647150600034 0.000000000000000 0.000000000000000 b 0.000000000000000 6.098275119999998 0.000000000000000 c -3.049378661090168 0.000000000000000 5.433506774399064 Atomic positions (fractional): 1 Li 0.70783841733608 0.65553088708661 0.93443919062038 6.941 2 Li 0.29216158266392 0.15553088708661 0.56556080937962 6.941 3 Li 0.29216158266392 0.34446911291339 0.06556080937962 6.941 4 Li 0.70783841733608 0.84446911291339 0.43443919062038 6.941 5 O 0.54629249659876 0.39155685836600 0.73619521412272 15.999 6 O 0.01217373963693 0.17289219701764 0.84677272850169 15.999 7 O 0.45370750340124 0.89155685836600 0.76380478587728 15.999 8 O 0.45370750340124 0.60844314163400 0.26380478587728 15.999 9 O 0.98782626036307 0.82710780298236 0.15322727149831 15.999 10 O 0.98782626036307 0.67289219701764 0.65322727149831 15.999 11 O 0.01217373963693 0.32710780298236 0.34677272850169 15.999 12 O 0.54629249659876 0.10844314163400 0.23619521412272 15.999 13 Y 0.76682819872735 0.13087313950370 0.02221376389952 88.906 14 Y 0.76682819872735 0.36912686049630 0.52221376389952 88.906 15 Y 0.23317180127265 0.86912686049630 0.97778623610048 88.906 16 Y 0.23317180127265 0.63087313950370 0.47778623610048 88.906 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.277294301200069 0.000000000000000 0.000000000000000 b 0.000000000000000 12.196550239999995 0.000000000000000 c -6.098757322180336 0.000000000000000 10.867013548798129 Atomic positions (fractional): 1 Li 0.35391920866804 0.32776544354330 0.46721959531019 6.941 > 1 2 Li 0.85391920866804 0.32776544354330 0.46721959531019 6.941 > 1 3 Li 0.35391920866804 0.82776544354330 0.46721959531019 6.941 > 1 4 Li 0.85391920866804 0.82776544354330 0.46721959531019 6.941 > 1 5 Li 0.35391920866804 0.32776544354330 0.96721959531019 6.941 > 1 6 Li 0.85391920866804 0.32776544354330 0.96721959531019 6.941 > 1 7 Li 0.35391920866804 0.82776544354330 0.96721959531019 6.941 > 1 8 Li 0.85391920866804 0.82776544354330 0.96721959531019 6.941 > 1 9 Li 0.14608079133196 0.07776544354330 0.28278040468981 6.941 > 9 10 Li 0.64608079133196 0.07776544354330 0.28278040468981 6.941 > 9 11 Li 0.14608079133196 0.57776544354330 0.28278040468981 6.941 > 9 12 Li 0.64608079133196 0.57776544354330 0.28278040468981 6.941 > 9 13 Li 0.14608079133196 0.07776544354330 0.78278040468981 6.941 > 9 14 Li 0.64608079133196 0.07776544354330 0.78278040468981 6.941 > 9 15 Li 0.14608079133196 0.57776544354330 0.78278040468981 6.941 > 9 16 Li 0.64608079133196 0.57776544354330 0.78278040468981 6.941 > 9 17 Li 0.14608079133196 0.17223455645670 0.03278040468981 6.941 > 17 18 Li 0.64608079133196 0.17223455645670 0.03278040468981 6.941 > 17 19 Li 0.14608079133196 0.67223455645670 0.03278040468981 6.941 > 17 20 Li 0.64608079133196 0.67223455645670 0.03278040468981 6.941 > 17 21 Li 0.14608079133196 0.17223455645670 0.53278040468981 6.941 > 17 22 Li 0.64608079133196 0.17223455645670 0.53278040468981 6.941 > 17 23 Li 0.14608079133196 0.67223455645670 0.53278040468981 6.941 > 17 24 Li 0.64608079133196 0.67223455645670 0.53278040468981 6.941 > 17 25 Li 0.35391920866804 0.42223455645670 0.21721959531019 6.941 > 25 26 Li 0.85391920866804 0.42223455645670 0.21721959531019 6.941 > 25 27 Li 0.35391920866804 0.92223455645670 0.21721959531019 6.941 > 25 28 Li 0.85391920866804 0.92223455645670 0.21721959531019 6.941 > 25 29 Li 0.35391920866804 0.42223455645670 0.71721959531019 6.941 > 25 30 Li 0.85391920866804 0.42223455645670 0.71721959531019 6.941 > 25 31 Li 0.35391920866804 0.92223455645670 0.71721959531019 6.941 > 25 32 Li 0.85391920866804 0.92223455645670 0.71721959531019 6.941 > 25 33 O 0.27314624829938 0.19577842918300 0.36809760706136 15.999 > 33 34 O 0.77314624829938 0.19577842918300 0.36809760706136 15.999 > 33 35 O 0.27314624829938 0.69577842918300 0.36809760706136 15.999 > 33 36 O 0.77314624829938 0.69577842918300 0.36809760706136 15.999 > 33 37 O 0.27314624829938 0.19577842918300 0.86809760706136 15.999 > 33 38 O 0.77314624829938 0.19577842918300 0.86809760706136 15.999 > 33 39 O 0.27314624829938 0.69577842918300 0.86809760706136 15.999 > 33 40 O 0.77314624829938 0.69577842918300 0.86809760706136 15.999 > 33 41 O 0.00608686981847 0.08644609850882 0.42338636425084 15.999 > 41 42 O 0.50608686981847 0.08644609850882 0.42338636425084 15.999 > 41 43 O 0.00608686981847 0.58644609850882 0.42338636425084 15.999 > 41 44 O 0.50608686981847 0.58644609850882 0.42338636425084 15.999 > 41 45 O 0.00608686981847 0.08644609850882 0.92338636425084 15.999 > 41 46 O 0.50608686981847 0.08644609850882 0.92338636425084 15.999 > 41 47 O 0.00608686981847 0.58644609850882 0.92338636425084 15.999 > 41 48 O 0.50608686981847 0.58644609850882 0.92338636425084 15.999 > 41 49 O 0.22685375170062 0.44577842918300 0.38190239293864 15.999 > 49 50 O 0.72685375170062 0.44577842918300 0.38190239293864 15.999 > 49 51 O 0.22685375170062 0.94577842918300 0.38190239293864 15.999 > 49 52 O 0.72685375170062 0.94577842918300 0.38190239293864 15.999 > 49 53 O 0.22685375170062 0.44577842918300 0.88190239293864 15.999 > 49 54 O 0.72685375170062 0.44577842918300 0.88190239293864 15.999 > 49 55 O 0.22685375170062 0.94577842918300 0.88190239293864 15.999 > 49 56 O 0.72685375170062 0.94577842918300 0.88190239293864 15.999 > 49 57 O 0.22685375170062 0.30422157081700 0.13190239293864 15.999 > 57 58 O 0.72685375170062 0.30422157081700 0.13190239293864 15.999 > 57 59 O 0.22685375170062 0.80422157081700 0.13190239293864 15.999 > 57 60 O 0.72685375170062 0.80422157081700 0.13190239293864 15.999 > 57 61 O 0.22685375170062 0.30422157081700 0.63190239293864 15.999 > 57 62 O 0.72685375170062 0.30422157081700 0.63190239293864 15.999 > 57 63 O 0.22685375170062 0.80422157081700 0.63190239293864 15.999 > 57 64 O 0.72685375170062 0.80422157081700 0.63190239293864 15.999 > 57 65 O 0.49391313018153 0.41355390149118 0.07661363574916 15.999 > 65 66 O 0.99391313018153 0.41355390149118 0.07661363574916 15.999 > 65 67 O 0.49391313018153 0.91355390149118 0.07661363574916 15.999 > 65 68 O 0.99391313018153 0.91355390149118 0.07661363574916 15.999 > 65 69 O 0.49391313018153 0.41355390149118 0.57661363574916 15.999 > 65 70 O 0.99391313018153 0.41355390149118 0.57661363574916 15.999 > 65 71 O 0.49391313018153 0.91355390149118 0.57661363574916 15.999 > 65 72 O 0.99391313018153 0.91355390149118 0.57661363574916 15.999 > 65 73 O 0.49391313018153 0.33644609850882 0.32661363574916 15.999 > 73 74 O 0.99391313018153 0.33644609850882 0.32661363574916 15.999 > 73 75 O 0.49391313018153 0.83644609850882 0.32661363574916 15.999 > 73 76 O 0.99391313018153 0.83644609850882 0.32661363574916 15.999 > 73 77 O 0.49391313018153 0.33644609850882 0.82661363574916 15.999 > 73 78 O 0.99391313018153 0.33644609850882 0.82661363574916 15.999 > 73 79 O 0.49391313018153 0.83644609850882 0.82661363574916 15.999 > 73 80 O 0.99391313018153 0.83644609850882 0.82661363574916 15.999 > 73 81 O 0.00608686981847 0.16355390149118 0.17338636425084 15.999 > 81 82 O 0.50608686981847 0.16355390149118 0.17338636425084 15.999 > 81 83 O 0.00608686981847 0.66355390149118 0.17338636425084 15.999 > 81 84 O 0.50608686981847 0.66355390149118 0.17338636425084 15.999 > 81 85 O 0.00608686981847 0.16355390149118 0.67338636425084 15.999 > 81 86 O 0.50608686981847 0.16355390149118 0.67338636425084 15.999 > 81 87 O 0.00608686981847 0.66355390149118 0.67338636425084 15.999 > 81 88 O 0.50608686981847 0.66355390149118 0.67338636425084 15.999 > 81 89 O 0.27314624829938 0.05422157081700 0.11809760706136 15.999 > 89 90 O 0.77314624829938 0.05422157081700 0.11809760706136 15.999 > 89 91 O 0.27314624829938 0.55422157081700 0.11809760706136 15.999 > 89 92 O 0.77314624829938 0.55422157081700 0.11809760706136 15.999 > 89 93 O 0.27314624829938 0.05422157081700 0.61809760706136 15.999 > 89 94 O 0.77314624829938 0.05422157081700 0.61809760706136 15.999 > 89 95 O 0.27314624829938 0.55422157081700 0.61809760706136 15.999 > 89 96 O 0.77314624829938 0.55422157081700 0.61809760706136 15.999 > 89 97 Y 0.38341409936368 0.06543656975185 0.01110688194976 88.906 > 97 98 Y 0.88341409936368 0.06543656975185 0.01110688194976 88.906 > 97 99 Y 0.38341409936368 0.56543656975185 0.01110688194976 88.906 > 97 100 Y 0.88341409936368 0.56543656975185 0.01110688194976 88.906 > 97 101 Y 0.38341409936368 0.06543656975185 0.51110688194976 88.906 > 97 102 Y 0.88341409936368 0.06543656975185 0.51110688194976 88.906 > 97 103 Y 0.38341409936368 0.56543656975185 0.51110688194976 88.906 > 97 104 Y 0.88341409936368 0.56543656975185 0.51110688194976 88.906 > 97 105 Y 0.38341409936368 0.18456343024815 0.26110688194976 88.906 > 105 106 Y 0.88341409936368 0.18456343024815 0.26110688194976 88.906 > 105 107 Y 0.38341409936368 0.68456343024815 0.26110688194976 88.906 > 105 108 Y 0.88341409936368 0.68456343024815 0.26110688194976 88.906 > 105 109 Y 0.38341409936368 0.18456343024815 0.76110688194976 88.906 > 105 110 Y 0.88341409936368 0.18456343024815 0.76110688194976 88.906 > 105 111 Y 0.38341409936368 0.68456343024815 0.76110688194976 88.906 > 105 112 Y 0.88341409936368 0.68456343024815 0.76110688194976 88.906 > 105 113 Y 0.11658590063632 0.43456343024815 0.48889311805024 88.906 > 113 114 Y 0.61658590063632 0.43456343024815 0.48889311805024 88.906 > 113 115 Y 0.11658590063632 0.93456343024815 0.48889311805024 88.906 > 113 116 Y 0.61658590063632 0.93456343024815 0.48889311805024 88.906 > 113 117 Y 0.11658590063632 0.43456343024815 0.98889311805024 88.906 > 113 118 Y 0.61658590063632 0.43456343024815 0.98889311805024 88.906 > 113 119 Y 0.11658590063632 0.93456343024815 0.98889311805024 88.906 > 113 120 Y 0.61658590063632 0.93456343024815 0.98889311805024 88.906 > 113 121 Y 0.11658590063632 0.31543656975185 0.23889311805024 88.906 > 121 122 Y 0.61658590063632 0.31543656975185 0.23889311805024 88.906 > 121 123 Y 0.11658590063632 0.81543656975185 0.23889311805024 88.906 > 121 124 Y 0.61658590063632 0.81543656975185 0.23889311805024 88.906 > 121 125 Y 0.11658590063632 0.31543656975185 0.73889311805024 88.906 > 121 126 Y 0.61658590063632 0.31543656975185 0.73889311805024 88.906 > 121 127 Y 0.11658590063632 0.81543656975185 0.73889311805024 88.906 > 121 128 Y 0.61658590063632 0.81543656975185 0.73889311805024 88.906 > 121 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.7928630 0.0000000 -0.0442818 0.0000000 3.7145177 0.0000000 -0.0442819 0.0000000 3.7800327 -------------------------- Born effective charges -------------------------- 1 Li 1.0096383 -0.0156860 0.0369674 -0.0064775 1.0313928 0.0736982 0.0371124 0.0605012 0.9988487 2 Li 1.0096383 0.0156860 0.0369674 0.0064775 1.0313928 -0.0736982 0.0371124 -0.0605012 0.9988487 3 Li 1.0096383 -0.0156860 0.0369674 -0.0064775 1.0313928 0.0736982 0.0371124 0.0605012 0.9988487 4 Li 1.0096383 0.0156860 0.0369674 0.0064775 1.0313928 -0.0736982 0.0371124 -0.0605012 0.9988487 5 O -2.2643293 0.3511926 -0.0798064 0.3577757 -2.2627649 0.7158637 -0.0713226 0.6455369 -2.3426648 6 O -2.3418236 0.4009646 -0.0297166 0.4035131 -2.3914822 0.7339874 -0.0143106 0.8311706 -2.3121911 7 O -2.2643293 -0.3511926 -0.0798064 -0.3577757 -2.2627649 -0.7158637 -0.0713226 -0.6455369 -2.3426648 8 O -2.2643293 0.3511926 -0.0798064 0.3577757 -2.2627649 0.7158637 -0.0713226 0.6455369 -2.3426648 9 O -2.3418236 0.4009646 -0.0297166 0.4035131 -2.3914822 0.7339874 -0.0143106 0.8311706 -2.3121911 10 O -2.3418236 -0.4009646 -0.0297166 -0.4035131 -2.3914822 -0.7339874 -0.0143106 -0.8311706 -2.3121911 11 O -2.3418236 -0.4009646 -0.0297166 -0.4035131 -2.3914822 -0.7339874 -0.0143106 -0.8311706 -2.3121911 12 O -2.2643293 -0.3511926 -0.0798064 -0.3577757 -2.2627649 -0.7158637 -0.0713226 -0.6455369 -2.3426648 13 Y 3.5965147 -0.0569568 0.0725556 0.0201096 3.6228543 0.1742619 0.0485208 -0.1114085 3.6560072 14 Y 3.5965147 0.0569568 0.0725556 -0.0201096 3.6228543 -0.1742619 0.0485208 0.1114085 3.6560072 15 Y 3.5965147 -0.0569568 0.0725556 0.0201096 3.6228543 0.1742619 0.0485208 -0.1114085 3.6560072 16 Y 3.5965147 0.0569568 0.0725556 -0.0201096 3.6228543 -0.1742619 0.0485208 0.1114085 3.6560072 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000003 (zxz) 0.00000003 (zxz) 0.00000003 (zzx) 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 ... [ 9 8 9 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.71, Number of G-points: 315, Lambda: 0.14 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/205) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 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 3.409 ( 0.000 0.000 0.000) 0.000 3.413 ( 0.000 0.000 0.000) 0.000 4.102 ( 0.000 0.000 0.000) 0.000 4.127 ( 0.000 0.000 0.000) 0.000 4.201 ( 0.000 0.000 0.000) 0.000 5.058 ( 0.000 0.000 0.000) 0.000 5.563 ( 0.000 0.000 0.000) 0.000 5.579 ( 0.000 0.000 0.000) 0.000 6.076 ( 0.000 0.000 0.000) 0.000 6.186 ( 0.000 0.000 0.000) 0.000 6.671 ( 0.000 0.000 0.000) 0.000 6.781 ( 0.000 0.000 0.000) 0.000 7.582 ( 0.000 0.000 0.000) 0.000 7.840 ( 0.000 0.000 0.000) 0.000 7.880 ( 0.000 0.000 0.000) 0.000 8.360 ( 0.000 0.000 0.000) 0.000 8.588 ( 0.000 0.000 0.000) 0.000 8.818 ( 0.000 0.000 0.000) 0.000 9.307 ( 0.000 0.000 0.000) 0.000 9.337 ( 0.000 0.000 0.000) 0.000 9.963 ( 0.000 0.000 0.000) 0.000 10.215 ( 0.000 0.000 0.000) 0.000 10.662 ( 0.000 0.000 0.000) 0.000 10.901 ( 0.000 0.000 0.000) 0.000 11.262 ( 0.000 0.000 0.000) 0.000 11.572 ( 0.000 0.000 0.000) 0.000 11.596 ( 0.000 0.000 0.000) 0.000 11.750 ( 0.000 0.000 0.000) 0.000 12.383 ( 0.000 0.000 0.000) 0.000 12.399 ( 0.000 0.000 0.000) 0.000 12.701 ( 0.000 0.000 0.000) 0.000 13.030 ( 0.000 0.000 0.000) 0.000 13.188 ( 0.000 0.000 0.000) 0.000 13.419 ( 0.000 0.000 0.000) 0.000 13.642 ( 0.000 0.000 0.000) 0.000 13.793 ( 0.000 0.000 0.000) 0.000 14.070 ( 0.000 0.000 0.000) 0.000 14.701 ( 0.000 0.000 0.000) 0.000 15.311 ( 0.000 0.000 0.000) 0.000 16.489 ( 0.000 0.000 0.000) 0.000 16.574 ( 0.000 0.000 0.000) 0.000 16.948 ( 0.000 0.000 0.000) 0.000 17.024 ( 0.000 0.000 0.000) 0.000 18.596 ( 0.000 0.000 0.000) 0.000 18.877 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/205) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.535 ( 22.303 0.000 14.799) 26.766 0.749 ( 31.728 0.000 17.837) 36.398 1.529 ( 55.545 0.000 48.789) 73.930 3.466 ( 0.893 0.000 6.795) 6.854 3.576 ( 17.650 0.000 -1.084) 17.683 3.946 ( -1.481 0.000 -11.683) 11.777 4.324 ( 5.894 0.000 8.143) 10.052 4.363 ( 11.123 0.000 10.045) 14.987 5.102 ( -0.760 0.000 3.290) 3.376 5.364 ( -14.485 0.000 -0.149) 14.486 5.574 ( -0.854 0.000 0.385) 0.937 6.001 ( -6.951 0.000 -1.635) 7.141 6.206 ( -2.151 0.000 4.432) 4.926 6.775 ( 10.304 0.000 -1.681) 10.440 6.885 ( 8.010 0.000 -14.052) 16.175 7.479 ( -6.466 0.000 -2.854) 7.068 7.886 ( -2.917 0.000 3.725) 4.732 7.961 ( 7.068 0.000 4.904) 8.602 8.241 ( -6.474 0.000 -6.497) 9.172 8.690 ( 7.479 0.000 7.008) 10.249 9.131 ( 3.128 0.000 -12.699) 13.078 9.334 ( 0.962 0.000 -2.929) 3.083 9.654 ( -17.726 0.000 -8.759) 19.772 10.360 ( 22.818 0.000 -23.582) 32.814 10.423 ( -20.787 0.000 2.713) 20.964 10.805 ( 37.022 0.000 -39.225) 53.937 10.982 ( 2.246 0.000 -1.155) 2.526 11.260 ( 0.618 0.000 -1.252) 1.397 11.595 ( 1.186 0.000 1.989) 2.316 11.655 ( 3.286 0.000 4.910) 5.908 11.816 ( -1.395 0.000 5.268) 5.449 12.338 ( -5.868 0.000 0.175) 5.870 12.374 ( -22.941 0.000 -9.806) 24.948 12.920 ( -5.735 0.000 -10.846) 12.269 12.936 ( 3.292 0.000 -0.167) 3.296 13.068 ( -3.745 0.000 2.140) 4.313 13.625 ( -0.973 0.000 -1.621) 1.891 13.859 ( 1.775 0.000 -12.194) 12.323 14.401 ( 18.615 0.000 14.613) 23.665 14.770 ( 9.431 0.000 5.292) 10.814 15.299 ( -2.158 0.000 1.631) 2.705 15.678 ( 2.860 0.000 -5.638) 6.322 16.593 ( 1.831 0.000 1.131) 2.152 16.746 ( -13.040 0.000 -10.426) 16.696 16.980 ( -2.922 0.000 -3.091) 4.254 18.289 ( 8.417 0.000 13.680) 16.062 18.844 ( -4.679 0.000 1.468) 4.904 20.499 ( -44.968 0.000 77.880) 89.930 ======================= Grid point 2 (3/205) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.122 ( 24.524 0.000 17.386) 30.062 1.509 ( 32.917 0.000 16.093) 36.640 2.963 ( 48.148 0.000 45.119) 65.985 3.464 ( -12.798 0.000 10.437) 16.514 3.906 ( 10.295 0.000 -10.125) 14.439 3.975 ( 26.388 0.000 -2.515) 26.508 4.508 ( 2.948 0.000 12.567) 12.909 4.734 ( 7.859 0.000 13.209) 15.370 4.836 ( -15.494 0.000 -1.364) 15.554 5.384 ( 3.294 0.000 12.295) 12.729 5.556 ( -1.647 0.000 0.806) 1.834 5.820 ( -8.972 0.000 -3.466) 9.618 6.183 ( -3.622 0.000 1.527) 3.931 6.898 ( 6.435 0.000 -9.155) 11.190 6.927 ( 6.379 0.000 -0.239) 6.383 7.355 ( -4.989 0.000 0.621) 5.027 7.764 ( -8.740 0.000 -7.512) 11.525 8.117 ( 6.803 0.000 -1.332) 6.932 8.133 ( -2.892 0.000 3.654) 4.660 8.995 ( -13.825 0.000 4.037) 14.402 9.002 ( 14.089 0.000 15.081) 20.638 9.261 ( -9.247 0.000 -16.860) 19.229 9.300 ( -0.691 0.000 -4.366) 4.420 10.055 ( -20.958 0.000 1.409) 21.005 10.536 ( 20.766 0.000 -19.050) 28.180 10.896 ( -12.102 0.000 3.444) 12.583 11.057 ( 18.135 0.000 -11.913) 21.698 11.249 ( 0.722 0.000 -5.187) 5.237 11.613 ( -3.953 0.000 2.004) 4.432 11.718 ( -5.008 0.000 1.576) 5.250 11.838 ( -1.756 0.000 5.713) 5.976 11.997 ( -2.798 0.000 -6.675) 7.238 12.252 ( -3.132 0.000 2.039) 3.737 12.726 ( -3.041 0.000 -9.412) 9.891 13.002 ( 4.468 0.000 -1.371) 4.674 13.007 ( -5.631 0.000 1.120) 5.741 13.575 ( -1.864 0.000 -2.813) 3.375 13.695 ( -4.981 0.000 -11.757) 12.768 14.601 ( 2.825 0.000 -0.676) 2.904 15.261 ( 23.413 0.000 13.501) 27.027 15.268 ( -3.288 0.000 2.212) 3.962 15.668 ( 2.395 0.000 -5.520) 6.017 16.374 ( -14.012 0.000 -10.985) 17.804 16.693 ( 6.809 0.000 5.520) 8.765 16.868 ( -4.509 0.000 -4.742) 6.543 18.597 ( 10.993 0.000 9.727) 14.678 18.727 ( -9.673 0.000 0.472) 9.685 20.468 ( -21.936 0.000 35.425) 41.667 ======================= Grid point 3 (4/205) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.766 ( 26.945 0.000 16.456) 31.573 2.257 ( 33.109 0.000 12.871) 35.523 3.237 ( -21.693 0.000 11.354) 24.485 3.839 ( 6.958 0.000 0.463) 6.974 4.180 ( -19.532 0.000 -1.610) 19.598 4.323 ( 38.642 0.000 21.596) 44.267 4.587 ( 21.501 0.000 -7.449) 22.755 4.702 ( 5.090 0.000 13.560) 14.484 5.166 ( 9.401 0.000 17.127) 19.537 5.520 ( -1.822 0.000 -2.976) 3.489 5.556 ( 1.283 0.000 10.943) 11.018 5.671 ( -4.176 0.000 0.989) 4.292 6.100 ( -6.264 0.000 -0.690) 6.302 6.922 ( 3.747 0.000 -4.794) 6.085 7.007 ( 2.058 0.000 2.541) 3.270 7.341 ( 0.704 0.000 4.695) 4.748 7.473 ( -10.445 0.000 -14.644) 17.988 8.140 ( 2.310 0.000 -11.383) 11.615 8.156 ( -2.092 0.000 8.387) 8.644 8.746 ( -16.505 0.000 6.078) 17.589 8.989 ( -3.886 0.000 -16.011) 16.475 9.223 ( -1.843 0.000 -3.612) 4.055 9.476 ( 13.074 0.000 23.062) 26.510 9.749 ( -11.423 0.000 1.495) 11.521 10.677 ( -14.213 0.000 3.670) 14.679 10.728 ( 18.646 0.000 -13.557) 23.053 11.095 ( -5.223 0.000 -19.947) 20.619 11.207 ( 8.579 0.000 -5.712) 10.307 11.453 ( -13.136 0.000 0.373) 13.141 11.660 ( -0.121 0.000 5.544) 5.546 11.894 ( 0.816 0.000 5.634) 5.693 11.993 ( 1.973 0.000 -3.073) 3.652 12.270 ( 0.887 0.000 3.296) 3.413 12.659 ( 1.342 0.000 -2.198) 2.575 12.895 ( -6.067 0.000 0.235) 6.072 13.060 ( 3.249 0.000 -1.262) 3.485 13.472 ( -6.084 0.000 -11.174) 12.723 13.508 ( -2.013 0.000 -2.904) 3.533 14.625 ( 1.457 0.000 -1.077) 1.812 15.229 ( -2.963 0.000 1.547) 3.343 15.654 ( 1.916 0.000 -4.865) 5.228 15.680 ( 11.614 0.000 4.965) 12.631 16.061 ( -9.893 0.000 -6.771) 11.988 16.740 ( -4.142 0.000 -4.190) 5.892 16.988 ( 15.429 0.000 12.011) 19.553 18.498 ( -13.969 0.000 -3.077) 14.304 18.852 ( 8.142 0.000 5.425) 9.784 20.430 ( -12.199 0.000 18.250) 21.952 ======================= Grid point 4 (5/205) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.387 ( 25.835 0.000 8.372) 27.157 2.909 ( -23.472 0.000 4.463) 23.893 2.952 ( 30.586 0.000 8.346) 31.704 3.652 ( -29.069 0.000 -4.247) 29.378 3.828 ( 0.467 0.000 -5.246) 5.267 4.769 ( 2.618 0.000 3.693) 4.527 4.997 ( 27.852 0.000 -11.779) 30.240 5.212 ( 15.126 0.000 20.362) 25.366 5.304 ( -17.034 0.000 19.365) 25.791 5.476 ( 4.491 0.000 -6.639) 8.015 5.662 ( -0.829 0.000 2.591) 2.720 5.704 ( 10.359 0.000 0.021) 10.359 5.952 ( -8.920 0.000 0.062) 8.920 6.938 ( 1.748 0.000 -0.991) 2.009 7.060 ( 0.968 0.000 1.498) 1.783 7.129 ( -9.728 0.000 -10.658) 14.430 7.457 ( 3.384 0.000 6.860) 7.649 8.002 ( -2.014 0.000 -10.954) 11.138 8.205 ( -0.923 0.000 4.571) 4.664 8.616 ( -5.078 0.000 9.455) 10.733 8.768 ( -2.917 0.000 -14.149) 14.447 9.169 ( -1.650 0.000 -0.010) 1.650 9.546 ( -4.069 0.000 0.463) 4.096 10.061 ( 14.565 0.000 25.212) 29.117 10.484 ( -8.221 0.000 -5.409) 9.841 10.724 ( -8.533 0.000 -19.065) 20.888 10.922 ( 13.660 0.000 -7.606) 15.635 11.217 ( -11.605 0.000 2.691) 11.912 11.271 ( 1.776 0.000 -1.736) 2.483 11.764 ( 2.472 0.000 4.571) 5.197 11.952 ( 0.581 0.000 2.326) 2.397 11.988 ( 0.471 0.000 -0.980) 1.088 12.311 ( 0.435 0.000 1.395) 1.461 12.619 ( -2.502 0.000 -3.074) 3.963 12.881 ( 1.204 0.000 3.817) 4.002 13.091 ( 1.174 0.000 -0.537) 1.291 13.281 ( -3.682 0.000 -6.362) 7.351 13.458 ( -0.877 0.000 -1.281) 1.552 14.637 ( 0.578 0.000 -0.374) 0.689 15.200 ( -1.214 0.000 0.454) 1.296 15.643 ( 0.875 0.000 -2.163) 2.333 15.824 ( 2.736 0.000 0.679) 2.819 15.893 ( -3.613 0.000 -1.887) 4.076 16.653 ( -1.693 0.000 -1.715) 2.410 17.402 ( 13.441 0.000 9.357) 16.377 18.195 ( -11.905 0.000 -5.027) 12.923 18.991 ( 2.998 0.000 1.661) 3.427 20.404 ( -4.095 0.000 5.835) 7.129 ======================= Grid point 9 (6/205) ======================= q-point: ( 0.00 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.702 ( 0.000 33.660 0.000) 33.660 0.748 ( 0.000 35.811 0.000) 35.811 1.465 ( 0.000 68.742 0.000) 68.742 3.315 ( 0.000 -7.827 0.000) 7.827 3.467 ( 0.000 -0.351 0.000) 0.351 4.028 ( 0.000 -3.435 0.000) 3.435 4.315 ( 0.000 19.160 0.000) 19.160 4.407 ( 0.000 13.260 0.000) 13.260 5.086 ( 0.000 2.896 0.000) 2.896 5.512 ( 0.000 -7.335 0.000) 7.335 5.607 ( 0.000 4.230 0.000) 4.230 5.845 ( 0.000 -12.601 0.000) 12.601 6.429 ( 0.000 9.744 0.000) 9.744 6.738 ( 0.000 -3.886 0.000) 3.886 6.738 ( 0.000 1.834 0.000) 1.834 7.524 ( 0.000 -5.273 0.000) 5.273 7.742 ( 0.000 -9.747 0.000) 9.747 8.054 ( 0.000 14.455 0.000) 14.455 8.507 ( 0.000 -5.973 0.000) 5.973 8.557 ( 0.000 16.272 0.000) 16.272 8.889 ( 0.000 4.078 0.000) 4.078 9.325 ( 0.000 1.748 0.000) 1.748 9.890 ( 0.000 -19.715 0.000) 19.715 9.955 ( 0.000 -0.879 0.000) 0.879 10.610 ( 0.000 2.385 0.000) 2.385 10.772 ( 0.000 2.901 0.000) 2.901 10.883 ( 0.000 -1.801 0.000) 1.801 11.199 ( 0.000 -5.249 0.000) 5.249 11.590 ( 0.000 1.029 0.000) 1.029 11.808 ( 0.000 5.216 0.000) 5.216 11.823 ( 0.000 8.758 0.000) 8.758 12.340 ( 0.000 -5.257 0.000) 5.257 12.392 ( 0.000 -0.201 0.000) 0.201 12.703 ( 0.000 -10.122 0.000) 10.122 12.852 ( 0.000 -13.191 0.000) 13.191 13.482 ( 0.000 3.352 0.000) 3.352 13.661 ( 0.000 -1.628 0.000) 1.628 13.742 ( 0.000 -4.892 0.000) 4.892 14.002 ( 0.000 2.202 0.000) 2.202 14.045 ( 0.000 -2.278 0.000) 2.278 15.529 ( 0.000 20.341 0.000) 20.341 16.446 ( 0.000 -3.362 0.000) 3.362 16.589 ( 0.000 0.862 0.000) 0.862 16.751 ( 0.000 -4.264 0.000) 4.264 16.924 ( 0.000 -2.256 0.000) 2.256 18.426 ( 0.000 -11.917 0.000) 11.917 19.073 ( 0.000 14.009 0.000) 14.009 20.407 ( 0.000 -2.928 0.000) 2.928 ======================= Grid point 10 (7/205) ======================= q-point: ( 0.11 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.885 ( 7.406 29.002 15.397) 33.660 1.169 ( 24.932 27.032 13.821) 39.286 2.019 ( 39.422 42.501 29.777) 65.169 3.414 ( 5.624 -5.090 6.050) 9.703 3.563 ( 11.510 -2.125 -0.758) 11.729 4.038 ( 1.392 5.527 -4.936) 7.540 4.327 ( 3.513 8.596 7.862) 12.167 4.560 ( 7.307 12.652 7.279) 16.323 5.127 ( -0.717 2.367 3.970) 4.677 5.410 ( -12.980 3.040 1.170) 13.382 5.540 ( -0.279 -3.050 0.603) 3.122 5.802 ( -3.806 -10.141 -1.193) 10.897 6.402 ( -4.474 11.333 4.922) 13.141 6.771 ( 5.855 -3.537 -4.151) 8.001 6.836 ( 10.375 -1.046 -6.551) 12.315 7.451 ( -5.534 -3.500 -2.850) 7.141 7.817 ( 4.140 -7.277 2.469) 8.728 8.054 ( -0.979 10.786 4.246) 11.633 8.390 ( -8.177 13.502 -6.268) 16.984 8.672 ( 13.559 -4.843 0.693) 14.415 9.050 ( 5.784 -2.442 -1.684) 6.500 9.316 ( -3.651 2.760 1.690) 4.879 9.588 ( -15.734 -6.890 -2.678) 17.384 10.085 ( 2.803 -12.199 -1.109) 12.566 10.493 ( 4.587 -3.680 -25.160) 25.838 10.865 ( 14.229 8.036 -3.538) 16.719 10.953 ( -0.727 -5.109 2.641) 5.797 11.300 ( 3.625 -4.750 3.589) 6.970 11.537 ( -1.694 1.855 -4.688) 5.319 11.722 ( 2.323 3.611 -4.190) 6.000 11.933 ( 1.036 9.228 7.133) 11.709 12.208 ( -10.470 -3.502 -3.548) 11.596 12.435 ( -15.025 -4.168 -5.294) 16.467 12.609 ( 6.724 -7.729 3.162) 10.722 12.898 ( -0.739 -12.166 6.147) 13.651 13.230 ( -6.294 9.759 -10.847) 15.890 13.630 ( -2.267 -1.322 -1.978) 3.286 13.813 ( 3.905 -4.651 -12.920) 14.277 14.062 ( 3.863 -18.786 9.075) 21.218 14.437 ( 19.596 -11.143 17.109) 28.300 15.579 ( 4.199 22.216 1.698) 22.673 16.134 ( -9.856 15.171 -16.484) 24.475 16.549 ( -1.667 -3.140 -1.390) 3.817 16.756 ( -7.513 0.314 -5.353) 9.230 16.884 ( -0.494 -6.458 -0.229) 6.481 18.396 ( 4.617 -1.596 -0.847) 4.958 18.975 ( -6.318 14.070 0.201) 15.425 20.431 ( -24.588 -5.142 44.206) 50.844 ======================= Grid point 11 (8/205) ======================= q-point: ( 0.22 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.280 ( 15.265 16.477 20.579) 30.463 1.787 ( 28.752 21.935 12.824) 38.370 3.169 ( 43.199 18.231 35.959) 59.089 3.478 ( -9.634 0.645 10.333) 14.142 3.837 ( 18.181 -5.148 -5.224) 19.604 4.089 ( 14.841 9.535 -5.362) 18.437 4.517 ( 1.542 1.781 11.317) 11.560 4.773 ( 1.101 3.170 9.264) 9.853 4.974 ( -7.657 12.047 2.865) 14.559 5.394 ( 1.083 1.858 10.252) 10.475 5.565 ( -0.025 -4.319 3.674) 5.670 5.704 ( -3.460 -1.443 -2.384) 4.442 6.353 ( -4.716 11.904 1.156) 12.856 6.829 ( 5.221 -5.952 -3.595) 8.695 6.945 ( 5.065 0.117 -2.273) 5.553 7.339 ( -3.805 -1.167 0.743) 4.049 7.798 ( -4.340 2.978 -6.537) 8.393 8.167 ( 5.629 3.809 6.884) 9.674 8.203 ( -5.661 8.496 -4.317) 11.085 8.928 ( 7.877 -8.815 -1.428) 11.908 8.998 ( -8.837 -0.362 1.413) 8.956 9.202 ( -4.563 2.864 6.019) 8.077 9.397 ( -3.179 3.550 -5.288) 7.119 9.947 ( -14.635 -8.533 0.108) 16.941 10.471 ( 14.928 -7.190 -17.094) 23.807 10.864 ( -11.508 -2.630 4.672) 12.696 11.078 ( 12.081 3.589 -4.815) 13.492 11.321 ( -0.122 -1.066 -6.385) 6.475 11.513 ( 1.497 -3.427 -0.060) 3.741 11.742 ( -0.956 1.152 1.334) 2.005 11.902 ( -11.352 4.143 -6.143) 13.556 12.012 ( 2.834 2.588 1.325) 4.060 12.258 ( -3.318 0.045 -1.443) 3.619 12.657 ( 0.042 -5.920 -0.352) 5.931 12.804 ( -6.821 -7.145 -6.147) 11.635 13.208 ( 3.375 8.650 3.327) 9.863 13.554 ( -3.545 -2.743 -3.669) 5.793 13.674 ( -2.991 -1.433 -11.902) 12.355 14.184 ( 2.293 -27.441 3.761) 27.793 14.901 ( 14.566 -20.577 8.876) 26.728 15.680 ( 3.694 24.033 -0.470) 24.320 15.911 ( -0.882 12.665 -7.361) 14.676 16.333 ( -12.451 -3.282 -9.534) 16.021 16.742 ( 6.495 3.397 4.278) 8.487 16.824 ( -3.350 -2.930 -2.132) 4.935 18.537 ( 4.874 -5.971 2.768) 8.189 18.875 ( -5.012 12.718 2.412) 13.881 20.409 ( -18.672 -5.491 29.280) 35.158 ======================= Grid point 12 (9/205) ======================= q-point: ( 0.33 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.824 ( 21.694 7.170 18.811) 29.595 2.453 ( 30.545 16.271 11.325) 36.414 3.255 ( -21.714 0.681 9.662) 23.777 3.888 ( 7.004 3.447 -3.999) 8.771 4.204 ( -15.763 3.154 1.327) 16.130 4.372 ( 37.546 4.901 18.861) 42.302 4.624 ( 21.571 3.258 -5.233) 22.435 4.798 ( 2.427 7.759 12.393) 14.821 5.184 ( 6.477 2.482 12.211) 14.044 5.453 ( -5.188 -3.178 6.435) 8.856 5.610 ( 2.000 -1.619 4.815) 5.460 5.720 ( 3.968 11.252 3.618) 12.467 6.236 ( -8.265 10.170 -1.877) 13.239 6.867 ( 1.528 -5.880 -2.567) 6.595 6.984 ( 0.357 -2.120 2.826) 3.551 7.363 ( 2.950 3.099 4.417) 6.150 7.574 ( -8.432 9.033 -12.217) 17.377 8.103 ( -0.723 2.982 -4.474) 5.425 8.296 ( 1.583 7.170 2.465) 7.746 8.729 ( -14.351 -1.757 3.877) 14.969 8.927 ( -2.051 -3.987 -9.806) 10.782 9.236 ( -3.311 -0.750 -6.644) 7.461 9.491 ( 9.277 1.918 19.824) 21.971 9.708 ( -9.519 -3.559 1.819) 10.324 10.524 ( -0.838 -11.320 -3.813) 11.974 10.749 ( 0.920 -0.495 -5.043) 5.150 11.072 ( -2.570 -1.677 -15.588) 15.887 11.278 ( 4.816 4.191 -3.383) 7.225 11.528 ( -3.550 3.449 -2.688) 5.632 11.644 ( -4.896 1.016 2.512) 5.596 11.810 ( 1.983 -3.167 2.435) 4.460 12.113 ( 5.171 1.594 1.207) 5.544 12.205 ( -1.539 0.206 -0.716) 1.710 12.597 ( -7.476 -15.952 -4.524) 18.188 12.701 ( 1.537 2.451 2.563) 3.865 13.286 ( 2.048 9.219 1.072) 9.504 13.398 ( -6.014 -3.525 -8.731) 11.172 13.532 ( -2.431 0.937 -5.300) 5.906 14.247 ( 1.789 -27.060 1.879) 27.184 15.134 ( 5.628 -19.154 3.034) 20.193 15.641 ( -1.954 14.555 -5.509) 15.685 15.929 ( 3.977 9.363 -2.112) 10.390 16.048 ( -8.843 -1.071 -5.822) 10.642 16.705 ( -3.551 -3.421 -4.186) 6.469 17.059 ( 15.383 6.821 12.762) 21.119 18.471 ( -10.811 -2.987 -3.325) 11.698 18.921 ( 4.908 6.585 3.583) 8.961 20.363 ( -11.648 -6.371 16.296) 21.020 ======================= Grid point 13 (10/205) ======================= q-point: ( 0.44 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.397 ( 23.562 2.048 10.242) 25.774 2.905 ( -23.202 -0.274 2.034) 23.292 3.093 ( 27.911 11.767 7.719) 31.258 3.736 ( -22.807 6.003 -5.411) 24.197 3.903 ( -2.193 7.967 -2.723) 8.701 4.804 ( 2.466 3.086 3.513) 5.286 5.007 ( 26.838 1.197 -10.957) 29.013 5.249 ( 8.046 2.193 14.700) 16.901 5.287 ( -8.847 -2.350 13.225) 16.084 5.429 ( 6.121 -0.826 3.588) 7.143 5.702 ( 1.600 5.595 3.263) 6.671 5.856 ( 6.591 11.755 -1.078) 13.520 6.027 ( -11.122 6.135 -0.912) 12.735 6.857 ( 0.135 -8.603 -0.711) 8.633 6.976 ( -2.794 -1.760 -1.465) 3.612 7.329 ( -4.270 13.507 -4.965) 15.011 7.505 ( 3.563 5.663 5.451) 8.630 8.048 ( 0.716 5.449 -6.997) 8.898 8.290 ( -2.575 6.432 1.689) 7.131 8.598 ( -4.677 -1.785 4.965) 7.051 8.774 ( -2.621 1.211 -8.497) 8.974 9.139 ( -2.138 -3.447 -0.781) 4.131 9.554 ( -3.204 0.927 0.409) 3.361 9.967 ( 11.997 -8.438 20.272) 25.022 10.415 ( -7.506 -6.137 -2.095) 9.920 10.580 ( -4.744 -9.742 -16.586) 19.811 11.012 ( 7.708 4.863 -5.561) 10.677 11.298 ( -4.094 4.665 -0.055) 6.207 11.363 ( -3.028 8.671 -1.875) 9.374 11.699 ( 1.869 -5.824 2.824) 6.737 11.899 ( 2.926 0.818 3.244) 4.445 12.167 ( 0.647 11.412 -0.263) 11.433 12.209 ( 0.870 -8.826 0.964) 8.921 12.416 ( -5.322 -18.506 -4.196) 19.708 12.782 ( 2.001 -0.431 3.704) 4.232 13.212 ( -3.322 -5.535 -6.204) 8.953 13.321 ( 0.299 11.416 0.360) 11.426 13.465 ( -1.064 0.576 -1.587) 1.996 14.286 ( 0.817 -24.857 0.748) 24.881 15.209 ( 1.356 -15.340 0.733) 15.417 15.566 ( -1.080 8.839 -2.505) 9.251 15.889 ( -2.352 -0.075 -2.456) 3.401 15.973 ( 0.626 6.570 -0.251) 6.605 16.623 ( -1.567 -2.889 -1.748) 3.723 17.473 ( 13.512 6.468 9.576) 17.780 18.189 ( -11.687 -0.661 -5.485) 12.927 19.024 ( 2.590 3.278 1.249) 4.360 20.328 ( -4.079 -7.171 5.319) 9.815 ======================= Grid point 18 (11/205) ======================= q-point: ( 0.00 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.363 ( 0.000 30.353 0.000) 30.353 1.461 ( 0.000 33.707 0.000) 33.707 2.716 ( 0.000 46.954 0.000) 46.954 3.106 ( 0.000 -11.818 0.000) 11.818 3.472 ( 0.000 4.938 0.000) 4.938 4.011 ( 0.000 1.658 0.000) 1.658 4.683 ( 0.000 12.658 0.000) 12.658 4.763 ( 0.000 19.482 0.000) 19.482 5.181 ( 0.000 6.130 0.000) 6.130 5.281 ( 0.000 -11.861 0.000) 11.861 5.679 ( 0.000 -3.259 0.000) 3.259 5.727 ( 0.000 7.193 0.000) 7.193 6.581 ( 0.000 4.846 0.000) 4.846 6.612 ( 0.000 -7.746 0.000) 7.746 6.817 ( 0.000 5.358 0.000) 5.358 7.390 ( 0.000 -7.241 0.000) 7.241 7.574 ( 0.000 -5.180 0.000) 5.180 8.367 ( 0.000 -8.008 0.000) 8.008 8.377 ( 0.000 14.826 0.000) 14.826 8.929 ( 0.000 -0.068 0.000) 0.068 8.984 ( 0.000 24.832 0.000) 24.832 9.347 ( 0.000 -1.024 0.000) 1.024 9.515 ( 0.000 -15.406 0.000) 15.406 9.926 ( 0.000 -1.661 0.000) 1.661 10.481 ( 0.000 -10.649 0.000) 10.649 10.821 ( 0.000 -4.540 0.000) 4.540 10.856 ( 0.000 2.045 0.000) 2.045 11.098 ( 0.000 -3.363 0.000) 3.363 11.584 ( 0.000 -2.140 0.000) 2.140 11.947 ( 0.000 8.030 0.000) 8.030 12.069 ( 0.000 14.366 0.000) 14.366 12.081 ( 0.000 -20.638 0.000) 20.638 12.443 ( 0.000 5.405 0.000) 5.405 12.569 ( 0.000 -1.518 0.000) 1.518 12.662 ( 0.000 -3.307 0.000) 3.307 13.492 ( 0.000 -3.303 0.000) 3.303 13.545 ( 0.000 -8.556 0.000) 8.556 13.602 ( 0.000 -8.232 0.000) 8.232 13.988 ( 0.000 -2.788 0.000) 2.788 14.033 ( 0.000 0.104 0.000) 0.104 16.073 ( 0.000 30.716 0.000) 30.716 16.378 ( 0.000 -2.796 0.000) 2.796 16.603 ( 0.000 0.687 0.000) 0.687 16.635 ( 0.000 -6.579 0.000) 6.579 16.859 ( 0.000 -3.935 0.000) 3.935 18.154 ( 0.000 -14.795 0.000) 14.795 19.378 ( 0.000 15.210 0.000) 15.210 20.317 ( 0.000 -5.935 0.000) 5.935 ======================= Grid point 19 (12/205) ======================= q-point: ( 0.11 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.532 ( 1.918 32.394 11.766) 34.518 1.713 ( 22.013 25.772 13.559) 36.505 2.921 ( 16.188 34.672 13.341) 40.523 3.256 ( 13.427 -9.615 3.066) 16.797 3.536 ( 5.784 4.058 1.258) 7.177 4.118 ( 7.178 3.632 4.860) 9.399 4.637 ( -2.346 17.215 0.041) 17.374 4.811 ( -0.403 8.789 4.574) 9.916 5.172 ( -2.436 0.412 5.462) 5.995 5.346 ( 6.747 -3.595 -1.508) 7.793 5.602 ( -7.606 8.008 -0.579) 11.059 5.727 ( -1.503 2.522 6.155) 6.820 6.570 ( -2.929 0.588 8.132) 8.664 6.674 ( 5.159 -0.110 -6.577) 8.360 6.841 ( 5.394 0.316 -3.179) 6.269 7.355 ( -3.120 -5.268 -0.481) 6.141 7.679 ( 7.234 -4.682 5.009) 9.967 8.297 ( -2.928 9.118 -0.604) 9.595 8.539 ( 10.961 -4.971 1.066) 12.082 8.728 ( -9.655 16.414 -4.978) 19.683 9.064 ( -1.263 3.226 3.619) 5.010 9.363 ( -13.494 -7.312 4.310) 15.942 9.452 ( 4.997 3.002 1.640) 6.056 9.893 ( -1.605 -6.714 -3.856) 7.907 10.373 ( -1.022 -8.223 -14.322) 16.546 10.835 ( 0.127 -4.686 2.273) 5.210 10.958 ( 9.163 0.184 0.430) 9.175 11.156 ( 0.781 -7.104 2.761) 7.661 11.540 ( -1.616 -2.827 -3.329) 4.657 11.841 ( -0.026 8.305 -8.960) 12.217 11.997 ( -5.031 -12.859 -1.885) 13.936 12.238 ( 5.951 6.017 4.166) 9.432 12.311 ( -11.022 3.521 -4.871) 12.554 12.597 ( -0.121 4.023 6.252) 7.435 12.729 ( 1.313 -3.103 7.138) 7.893 13.333 ( -3.364 0.022 -9.845) 10.404 13.520 ( -2.902 -9.332 -0.931) 9.816 13.637 ( 3.443 -10.741 -6.212) 12.876 13.874 ( -4.749 -2.195 -4.425) 6.852 14.239 ( 9.416 -8.777 10.095) 16.358 16.091 ( 3.183 24.504 -3.206) 24.917 16.270 ( -5.339 1.539 -8.978) 10.559 16.501 ( -4.781 -0.939 -3.104) 5.777 16.753 ( 2.598 -2.791 4.665) 6.025 16.768 ( -3.493 -1.351 -4.449) 5.815 18.221 ( 6.164 -13.096 1.163) 14.521 19.305 ( -5.410 16.336 -2.476) 17.386 20.306 ( -11.678 -7.150 18.149) 22.736 ======================= Grid point 20 (13/205) ======================= q-point: ( 0.22 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.736 ( 3.379 25.829 19.789) 32.713 2.267 ( 23.774 23.483 12.216) 35.579 3.364 ( -2.580 -5.239 15.045) 16.139 3.608 ( 23.029 2.076 5.445) 23.755 3.780 ( 25.575 11.834 5.451) 28.702 4.310 ( 12.398 9.587 -1.290) 15.726 4.603 ( -7.254 6.659 5.383) 11.222 4.845 ( 0.197 4.036 6.891) 7.988 5.216 ( 1.218 5.721 3.596) 6.867 5.457 ( -1.543 4.513 2.760) 5.510 5.493 ( 0.487 5.652 6.550) 8.665 5.809 ( 3.195 7.743 7.397) 11.175 6.596 ( -3.894 11.065 -1.530) 11.830 6.681 ( 3.014 -6.936 2.751) 8.047 6.898 ( 0.724 -4.669 0.368) 4.740 7.326 ( 1.189 -0.189 2.287) 2.584 7.853 ( 5.544 1.890 0.325) 5.866 8.282 ( 0.619 7.356 4.509) 8.650 8.475 ( -9.944 16.325 -5.036) 19.767 8.727 ( 6.256 -9.038 -4.839) 12.010 9.002 ( -9.581 0.792 3.707) 10.303 9.202 ( -4.522 -4.839 4.403) 7.953 9.528 ( -0.364 9.922 1.582) 10.054 9.773 ( -8.096 -7.369 -1.972) 11.124 10.264 ( 4.432 -12.091 -11.042) 16.963 10.822 ( -5.492 -1.251 3.965) 6.888 11.093 ( 1.291 -6.332 -6.452) 9.132 11.169 ( 4.686 -6.606 3.099) 8.672 11.513 ( 4.441 -0.874 -7.802) 9.020 11.761 ( -2.371 -0.635 -4.941) 5.517 11.899 ( 1.059 -10.906 -4.125) 11.708 12.047 ( -11.756 9.026 -4.703) 15.549 12.333 ( 2.370 5.723 -0.931) 6.264 12.608 ( -5.645 4.299 1.259) 7.207 12.742 ( -2.123 0.556 1.855) 2.873 13.318 ( 2.637 0.375 -0.824) 2.788 13.468 ( -0.365 -5.129 1.975) 5.508 13.586 ( 1.463 -14.299 -10.026) 17.524 13.737 ( -6.433 -7.058 -1.148) 9.618 14.501 ( 9.166 -18.175 6.172) 21.270 16.073 ( -4.827 4.706 -9.271) 11.463 16.103 ( 2.495 13.449 -5.766) 14.844 16.278 ( -11.037 -0.297 -8.966) 14.223 16.687 ( -1.462 -5.961 -3.914) 7.280 16.922 ( 8.638 11.081 10.127) 17.320 18.353 ( 5.255 -11.880 1.042) 13.032 19.177 ( -5.829 15.654 -0.955) 16.731 20.257 ( -13.773 -9.004 17.847) 24.275 ======================= Grid point 21 (14/205) ======================= q-point: ( 0.33 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.068 ( 10.652 15.592 19.865) 27.408 2.826 ( 25.092 18.673 10.190) 32.896 3.221 ( -19.803 -4.533 8.205) 21.909 3.897 ( 9.229 -3.474 -5.589) 11.335 4.350 ( -11.951 10.874 3.174) 16.467 4.517 ( 32.804 8.181 7.953) 34.732 4.703 ( 23.972 4.058 -1.659) 24.370 4.918 ( -0.221 2.827 7.587) 8.099 5.247 ( -0.556 0.940 0.743) 1.321 5.455 ( -6.124 5.191 13.619) 15.809 5.684 ( 8.055 9.612 8.935) 15.398 5.991 ( 7.835 14.122 7.487) 17.801 6.422 ( -11.075 6.473 -4.455) 13.579 6.686 ( -5.749 -10.626 1.489) 12.173 6.967 ( 3.612 2.454 5.844) 7.295 7.460 ( 7.666 5.197 6.426) 11.272 7.807 ( -5.145 12.620 -7.773) 15.690 8.264 ( -2.200 10.852 -6.413) 12.796 8.430 ( 2.433 6.983 7.051) 10.218 8.659 ( -7.586 -5.474 -0.234) 9.358 8.889 ( -4.828 0.478 0.078) 4.852 9.159 ( -2.722 -6.131 -8.862) 11.115 9.548 ( 0.517 2.835 11.058) 11.427 9.637 ( -5.332 -2.000 0.834) 5.755 10.256 ( 0.777 -14.148 -2.758) 14.435 10.713 ( -8.299 -4.062 -7.524) 11.916 10.983 ( 0.833 -6.452 -5.668) 8.629 11.294 ( 5.238 -4.142 -0.446) 6.693 11.527 ( 5.115 0.424 -5.910) 7.828 11.751 ( 3.335 -5.800 0.970) 6.760 11.782 ( -11.191 7.663 -4.069) 14.160 11.930 ( 3.087 -8.334 -0.136) 8.888 12.310 ( -2.659 0.496 -4.066) 4.884 12.467 ( -4.162 6.370 -4.232) 8.707 12.764 ( -2.317 3.873 6.974) 8.306 13.244 ( -2.050 -4.600 -8.757) 10.102 13.446 ( -2.551 -4.692 -3.905) 6.616 13.552 ( -1.518 1.661 -4.293) 4.847 13.734 ( 3.748 -16.382 8.733) 18.939 14.677 ( 5.284 -23.307 2.554) 24.035 15.904 ( -3.746 8.137 -8.142) 12.105 16.014 ( -7.845 -0.749 -6.235) 10.049 16.083 ( 0.866 5.883 -4.293) 7.334 16.605 ( -2.553 -6.004 -4.195) 7.756 17.258 ( 14.434 12.281 12.423) 22.660 18.361 ( -4.291 -7.904 -3.146) 9.528 19.109 ( -0.871 11.327 0.435) 11.369 20.182 ( -10.522 -10.869 11.397) 18.941 ======================= Grid point 22 (15/205) ======================= q-point: ( 0.44 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.488 ( 16.682 6.389 11.504) 21.247 2.897 ( -19.851 -0.732 0.202) 19.866 3.356 ( 21.718 12.621 7.733) 26.282 3.824 ( -9.671 2.231 -7.979) 12.735 4.146 ( -7.237 14.191 1.266) 15.980 4.869 ( 0.608 2.246 1.721) 2.894 5.048 ( 24.532 2.554 -8.352) 26.040 5.232 ( 3.368 -0.157 -0.363) 3.391 5.275 ( 1.881 -0.029 12.050) 12.196 5.462 ( 4.294 1.794 6.884) 8.309 5.861 ( -3.846 7.396 9.058) 12.310 6.138 ( -6.361 12.708 -4.351) 14.863 6.204 ( 2.785 14.663 2.730) 15.173 6.602 ( -3.176 -14.917 0.576) 15.263 7.042 ( 0.290 8.211 0.850) 8.260 7.638 ( -3.682 15.971 -3.688) 16.800 7.672 ( 5.604 8.754 6.333) 12.171 8.228 ( 2.968 11.154 -3.579) 12.084 8.422 ( -4.946 6.577 -1.487) 8.362 8.552 ( -4.181 -2.737 0.783) 5.058 8.820 ( -2.060 2.615 -0.445) 3.358 9.027 ( -1.540 -6.240 -3.305) 7.227 9.580 ( -1.729 1.270 0.243) 2.159 9.764 ( 6.342 -9.964 12.217) 16.993 10.233 ( -1.976 -11.521 0.820) 11.718 10.387 ( -8.765 -9.459 -14.396) 19.327 11.063 ( 7.146 -0.551 -0.734) 7.205 11.322 ( -1.591 -3.689 -0.941) 4.126 11.549 ( -0.784 7.463 -2.229) 7.829 11.591 ( -2.539 -2.302 0.345) 3.445 11.883 ( 6.422 -13.233 0.728) 14.727 11.991 ( 2.155 -4.347 4.410) 6.557 12.150 ( -7.188 -0.079 -6.565) 9.735 12.415 ( -0.090 9.511 -0.879) 9.551 12.779 ( -1.522 -1.215 3.203) 3.749 13.135 ( -0.946 0.906 -5.103) 5.268 13.381 ( -0.948 -9.578 -1.787) 9.789 13.488 ( -1.413 2.095 -0.985) 2.712 13.871 ( 2.296 -10.231 3.697) 11.118 14.752 ( 1.582 -25.248 0.566) 25.304 15.788 ( -1.868 9.026 -3.299) 9.790 15.885 ( -2.150 -0.195 -1.960) 2.916 16.061 ( 0.107 2.709 -1.485) 3.091 16.534 ( -1.254 -5.719 -1.885) 6.151 17.637 ( 12.571 8.886 9.088) 17.877 18.162 ( -9.644 -2.180 -5.797) 11.461 19.127 ( 1.068 6.863 0.398) 6.957 20.124 ( -4.041 -12.248 3.891) 13.472 ======================= Grid point 27 (16/205) ======================= q-point: ( 0.00 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.934 ( 0.000 25.319 0.000) 25.319 2.123 ( 0.000 30.405 0.000) 30.405 2.788 ( 0.000 -16.582 0.000) 16.582 3.035 ( 0.000 -9.616 0.000) 9.616 3.958 ( 0.000 29.144 0.000) 29.144 4.086 ( 0.000 5.261 0.000) 5.261 4.861 ( 0.000 -3.374 0.000) 3.374 4.894 ( 0.000 7.598 0.000) 7.598 5.228 ( 0.000 1.863 0.000) 1.863 5.287 ( 0.000 1.953 0.000) 1.953 5.744 ( 0.000 9.604 0.000) 9.604 5.883 ( 0.000 7.038 0.000) 7.038 6.456 ( 0.000 -5.815 0.000) 5.815 6.597 ( 0.000 -4.088 0.000) 4.088 6.944 ( 0.000 6.778 0.000) 6.778 7.239 ( 0.000 -7.405 0.000) 7.405 7.590 ( 0.000 7.588 0.000) 7.588 8.157 ( 0.000 -12.848 0.000) 12.848 8.632 ( 0.000 10.351 0.000) 10.351 8.900 ( 0.000 -2.649 0.000) 2.649 9.206 ( 0.000 -6.869 0.000) 6.869 9.256 ( 0.000 -6.936 0.000) 6.936 9.619 ( 0.000 27.486 0.000) 27.486 9.905 ( 0.000 0.150 0.000) 0.150 10.252 ( 0.000 -9.539 0.000) 9.539 10.676 ( 0.000 -10.544 0.000) 10.544 10.881 ( 0.000 1.768 0.000) 1.768 11.069 ( 0.000 -1.170 0.000) 1.170 11.509 ( 0.000 -4.636 0.000) 4.636 11.612 ( 0.000 -20.354 0.000) 20.354 12.125 ( 0.000 8.847 0.000) 8.847 12.342 ( 0.000 6.867 0.000) 6.867 12.482 ( 0.000 4.192 0.000) 4.192 12.668 ( 0.000 1.909 0.000) 1.909 12.752 ( 0.000 15.316 0.000) 15.316 13.329 ( 0.000 -11.291 0.000) 11.291 13.359 ( 0.000 -8.335 0.000) 8.335 13.429 ( 0.000 -9.003 0.000) 9.003 13.950 ( 0.000 -0.661 0.000) 0.661 14.007 ( 0.000 -2.184 0.000) 2.184 16.347 ( 0.000 0.070 0.000) 0.070 16.493 ( 0.000 -5.998 0.000) 5.998 16.627 ( 0.000 1.755 0.000) 1.755 16.698 ( 0.000 19.505 0.000) 19.505 16.797 ( 0.000 6.875 0.000) 6.875 17.802 ( 0.000 -19.953 0.000) 19.953 19.681 ( 0.000 14.142 0.000) 14.142 20.164 ( 0.000 -8.986 0.000) 8.986 ======================= Grid point 28 (17/205) ======================= q-point: ( 0.11 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.176 ( -0.699 29.527 10.200) 31.247 2.211 ( 20.458 22.845 10.558) 32.432 2.967 ( 12.471 -14.259 8.336) 20.696 3.106 ( 4.494 -11.791 7.030) 14.445 3.929 ( 3.469 21.291 -2.465) 21.712 4.212 ( 6.027 4.660 5.927) 9.653 4.834 ( -2.312 -0.120 0.089) 2.316 4.924 ( 1.973 8.566 0.406) 8.799 5.224 ( -0.002 4.513 -0.405) 4.531 5.358 ( 7.625 1.927 1.558) 8.017 5.786 ( 1.449 8.007 1.807) 8.335 5.839 ( -6.201 6.095 6.285) 10.728 6.488 ( 2.678 -2.007 4.787) 5.841 6.694 ( 5.741 -3.889 3.708) 7.863 6.895 ( -3.249 6.405 -3.044) 7.801 7.228 ( -1.073 -7.543 1.202) 7.713 7.693 ( 7.767 7.113 4.956) 11.640 8.237 ( 6.943 -11.898 1.062) 13.816 8.614 ( -2.330 8.909 1.120) 9.277 8.889 ( -2.279 -0.517 1.764) 2.928 9.133 ( -7.337 -1.462 3.718) 8.354 9.220 ( -8.823 -3.501 2.697) 9.868 9.663 ( 6.826 17.229 -2.798) 18.742 9.822 ( -4.347 0.458 -5.472) 7.004 10.184 ( -6.716 -7.509 -1.001) 10.123 10.725 ( 2.474 -10.291 1.378) 10.674 10.928 ( 6.820 -0.543 -3.504) 7.687 11.048 ( -0.068 -3.186 -4.094) 5.188 11.440 ( -2.641 -5.859 -2.384) 6.855 11.604 ( -0.886 -17.405 -4.265) 17.942 12.048 ( -2.798 10.912 -4.971) 12.313 12.354 ( -4.265 -1.061 1.726) 4.721 12.471 ( 2.557 12.869 -3.035) 13.467 12.729 ( 1.305 2.715 5.036) 5.868 12.779 ( -1.402 10.548 7.491) 13.013 13.227 ( -4.544 -8.751 -7.662) 12.487 13.296 ( -0.048 -10.224 -5.728) 11.720 13.454 ( 0.592 -7.854 -0.899) 7.927 13.875 ( -3.820 1.756 -4.405) 6.089 14.072 ( 2.817 -7.447 3.786) 8.816 16.280 ( -4.404 0.718 -5.045) 6.735 16.357 ( -5.645 0.342 -8.492) 10.203 16.552 ( -2.794 3.665 -5.194) 6.944 16.664 ( -3.493 -3.727 -5.747) 7.689 16.958 ( 9.566 20.558 9.517) 24.591 17.890 ( 7.017 -19.019 2.599) 20.438 19.625 ( -5.010 14.731 -1.483) 15.630 20.133 ( -7.336 -9.809 7.051) 14.133 ======================= Grid point 29 (18/205) ======================= q-point: ( 0.22 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( -3.737 25.873 17.409) 31.408 2.721 ( 20.893 20.127 11.107) 31.065 3.158 ( -6.208 -13.845 14.215) 20.791 3.426 ( 20.464 -12.795 4.481) 24.547 4.134 ( 22.003 13.615 -0.161) 25.875 4.407 ( 12.244 -0.538 2.778) 12.567 4.764 ( -6.954 8.885 0.599) 11.298 4.962 ( 0.956 5.268 1.395) 5.533 5.234 ( 2.219 2.751 -1.223) 3.740 5.538 ( 4.477 -1.741 0.873) 4.882 5.747 ( -1.451 15.449 10.544) 18.760 5.960 ( 5.222 5.577 11.776) 14.037 6.580 ( -2.891 -0.972 5.494) 6.283 6.739 ( -8.048 -4.135 -1.903) 9.247 6.876 ( 6.975 9.537 6.383) 13.430 7.287 ( 5.764 -5.037 4.595) 8.927 7.919 ( 9.266 6.338 5.622) 12.555 8.373 ( 5.545 -5.592 1.714) 8.059 8.576 ( -3.755 3.623 1.644) 5.471 8.818 ( -8.134 10.036 -1.133) 12.968 9.017 ( -5.706 -0.779 -0.038) 5.759 9.069 ( -8.759 -4.940 3.172) 10.545 9.681 ( -4.303 -0.623 -1.627) 4.642 9.772 ( 2.885 12.597 -1.360) 12.995 10.024 ( -5.520 -8.446 -4.959) 11.243 10.718 ( -4.647 -15.449 -1.823) 16.235 10.923 ( -2.449 -1.640 -3.334) 4.450 11.091 ( 9.553 -3.145 -6.323) 11.880 11.438 ( 4.833 -5.443 -2.598) 7.728 11.502 ( -0.970 -13.537 -6.905) 15.227 11.973 ( -1.461 10.399 -2.543) 10.805 12.202 ( -11.817 3.643 -1.359) 12.441 12.480 ( 2.037 10.615 -5.814) 12.273 12.686 ( -4.613 2.260 -6.425) 8.226 12.833 ( -2.147 2.583 6.340) 7.174 13.136 ( -1.725 -19.064 -2.810) 19.348 13.261 ( 2.794 -0.371 -2.781) 3.959 13.475 ( 1.338 -1.841 6.140) 6.548 13.746 ( -4.440 3.902 -5.248) 7.904 14.158 ( 3.072 -15.287 1.843) 15.701 16.120 ( -5.202 1.226 -6.921) 8.744 16.175 ( -6.188 -1.314 -6.922) 9.377 16.382 ( -4.648 5.664 -11.086) 13.289 16.566 ( -1.966 -5.467 -5.181) 7.785 17.245 ( 11.140 19.501 9.439) 24.362 18.055 ( 7.264 -17.047 1.870) 18.625 19.494 ( -7.097 15.060 -1.347) 16.703 20.046 ( -10.557 -11.530 8.180) 17.644 ======================= Grid point 30 (19/205) ======================= q-point: ( 0.33 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.419 ( 0.088 17.728 18.046) 25.297 3.038 ( -11.348 -9.355 11.006) 18.369 3.216 ( 15.640 15.306 7.475) 23.124 3.761 ( 12.242 -9.276 -0.782) 15.379 4.586 ( -8.616 10.356 2.316) 13.669 4.652 ( 29.249 4.444 -0.781) 29.595 4.776 ( 25.629 2.935 -1.906) 25.867 4.933 ( -5.452 -1.268 1.010) 5.688 5.278 ( 2.462 4.241 0.300) 4.913 5.514 ( -3.441 -1.341 1.713) 4.071 5.970 ( 2.016 14.351 16.794) 22.182 6.224 ( 5.756 5.452 17.432) 19.150 6.479 ( -8.724 -0.481 0.236) 8.740 6.524 ( -9.530 -1.400 -3.400) 10.215 7.122 ( 8.847 11.577 7.969) 16.607 7.512 ( 10.050 -1.685 8.864) 13.507 8.049 ( -0.293 10.526 0.152) 10.532 8.453 ( 0.662 6.618 -2.893) 7.253 8.496 ( -4.739 -7.000 2.365) 8.778 8.668 ( -3.938 13.526 3.114) 14.428 8.882 ( -9.740 -3.923 -1.121) 10.560 9.022 ( 2.670 -6.174 -2.880) 7.318 9.602 ( -5.388 3.915 1.512) 6.830 9.702 ( -3.911 9.371 -3.550) 10.757 9.969 ( 0.943 -13.182 -0.636) 13.231 10.489 ( -12.069 -18.533 -11.837) 25.085 10.905 ( 2.659 0.127 0.219) 2.671 11.151 ( 4.518 -8.497 -5.237) 10.956 11.507 ( 7.055 -4.329 -4.298) 9.326 11.538 ( 6.008 -6.728 0.112) 9.021 11.923 ( -2.680 4.659 -2.792) 6.056 11.931 ( -12.714 4.687 -3.128) 13.906 12.424 ( -1.891 10.643 -4.366) 11.658 12.554 ( -2.348 2.156 -4.578) 5.579 12.793 ( -4.192 -4.448 -1.717) 6.349 13.069 ( -0.588 -19.708 -4.461) 20.215 13.305 ( 1.294 9.703 1.983) 9.988 13.621 ( -1.155 4.948 -0.847) 5.151 13.643 ( 2.527 -1.193 8.185) 8.649 14.213 ( 1.886 -21.473 0.136) 21.556 15.974 ( -3.511 0.755 -5.769) 6.796 16.003 ( -5.546 -0.443 -4.633) 7.240 16.213 ( -2.369 6.231 -8.729) 10.983 16.472 ( -2.290 -6.738 -5.254) 8.846 17.545 ( 11.593 15.220 8.538) 20.951 18.149 ( 1.910 -12.543 -1.149) 12.739 19.368 ( -5.035 13.514 -0.710) 14.439 19.932 ( -9.252 -13.206 5.669) 17.092 ======================= Grid point 31 (20/205) ======================= q-point: ( 0.44 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.635 ( 7.153 7.400 10.006) 14.354 2.862 ( -12.545 -2.936 2.132) 13.059 3.584 ( 13.932 9.446 5.868) 17.826 3.825 ( -1.424 -2.076 -5.304) 5.871 4.438 ( -6.104 13.654 1.118) 14.998 4.848 ( -3.187 -4.732 0.364) 5.717 5.110 ( 23.159 3.679 -5.424) 24.068 5.252 ( 12.396 -2.043 4.928) 13.495 5.314 ( 4.707 6.520 -3.343) 8.709 5.471 ( 0.080 -0.702 1.121) 1.325 5.932 ( -19.468 1.658 9.430) 21.695 6.286 ( -8.512 -14.601 6.012) 17.939 6.436 ( 2.771 15.330 0.799) 15.599 6.539 ( 7.001 13.423 2.137) 15.289 7.288 ( 3.025 14.718 2.367) 15.211 7.759 ( 6.462 -1.914 5.403) 8.638 7.964 ( -4.624 15.118 -0.666) 15.823 8.427 ( -0.620 1.188 3.479) 3.728 8.447 ( 0.118 -0.920 -1.975) 2.182 8.581 ( -7.019 4.661 -7.439) 11.240 8.843 ( 1.863 2.141 8.508) 8.969 9.003 ( -0.310 4.255 -6.746) 7.982 9.554 ( -0.907 -2.960 3.224) 4.470 9.668 ( 0.657 2.502 1.002) 2.774 9.979 ( -0.048 -12.251 0.564) 12.264 10.136 ( -9.426 -16.255 -11.425) 21.991 10.996 ( 4.314 -3.869 1.591) 6.009 11.170 ( 1.007 -9.263 -1.409) 9.423 11.551 ( 0.869 -0.688 -3.661) 3.825 11.643 ( 4.108 -3.044 1.393) 5.299 11.719 ( -4.935 3.448 -1.392) 6.179 11.868 ( -1.723 -5.917 -1.312) 6.301 12.354 ( -1.672 14.001 -1.435) 14.173 12.512 ( -0.044 2.233 -0.534) 2.296 12.697 ( -2.521 -6.789 -2.545) 7.676 13.037 ( 0.183 -17.869 -1.538) 17.936 13.328 ( 0.031 15.794 0.264) 15.796 13.572 ( -0.892 6.367 -0.201) 6.433 13.789 ( 2.133 -3.083 4.551) 5.896 14.233 ( 0.555 -24.600 -0.188) 24.607 15.886 ( -1.428 0.492 -2.083) 2.573 15.900 ( -1.912 1.975 -1.951) 3.370 16.125 ( -0.727 4.437 -3.028) 5.421 16.397 ( -1.101 -7.402 -2.372) 7.850 17.818 ( 8.934 8.401 6.105) 13.699 18.093 ( -4.303 -4.608 -3.676) 7.298 19.308 ( -1.270 10.706 -0.150) 10.783 19.847 ( -3.842 -14.259 1.991) 14.901 ======================= Grid point 36 (21/205) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 123 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.404 ( 0.000 -20.758 0.000) 20.758 2.404 ( 0.000 20.758 0.000) 20.758 2.681 ( 0.000 -23.238 0.000) 23.238 2.681 ( 0.000 23.238 0.000) 23.238 4.192 ( 0.000 -2.758 0.000) 2.758 4.192 ( 0.000 2.758 0.000) 2.758 4.946 ( 0.000 -5.186 0.000) 5.186 4.946 ( 0.000 5.186 0.000) 5.186 5.241 ( 0.000 -2.663 0.000) 2.663 5.241 ( 0.000 2.663 0.000) 2.663 5.927 ( 0.000 -4.628 0.000) 4.628 5.927 ( 0.000 4.628 0.000) 4.628 6.458 ( 0.000 -6.324 0.000) 6.324 6.458 ( 0.000 6.324 0.000) 6.324 7.089 ( 0.000 -7.251 0.000) 7.251 7.089 ( 0.000 7.251 0.000) 7.251 7.851 ( 0.000 -15.817 0.000) 15.817 7.851 ( 0.000 15.817 0.000) 15.817 8.809 ( 0.000 -6.663 0.000) 6.663 8.809 ( 0.000 6.663 0.000) 6.663 9.144 ( 0.000 -1.954 0.000) 1.954 9.144 ( 0.000 1.954 0.000) 1.954 9.938 ( 0.000 -1.057 0.000) 1.057 9.938 ( 0.000 1.057 0.000) 1.057 10.342 ( 0.000 -20.291 0.000) 20.291 10.342 ( 0.000 20.291 0.000) 20.291 10.966 ( 0.000 -6.771 0.000) 6.771 10.966 ( 0.000 6.771 0.000) 6.771 11.429 ( 0.000 -1.281 0.000) 1.281 11.429 ( 0.000 1.281 0.000) 1.281 12.290 ( 0.000 -6.680 0.000) 6.680 12.290 ( 0.000 6.680 0.000) 6.680 12.654 ( 0.000 -5.504 0.000) 5.504 12.654 ( 0.000 5.504 0.000) 5.504 13.070 ( 0.000 -14.301 0.000) 14.301 13.070 ( 0.000 14.301 0.000) 14.301 13.278 ( 0.000 -2.498 0.000) 2.498 13.278 ( 0.000 2.498 0.000) 2.498 13.963 ( 0.000 -1.739 0.000) 1.739 13.963 ( 0.000 1.739 0.000) 1.739 16.387 ( 0.000 -3.781 0.000) 3.781 16.387 ( 0.000 3.781 0.000) 3.781 16.679 ( 0.000 -3.309 0.000) 3.309 16.679 ( 0.000 3.309 0.000) 3.309 17.328 ( 0.000 -26.241 0.000) 26.241 17.328 ( 0.000 26.241 0.000) 26.241 19.949 ( 0.000 -11.862 0.000) 11.862 19.949 ( 0.000 11.862 0.000) 11.862 ======================= Grid point 38 (22/205) ======================= q-point: ( 0.11 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.626 ( 15.803 -17.502 7.490) 24.742 2.626 ( 15.803 17.502 7.490) 24.742 2.737 ( 1.438 -22.403 9.992) 24.572 2.737 ( 1.438 22.403 9.992) 24.572 4.191 ( 0.073 -6.937 2.514) 7.379 4.191 ( 0.073 6.937 2.514) 7.379 4.941 ( 3.344 -6.320 -5.351) 8.931 4.941 ( 3.344 6.320 -5.351) 8.931 5.333 ( 4.570 -5.311 4.434) 8.291 5.333 ( 4.570 5.311 4.434) 8.291 5.887 ( -2.543 -1.900 1.646) 3.576 5.887 ( -2.543 1.900 1.646) 3.576 6.558 ( 4.425 -7.283 7.308) 11.226 6.558 ( 4.425 7.283 7.308) 11.226 7.057 ( -2.016 -8.582 -0.380) 8.824 7.057 ( -2.016 8.582 -0.380) 8.824 7.941 ( 7.004 -15.217 3.601) 17.134 7.941 ( 7.004 15.217 3.601) 17.134 8.791 ( -2.267 -7.647 1.146) 8.058 8.791 ( -2.267 7.647 1.146) 8.058 9.137 ( -4.210 -3.279 4.409) 6.922 9.137 ( -4.210 3.279 4.409) 6.922 9.855 ( -4.168 -3.888 -5.268) 7.761 9.855 ( -4.168 3.888 -5.268) 7.761 10.347 ( -1.709 -22.464 1.162) 22.559 10.347 ( -1.709 22.464 1.162) 22.559 10.977 ( 4.246 -4.021 -4.820) 7.579 10.977 ( 4.246 4.021 -4.820) 7.579 11.396 ( -1.189 -3.653 -3.745) 5.365 11.396 ( -1.189 3.653 -3.745) 5.365 12.254 ( -3.408 -8.169 0.441) 8.862 12.254 ( -3.408 8.169 0.441) 8.862 12.701 ( 3.478 -7.598 -0.653) 8.382 12.701 ( 3.478 7.598 -0.653) 8.382 12.994 ( -6.802 -11.807 -2.503) 13.854 12.994 ( -6.802 11.807 -2.503) 13.854 13.284 ( 2.225 -7.538 -0.512) 7.876 13.284 ( 2.225 7.538 -0.512) 7.876 13.943 ( -1.382 -4.901 -1.316) 5.259 13.943 ( -1.382 4.901 -1.316) 5.259 16.314 ( -4.826 -2.565 -4.999) 7.407 16.314 ( -4.826 2.565 -4.999) 7.407 16.602 ( -3.310 -2.388 -6.175) 7.402 16.602 ( -3.310 2.388 -6.175) 7.402 17.446 ( 8.307 -23.919 4.886) 25.787 17.446 ( 8.307 23.919 4.886) 25.787 19.904 ( -5.617 -12.472 1.448) 13.755 19.904 ( -5.617 12.472 1.448) 13.755 ======================= Grid point 40 (23/205) ======================= q-point: ( 0.22 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.763 ( -6.932 -20.559 14.780) 26.252 2.763 ( -6.932 20.559 14.780) 26.252 3.128 ( 20.839 -15.750 9.148) 27.677 3.128 ( 20.839 15.750 9.148) 27.677 4.326 ( 14.761 -6.424 0.406) 16.103 4.326 ( 14.761 6.424 0.406) 16.103 4.939 ( -1.141 -6.532 -1.769) 6.863 4.939 ( -1.141 6.532 -1.769) 6.863 5.399 ( 1.766 -10.198 -2.155) 10.572 5.399 ( 1.766 10.198 -2.155) 10.572 5.975 ( 3.975 -5.246 13.455) 14.978 5.975 ( 3.975 5.246 13.455) 14.978 6.629 ( -5.914 -4.759 4.180) 8.665 6.629 ( -5.914 4.759 4.180) 8.665 7.110 ( 7.294 -11.260 5.597) 14.537 7.110 ( 7.294 11.260 5.597) 14.537 8.130 ( 7.554 -13.227 5.102) 16.064 8.130 ( 7.554 13.227 5.102) 16.064 8.763 ( -2.511 -10.363 2.000) 10.849 8.763 ( -2.511 10.363 2.000) 10.849 9.036 ( -10.061 -2.092 0.725) 10.302 9.036 ( -10.061 2.092 0.725) 10.302 9.754 ( -1.603 -7.070 -2.405) 7.638 9.754 ( -1.603 7.070 -2.405) 7.638 10.264 ( -6.284 -23.943 -3.914) 25.061 10.264 ( -6.284 23.943 -3.914) 25.061 10.998 ( 3.451 -5.848 -7.002) 9.754 10.998 ( 3.451 5.848 -7.002) 9.754 11.366 ( 3.776 -1.086 -3.162) 5.043 11.366 ( 3.776 1.086 -3.162) 5.043 12.171 ( -6.638 -6.695 -0.636) 9.449 12.171 ( -6.638 6.695 -0.636) 9.449 12.708 ( 0.578 -9.946 -5.980) 11.620 12.708 ( 0.578 9.946 -5.980) 11.620 12.819 ( -5.670 -12.006 -5.823) 14.498 12.819 ( -5.670 12.006 -5.823) 14.498 13.378 ( 3.380 -7.580 8.347) 11.771 13.378 ( 3.380 7.580 8.347) 11.771 13.890 ( -1.900 -10.280 -2.970) 10.868 13.890 ( -1.900 10.280 -2.970) 10.868 16.145 ( -6.165 -1.407 -6.614) 9.151 16.145 ( -6.165 1.407 -6.614) 9.151 16.471 ( -2.956 -3.932 -8.064) 9.446 16.471 ( -2.956 3.932 -8.064) 9.446 17.666 ( 9.459 -20.446 4.788) 23.031 17.666 ( 9.459 20.446 4.788) 23.031 19.788 ( -8.538 -13.550 1.756) 16.112 19.788 ( -8.538 13.550 1.756) 16.112 ======================= Grid point 42 (24/205) ======================= q-point: ( 0.33 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.766 ( -8.281 -15.678 14.592) 22.963 2.766 ( -8.281 15.678 14.592) 22.963 3.526 ( 14.986 -13.581 3.983) 20.613 3.526 ( 14.986 13.581 3.983) 20.613 4.699 ( 19.203 -0.568 0.401) 19.216 4.699 ( 19.203 0.568 0.401) 19.216 4.860 ( 0.280 -5.320 -2.378) 5.834 4.860 ( 0.280 5.320 -2.378) 5.834 5.414 ( 3.036 -7.344 -3.021) 8.502 5.414 ( 3.036 7.344 -3.021) 8.502 6.179 ( -8.242 -6.615 21.420) 23.885 6.179 ( -8.242 6.615 21.420) 23.885 6.522 ( -0.138 -2.022 -1.745) 2.675 6.522 ( -0.138 2.022 -1.745) 2.675 7.371 ( 10.427 -11.094 9.059) 17.716 7.371 ( 10.427 11.094 9.059) 17.716 8.263 ( 0.264 -11.063 4.842) 12.079 8.263 ( 0.264 11.063 4.842) 12.079 8.695 ( -5.528 -12.173 -5.611) 14.499 8.695 ( -5.528 12.173 -5.611) 14.499 8.898 ( -2.238 -7.780 3.602) 8.860 8.898 ( -2.238 7.780 3.602) 8.860 9.735 ( -0.700 -9.050 0.907) 9.122 9.735 ( -0.700 9.050 0.907) 9.122 10.041 ( -9.484 -21.938 -10.634) 26.160 10.041 ( -9.484 21.938 -10.634) 26.160 10.982 ( 2.120 -6.924 -3.505) 8.045 10.982 ( 2.120 6.924 -3.505) 8.045 11.465 ( 8.047 -1.680 -1.469) 8.351 11.465 ( 8.047 1.680 -1.469) 8.351 11.986 ( -9.875 -0.522 -4.493) 10.861 11.986 ( -9.875 0.522 -4.493) 10.861 12.618 ( -2.991 -6.982 -4.410) 8.783 12.618 ( -2.991 6.982 -4.410) 8.783 12.724 ( -0.075 -12.928 -3.940) 13.515 12.724 ( -0.075 12.928 -3.940) 13.515 13.539 ( 3.335 -8.888 9.376) 13.343 13.539 ( 3.335 8.888 9.376) 13.343 13.825 ( -1.558 -15.102 -2.984) 15.473 13.825 ( -1.558 15.102 -2.984) 15.473 15.988 ( -4.234 -0.850 -4.841) 6.487 15.988 ( -4.234 0.850 -4.841) 6.487 16.338 ( -2.625 -6.201 -7.396) 10.003 16.338 ( -2.625 6.201 -7.396) 10.003 17.861 ( 7.199 -15.172 3.091) 17.075 17.861 ( 7.199 15.172 3.091) 17.075 19.652 ( -7.585 -13.975 1.180) 15.944 19.652 ( -7.585 13.975 1.180) 15.944 ======================= Grid point 44 (25/205) ======================= q-point: ( 0.44 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.773 ( -3.025 -5.725 6.297) 9.032 2.773 ( -3.025 5.725 6.297) 9.032 3.742 ( 6.050 -5.936 0.503) 8.491 3.742 ( 6.050 5.936 0.503) 8.491 4.688 ( -4.353 -10.405 0.355) 11.284 4.688 ( -4.353 10.405 0.355) 11.284 5.190 ( 18.959 -3.782 -1.160) 19.367 5.190 ( 18.959 3.782 -1.160) 19.367 5.430 ( 2.282 -3.759 -3.782) 5.800 5.430 ( 2.282 3.759 -3.782) 5.800 6.031 ( -16.886 -9.075 9.358) 21.332 6.031 ( -16.886 9.075 9.358) 21.332 6.653 ( 6.193 -3.427 2.806) 7.614 6.653 ( 6.193 3.427 2.806) 7.614 7.590 ( 4.781 -13.206 3.950) 14.590 7.590 ( 4.781 13.206 3.950) 14.590 8.240 ( -4.263 -11.608 1.759) 12.491 8.240 ( -4.263 11.608 1.759) 12.491 8.553 ( -1.845 -4.897 -4.076) 6.633 8.553 ( -1.845 4.897 -4.076) 6.633 8.987 ( 3.486 -7.595 4.521) 9.501 8.987 ( 3.486 7.595 4.521) 9.501 9.700 ( -3.514 -14.516 -3.634) 15.371 9.700 ( -3.514 14.516 -3.634) 15.371 9.803 ( -3.511 -8.663 -3.801) 10.091 9.803 ( -3.511 8.663 -3.801) 10.091 11.006 ( 1.665 -5.281 -0.222) 5.542 11.006 ( 1.665 5.281 -0.222) 5.542 11.580 ( 4.983 -3.194 -0.743) 5.965 11.580 ( 4.983 3.194 -0.743) 5.965 11.787 ( -6.279 -2.762 -2.565) 7.324 11.787 ( -6.279 2.762 -2.565) 7.324 12.545 ( -1.503 -5.988 -1.341) 6.318 12.545 ( -1.503 5.988 -1.341) 6.318 12.704 ( 0.408 -14.781 -1.398) 14.852 12.704 ( 0.408 14.781 -1.398) 14.852 13.655 ( 1.421 -11.413 3.837) 12.124 13.655 ( 1.421 11.413 3.837) 12.124 13.784 ( -0.560 -17.029 -1.097) 17.073 13.784 ( -0.560 17.029 -1.097) 17.073 15.902 ( -1.468 -0.879 -1.714) 2.422 15.902 ( -1.468 0.879 -1.714) 2.422 16.246 ( -1.128 -6.974 -3.121) 7.723 16.246 ( -1.128 6.974 -3.121) 7.723 17.975 ( 2.731 -6.831 1.042) 7.430 17.975 ( 2.731 6.831 1.042) 7.430 19.559 ( -3.058 -13.500 0.390) 13.848 19.559 ( -3.058 13.500 0.390) 13.848 ======================= Grid point 81 (26/205) ======================= q-point: ( 0.00 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.719 ( 1.038 0.000 34.851) 34.867 0.761 ( 2.158 0.000 36.581) 36.645 1.406 ( 14.743 0.000 66.590) 68.202 3.396 ( -0.308 0.000 -1.532) 1.563 3.543 ( -2.339 0.000 11.810) 12.039 4.167 ( -5.230 0.000 6.832) 8.604 4.287 ( 6.320 0.000 7.545) 9.843 4.442 ( -8.018 0.000 -3.589) 8.785 5.124 ( 2.967 0.000 6.146) 6.825 5.440 ( 2.863 0.000 -9.699) 10.112 5.638 ( -4.108 0.000 5.274) 6.685 6.105 ( -3.954 0.000 2.392) 4.621 6.297 ( 1.942 0.000 8.494) 8.713 6.687 ( -6.890 0.000 -10.008) 12.150 6.694 ( -4.592 0.000 2.275) 5.125 7.461 ( 0.585 0.000 -10.220) 10.236 7.877 ( 6.278 0.000 1.927) 6.567 8.030 ( -4.056 0.000 12.462) 13.105 8.328 ( -11.449 0.000 -3.024) 11.841 8.572 ( 8.084 0.000 -1.383) 8.201 8.891 ( -6.935 0.000 1.208) 7.039 9.330 ( -1.623 0.000 -0.044) 1.624 9.970 ( 9.260 0.000 4.981) 10.515 10.161 ( -4.378 0.000 -4.935) 6.597 10.489 ( 10.447 0.000 -14.113) 17.558 10.713 ( -66.614 0.000 -3.187) 66.690 10.947 ( -2.471 0.000 2.531) 3.538 11.259 ( -0.835 0.000 -1.919) 2.093 11.608 ( -4.243 0.000 2.761) 5.062 11.638 ( 3.462 0.000 3.554) 4.962 11.923 ( -4.073 0.000 5.365) 6.736 12.395 ( 0.285 0.000 -0.118) 0.308 12.477 ( -1.677 0.000 -15.737) 15.826 12.943 ( -6.549 0.000 -13.817) 15.290 12.978 ( -10.614 0.000 -5.237) 11.835 13.140 ( -1.772 0.000 3.250) 3.702 13.615 ( -0.567 0.000 -2.582) 2.643 13.752 ( -5.700 0.000 -4.200) 7.080 14.427 ( 3.845 0.000 26.916) 27.190 14.720 ( 0.666 0.000 2.107) 2.210 15.307 ( 2.746 0.000 -0.523) 2.795 15.741 ( -14.076 0.000 -0.891) 14.104 16.580 ( 0.709 0.000 0.724) 1.013 16.852 ( -8.953 0.000 -8.485) 12.335 16.990 ( -1.665 0.000 -2.987) 3.420 18.144 ( 15.756 0.000 1.331) 15.812 18.943 ( -1.828 0.000 6.178) 6.443 20.198 ( 114.215 0.000 -2.338) 114.239 ======================= Grid point 82 (27/205) ======================= q-point: ( 0.11 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.170 ( 4.210 0.000 37.286) 37.523 1.249 ( 18.529 0.000 27.698) 33.324 2.619 ( 42.744 0.000 52.606) 67.782 3.527 ( 16.737 0.000 -3.954) 17.197 3.649 ( 1.736 0.000 7.767) 7.959 3.990 ( -17.525 0.000 14.579) 22.796 4.526 ( 7.055 0.000 7.462) 10.269 4.581 ( 14.801 0.000 10.324) 18.046 5.122 ( -11.959 0.000 -4.190) 12.672 5.454 ( 5.683 0.000 12.158) 13.420 5.609 ( -3.383 0.000 1.790) 3.827 5.970 ( -10.335 0.000 -1.801) 10.491 6.291 ( -6.883 0.000 3.123) 7.558 6.661 ( 7.927 0.000 -4.366) 9.050 6.785 ( 8.314 0.000 1.967) 8.543 7.361 ( -0.206 0.000 -8.278) 8.280 7.955 ( -15.550 0.000 -1.339) 15.608 7.984 ( 4.946 0.000 -3.522) 6.072 8.176 ( 0.023 0.000 4.405) 4.405 8.820 ( 16.240 0.000 5.473) 17.137 9.038 ( 6.884 0.000 2.100) 7.197 9.317 ( -0.878 0.000 3.014) 3.139 9.625 ( -28.642 0.000 5.732) 29.210 10.173 ( -3.035 0.000 -3.163) 4.384 10.339 ( -9.992 0.000 -10.815) 14.725 10.540 ( 25.671 0.000 -7.562) 26.761 10.986 ( 1.914 0.000 0.468) 1.971 11.193 ( -2.602 0.000 -5.859) 6.410 11.655 ( 1.960 0.000 3.772) 4.250 11.756 ( 3.821 0.000 4.181) 5.664 11.931 ( -2.691 0.000 4.332) 5.100 12.125 ( -16.376 0.000 -10.731) 19.579 12.356 ( -4.661 0.000 2.440) 5.261 12.672 ( -4.178 0.000 -12.200) 12.896 12.913 ( 3.424 0.000 -2.221) 4.081 13.108 ( -4.430 0.000 1.034) 4.549 13.570 ( -1.025 0.000 -3.677) 3.817 13.644 ( -2.498 0.000 -9.427) 9.753 14.614 ( -1.918 0.000 5.568) 5.889 15.037 ( 19.038 0.000 19.393) 27.176 15.339 ( -0.237 0.000 1.160) 1.184 15.608 ( -2.606 0.000 -2.467) 3.588 16.519 ( -14.041 0.000 -10.758) 17.689 16.640 ( 4.297 0.000 3.576) 5.590 16.901 ( -3.874 0.000 -3.773) 5.408 18.410 ( 14.060 0.000 0.772) 14.081 18.916 ( -7.963 0.000 5.035) 9.421 20.889 ( 5.401 0.000 -8.317) 9.917 ======================= Grid point 83 (28/205) ======================= q-point: ( 0.22 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.674 ( 11.190 0.000 32.708) 34.570 1.888 ( 24.598 0.000 19.740) 31.539 3.697 ( -0.138 0.000 -1.052) 1.061 3.788 ( 3.233 0.000 14.215) 14.578 3.866 ( 25.876 0.000 -8.386) 27.201 3.942 ( 20.598 0.000 43.726) 48.334 4.727 ( 5.966 0.000 7.609) 9.669 4.735 ( -22.556 0.000 -5.418) 23.197 4.986 ( 18.046 0.000 8.847) 20.098 5.530 ( -4.072 0.000 -4.867) 6.346 5.738 ( 3.033 0.000 20.015) 20.244 5.784 ( -7.678 0.000 1.243) 7.778 6.191 ( -5.380 0.000 -0.260) 5.386 6.787 ( 6.859 0.000 0.681) 6.893 6.923 ( 5.998 0.000 -1.683) 6.230 7.314 ( 2.868 0.000 -3.749) 4.720 7.603 ( -16.278 0.000 -8.057) 18.163 7.967 ( 2.311 0.000 -12.553) 12.764 8.244 ( -0.350 0.000 6.395) 6.405 9.036 ( -7.876 0.000 -0.393) 7.886 9.123 ( 8.585 0.000 -1.920) 8.797 9.219 ( -24.364 0.000 11.583) 26.977 9.477 ( 10.940 0.000 19.937) 22.741 10.012 ( -14.988 0.000 -5.393) 15.929 10.243 ( 16.475 0.000 -11.376) 20.021 10.856 ( 19.157 0.000 -9.927) 21.576 10.932 ( -2.383 0.000 -13.402) 13.612 10.992 ( -13.206 0.000 -5.623) 14.353 11.648 ( -7.081 0.000 0.922) 7.141 11.762 ( -4.753 0.000 4.204) 6.345 11.936 ( 0.107 0.000 3.362) 3.363 11.936 ( 0.794 0.000 -0.495) 0.936 12.329 ( -2.286 0.000 5.341) 5.809 12.574 ( 3.258 0.000 -5.833) 6.681 12.986 ( 4.729 0.000 0.260) 4.736 13.004 ( -6.382 0.000 -1.424) 6.539 13.463 ( -5.404 0.000 -10.236) 11.575 13.508 ( -1.453 0.000 -3.568) 3.853 14.623 ( -0.769 0.000 2.440) 2.559 15.317 ( -3.650 0.000 1.683) 4.019 15.521 ( 14.357 0.000 11.130) 18.166 15.563 ( 1.417 0.000 -4.630) 4.842 16.192 ( -11.530 0.000 -6.231) 13.106 16.748 ( -0.608 0.000 -4.634) 4.674 16.886 ( 7.842 0.000 11.278) 13.737 18.647 ( 13.371 0.000 -4.041) 13.968 18.745 ( -14.366 0.000 0.936) 14.397 20.773 ( -9.637 0.000 -0.444) 9.647 ======================= Grid point 84 (29/205) ======================= q-point: ( 0.33 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( 12.938 0.000 23.158) 26.527 2.520 ( 26.957 0.000 12.277) 29.621 3.434 ( -25.778 0.000 3.527) 26.019 3.797 ( 0.682 0.000 3.174) 3.246 4.082 ( -12.729 0.000 -8.739) 15.440 4.389 ( 13.113 0.000 -10.882) 17.040 4.807 ( 3.856 0.000 14.843) 15.335 5.006 ( 28.707 0.000 17.738) 33.745 5.387 ( 17.066 0.000 6.448) 18.244 5.393 ( -3.680 0.000 -6.540) 7.504 5.725 ( -2.649 0.000 4.284) 5.037 5.838 ( -12.041 0.000 11.840) 16.887 6.089 ( -6.174 0.000 0.282) 6.181 6.899 ( 3.073 0.000 3.420) 4.598 6.976 ( 4.814 0.000 -6.350) 7.968 7.234 ( -13.604 0.000 -8.661) 16.127 7.405 ( 6.471 0.000 1.144) 6.571 7.854 ( 2.878 0.000 -13.197) 13.507 8.261 ( -2.875 0.000 0.771) 2.976 8.814 ( -12.704 0.000 -0.734) 12.725 9.007 ( -16.170 0.000 18.912) 24.883 9.157 ( 1.271 0.000 -3.662) 3.876 9.714 ( -11.448 0.000 0.658) 11.466 10.022 ( 16.863 0.000 22.520) 28.134 10.479 ( 20.962 0.000 -10.684) 23.528 10.558 ( -10.711 0.000 -24.450) 26.693 10.766 ( -11.128 0.000 1.016) 11.174 11.047 ( 13.611 0.000 -10.115) 16.958 11.478 ( -11.018 0.000 1.934) 11.187 11.797 ( 0.084 0.000 6.144) 6.144 11.958 ( 1.510 0.000 -0.158) 1.519 11.970 ( -0.145 0.000 1.490) 1.497 12.354 ( -1.455 0.000 4.417) 4.651 12.594 ( 1.918 0.000 -4.574) 4.960 12.899 ( -2.146 0.000 -0.874) 2.317 13.068 ( 2.621 0.000 2.281) 3.474 13.285 ( -3.806 0.000 -5.634) 6.799 13.458 ( -0.712 0.000 -1.669) 1.815 14.641 ( -0.076 0.000 2.394) 2.395 15.256 ( -3.843 0.000 0.656) 3.899 15.563 ( 3.270 0.000 -3.664) 4.911 15.769 ( 5.765 0.000 3.950) 6.988 15.992 ( -7.160 0.000 0.042) 7.160 16.665 ( -1.980 0.000 -2.823) 3.448 17.253 ( 14.596 0.000 12.949) 19.512 18.427 ( -18.040 0.000 -3.831) 18.442 18.800 ( 11.209 0.000 -9.902) 14.957 20.577 ( -9.968 0.000 -2.614) 10.305 ======================= Grid point 85 (30/205) ======================= q-point: ( 0.44 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.575 ( 11.893 0.000 7.639) 14.136 2.900 ( -32.749 0.000 -1.770) 32.797 3.090 ( 23.253 0.000 4.774) 23.738 3.530 ( -27.104 0.000 -7.634) 28.158 3.884 ( 2.641 0.000 6.765) 7.263 4.679 ( 25.677 0.000 -18.357) 31.564 4.852 ( -4.995 0.000 6.199) 7.961 5.204 ( -5.992 0.000 -15.616) 16.726 5.493 ( 7.788 0.000 2.634) 8.221 5.581 ( -22.273 0.000 2.919) 22.464 5.719 ( 12.135 0.000 5.928) 13.505 5.734 ( -6.854 0.000 4.344) 8.115 5.936 ( -10.079 0.000 -1.985) 10.272 6.967 ( 3.821 0.000 -11.212) 11.845 6.978 ( 0.220 0.000 4.138) 4.144 7.075 ( 4.691 0.000 5.724) 7.401 7.390 ( -1.015 0.000 -13.020) 13.060 7.977 ( 11.457 0.000 9.262) 14.732 8.158 ( -3.458 0.000 -7.056) 7.858 8.611 ( -8.881 0.000 0.850) 8.922 9.037 ( -7.225 0.000 26.576) 27.541 9.128 ( 0.630 0.000 -4.310) 4.356 9.573 ( -5.461 0.000 2.259) 5.909 10.031 ( -10.940 0.000 -25.543) 27.787 10.491 ( -0.988 0.000 7.547) 7.611 10.751 ( 9.335 0.000 17.673) 19.987 10.761 ( 19.646 0.000 -7.154) 20.908 11.158 ( 9.377 0.000 -8.484) 12.645 11.330 ( -9.851 0.000 7.122) 12.156 11.791 ( -4.520 0.000 -2.502) 5.167 11.949 ( -1.690 0.000 -2.152) 2.736 11.986 ( 1.633 0.000 1.033) 1.932 12.346 ( -2.916 0.000 1.683) 3.366 12.593 ( 2.702 0.000 1.142) 2.934 12.850 ( -1.345 0.000 -6.526) 6.663 13.123 ( 0.137 0.000 3.488) 3.491 13.279 ( 3.471 0.000 5.753) 6.719 13.456 ( 0.710 0.000 1.263) 1.449 14.664 ( -0.484 0.000 3.012) 3.051 15.205 ( -1.837 0.000 -0.127) 1.842 15.611 ( 4.341 0.000 -0.374) 4.357 15.851 ( 0.497 0.000 1.996) 2.057 15.927 ( -2.710 0.000 4.781) 5.496 16.642 ( 0.856 0.000 0.758) 1.143 17.499 ( -2.061 0.000 -0.926) 2.259 18.143 ( -4.041 0.000 0.798) 4.119 18.845 ( 7.873 0.000 -15.519) 17.402 20.363 ( -7.006 0.000 -9.309) 11.651 ======================= Grid point 86 (31/205) ======================= q-point: (-0.44 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.226 ( -32.893 0.000 -7.749) 33.794 2.764 ( -34.230 0.000 -9.650) 35.564 2.849 ( 12.018 0.000 2.834) 12.347 3.700 ( 28.136 0.000 0.384) 28.139 3.955 ( -2.627 0.000 -0.066) 2.628 4.729 ( -13.397 0.000 -5.536) 14.496 4.752 ( -25.172 0.000 -13.298) 28.469 4.847 ( 14.824 0.000 -23.518) 27.800 5.143 ( -27.446 0.000 1.517) 27.488 5.541 ( -4.399 0.000 -1.133) 4.543 5.586 ( 3.443 0.000 -2.546) 4.282 5.678 ( -13.373 0.000 -2.400) 13.586 5.971 ( 9.171 0.000 2.786) 9.585 6.892 ( 4.380 0.000 -15.651) 16.253 6.999 ( -1.147 0.000 3.522) 3.704 7.259 ( 1.373 0.000 -9.872) 9.967 7.451 ( 14.867 0.000 18.643) 23.845 8.035 ( -0.384 0.000 -8.994) 9.002 8.250 ( 3.284 0.000 10.353) 10.862 8.553 ( 1.080 0.000 2.471) 2.697 9.138 ( 5.908 0.000 -3.463) 6.848 9.220 ( -3.525 0.000 26.581) 26.814 9.459 ( -8.075 0.000 -14.055) 16.210 9.670 ( -3.515 0.000 -3.786) 5.166 10.482 ( 2.222 0.000 -2.383) 3.258 10.996 ( 7.531 0.000 -0.915) 7.587 11.156 ( 8.577 0.000 15.648) 17.844 11.210 ( 4.596 0.000 -3.662) 5.876 11.321 ( 0.870 0.000 10.098) 10.135 11.637 ( -3.713 0.000 -5.654) 6.764 11.874 ( -2.688 0.000 -4.147) 4.942 12.045 ( 0.830 0.000 4.589) 4.663 12.291 ( -3.441 0.000 -0.769) 3.526 12.673 ( 1.352 0.000 1.118) 1.754 12.789 ( 3.857 0.000 -2.558) 4.628 13.140 ( -2.570 0.000 3.926) 4.692 13.468 ( 6.710 0.000 10.591) 12.537 13.503 ( 1.768 0.000 3.058) 3.533 14.683 ( -1.516 0.000 4.183) 4.450 15.189 ( 0.447 0.000 -0.541) 0.702 15.697 ( 2.602 0.000 3.432) 4.307 15.819 ( -6.263 0.000 0.071) 6.264 16.002 ( 4.282 0.000 8.276) 9.318 16.707 ( 3.568 0.000 3.329) 4.880 17.171 ( -18.080 0.000 -12.215) 21.820 18.309 ( 11.572 0.000 5.524) 12.823 18.762 ( 3.254 0.000 -21.026) 21.276 20.130 ( -2.577 0.000 -19.876) 20.043 ======================= Grid point 87 (32/205) ======================= q-point: (-0.33 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.593 ( -31.650 0.000 0.685) 31.658 2.021 ( -36.248 0.000 -9.442) 37.458 3.101 ( 11.906 0.000 -1.175) 11.964 3.452 ( -38.488 0.000 -26.640) 46.808 4.172 ( 19.408 0.000 -1.785) 19.490 4.252 ( -13.210 0.000 1.309) 13.275 4.448 ( -10.252 0.000 -8.048) 13.033 4.672 ( -19.486 0.000 0.539) 19.493 4.731 ( -1.306 0.000 -22.459) 22.497 5.428 ( -10.548 0.000 -3.234) 11.033 5.533 ( 1.483 0.000 2.136) 2.600 5.702 ( 7.987 0.000 2.625) 8.407 6.103 ( 3.856 0.000 -0.645) 3.909 6.891 ( 9.706 0.000 -8.334) 12.793 7.008 ( -0.647 0.000 1.488) 1.623 7.227 ( 2.984 0.000 -5.701) 6.434 7.813 ( 2.184 0.000 16.050) 16.198 8.003 ( 6.283 0.000 -3.332) 7.111 8.248 ( -7.224 0.000 -1.226) 7.328 8.693 ( 11.943 0.000 1.046) 11.989 9.013 ( -8.455 0.000 -20.033) 21.744 9.358 ( 3.378 0.000 8.484) 9.132 9.429 ( -1.164 0.000 22.002) 22.033 9.730 ( 9.217 0.000 -0.920) 9.262 10.570 ( 13.365 0.000 -6.909) 15.045 10.997 ( -8.776 0.000 9.008) 12.576 11.271 ( -0.120 0.000 -2.184) 2.187 11.293 ( 5.032 0.000 1.725) 5.319 11.533 ( 6.562 0.000 13.551) 15.056 11.645 ( 3.034 0.000 2.272) 3.790 11.782 ( -2.480 0.000 -3.581) 4.356 12.080 ( -1.926 0.000 5.663) 5.982 12.224 ( -1.892 0.000 -1.336) 2.317 12.745 ( 4.400 0.000 7.435) 8.639 12.886 ( 6.047 0.000 -1.138) 6.153 13.111 ( -4.716 0.000 3.747) 6.024 13.572 ( 1.815 0.000 3.543) 3.981 13.703 ( 6.615 0.000 10.814) 12.677 14.694 ( -2.901 0.000 5.789) 6.475 15.210 ( 2.020 0.000 0.122) 2.024 15.561 ( -19.941 0.000 -6.587) 21.000 15.760 ( -0.570 0.000 5.698) 5.726 16.253 ( 11.588 0.000 11.382) 16.243 16.766 ( -6.697 0.000 -6.011) 8.999 16.846 ( 0.850 0.000 2.474) 2.616 18.529 ( -1.613 0.000 -28.399) 28.445 18.558 ( 10.414 0.000 3.112) 10.869 19.841 ( 0.786 0.000 -35.998) 36.006 ======================= Grid point 88 (33/205) ======================= q-point: (-0.22 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.121 ( -29.663 0.000 15.194) 33.328 1.290 ( -36.079 0.000 -3.811) 36.279 2.195 ( -57.345 0.000 -25.084) 62.591 3.388 ( 9.310 0.000 2.674) 9.686 3.993 ( -25.121 0.000 -0.283) 25.123 4.092 ( -7.560 0.000 5.645) 9.435 4.285 ( 0.987 0.000 -7.480) 7.544 4.418 ( -7.081 0.000 -14.443) 16.085 4.855 ( 24.320 0.000 -1.035) 24.342 5.235 ( -6.217 0.000 -3.553) 7.161 5.594 ( -0.000 0.000 5.853) 5.853 5.893 ( 8.779 0.000 3.663) 9.513 6.130 ( 2.453 0.000 -2.955) 3.841 6.971 ( -3.270 0.000 4.210) 5.330 6.997 ( -0.434 0.000 -2.606) 2.642 7.279 ( 11.716 0.000 -6.636) 13.465 7.885 ( -0.940 0.000 4.858) 4.948 8.039 ( -8.899 0.000 -7.813) 11.842 8.189 ( 6.402 0.000 10.312) 12.137 8.701 ( -5.895 0.000 -13.291) 14.540 8.977 ( 16.667 0.000 2.575) 16.865 9.425 ( -4.030 0.000 5.146) 6.536 9.581 ( 0.416 0.000 6.105) 6.119 9.976 ( 20.065 0.000 -5.161) 20.718 10.809 ( 17.809 0.000 -5.884) 18.756 10.866 ( -15.200 0.000 5.290) 16.094 11.249 ( 1.581 0.000 -2.836) 3.247 11.446 ( 6.995 0.000 1.464) 7.146 11.646 ( -1.348 0.000 -4.629) 4.822 11.747 ( -0.823 0.000 6.363) 6.416 11.836 ( 3.119 0.000 38.991) 39.115 12.180 ( 6.145 0.000 9.039) 10.930 12.232 ( 3.958 0.000 0.303) 3.970 12.942 ( 4.985 0.000 10.629) 11.740 12.960 ( 4.846 0.000 -3.247) 5.833 13.067 ( -4.865 0.000 7.597) 9.021 13.633 ( 0.640 0.000 4.013) 4.063 13.915 ( 5.580 0.000 8.847) 10.460 14.673 ( -9.087 0.000 6.935) 11.431 15.008 ( -26.898 0.000 -10.423) 28.847 15.263 ( 2.281 0.000 2.553) 3.424 15.822 ( -0.578 0.000 12.260) 12.274 16.611 ( 13.773 0.000 11.390) 17.873 16.622 ( -3.025 0.000 -1.943) 3.595 16.949 ( 3.721 0.000 2.726) 4.613 18.095 ( -5.960 0.000 -48.770) 49.133 18.745 ( 7.036 0.000 2.767) 7.560 19.351 ( -5.466 0.000 -56.895) 57.157 ======================= Grid point 89 (34/205) ======================= q-point: (-0.11 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.708 ( -34.395 0.000 7.228) 35.147 0.714 ( -29.865 0.000 15.659) 33.721 1.149 ( -43.750 0.000 33.184) 54.911 3.493 ( -2.313 0.000 8.270) 8.587 3.577 ( -17.563 0.000 -0.878) 17.585 4.103 ( 1.358 0.000 2.811) 3.122 4.229 ( -3.172 0.000 -1.939) 3.718 4.389 ( 14.116 0.000 1.669) 14.215 5.075 ( -0.938 0.000 0.778) 1.218 5.317 ( 19.050 0.000 -6.104) 20.004 5.635 ( -2.325 0.000 6.542) 6.943 6.066 ( 4.630 0.000 4.456) 6.426 6.167 ( 3.459 0.000 1.708) 3.858 6.848 ( -12.940 0.000 4.866) 13.825 6.924 ( -0.621 0.000 -11.415) 11.432 7.458 ( 10.771 0.000 -5.564) 12.123 7.839 ( -3.149 0.000 -5.420) 6.269 7.947 ( -0.428 0.000 9.926) 9.935 8.368 ( 2.085 0.000 6.818) 7.130 8.545 ( 0.187 0.000 -7.089) 7.092 9.260 ( 1.139 0.000 -1.955) 2.263 9.374 ( -3.400 0.000 0.393) 3.423 9.587 ( 12.424 0.000 -9.269) 15.501 10.290 ( 21.187 0.000 -8.953) 23.001 10.544 ( -21.843 0.000 -0.695) 21.854 10.976 ( 3.704 0.000 -2.886) 4.695 11.265 ( 1.766 0.000 -1.357) 2.227 11.474 ( 2.602 0.000 -10.608) 10.923 11.587 ( 0.152 0.000 -1.229) 1.239 11.789 ( -2.223 0.000 5.153) 5.612 12.283 ( 4.730 0.000 -4.726) 6.687 12.434 ( 0.340 0.000 1.885) 1.916 12.438 ( 14.546 0.000 -2.513) 14.762 13.001 ( 4.838 0.000 -4.175) 6.391 13.102 ( 2.322 0.000 5.815) 6.261 13.324 ( 13.560 0.000 16.469) 21.333 13.696 ( -1.170 0.000 6.611) 6.714 14.040 ( -2.430 0.000 -5.065) 5.618 14.287 ( -26.980 0.000 15.330) 31.031 14.741 ( -3.601 0.000 1.186) 3.791 15.312 ( -0.530 0.000 -0.797) 0.957 16.398 ( 41.508 0.000 73.541) 84.446 16.581 ( -0.867 0.000 -0.270) 0.908 16.902 ( -3.638 0.000 -15.089) 15.521 16.925 ( -32.683 0.000 -64.319) 72.147 17.010 ( 1.348 0.000 -0.229) 1.367 18.634 ( -11.853 0.000 -16.718) 20.494 18.873 ( 3.067 0.000 4.625) 5.549 ======================= Grid point 90 (35/205) ======================= q-point: ( 0.00 0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.015 ( 3.410 24.423 23.353) 33.963 1.072 ( 8.557 23.999 26.716) 36.918 1.978 ( 4.437 46.750 42.906) 63.609 3.336 ( -0.427 -5.710 1.330) 5.879 3.535 ( -0.651 -1.374 8.143) 8.284 4.199 ( -5.838 -3.570 9.942) 12.069 4.349 ( -0.395 13.457 5.175) 14.424 4.502 ( 6.229 10.090 3.775) 12.444 5.149 ( 3.142 2.343 5.788) 6.990 5.473 ( 5.347 2.526 -8.793) 10.597 5.579 ( -3.870 -5.464 5.741) 8.820 5.921 ( -5.774 -10.611 4.312) 12.826 6.400 ( 7.982 4.658 -0.666) 9.265 6.717 ( -7.429 2.876 -1.586) 8.123 6.757 ( -4.203 3.050 1.168) 5.323 7.416 ( 1.176 -3.545 -8.359) 9.155 7.785 ( 4.182 -7.046 3.542) 8.927 8.158 ( -3.449 11.371 9.081) 14.955 8.502 ( -8.238 13.208 -4.936) 16.331 8.533 ( -0.901 -1.940 0.883) 2.314 8.943 ( 4.322 4.040 3.070) 6.665 9.366 ( -1.169 1.878 1.982) 2.970 9.866 ( 11.461 -19.202 -5.688) 23.074 9.974 ( -12.163 -2.655 4.896) 13.378 10.400 ( -19.057 -6.558 -6.646) 21.221 10.658 ( 4.927 4.549 -9.352) 11.508 10.962 ( -0.653 -3.580 -1.080) 3.796 11.309 ( -0.164 -2.153 3.434) 4.056 11.587 ( -5.773 0.738 -4.228) 7.194 11.690 ( -2.890 1.015 2.382) 3.880 11.993 ( 0.629 8.780 7.524) 11.579 12.291 ( -3.899 -3.915 -4.991) 7.445 12.517 ( 6.650 -9.563 2.980) 12.023 12.574 ( -3.933 -4.905 -8.897) 10.894 12.956 ( 1.777 -12.746 7.470) 14.880 13.258 ( -10.151 7.901 -13.005) 18.292 13.589 ( 3.617 -3.231 -5.985) 7.704 13.729 ( -9.088 -1.726 -3.305) 9.823 14.165 ( -0.195 -18.071 16.456) 24.442 14.378 ( 7.768 -7.980 18.225) 21.358 15.557 ( 0.932 20.833 2.636) 21.020 16.178 ( -13.269 13.806 -15.818) 24.837 16.558 ( -0.093 -1.391 0.753) 1.585 16.830 ( -5.729 -2.196 -4.777) 7.776 16.887 ( 0.242 -6.401 0.214) 6.410 18.289 ( 2.642 1.044 -6.736) 7.310 19.052 ( -2.085 11.164 1.317) 11.433 20.276 ( 61.744 2.652 -7.270) 62.227 ======================= Grid point 91 (36/205) ======================= q-point: ( 0.11 0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( 7.713 19.838 28.666) 35.704 1.553 ( 13.969 23.704 23.943) 36.473 2.833 ( 35.140 20.123 42.533) 58.726 3.472 ( 14.243 -4.672 -0.405) 14.995 3.651 ( 3.122 -0.910 7.299) 7.991 4.097 ( -13.287 9.137 10.967) 19.501 4.534 ( 8.295 3.902 10.088) 13.631 4.709 ( 10.118 9.079 6.641) 15.130 5.188 ( -8.602 6.112 -1.179) 10.617 5.459 ( 2.412 1.217 6.121) 6.691 5.622 ( 0.363 -4.371 7.591) 8.766 5.785 ( -8.290 -6.419 -1.684) 10.619 6.451 ( -4.039 9.301 0.705) 10.165 6.658 ( 5.154 -0.138 -2.477) 5.720 6.821 ( 6.632 2.119 2.142) 7.284 7.347 ( -0.204 -0.621 -5.901) 5.937 7.858 ( -1.885 -3.785 0.453) 4.253 8.169 ( -5.172 10.583 0.424) 11.787 8.262 ( -3.929 9.515 -0.833) 10.328 8.706 ( 12.083 -6.728 4.165) 14.444 9.123 ( 3.720 3.409 3.427) 6.099 9.365 ( -1.161 5.113 4.818) 7.121 9.590 ( -21.049 -3.579 3.697) 21.669 10.020 ( 2.847 -11.941 -5.593) 13.490 10.174 ( -0.737 -7.394 -7.898) 10.844 10.760 ( 13.697 10.674 -8.806) 19.471 10.978 ( 1.651 -1.111 -1.455) 2.465 11.260 ( -3.900 3.906 -5.931) 8.102 11.546 ( -0.419 -9.324 3.821) 10.085 11.728 ( 2.759 -2.409 3.274) 4.912 12.027 ( -2.346 3.635 0.683) 4.380 12.086 ( -12.142 3.977 -6.655) 14.406 12.315 ( -7.429 -8.343 -5.884) 12.626 12.637 ( 3.133 2.922 2.306) 4.865 12.860 ( -7.352 -7.414 -8.305) 13.341 13.186 ( 2.844 6.722 3.687) 8.177 13.557 ( 1.034 -2.219 -6.987) 7.403 13.590 ( -3.964 -4.073 -6.966) 8.990 14.258 ( -2.713 -23.648 8.957) 25.433 14.748 ( 13.262 -17.448 12.674) 25.317 15.640 ( 3.358 20.094 3.915) 20.745 15.883 ( -5.668 14.864 -8.685) 18.124 16.461 ( -11.264 -3.884 -7.818) 14.251 16.689 ( 2.018 2.543 0.190) 3.252 16.864 ( -2.290 -2.299 -0.096) 3.246 18.406 ( 10.186 -2.609 0.039) 10.515 18.997 ( -6.435 8.474 1.936) 10.815 20.744 ( 5.660 -11.989 -3.496) 13.711 ======================= Grid point 92 (37/205) ======================= q-point: ( 0.22 0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.836 ( 7.870 14.877 30.850) 35.143 2.091 ( 22.552 17.764 16.308) 33.017 3.668 ( 2.513 -2.595 -0.754) 3.690 3.763 ( 6.393 -1.849 3.632) 7.581 3.954 ( 35.333 3.177 33.910) 49.075 4.013 ( 2.220 10.319 2.413) 10.827 4.670 ( -8.006 0.567 3.783) 8.873 4.899 ( -3.983 6.263 3.073) 8.033 5.079 ( 11.080 11.379 7.347) 17.499 5.536 ( -1.412 -1.307 -2.736) 3.345 5.640 ( -0.560 -7.705 5.186) 9.305 5.802 ( 0.414 6.259 14.524) 15.821 6.342 ( -6.480 10.454 -1.061) 12.345 6.781 ( 6.741 -0.613 1.447) 6.922 6.938 ( 4.311 0.737 -0.941) 4.473 7.321 ( 2.861 1.532 -1.224) 3.468 7.675 ( -12.862 6.247 -6.694) 15.788 8.017 ( -0.745 6.304 -11.853) 13.445 8.321 ( 0.596 6.348 6.125) 8.841 8.905 ( 0.545 -8.383 3.578) 9.131 9.081 ( -8.395 -2.926 1.971) 9.106 9.274 ( -12.348 1.085 3.763) 12.954 9.537 ( 5.738 5.084 15.718) 17.487 9.921 ( -9.324 -7.414 -2.496) 12.170 10.199 ( 15.021 -4.831 -10.467) 18.935 10.877 ( 1.964 0.521 -9.484) 9.699 10.923 ( -1.546 -1.074 -10.882) 11.043 11.082 ( -1.262 8.462 -8.073) 11.763 11.581 ( -1.272 -8.767 3.965) 9.706 11.786 ( -3.227 1.479 1.287) 3.776 11.826 ( -5.748 -1.336 0.617) 5.934 12.042 ( 3.888 -1.034 1.482) 4.288 12.213 ( -0.978 -2.847 -2.320) 3.801 12.657 ( -4.546 -5.955 -7.369) 10.509 12.715 ( -0.145 -0.177 4.642) 4.647 13.257 ( 1.859 7.344 0.247) 7.580 13.413 ( -5.157 -2.270 -8.860) 10.500 13.507 ( -0.717 -0.125 -4.026) 4.091 14.289 ( -1.720 -24.592 6.184) 25.416 15.039 ( 8.639 -21.240 4.333) 23.335 15.650 ( -3.636 14.842 -2.283) 15.450 15.836 ( 4.475 11.647 -0.740) 12.499 16.167 ( -10.659 -2.206 -5.827) 12.346 16.706 ( -1.175 -3.952 -4.771) 6.305 16.964 ( 9.025 7.314 12.611) 17.146 18.551 ( 3.429 -7.078 -1.914) 8.094 18.872 ( -4.892 9.760 -2.289) 11.155 20.671 ( -8.367 -9.379 -0.229) 12.571 ======================= Grid point 93 (38/205) ======================= q-point: ( 0.33 0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.274 ( 9.175 8.313 23.413) 26.484 2.670 ( 26.011 13.088 9.455) 30.615 3.416 ( -26.023 -1.682 3.224) 26.276 3.806 ( -0.649 0.570 -0.849) 1.211 4.183 ( -4.754 8.915 -4.182) 10.934 4.416 ( 10.087 2.617 -8.622) 13.525 4.830 ( 10.060 0.965 16.843) 19.642 4.992 ( 19.646 -1.249 4.246) 20.138 5.296 ( 1.479 -1.319 3.252) 3.808 5.595 ( 8.516 9.984 3.115) 13.487 5.722 ( 3.350 2.718 7.505) 8.656 5.852 ( -10.015 2.859 8.378) 13.367 6.197 ( -8.646 8.247 -1.256) 12.014 6.873 ( 0.247 -2.251 3.059) 3.806 6.955 ( 1.104 -1.368 -4.933) 5.236 7.366 ( -9.382 11.136 -8.509) 16.866 7.439 ( 7.125 4.219 1.806) 8.475 7.913 ( 3.399 6.545 -9.680) 12.169 8.334 ( -2.933 6.102 -0.822) 6.820 8.785 ( -11.964 -2.486 1.684) 12.335 8.957 ( -10.001 -2.818 10.068) 14.468 9.177 ( -3.749 -0.631 2.188) 4.386 9.704 ( -9.324 -0.679 2.532) 9.685 9.926 ( 11.864 -7.898 14.370) 20.239 10.412 ( 13.552 -6.320 -3.395) 15.334 10.534 ( -10.910 -2.944 -19.904) 22.888 10.811 ( -1.942 3.965 -3.717) 5.771 11.142 ( 10.983 8.142 -9.143) 16.447 11.522 ( -8.169 1.812 1.538) 8.508 11.723 ( -1.029 -5.132 3.475) 6.283 11.876 ( 2.606 -1.710 3.354) 4.579 12.128 ( 2.358 5.297 0.144) 5.800 12.220 ( 1.392 -7.427 2.303) 7.899 12.477 ( -6.226 -14.886 -6.104) 17.252 12.777 ( 1.523 2.257 2.180) 3.488 13.204 ( -2.790 -5.145 -5.157) 7.801 13.328 ( 0.099 10.261 0.505) 10.274 13.457 ( -0.650 0.558 -2.443) 2.589 14.323 ( -1.290 -22.938 5.271) 23.571 15.167 ( 3.895 -18.292 0.149) 18.703 15.569 ( -2.004 10.943 -1.353) 11.207 15.890 ( 1.099 4.752 -0.943) 4.968 16.003 ( -4.019 1.347 0.816) 4.316 16.631 ( -1.610 -3.279 -2.724) 4.557 17.331 ( 14.106 7.077 13.030) 20.465 18.391 ( -14.627 -3.442 -4.501) 15.686 18.863 ( 7.868 5.944 -8.820) 13.230 20.490 ( -9.385 -8.246 -2.803) 12.803 ======================= Grid point 94 (39/205) ======================= q-point: ( 0.44 0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.615 ( 9.971 3.826 8.856) 13.874 2.874 ( -32.652 -1.472 -2.380) 32.772 3.182 ( 20.398 8.297 1.294) 22.059 3.599 ( -16.719 5.125 -7.205) 18.913 4.013 ( -3.849 11.676 9.053) 15.268 4.701 ( 25.323 2.260 -17.282) 30.741 4.877 ( -5.166 2.129 4.863) 7.407 5.195 ( -0.437 -1.482 -11.307) 11.412 5.460 ( 4.877 -1.503 -0.962) 5.194 5.572 ( -19.814 -1.867 4.511) 20.406 5.769 ( 7.722 7.753 2.284) 11.178 5.862 ( -5.780 8.908 4.339) 11.472 5.998 ( -8.337 5.819 -2.536) 10.479 6.880 ( 1.624 -5.123 -2.644) 5.990 6.909 ( -0.683 -4.043 -1.236) 4.282 7.269 ( 4.820 12.764 0.082) 13.644 7.452 ( -0.135 6.954 -10.712) 12.772 8.052 ( 9.268 7.405 8.544) 14.620 8.223 ( -2.009 5.353 -6.839) 8.914 8.610 ( -8.017 -0.291 1.583) 8.177 8.960 ( -4.143 -4.745 13.944) 15.300 9.154 ( -2.893 0.075 6.579) 7.188 9.595 ( -5.439 2.104 3.429) 6.765 9.940 ( -8.693 -8.586 -21.309) 24.563 10.371 ( 2.171 -7.585 2.564) 8.296 10.638 ( 6.418 -9.382 15.896) 19.542 10.886 ( 13.882 7.994 -4.681) 16.689 11.232 ( 8.367 6.363 -7.976) 13.195 11.412 ( -6.776 4.855 6.790) 10.751 11.723 ( -2.421 -6.131 -0.310) 6.599 11.902 ( -1.209 1.614 -3.467) 4.011 12.144 ( 1.020 8.482 -1.038) 8.606 12.251 ( -1.497 -6.652 2.125) 7.141 12.393 ( 1.160 -18.652 2.422) 18.845 12.768 ( -1.269 -1.232 -4.692) 5.015 13.206 ( 3.624 -3.744 5.285) 7.422 13.337 ( -0.679 9.891 1.254) 9.994 13.451 ( 1.438 -0.491 0.450) 1.585 14.336 ( -2.640 -22.921 3.887) 23.398 15.203 ( 0.987 -15.280 -1.313) 15.368 15.570 ( 1.400 9.122 2.903) 9.674 15.892 ( 0.216 0.629 2.547) 2.632 15.999 ( -0.399 5.017 2.976) 5.846 16.614 ( 0.955 -2.771 0.909) 3.069 17.574 ( -2.372 6.688 -0.992) 7.165 18.133 ( -3.062 -0.814 1.081) 3.347 18.893 ( 7.207 4.478 -13.796) 16.196 20.285 ( -6.466 -7.366 -9.023) 13.322 ======================= Grid point 95 (40/205) ======================= q-point: (-0.44 0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.212 ( -32.652 0.272 -7.514) 33.507 2.816 ( -3.929 5.123 -6.934) 9.474 2.957 ( -12.891 7.542 -1.708) 15.032 3.760 ( 24.980 5.583 -1.691) 25.652 4.066 ( -3.356 9.665 5.678) 11.701 4.741 ( -11.923 1.224 -1.744) 12.112 4.824 ( -14.451 5.360 -21.272) 26.269 4.909 ( 5.169 7.460 -19.180) 21.219 5.140 ( -23.940 -0.160 1.399) 23.981 5.453 ( -4.842 -5.934 2.421) 8.032 5.597 ( -5.365 2.673 -6.395) 8.765 5.815 ( -9.020 10.156 -4.427) 14.287 6.068 ( 12.444 7.611 3.284) 14.952 6.854 ( 4.246 -3.304 -12.809) 13.893 6.899 ( -0.218 -8.207 0.053) 8.210 7.323 ( -0.021 5.688 -9.007) 10.653 7.553 ( 12.670 9.007 14.898) 21.532 8.083 ( -0.765 5.454 -5.064) 7.482 8.318 ( 2.712 5.440 5.541) 8.225 8.560 ( 0.627 0.489 1.992) 2.145 9.051 ( 2.293 -5.917 8.337) 10.478 9.249 ( 0.847 0.240 15.920) 15.944 9.466 ( -9.018 0.780 -15.661) 18.089 9.646 ( -2.574 -1.920 -0.043) 3.211 10.400 ( 2.965 -7.153 -2.087) 8.019 10.941 ( 2.498 -11.532 14.484) 18.682 11.036 ( 8.112 1.596 -2.393) 8.607 11.277 ( 3.903 4.808 -5.244) 8.115 11.492 ( 5.392 6.840 10.571) 13.697 11.632 ( -4.203 1.177 -1.784) 4.715 11.826 ( -1.945 -2.204 -2.222) 3.685 12.164 ( 0.915 9.855 0.241) 9.900 12.208 ( -3.408 -6.919 0.103) 7.714 12.516 ( 5.930 -17.825 4.256) 19.261 12.696 ( -0.609 0.128 -2.274) 2.358 13.317 ( -2.193 9.887 -0.135) 10.128 13.381 ( 5.621 -5.268 8.127) 11.198 13.525 ( 3.953 0.234 5.018) 6.393 14.307 ( -3.995 -25.770 2.684) 26.215 15.176 ( -2.203 -16.222 -2.504) 16.562 15.669 ( 3.025 12.018 7.507) 14.489 15.976 ( 4.151 2.322 4.509) 6.554 16.021 ( -1.225 5.109 5.714) 7.762 16.679 ( 3.386 -2.716 3.503) 5.578 17.238 ( -18.302 6.429 -12.520) 23.088 18.313 ( 11.172 0.240 6.069) 12.716 18.830 ( 3.703 6.261 -17.966) 19.382 20.073 ( -1.576 -5.439 -18.728) 19.565 ======================= Grid point 96 (41/205) ======================= q-point: (-0.33 0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.587 ( -29.294 3.192 -2.623) 29.584 2.227 ( -30.715 16.367 -10.081) 36.234 3.135 ( 13.544 1.226 -0.812) 13.623 3.681 ( -37.711 20.816 -19.725) 47.376 4.138 ( 13.004 -1.821 -4.197) 13.785 4.265 ( -16.871 0.385 3.260) 17.188 4.516 ( -3.947 6.177 -11.993) 14.056 4.711 ( -18.879 3.150 0.123) 19.140 4.828 ( 3.071 10.011 -18.166) 20.968 5.395 ( -5.732 -2.211 -0.703) 6.184 5.538 ( 0.612 -2.130 -1.087) 2.468 5.690 ( -0.010 3.379 0.849) 3.484 6.248 ( 5.362 11.475 -1.374) 12.741 6.849 ( 7.015 -4.428 -7.212) 10.993 6.915 ( 4.105 -7.979 -1.539) 9.104 7.260 ( 0.724 2.721 -5.298) 5.999 7.883 ( 2.548 5.655 16.901) 18.004 8.070 ( 4.713 7.215 -4.206) 9.590 8.265 ( -6.668 1.521 -2.603) 7.318 8.684 ( 11.315 -0.467 -0.220) 11.327 9.080 ( -4.547 4.745 -17.393) 18.593 9.246 ( -3.577 -8.128 16.086) 18.374 9.454 ( 1.672 1.037 13.221) 13.366 9.704 ( 7.543 -2.144 1.053) 7.912 10.490 ( 12.417 -8.187 -6.339) 16.168 10.914 ( -9.434 -6.362 9.256) 14.668 11.239 ( 0.277 1.439 0.733) 1.639 11.263 ( 5.577 -5.989 -3.310) 8.827 11.610 ( -0.164 3.229 6.679) 7.420 11.661 ( 4.514 4.429 2.051) 6.649 11.847 ( 2.082 4.205 5.611) 7.314 12.097 ( -5.074 0.198 1.003) 5.176 12.221 ( 1.783 1.822 0.191) 2.556 12.636 ( 4.137 -13.513 2.535) 14.358 12.757 ( 4.443 -2.872 5.254) 7.456 13.247 ( -4.033 7.597 -1.488) 8.729 13.527 ( 3.792 -3.878 4.177) 6.845 13.699 ( 5.818 -0.361 9.814) 11.414 14.250 ( -5.059 -28.623 2.095) 29.142 15.045 ( -8.892 -20.986 -5.772) 23.512 15.785 ( -2.054 23.705 7.996) 25.101 15.985 ( -2.135 10.657 4.418) 11.732 16.222 ( 10.413 -2.528 10.271) 14.843 16.786 ( 3.459 -2.330 2.618) 4.924 16.839 ( -10.854 3.889 -7.364) 13.681 18.524 ( 4.131 -2.461 0.773) 4.870 18.694 ( 5.806 13.238 -18.751) 23.676 19.832 ( 3.272 -0.936 -32.863) 33.038 ======================= Grid point 97 (42/205) ======================= q-point: (-0.22 0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.132 ( -23.177 10.073 7.282) 26.300 1.595 ( -30.284 20.859 -5.368) 37.162 2.617 ( -47.790 34.897 -14.752) 60.986 3.374 ( 6.755 -1.270 0.628) 6.902 3.900 ( -20.147 -7.905 0.885) 21.660 4.207 ( -9.923 7.321 4.715) 13.202 4.291 ( -1.125 5.360 -8.448) 10.069 4.545 ( -1.318 8.996 -11.495) 14.657 4.924 ( 19.272 6.900 -3.320) 20.737 5.257 ( -4.456 2.127 -3.510) 6.058 5.560 ( -0.450 -2.931 4.251) 5.183 5.774 ( 3.879 -6.833 4.380) 8.995 6.271 ( 3.483 9.391 -6.292) 11.828 6.877 ( -0.679 -6.256 1.309) 6.428 7.012 ( -0.039 -1.014 2.102) 2.334 7.265 ( 9.278 -1.072 -6.297) 11.264 7.934 ( -9.459 -5.850 -0.649) 11.141 8.031 ( 0.229 10.990 1.801) 11.139 8.307 ( 7.169 9.501 6.505) 13.564 8.748 ( -3.598 3.120 -12.495) 13.371 9.004 ( 13.606 1.958 0.237) 13.748 9.334 ( -5.467 -8.273 9.499) 13.732 9.526 ( -1.013 -4.123 5.792) 7.182 9.917 ( 13.697 -4.517 -2.806) 14.693 10.704 ( 17.010 -12.251 -7.880) 22.395 10.853 ( -10.361 -2.271 9.504) 14.242 11.158 ( -4.206 -2.639 3.456) 6.049 11.296 ( 0.495 -9.038 -5.865) 10.786 11.743 ( 1.298 2.266 15.985) 16.197 11.779 ( -0.095 -2.206 13.938) 14.111 11.864 ( -0.757 10.291 -6.225) 12.051 12.114 ( 2.679 -2.224 6.046) 6.977 12.289 ( 6.004 1.786 3.267) 7.065 12.715 ( -3.015 -12.530 4.614) 13.689 12.813 ( -0.346 -10.178 -7.010) 12.363 13.237 ( 3.473 7.780 7.602) 11.418 13.622 ( 2.296 -2.040 4.303) 5.287 13.897 ( 5.197 -1.635 8.629) 10.205 14.146 ( -8.630 -27.481 0.127) 28.805 14.693 ( -20.886 -18.780 -10.269) 29.906 15.691 ( -8.958 27.463 1.012) 28.904 16.149 ( 7.511 13.532 16.100) 22.333 16.507 ( 7.515 -5.072 6.362) 11.076 16.701 ( 1.605 3.109 1.105) 3.669 16.874 ( 1.481 -5.579 1.152) 5.886 18.426 ( 0.258 12.170 -10.487) 16.068 18.760 ( 11.250 10.184 -10.354) 18.371 19.494 ( 5.235 11.503 -49.488) 51.076 ======================= Grid point 98 (43/205) ======================= q-point: (-0.11 0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.910 ( -13.853 22.288 15.030) 30.242 1.026 ( -25.713 25.333 3.940) 36.310 1.888 ( -28.547 53.031 18.090) 62.884 3.402 ( -6.523 -6.242 5.663) 10.657 3.579 ( -11.786 -2.463 0.407) 12.048 4.160 ( -2.288 -5.041 4.573) 7.180 4.293 ( 4.252 16.825 2.795) 17.578 4.450 ( 0.117 9.533 -3.708) 10.229 5.092 ( 0.111 1.331 0.559) 1.448 5.338 ( 16.780 1.471 -6.373) 18.010 5.588 ( -2.299 -3.271 5.467) 6.773 5.886 ( 1.796 -10.722 6.707) 12.774 6.292 ( 5.471 6.373 -4.219) 9.399 6.846 ( -4.303 -1.659 0.280) 4.620 6.904 ( -10.231 0.372 0.905) 10.278 7.416 ( 9.205 -3.882 -5.954) 11.630 7.756 ( -3.496 -6.974 -3.189) 8.428 8.103 ( -0.475 13.687 8.858) 16.311 8.505 ( 6.884 11.276 5.153) 14.181 8.573 ( -3.086 1.608 -6.918) 7.744 9.161 ( -14.624 -10.901 -0.465) 18.246 9.297 ( 7.929 1.531 2.198) 8.369 9.608 ( 10.391 -5.060 -2.041) 11.736 10.077 ( 4.657 -12.212 -1.446) 13.149 10.668 ( -8.832 6.755 -6.051) 12.659 10.840 ( 3.498 -15.038 -7.072) 16.982 11.147 ( -10.688 -14.607 -8.935) 20.185 11.225 ( -0.156 -8.652 11.541) 14.425 11.752 ( -3.265 8.474 -5.824) 10.789 11.852 ( -9.275 -2.773 11.934) 15.367 11.916 ( -7.713 -14.429 11.268) 19.865 12.275 ( 8.845 -5.758 8.298) 13.426 12.444 ( -11.416 -3.943 -7.833) 14.395 12.510 ( 11.969 -3.783 2.678) 12.835 12.837 ( 3.209 -13.287 2.833) 13.960 13.436 ( 6.379 4.880 1.803) 8.232 13.659 ( -5.545 -5.153 -1.918) 7.809 13.985 ( -6.892 -13.019 10.077) 17.848 14.017 ( -1.621 -2.957 -5.079) 6.096 14.217 ( -17.086 -5.955 8.765) 20.105 15.572 ( -4.550 22.695 0.828) 23.162 16.458 ( 2.498 -2.395 6.672) 7.516 16.598 ( -0.513 0.868 0.807) 1.292 16.747 ( 0.332 -5.100 -0.778) 5.170 16.898 ( 3.015 -1.613 0.896) 3.535 18.463 ( -4.672 -10.859 -1.433) 11.908 18.972 ( 40.849 41.686 -7.014) 58.784 19.151 ( 20.491 41.664 -40.278) 61.466 ======================= Grid point 99 (44/205) ======================= q-point: ( 0.00 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.557 ( 8.566 26.550 16.010) 32.165 1.631 ( 4.382 29.036 15.221) 33.075 2.955 ( 1.463 37.843 20.665) 43.143 3.176 ( -2.251 -7.768 6.868) 10.610 3.507 ( 0.288 2.620 4.037) 4.822 4.161 ( -0.130 0.706 12.470) 12.491 4.658 ( 1.227 11.806 -0.535) 11.881 4.817 ( 2.560 18.554 2.956) 18.961 5.204 ( 5.589 1.494 3.821) 6.934 5.371 ( -5.837 -7.939 7.777) 12.553 5.582 ( 2.831 4.514 -6.314) 8.262 5.800 ( 0.843 -0.913 3.794) 3.992 6.463 ( 9.021 1.598 -5.655) 10.766 6.682 ( -1.806 -4.448 1.178) 4.943 6.879 ( -8.761 7.513 5.591) 12.824 7.350 ( 1.007 -2.864 -1.743) 3.501 7.653 ( 3.100 -4.438 6.366) 8.357 8.367 ( -3.775 0.816 0.752) 3.935 8.489 ( -0.132 5.697 8.570) 10.291 8.857 ( -10.877 13.529 -6.079) 18.393 9.040 ( 9.834 10.333 3.786) 14.759 9.367 ( 1.828 -2.569 1.873) 3.667 9.482 ( 6.601 -15.450 -3.797) 17.225 9.942 ( -7.907 -1.383 1.935) 8.257 10.343 ( -12.308 -1.210 -10.158) 16.004 10.686 ( 9.364 -1.653 -5.806) 11.141 10.840 ( 7.072 -6.893 -5.492) 11.300 11.190 ( -0.422 -7.591 5.447) 9.352 11.571 ( -4.811 -3.507 -3.937) 7.138 11.790 ( -3.334 10.194 -6.550) 12.567 12.029 ( -1.560 -22.009 -5.713) 22.792 12.191 ( 2.247 6.583 4.493) 8.281 12.416 ( -2.431 5.447 -2.712) 6.553 12.632 ( 4.412 6.243 7.305) 10.574 12.771 ( 2.115 -4.015 7.074) 8.405 13.297 ( -6.687 -4.036 -10.653) 13.210 13.504 ( 3.255 -3.801 -6.203) 7.970 13.640 ( -10.062 -8.541 0.069) 13.199 13.932 ( -2.521 -5.518 2.147) 6.435 14.223 ( 4.316 -7.510 9.941) 13.185 16.038 ( -0.917 22.308 -2.862) 22.509 16.311 ( -8.518 3.219 -7.705) 11.928 16.546 ( -2.001 0.377 0.422) 2.079 16.754 ( 2.548 -4.354 4.624) 6.844 16.794 ( -3.772 -1.946 -4.084) 5.891 18.158 ( 1.651 -11.603 0.771) 11.745 19.331 ( -1.279 14.648 -3.577) 15.133 20.251 ( 24.888 -4.523 -5.721) 25.934 ======================= Grid point 100 (45/205) ======================= q-point: ( 0.11 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.887 ( 7.392 27.010 19.989) 34.405 2.053 ( 16.569 23.421 19.009) 34.415 3.313 ( 17.152 6.470 6.866) 19.575 3.371 ( 12.540 9.504 20.903) 26.163 3.601 ( 3.642 -1.853 5.459) 6.819 4.283 ( -2.872 7.745 10.067) 13.022 4.712 ( 2.048 12.014 7.890) 14.518 4.886 ( 1.324 6.613 2.442) 7.173 5.305 ( -6.769 -4.434 5.750) 9.926 5.384 ( 6.882 -1.160 6.423) 9.484 5.557 ( 0.554 6.776 -4.935) 8.401 5.853 ( 1.180 6.855 6.863) 9.772 6.571 ( 6.727 1.775 -1.638) 7.148 6.688 ( -2.444 4.293 2.150) 5.388 6.853 ( 2.553 1.876 4.423) 5.441 7.339 ( -1.217 -1.064 0.384) 1.661 7.804 ( 4.464 -0.962 6.120) 7.636 8.346 ( -2.358 5.936 3.703) 7.383 8.577 ( -7.827 15.943 -7.784) 19.391 8.619 ( 3.309 1.921 5.473) 6.678 9.126 ( -2.798 -1.825 0.431) 3.368 9.448 ( -9.485 -6.177 3.655) 11.895 9.516 ( 6.899 3.848 4.894) 9.292 9.803 ( -1.827 -7.720 -4.332) 9.039 10.078 ( -3.491 -2.251 -11.314) 12.053 10.844 ( 9.204 -1.311 -2.759) 9.697 10.934 ( 6.137 -3.594 -4.803) 8.582 11.216 ( -1.784 -12.323 3.801) 13.019 11.411 ( -3.598 -0.061 -7.767) 8.560 11.726 ( 0.065 3.532 -2.045) 4.082 11.875 ( -4.648 -17.437 -8.640) 20.008 12.199 ( -7.225 6.175 -3.680) 10.191 12.308 ( -1.211 7.299 0.042) 7.399 12.699 ( -7.291 -2.043 -5.262) 9.221 12.792 ( 1.508 6.633 5.288) 8.616 13.247 ( 3.952 -2.968 0.742) 4.998 13.457 ( 0.524 -7.421 -8.942) 11.632 13.515 ( -2.484 -3.284 0.892) 4.214 13.868 ( -6.523 -11.627 3.159) 13.701 14.418 ( 7.054 -14.848 6.987) 17.862 16.014 ( 1.254 14.224 -3.979) 14.823 16.083 ( -6.213 5.719 -8.262) 11.814 16.396 ( -11.039 -1.972 -7.616) 13.555 16.662 ( -0.900 -5.041 -4.894) 7.083 16.914 ( 4.590 8.495 10.835) 14.513 18.262 ( 6.326 -11.097 2.283) 12.976 19.242 ( -4.451 14.298 -3.468) 15.371 20.470 ( 3.549 -14.018 -1.087) 14.501 ======================= Grid point 101 (46/205) ======================= q-point: ( 0.22 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.227 ( 3.342 21.832 25.725) 33.905 2.518 ( 18.518 22.040 12.286) 31.299 3.592 ( -0.140 -5.176 3.993) 6.539 3.688 ( 8.223 -5.891 2.796) 10.495 4.019 ( 28.132 3.837 15.954) 32.567 4.273 ( 3.832 12.241 -1.770) 12.949 4.714 ( -11.023 3.018 5.420) 12.649 4.993 ( 1.881 3.878 7.288) 8.467 5.271 ( -0.991 -1.070 1.576) 2.147 5.547 ( 5.026 6.308 -0.041) 8.066 5.613 ( 8.689 7.401 9.805) 15.047 5.979 ( 1.746 10.209 9.608) 14.128 6.537 ( -6.625 8.011 -1.386) 10.487 6.791 ( 5.350 3.110 6.164) 8.734 6.935 ( 0.148 -1.055 2.530) 2.745 7.366 ( 4.869 1.860 2.017) 5.589 7.847 ( -3.969 10.251 -1.590) 11.107 8.234 ( -5.162 12.928 -10.393) 17.373 8.478 ( -0.067 9.871 5.363) 11.234 8.760 ( 0.845 -5.932 8.008) 10.002 9.026 ( -5.023 -2.414 -3.506) 6.584 9.226 ( -14.152 -4.984 2.112) 15.152 9.650 ( -0.417 5.357 8.184) 9.790 9.760 ( -3.604 -7.111 0.772) 8.009 10.054 ( 12.103 -8.844 -8.003) 16.992 10.838 ( -8.264 -5.722 -13.997) 17.233 10.889 ( 0.121 -1.131 -3.856) 4.021 11.225 ( 1.738 -3.378 0.157) 3.802 11.365 ( 4.821 -4.225 -2.313) 6.815 11.708 ( 0.781 -10.166 -0.918) 10.238 11.814 ( 3.165 -4.374 -3.559) 6.467 11.989 ( -9.556 7.895 -0.684) 12.414 12.306 ( -0.286 3.526 -1.295) 3.767 12.481 ( -5.266 -1.957 -9.278) 10.846 12.851 ( -0.973 4.910 2.855) 5.762 13.214 ( -3.341 -4.411 -4.995) 7.455 13.382 ( 0.835 -7.544 -8.321) 11.263 13.565 ( 0.280 5.649 3.305) 6.551 13.831 ( -2.315 -15.770 9.766) 18.693 14.595 ( 6.427 -21.323 3.006) 22.473 15.897 ( -4.162 7.840 -6.821) 11.195 16.020 ( 1.211 7.159 -3.339) 7.992 16.117 ( -9.655 -2.163 -5.781) 11.459 16.595 ( -1.324 -6.534 -4.852) 8.245 17.171 ( 9.785 12.561 13.706) 21.009 18.366 ( 2.254 -11.042 -0.304) 11.274 19.115 ( -3.981 13.571 -4.916) 14.973 20.418 ( -6.535 -14.642 -1.002) 16.066 ======================= Grid point 102 (47/205) ======================= q-point: ( 0.33 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.512 ( 1.319 14.021 21.999) 26.120 2.988 ( 22.783 16.604 5.133) 28.655 3.366 ( -25.028 -3.367 5.054) 25.755 3.798 ( 1.173 -1.789 -3.543) 4.139 4.393 ( 12.978 9.762 -6.369) 17.444 4.497 ( -0.877 5.759 -0.162) 5.827 4.789 ( 26.328 -4.412 6.928) 27.580 4.993 ( -3.223 0.725 0.758) 3.389 5.285 ( 1.019 -0.133 2.094) 2.333 5.635 ( -0.646 -4.555 2.805) 5.389 5.957 ( 10.728 18.308 16.820) 27.078 6.051 ( 1.083 14.959 -1.207) 15.047 6.351 ( -12.481 5.839 -2.016) 13.926 6.806 ( -11.014 -4.377 9.364) 15.105 6.978 ( 4.567 5.178 -4.478) 8.230 7.512 ( 6.853 5.233 -5.031) 9.983 7.708 ( -3.187 17.946 -0.869) 18.247 8.124 ( 3.088 13.023 -5.067) 14.311 8.478 ( -3.890 7.829 -2.234) 9.023 8.726 ( -11.060 -3.582 4.139) 12.341 8.921 ( -4.112 -0.615 0.452) 4.182 9.090 ( -5.368 -7.100 7.532) 11.660 9.692 ( -5.633 -1.079 4.279) 7.155 9.752 ( 4.026 -7.676 4.864) 9.939 10.230 ( 7.274 -10.817 3.696) 13.549 10.440 ( -12.694 -6.809 -17.307) 22.517 10.887 ( 4.992 2.637 -2.950) 6.370 11.284 ( 5.460 0.363 -3.401) 6.443 11.456 ( 4.686 -3.415 -0.162) 5.801 11.688 ( -6.495 -1.273 -4.810) 8.182 11.792 ( 4.304 -8.445 3.006) 9.944 11.988 ( 2.993 -4.721 5.259) 7.675 12.216 ( -6.481 -2.418 -5.159) 8.629 12.380 ( 1.460 7.503 -3.754) 8.516 12.805 ( -2.359 -3.301 -4.823) 6.303 13.135 ( -1.676 1.875 1.000) 2.706 13.333 ( 1.392 -7.781 -4.689) 9.191 13.538 ( -3.310 3.534 0.877) 4.921 13.935 ( -0.622 -10.737 9.725) 14.500 14.705 ( 3.925 -24.472 0.291) 24.786 15.788 ( -1.971 8.224 -2.831) 8.918 15.931 ( -4.357 0.680 -1.434) 4.637 16.040 ( 0.900 1.845 -0.352) 2.083 16.532 ( -0.873 -6.218 -2.530) 6.769 17.515 ( 12.317 10.237 12.220) 20.145 18.289 ( -8.355 -6.445 -3.917) 11.256 19.035 ( 2.418 10.601 -7.534) 13.228 20.256 ( -8.027 -14.032 -3.528) 16.546 ======================= Grid point 103 (48/205) ======================= q-point: ( 0.44 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.719 ( 3.935 5.844 9.681) 11.973 2.865 ( -29.874 0.562 -1.965) 29.944 3.388 ( 14.129 10.634 -4.223) 18.180 3.697 ( -3.043 4.039 -4.450) 6.736 4.290 ( -10.166 13.671 10.443) 19.982 4.775 ( 24.271 4.926 -14.547) 28.722 4.918 ( -3.804 1.095 1.438) 4.212 5.152 ( 7.753 -1.663 -6.707) 10.385 5.421 ( 9.702 -3.288 -0.031) 10.244 5.521 ( -13.254 -3.128 0.491) 13.627 5.987 ( -18.423 5.886 1.750) 19.420 6.022 ( -0.041 12.394 -5.065) 13.389 6.230 ( 0.644 16.764 0.214) 16.778 6.691 ( -8.455 -10.218 5.955) 14.538 6.973 ( 2.759 8.597 -7.946) 12.027 7.517 ( 5.785 10.409 -6.254) 13.452 7.674 ( -0.462 13.294 -7.061) 15.060 8.266 ( 5.291 12.035 6.386) 14.615 8.350 ( 0.161 7.252 -4.442) 8.506 8.591 ( -6.741 -1.420 4.063) 7.998 8.878 ( -3.199 -3.187 4.530) 6.396 9.113 ( -3.519 -3.269 11.370) 12.343 9.646 ( -4.739 1.200 5.606) 7.438 9.726 ( -5.151 -9.559 -13.808) 17.566 10.217 ( -0.466 -8.183 -1.853) 8.403 10.412 ( 5.085 -12.197 15.277) 20.199 11.009 ( 9.281 2.969 -3.365) 10.308 11.327 ( 1.941 -1.905 -1.306) 3.017 11.476 ( 1.302 5.012 -3.888) 6.476 11.592 ( -0.395 -5.479 0.673) 5.535 11.926 ( 4.789 -12.934 2.485) 14.014 12.018 ( -7.505 -4.987 -4.789) 10.204 12.110 ( 3.650 0.997 5.827) 6.948 12.395 ( 2.012 9.818 -1.123) 10.085 12.711 ( -0.505 -5.121 -6.796) 8.524 13.179 ( 1.527 3.109 6.863) 7.687 13.343 ( 2.699 -8.688 -0.565) 9.115 13.504 ( -1.221 3.098 1.450) 3.632 13.950 ( -5.542 -11.081 3.760) 12.948 14.748 ( 1.193 -25.290 -0.998) 25.338 15.784 ( 1.768 8.052 2.804) 8.707 15.900 ( -0.467 0.616 3.439) 3.525 16.070 ( 1.316 2.380 2.527) 3.712 16.529 ( 1.232 -5.504 1.386) 5.808 17.738 ( -2.797 8.483 -0.926) 8.980 18.113 ( -0.822 -1.211 2.472) 2.873 19.023 ( 5.364 8.187 -10.374) 14.262 20.075 ( -4.923 -12.616 -8.265) 15.865 ======================= Grid point 104 (49/205) ======================= q-point: (-0.44 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.279 ( -27.295 6.285 -7.901) 29.102 2.891 ( 9.356 0.132 0.906) 9.401 3.145 ( -20.397 11.816 -11.365) 26.169 3.883 ( 16.975 4.616 -2.572) 17.779 4.275 ( -5.776 9.495 10.448) 15.254 4.798 ( -4.456 3.929 -5.989) 8.435 4.939 ( -1.907 6.683 -18.540) 19.799 5.119 ( -8.223 8.640 -7.751) 14.224 5.141 ( -11.032 1.286 -1.179) 11.169 5.393 ( -12.693 1.284 1.410) 12.835 5.659 ( -3.758 2.860 -9.809) 10.887 6.063 ( -9.945 12.796 -9.349) 18.709 6.216 ( 15.488 6.319 3.473) 17.084 6.649 ( -1.052 -11.933 2.651) 12.269 6.892 ( 0.276 6.047 -14.273) 15.503 7.451 ( -1.986 5.478 -12.547) 13.834 7.781 ( 9.845 12.462 9.729) 18.624 8.261 ( 1.248 10.964 -1.988) 11.212 8.434 ( -0.994 5.480 -1.242) 5.707 8.558 ( -0.070 -1.006 2.443) 2.643 8.935 ( 0.065 -4.956 11.445) 12.473 9.209 ( 1.399 -3.665 10.500) 11.209 9.467 ( -4.362 -1.007 -11.771) 12.594 9.638 ( -2.772 2.260 5.697) 6.727 10.215 ( 1.172 -10.559 -1.528) 10.733 10.715 ( 7.906 -11.077 15.099) 20.327 11.016 ( -2.390 -3.530 -4.334) 6.079 11.351 ( 0.929 -0.106 -1.900) 2.118 11.582 ( 9.536 5.245 1.314) 10.962 11.633 ( 2.549 -1.718 7.811) 8.394 11.841 ( -6.172 1.209 -3.333) 7.117 11.978 ( -1.332 -14.762 2.230) 14.989 12.275 ( 6.626 -1.793 5.241) 8.636 12.418 ( 2.238 12.947 -1.620) 13.238 12.664 ( 1.547 -3.085 -4.141) 5.391 13.293 ( 2.093 -1.307 7.071) 7.489 13.409 ( 3.129 -5.415 1.612) 6.458 13.544 ( 3.270 2.739 3.385) 5.446 13.824 ( -9.384 -17.445 0.055) 19.809 14.722 ( -2.398 -24.405 -2.539) 24.654 15.907 ( 5.517 6.869 7.574) 11.618 15.977 ( 3.061 0.068 6.924) 7.571 16.139 ( 1.089 5.674 6.588) 8.762 16.597 ( 2.837 -5.168 3.904) 7.071 17.426 ( -16.915 11.593 -10.930) 23.237 18.296 ( 7.939 -2.618 6.726) 10.729 19.002 ( 5.150 10.133 -11.935) 16.482 19.919 ( 1.077 -9.211 -15.504) 18.066 ======================= Grid point 105 (50/205) ======================= q-point: (-0.33 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.777 ( -18.303 14.575 -6.706) 24.340 2.607 ( -24.817 19.742 -9.933) 33.231 3.092 ( 12.112 -5.948 -3.336) 13.900 3.960 ( -12.380 -5.610 0.062) 13.592 4.258 ( -29.268 20.777 -11.290) 37.626 4.354 ( 3.725 8.619 -1.566) 9.520 4.649 ( -11.069 6.192 -8.701) 15.381 4.790 ( -10.938 4.962 -2.877) 12.350 5.114 ( 7.623 16.033 -11.895) 21.370 5.332 ( -0.690 -3.357 1.994) 3.965 5.555 ( -2.704 5.616 -2.876) 6.865 5.804 ( -6.386 5.492 -8.632) 12.061 6.502 ( 8.100 11.920 0.838) 14.436 6.671 ( 1.200 -11.112 -1.983) 11.352 6.786 ( 7.568 -3.420 -8.033) 11.555 7.311 ( -1.271 1.538 -8.244) 8.482 7.992 ( -2.861 4.128 8.358) 9.751 8.261 ( -1.681 8.472 -5.934) 10.479 8.356 ( 5.121 9.810 1.782) 11.208 8.681 ( 9.787 -0.067 0.651) 9.809 9.036 ( -2.704 -8.854 12.977) 15.941 9.146 ( -6.806 -2.862 -9.018) 11.655 9.518 ( 4.612 6.419 7.423) 10.843 9.666 ( 2.264 -0.636 3.617) 4.314 10.247 ( 6.130 -14.250 -4.479) 16.146 10.845 ( -4.653 -0.263 7.374) 8.724 11.036 ( 6.019 -12.680 0.285) 14.039 11.313 ( -4.242 1.618 -0.116) 4.541 11.656 ( -2.886 -1.123 4.966) 5.853 11.744 ( 2.299 3.570 1.376) 4.463 11.905 ( 8.115 -0.519 6.939) 10.690 11.975 ( -0.334 -8.083 3.927) 8.992 12.375 ( -0.393 7.600 0.405) 7.620 12.465 ( 6.585 4.119 -3.554) 8.541 12.700 ( 2.833 -3.155 2.661) 5.006 13.356 ( -1.768 2.034 -0.276) 2.709 13.446 ( 1.332 -2.672 0.046) 2.986 13.652 ( 2.733 -15.534 2.756) 16.012 13.730 ( -1.413 -10.124 9.218) 13.765 14.597 ( -7.244 -21.279 -5.418) 23.122 16.088 ( 4.069 3.351 8.655) 10.134 16.158 ( 7.084 -1.303 8.181) 10.900 16.245 ( 1.469 13.393 11.151) 17.489 16.690 ( 2.521 -5.604 3.843) 7.248 17.024 ( -13.944 13.939 -10.101) 22.153 18.418 ( -0.839 -8.264 2.487) 8.671 19.009 ( 9.276 15.985 -9.891) 20.962 19.797 ( 7.827 -2.777 -24.668) 26.029 ======================= Grid point 106 (51/205) ======================= q-point: (-0.22 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.513 ( -7.035 24.305 -0.382) 25.305 2.062 ( -26.245 23.826 -6.403) 36.021 3.123 ( -9.264 -0.312 -5.985) 11.034 3.555 ( -21.475 21.593 1.126) 30.475 3.705 ( -15.643 -3.712 -2.920) 16.341 4.289 ( -14.991 2.989 -2.358) 15.467 4.561 ( 8.656 15.451 0.804) 17.728 4.696 ( 2.878 6.127 -7.392) 10.023 5.135 ( 1.985 11.751 -4.691) 12.807 5.333 ( 4.522 6.221 -5.680) 9.561 5.523 ( -1.717 0.561 6.707) 6.946 5.680 ( -1.089 -1.967 -3.884) 4.488 6.438 ( 0.364 5.468 -11.956) 13.152 6.757 ( 1.952 -3.934 4.252) 6.113 6.947 ( 5.049 -4.848 4.750) 8.459 7.246 ( 3.174 -1.131 -5.518) 6.465 7.818 ( -11.955 -3.667 -3.776) 13.063 8.290 ( 1.953 11.858 6.494) 13.660 8.520 ( 8.754 7.948 -0.691) 11.844 8.803 ( -2.997 3.157 -2.779) 5.164 8.999 ( 3.798 -2.606 0.063) 4.607 9.124 ( 1.863 -10.218 6.394) 12.197 9.535 ( -4.525 6.806 0.529) 8.190 9.820 ( 7.884 -4.768 2.021) 9.433 10.353 ( 10.408 -18.287 -4.618) 21.542 10.849 ( -4.215 1.478 6.745) 8.090 11.087 ( 0.577 -8.075 -4.201) 9.121 11.190 ( -7.853 0.117 2.245) 8.168 11.632 ( -5.477 -7.713 6.208) 11.315 11.867 ( 5.421 3.011 3.210) 6.983 11.966 ( 0.131 -7.029 3.062) 7.668 12.121 ( 6.670 6.568 -0.810) 9.396 12.349 ( -0.206 6.951 1.672) 7.152 12.543 ( 1.813 -1.097 1.719) 2.728 12.683 ( -3.664 -2.277 -8.377) 9.422 13.333 ( 3.342 0.656 3.591) 4.949 13.522 ( 2.072 -7.423 5.309) 9.358 13.716 ( 0.120 -15.528 4.222) 16.092 13.862 ( 3.841 -1.799 7.380) 8.512 14.352 ( -11.818 -14.450 -7.691) 20.189 16.187 ( -2.112 12.655 3.690) 13.350 16.318 ( 1.165 8.220 12.070) 14.649 16.437 ( 6.907 1.072 6.192) 9.338 16.758 ( 0.303 -4.595 1.044) 4.722 16.773 ( -3.719 5.257 -2.572) 6.934 18.342 ( -7.268 -11.723 0.304) 13.797 19.149 ( 13.568 18.855 -4.271) 23.618 19.708 ( 15.431 7.443 -32.377) 36.630 ======================= Grid point 107 (52/205) ======================= q-point: (-0.11 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.474 ( -2.444 30.089 5.500) 30.685 1.584 ( -18.326 27.233 2.954) 32.958 2.876 ( -10.647 30.022 8.964) 33.092 3.283 ( -15.432 -4.503 6.057) 17.179 3.527 ( -4.881 5.982 0.397) 7.731 4.119 ( -5.724 0.921 4.944) 7.619 4.627 ( 3.832 12.271 -3.057) 13.214 4.754 ( 3.352 16.353 0.557) 16.703 5.118 ( 1.168 2.002 0.140) 2.322 5.371 ( 1.658 3.866 -0.585) 4.247 5.584 ( 2.728 3.301 -2.580) 4.999 5.697 ( 3.032 -7.031 5.887) 9.658 6.389 ( 5.962 2.689 -8.573) 10.783 6.758 ( -4.027 -5.694 -0.523) 6.994 6.964 ( -7.944 3.932 8.623) 12.366 7.320 ( 6.255 -4.907 -3.361) 8.632 7.626 ( -5.024 -3.904 -0.041) 6.363 8.400 ( 0.700 11.821 8.854) 14.786 8.501 ( -7.577 -5.238 -3.902) 10.003 8.807 ( 8.647 11.045 2.951) 14.334 9.052 ( -5.471 2.650 2.117) 6.437 9.275 ( 12.391 -8.031 -4.457) 15.424 9.441 ( -4.169 -1.122 0.954) 4.422 9.950 ( 4.051 -2.535 1.533) 5.019 10.485 ( 5.611 -16.699 -1.865) 17.715 10.749 ( -5.438 0.613 -6.802) 8.731 10.939 ( -9.100 -4.944 -9.583) 14.110 11.140 ( -1.896 -2.620 6.258) 7.044 11.615 ( -2.296 -7.985 5.001) 9.698 11.923 ( 0.362 5.833 -5.750) 8.199 12.024 ( 2.026 -12.378 2.383) 12.767 12.139 ( 0.046 9.073 -0.938) 9.122 12.421 ( 0.650 2.127 2.648) 3.458 12.514 ( 2.741 3.848 -1.258) 4.889 12.650 ( 2.982 -3.003 3.625) 5.572 13.456 ( 4.856 -5.064 -0.749) 7.056 13.530 ( -5.046 -4.836 -3.315) 7.735 13.756 ( -4.114 -11.566 9.551) 15.554 13.960 ( 0.646 -2.666 -3.397) 4.367 14.109 ( -5.356 -4.634 4.357) 8.315 16.114 ( -4.817 25.723 -1.303) 26.203 16.428 ( -1.709 2.570 6.858) 7.521 16.602 ( 4.241 -2.044 5.946) 7.584 16.630 ( -3.578 -4.188 -6.036) 8.171 16.845 ( 2.026 -3.449 1.244) 4.189 18.209 ( -6.162 -13.941 -0.765) 15.261 19.335 ( 5.068 14.298 -0.072) 15.170 19.815 ( 32.360 14.184 -24.223) 42.838 ======================= Grid point 108 (53/205) ======================= q-point: ( 0.00 0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.067 ( 6.959 22.717 11.359) 26.335 2.213 ( 5.781 26.313 8.196) 28.160 2.904 ( 0.653 -13.112 9.609) 16.270 3.157 ( 3.883 -11.302 10.408) 15.847 3.990 ( -7.239 29.209 4.569) 30.437 4.219 ( 2.514 4.439 12.003) 13.042 4.781 ( 5.608 0.469 -3.120) 6.435 4.994 ( -6.001 -1.635 4.407) 7.623 5.241 ( 1.182 4.867 5.248) 7.254 5.397 ( -7.337 5.901 5.976) 11.152 5.666 ( 6.926 4.758 -5.820) 10.222 5.854 ( 6.790 3.828 -1.487) 7.935 6.456 ( 5.521 -0.983 -0.850) 5.672 6.604 ( 6.188 -3.397 0.024) 7.060 7.034 ( -8.919 7.176 8.377) 14.185 7.275 ( -1.659 -4.694 4.264) 6.555 7.672 ( 2.246 7.420 7.590) 10.850 8.220 ( -0.847 -11.623 5.174) 12.751 8.675 ( -1.800 8.630 4.363) 9.837 8.908 ( 0.991 -2.314 0.432) 2.554 9.186 ( 9.706 -6.547 -1.776) 11.842 9.251 ( 3.152 -7.523 -0.510) 8.173 9.567 ( -4.437 26.164 -5.274) 27.057 9.933 ( -9.836 1.076 2.654) 10.245 10.274 ( -3.268 -4.980 0.970) 6.035 10.627 ( 7.236 -6.803 -4.685) 10.981 10.743 ( 4.825 0.253 -10.187) 11.274 11.038 ( -3.017 -7.927 -3.008) 9.000 11.468 ( -2.812 -5.867 -4.169) 7.727 11.542 ( 1.596 -19.951 -6.337) 20.994 12.044 ( -2.333 12.876 -5.812) 14.318 12.320 ( 2.742 3.368 -2.640) 5.082 12.504 ( -1.624 4.414 1.541) 4.949 12.746 ( 2.173 -0.439 4.389) 4.917 12.854 ( 1.836 12.512 7.709) 14.810 13.180 ( -5.086 -3.173 -7.599) 9.679 13.396 ( -9.724 -13.807 0.160) 16.889 13.419 ( 2.282 -5.629 -0.800) 6.126 13.894 ( -2.243 0.712 -3.124) 3.911 14.070 ( 1.820 -7.191 3.508) 8.205 16.271 ( -1.435 3.244 -6.239) 7.177 16.391 ( -7.199 0.420 -7.702) 10.550 16.564 ( -2.839 1.154 -3.572) 4.706 16.678 ( -4.881 -3.722 -6.246) 8.757 16.949 ( 4.418 19.710 13.439) 24.261 17.850 ( 1.206 -18.144 4.592) 18.755 19.628 ( 0.903 13.992 -4.907) 14.855 20.111 ( 10.977 -8.885 -5.046) 14.996 ======================= Grid point 109 (54/205) ======================= q-point: ( 0.11 0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.437 ( 8.363 25.297 13.968) 30.083 2.490 ( 17.714 19.183 14.572) 29.902 3.145 ( 14.435 -10.360 8.583) 19.732 3.352 ( 2.902 -12.804 12.530) 18.149 3.924 ( -0.737 21.122 3.475) 21.418 4.394 ( -0.973 1.562 10.252) 10.416 4.873 ( -1.501 -1.166 4.344) 4.742 4.923 ( 2.504 -0.074 0.745) 2.614 5.228 ( -3.010 5.689 0.909) 6.500 5.471 ( 3.721 1.518 5.528) 6.834 5.736 ( 7.054 9.901 -2.686) 12.450 5.966 ( 4.911 2.532 6.481) 8.516 6.623 ( 8.457 4.954 6.937) 12.008 6.771 ( 8.110 1.974 1.728) 8.523 6.935 ( -9.696 6.512 8.331) 14.346 7.267 ( -2.141 -6.283 3.432) 7.472 7.860 ( 6.851 7.284 10.568) 14.549 8.328 ( 4.697 -7.884 6.962) 11.519 8.666 ( -3.702 6.568 3.506) 8.315 8.902 ( -1.861 4.137 -1.162) 4.683 9.122 ( -11.121 4.360 -5.135) 13.002 9.290 ( -3.046 -6.320 3.793) 7.975 9.609 ( 12.523 5.808 -2.172) 13.974 9.720 ( -7.886 -0.825 -4.654) 9.194 10.091 ( -10.246 4.420 -7.145) 13.250 10.770 ( 4.868 -8.464 3.172) 10.266 10.850 ( 10.726 -5.468 -3.862) 12.644 10.904 ( -3.967 -12.109 -9.836) 16.097 11.370 ( -1.305 -3.936 -3.592) 5.486 11.471 ( -1.487 -14.951 -6.280) 16.285 11.955 ( -1.228 14.164 -4.870) 15.028 12.346 ( 2.620 0.674 -3.529) 4.447 12.419 ( -8.715 9.646 -0.879) 13.030 12.709 ( -6.389 3.360 -8.140) 10.879 12.842 ( 0.643 -7.480 -4.263) 8.634 13.177 ( -4.697 -12.888 -1.388) 13.787 13.233 ( 1.381 4.084 5.740) 7.178 13.498 ( 3.474 -1.132 6.342) 7.320 13.789 ( -4.977 1.663 -3.526) 6.322 14.131 ( 1.888 -13.133 1.910) 13.405 16.149 ( -5.224 2.460 -6.983) 9.061 16.190 ( -4.269 2.575 -7.353) 8.884 16.393 ( -8.300 1.522 -9.559) 12.751 16.542 ( -1.814 -5.822 -6.255) 8.736 17.195 ( 7.133 17.938 13.021) 23.285 17.972 ( 5.370 -16.720 5.069) 18.278 19.552 ( -3.223 15.516 -5.448) 16.757 20.177 ( 0.575 -14.660 -2.783) 14.933 ======================= Grid point 110 (55/205) ======================= q-point: ( 0.22 0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.684 ( -0.575 21.991 20.375) 29.984 2.943 ( 16.552 18.465 9.871) 26.691 3.432 ( -6.346 -10.959 10.588) 16.507 3.526 ( 14.215 -9.461 5.114) 17.825 4.124 ( 20.942 6.554 -0.989) 21.966 4.398 ( 4.855 -1.419 -3.793) 6.322 4.815 ( -8.621 7.228 4.720) 12.200 5.032 ( -0.611 -0.936 5.371) 5.486 5.244 ( 2.821 1.981 1.777) 3.878 5.492 ( 1.526 -6.185 -4.575) 7.843 5.978 ( 13.163 17.825 11.661) 25.039 6.174 ( 8.133 7.339 8.538) 13.889 6.672 ( -10.454 5.672 3.661) 12.444 6.869 ( -13.725 -1.785 13.620) 19.418 6.968 ( 12.933 9.743 2.270) 16.350 7.360 ( 10.051 -3.435 2.397) 10.889 8.069 ( 3.527 11.303 8.187) 14.396 8.443 ( -1.415 5.724 -1.038) 5.987 8.622 ( -2.826 -4.321 6.809) 8.545 8.786 ( -6.841 16.003 -0.460) 17.410 8.934 ( -2.124 -7.910 -8.689) 11.941 9.134 ( -14.145 -3.044 3.204) 14.819 9.656 ( 1.625 -1.384 -0.739) 2.258 9.795 ( -5.701 9.536 1.082) 11.163 9.861 ( 6.301 -9.064 -6.426) 12.773 10.593 ( -12.095 -19.292 -13.075) 26.257 10.877 ( 1.067 -0.385 -0.803) 1.390 11.001 ( 7.761 -8.996 -0.414) 11.889 11.359 ( 4.215 -2.351 -2.523) 5.446 11.458 ( 3.239 -9.318 0.781) 9.895 11.897 ( 0.377 9.364 -5.827) 11.035 12.143 ( -14.866 3.488 -4.422) 15.897 12.359 ( 2.128 6.373 -6.020) 9.021 12.546 ( -2.341 5.037 -5.647) 7.920 12.774 ( -1.550 -10.661 -8.266) 13.579 13.042 ( -1.991 -16.623 -5.078) 17.495 13.360 ( -0.276 11.906 8.201) 14.460 13.658 ( -0.663 3.836 3.408) 5.174 13.690 ( 0.999 -1.798 6.702) 7.010 14.177 ( 1.966 -19.297 0.184) 19.398 15.986 ( -4.442 2.243 -5.720) 7.582 16.058 ( -4.901 -1.799 -4.377) 6.813 16.175 ( -3.797 6.283 -8.182) 10.992 16.451 ( -1.531 -7.314 -5.741) 9.423 17.463 ( 8.613 15.461 11.460) 21.085 18.103 ( 3.742 -14.367 2.577) 15.068 19.417 ( -4.590 15.666 -6.012) 17.397 20.093 ( -5.621 -16.588 -3.175) 17.800 ======================= Grid point 111 (56/205) ======================= q-point: ( 0.33 0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.812 ( -7.220 14.425 19.035) 24.951 3.263 ( -20.826 -6.057 7.958) 23.103 3.313 ( 16.817 13.603 3.776) 21.957 3.723 ( 5.608 -5.648 -2.467) 8.332 4.520 ( 28.351 4.038 -11.997) 31.049 4.680 ( -11.653 10.133 6.427) 16.726 4.693 ( 29.429 -4.353 -4.813) 30.136 4.975 ( -7.496 -2.936 2.843) 8.538 5.300 ( 1.295 1.770 0.482) 2.245 5.501 ( 1.162 -7.445 -1.419) 7.668 6.336 ( 2.090 14.212 6.465) 15.753 6.362 ( 12.207 14.850 6.288) 20.226 6.437 ( -16.806 3.271 0.394) 17.126 6.713 ( -17.740 -4.265 16.097) 24.332 7.172 ( 8.648 12.693 -2.784) 15.609 7.574 ( 11.135 -0.969 -4.263) 11.962 8.070 ( -6.546 16.292 -1.760) 17.646 8.383 ( 2.859 11.181 1.495) 11.637 8.585 ( -9.664 -6.925 -5.894) 13.270 8.672 ( -7.142 4.821 4.522) 9.732 8.917 ( 5.101 -1.190 4.995) 7.237 8.985 ( -6.824 0.839 2.839) 7.438 9.599 ( -3.827 -2.851 -4.140) 6.317 9.711 ( -0.822 0.646 4.644) 4.760 10.006 ( 3.043 -9.903 6.277) 12.113 10.214 ( -12.259 -15.836 -13.153) 23.960 10.911 ( 4.314 0.352 -0.174) 4.332 11.112 ( 4.498 -10.341 0.306) 11.281 11.449 ( 6.171 -1.508 -0.784) 6.401 11.561 ( 5.700 -5.246 1.522) 7.895 11.794 ( -5.682 4.479 -8.119) 10.875 11.902 ( -5.168 -2.675 -1.000) 5.905 12.320 ( 0.979 8.102 -6.058) 10.164 12.499 ( 0.086 4.816 -0.990) 4.917 12.655 ( -0.595 -8.421 -8.575) 12.033 13.009 ( 0.901 -14.769 -0.576) 14.808 13.389 ( -2.471 14.712 4.248) 15.511 13.611 ( -2.734 5.225 1.508) 6.087 13.837 ( 0.576 -3.181 7.867) 8.505 14.207 ( 1.677 -23.419 -0.563) 23.486 15.885 ( -1.834 2.087 -2.747) 3.907 15.942 ( -3.666 -0.204 -1.086) 3.829 16.100 ( 0.461 4.774 -2.197) 5.276 16.386 ( -0.409 -7.761 -2.555) 8.181 17.731 ( 8.878 10.554 9.321) 16.646 18.132 ( -1.991 -8.628 -0.474) 8.867 19.289 ( -1.707 14.005 -6.822) 15.671 19.938 ( -6.387 -16.457 -4.745) 18.279 ======================= Grid point 112 (57/205) ======================= q-point: ( 0.44 0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.829 ( -5.521 4.321 8.190) 10.781 2.884 ( -24.090 0.915 0.478) 24.112 3.585 ( 8.494 8.194 -6.032) 13.254 3.750 ( 4.610 0.751 -1.381) 4.870 4.540 ( -10.640 10.708 7.613) 16.907 4.873 ( -2.418 -2.119 1.527) 3.559 4.912 ( 24.002 4.670 -12.558) 27.488 5.145 ( 21.789 -0.484 -9.445) 23.753 5.335 ( 5.058 -3.350 -0.103) 6.068 5.442 ( -5.929 -4.460 -2.621) 7.869 6.052 ( -25.778 3.617 2.454) 26.146 6.255 ( -4.588 2.328 -6.229) 8.079 6.565 ( -10.134 8.738 2.151) 13.553 6.584 ( -0.929 8.363 6.565) 10.672 7.221 ( 3.418 14.445 -9.029) 17.375 7.637 ( 5.621 -0.210 -12.804) 13.985 7.944 ( -1.110 12.750 -3.950) 13.393 8.365 ( -1.187 -5.105 -6.102) 8.044 8.538 ( 1.035 8.611 6.180) 10.650 8.627 ( -4.118 6.219 11.658) 13.840 8.855 ( -5.812 2.200 -2.884) 6.851 9.072 ( 0.845 -0.124 9.197) 9.236 9.508 ( -1.154 -5.147 -6.747) 8.565 9.739 ( -3.913 4.109 6.550) 8.666 10.005 ( -1.804 -12.965 -1.412) 13.166 10.139 ( 3.392 -14.433 14.013) 20.400 10.994 ( 3.085 -2.737 -1.641) 4.438 11.171 ( 2.314 -9.651 0.947) 9.970 11.540 ( 3.589 0.930 2.519) 4.483 11.619 ( 2.908 6.690 -6.397) 9.702 11.705 ( 0.333 -5.919 2.604) 6.475 11.858 ( -0.092 -8.039 -0.171) 8.042 12.301 ( 2.696 10.434 -2.761) 11.125 12.497 ( 1.103 -0.631 -1.279) 1.803 12.622 ( 3.542 -0.501 -3.336) 4.891 13.041 ( 1.214 -15.369 2.633) 15.640 13.391 ( -2.458 14.345 4.846) 15.339 13.579 ( -1.493 5.567 0.365) 5.776 13.835 ( -5.200 -4.118 -0.242) 6.638 14.228 ( 1.037 -24.503 -0.245) 24.526 15.870 ( 1.231 1.737 1.216) 2.451 15.919 ( -0.160 0.298 3.164) 3.182 16.134 ( 2.278 4.432 3.846) 6.295 16.396 ( 1.651 -7.134 2.313) 7.680 17.898 ( -2.170 6.802 0.297) 7.146 18.079 ( 0.508 -2.286 3.628) 4.318 19.226 ( 2.826 11.553 -7.729) 14.184 19.790 ( -2.622 -14.717 -7.338) 16.652 ======================= Grid point 113 (58/205) ======================= q-point: (-0.44 0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.449 ( -18.338 9.688 -7.161) 21.942 2.820 ( 1.378 -6.410 -1.241) 6.673 3.422 ( -12.519 14.217 -8.871) 20.918 3.882 ( 3.285 -5.185 -0.361) 6.149 4.476 ( -1.704 10.709 2.730) 11.182 4.828 ( 0.424 -2.617 -3.221) 4.172 5.075 ( -3.861 5.309 -11.617) 13.344 5.158 ( -16.964 1.318 -0.386) 17.019 5.272 ( 9.250 6.795 -5.150) 12.580 5.471 ( -8.315 2.967 1.005) 8.886 5.691 ( 3.155 1.955 -11.699) 12.274 6.144 ( -4.967 -10.000 -7.131) 13.248 6.394 ( -0.664 13.045 -3.363) 13.488 6.553 ( -3.794 4.078 2.339) 6.042 7.102 ( -2.450 12.866 -15.142) 20.020 7.493 ( -2.712 -2.290 -16.791) 17.162 8.030 ( 6.456 10.908 5.037) 13.640 8.388 ( 5.960 -3.710 -1.652) 7.212 8.551 ( -5.777 3.654 5.652) 8.870 8.602 ( -1.195 12.727 -5.072) 13.753 8.848 ( -0.683 -4.168 10.854) 11.647 9.086 ( -3.128 -9.107 -1.191) 9.702 9.513 ( 4.327 7.344 2.239) 8.813 9.741 ( -2.458 8.303 7.765) 11.631 9.978 ( -1.629 -12.326 -0.262) 12.436 10.428 ( 9.339 -17.898 14.248) 24.709 10.957 ( -3.059 -0.318 -1.005) 3.235 11.233 ( 0.987 -9.729 3.517) 10.393 11.610 ( -0.544 -0.411 1.202) 1.382 11.682 ( -3.122 -6.477 5.558) 9.088 11.731 ( 9.935 5.658 0.857) 11.465 11.886 ( 2.720 -0.044 0.012) 2.720 12.372 ( 5.777 8.570 0.991) 10.383 12.543 ( 3.486 -1.301 2.469) 4.465 12.669 ( 5.142 4.099 -5.002) 8.262 13.108 ( 1.309 -18.652 6.266) 19.720 13.366 ( -4.167 8.282 1.964) 9.477 13.606 ( 2.209 3.872 1.847) 4.825 13.665 ( -7.867 -2.288 -5.666) 9.961 14.233 ( -0.460 -22.547 -0.361) 22.554 15.955 ( 4.489 0.579 4.987) 6.735 15.987 ( 2.290 -0.147 5.825) 6.261 16.255 ( 3.442 5.303 9.311) 11.254 16.479 ( 2.746 -5.995 5.159) 8.373 17.694 ( -12.423 13.962 -5.506) 19.483 18.187 ( 1.409 -8.112 5.149) 9.710 19.230 ( 6.494 11.778 -7.764) 15.530 19.709 ( 4.201 -11.033 -11.170) 16.253 ======================= Grid point 114 (59/205) ======================= q-point: (-0.33 0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( -6.557 19.219 -8.280) 21.929 2.855 ( 4.071 -10.922 -6.041) 13.128 3.048 ( -16.644 16.885 -7.759) 24.947 3.741 ( -16.292 -13.618 -2.398) 21.369 4.547 ( 1.415 8.038 -3.121) 8.738 4.575 ( -18.292 7.893 -7.081) 21.143 4.756 ( -19.139 5.040 -3.967) 20.185 4.931 ( 1.468 5.545 0.206) 5.740 5.316 ( -4.535 4.477 3.503) 7.272 5.403 ( 9.204 9.834 -7.362) 15.350 5.724 ( 2.408 7.602 -7.142) 10.705 5.854 ( -8.195 -1.193 -15.483) 17.559 6.491 ( 4.667 -3.459 0.135) 5.811 6.623 ( 9.041 -0.845 4.596) 10.178 6.876 ( -4.223 11.720 -13.380) 18.282 7.286 ( -2.546 -4.695 -12.330) 13.437 8.069 ( -8.468 5.042 0.430) 9.865 8.447 ( -1.330 6.559 -0.611) 6.720 8.482 ( 5.503 -1.115 -1.907) 5.929 8.717 ( 6.741 6.119 7.689) 11.917 8.909 ( -0.185 -2.063 3.591) 4.145 9.013 ( -1.594 -8.999 -3.544) 9.802 9.615 ( 3.712 2.399 2.825) 5.246 9.809 ( 0.822 15.531 5.210) 16.402 9.955 ( 1.321 -13.361 -2.282) 13.619 10.679 ( 5.846 -19.237 6.801) 21.224 10.935 ( -0.573 4.996 3.845) 6.330 11.269 ( -1.945 -6.311 3.630) 7.536 11.564 ( -8.009 -5.621 2.446) 10.086 11.628 ( -4.476 -8.186 7.611) 12.040 11.944 ( 3.971 6.685 1.184) 7.866 12.007 ( 12.432 4.199 3.153) 13.496 12.502 ( 5.185 7.890 2.987) 9.903 12.640 ( 5.392 0.135 -5.747) 7.882 12.697 ( 3.158 8.626 -0.050) 9.186 13.184 ( -2.161 -21.096 5.551) 21.921 13.336 ( -0.935 -1.230 3.591) 3.909 13.441 ( -2.794 -0.718 -6.545) 7.153 13.734 ( 3.692 3.683 6.033) 7.975 14.194 ( -2.707 -17.675 -1.939) 17.986 16.110 ( 3.790 -0.055 6.927) 7.896 16.124 ( 6.876 -1.130 7.200) 10.020 16.429 ( 3.526 4.782 11.195) 12.674 16.579 ( 2.251 -4.803 4.978) 7.275 17.396 ( -13.682 20.866 -5.634) 25.580 18.180 ( -6.089 -14.815 1.910) 16.131 19.314 ( 10.557 13.392 -6.115) 18.116 19.710 ( 10.464 -5.886 -15.274) 19.428 ======================= Grid point 115 (60/205) ======================= q-point: (-0.22 0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.043 ( 2.238 26.093 -4.192) 26.522 2.542 ( -23.764 22.595 -5.322) 33.220 2.929 ( 2.637 -14.865 -6.286) 16.353 3.358 ( -20.293 -16.786 -1.760) 26.394 4.138 ( -15.739 15.437 0.559) 22.052 4.336 ( -13.691 0.731 -2.857) 14.005 4.766 ( 8.621 10.314 -0.114) 13.443 4.949 ( -1.246 13.028 -0.234) 13.090 5.280 ( -4.034 3.636 2.357) 5.920 5.508 ( -0.355 1.511 -2.595) 3.024 5.552 ( 4.317 7.454 -7.005) 11.103 5.729 ( 1.278 5.134 -7.846) 9.463 6.465 ( -1.482 -0.004 -8.616) 8.743 6.718 ( -0.802 -4.390 -4.227) 6.147 6.895 ( 6.844 3.253 8.845) 11.647 7.180 ( 1.341 -5.750 -4.837) 7.632 7.843 ( -11.839 7.070 -2.297) 13.980 8.404 ( -6.579 -9.504 1.691) 11.682 8.557 ( 3.812 6.372 1.547) 7.585 8.855 ( -1.495 -0.763 4.977) 5.252 8.971 ( 5.034 -3.588 -5.688) 8.400 9.007 ( 9.081 2.000 -0.951) 9.347 9.726 ( 4.311 0.847 2.811) 5.216 9.828 ( -1.373 17.469 2.332) 17.677 10.014 ( 8.921 -13.985 -3.947) 17.051 10.774 ( -1.494 -14.871 2.742) 15.195 10.985 ( 0.840 2.501 2.074) 3.356 11.189 ( -9.017 -1.399 3.128) 9.646 11.459 ( -4.004 -7.131 -0.816) 8.219 11.642 ( -1.780 -12.884 4.354) 13.716 12.036 ( 3.547 6.908 3.307) 8.441 12.212 ( 8.265 1.140 -0.052) 8.344 12.560 ( -0.600 10.667 -1.258) 10.758 12.647 ( 4.287 8.417 -4.154) 10.319 12.713 ( -2.109 5.611 -3.440) 6.911 13.187 ( 2.776 -13.044 2.230) 13.522 13.401 ( 0.802 -4.693 8.769) 9.978 13.469 ( 1.583 -8.922 4.479) 10.108 13.851 ( 3.551 1.361 3.818) 5.389 14.098 ( -4.166 -10.327 -3.740) 11.747 16.249 ( 4.070 0.560 5.017) 6.485 16.327 ( 6.748 -2.744 7.233) 10.266 16.576 ( 1.598 3.052 6.432) 7.297 16.667 ( 2.481 -3.592 5.123) 6.731 17.098 ( -13.414 24.299 -4.233) 28.077 18.035 ( -9.866 -18.067 0.055) 20.585 19.472 ( 11.340 12.951 -3.334) 17.534 19.773 ( 15.028 -0.929 -17.252) 22.899 ======================= Grid point 116 (61/205) ======================= q-point: (-0.11 0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.084 ( 3.038 28.113 1.195) 28.302 2.106 ( -17.078 23.634 1.160) 29.182 2.901 ( -4.530 -11.979 3.936) 13.398 3.085 ( -7.191 -15.324 3.206) 17.228 4.008 ( -3.941 20.648 5.560) 21.743 4.181 ( -4.978 4.779 3.149) 7.585 4.798 ( -2.466 8.431 -3.786) 9.566 4.963 ( 1.778 7.061 5.266) 8.987 5.225 ( -2.751 4.746 0.829) 5.548 5.450 ( -4.410 -3.586 7.089) 9.086 5.658 ( 2.185 9.275 -8.131) 12.526 5.715 ( 10.768 6.359 -4.441) 13.271 6.397 ( 3.843 -0.889 -5.827) 7.037 6.622 ( -3.584 -8.011 -4.625) 9.920 7.043 ( -2.324 3.964 10.953) 11.878 7.225 ( 3.107 -4.428 2.080) 5.795 7.663 ( -6.435 8.354 1.563) 10.660 8.270 ( -8.400 -14.048 2.715) 16.591 8.638 ( 1.183 8.860 4.184) 9.869 8.871 ( 1.844 -0.868 0.339) 2.066 9.040 ( 8.266 -5.562 -4.065) 10.760 9.159 ( 8.460 -4.410 -3.067) 10.021 9.704 ( -6.284 23.483 0.660) 24.318 9.929 ( 4.708 1.898 4.372) 6.699 10.174 ( 9.744 -12.814 0.125) 16.098 10.677 ( -5.816 -8.821 -4.032) 11.309 10.903 ( -6.846 0.737 -7.804) 10.407 11.100 ( -3.532 -2.948 1.175) 4.748 11.445 ( 4.460 -8.346 -1.773) 9.628 11.617 ( -2.357 -15.613 -2.593) 16.001 12.105 ( 1.448 7.782 -1.381) 8.035 12.304 ( 3.327 1.435 -3.015) 4.714 12.508 ( -2.532 8.216 0.737) 8.629 12.661 ( 1.919 2.859 1.855) 3.911 12.729 ( 3.435 14.609 3.041) 15.312 13.278 ( 2.618 -9.944 0.196) 10.285 13.432 ( -2.532 -6.168 -1.841) 6.917 13.510 ( -5.322 -11.530 7.922) 14.967 13.925 ( 1.912 -0.432 -1.286) 2.345 14.019 ( -0.692 -4.164 0.764) 4.290 16.319 ( 1.191 1.621 -1.604) 2.572 16.479 ( 2.672 -6.292 1.717) 7.048 16.627 ( 0.236 1.782 0.970) 2.042 16.742 ( -0.435 0.144 1.700) 1.761 16.863 ( -7.969 24.477 2.833) 25.897 17.874 ( -6.953 -19.107 1.136) 20.365 19.608 ( 6.157 12.112 -3.145) 13.946 19.921 ( 17.712 -1.242 -12.166) 21.523 ======================= Grid point 117 (62/205) ======================= q-point: ( 0.00 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.456 ( 6.489 -12.039 5.272) 14.657 2.456 ( 6.489 12.039 5.272) 14.657 2.839 ( 2.323 -15.465 12.760) 20.184 2.839 ( 2.323 15.465 12.760) 20.184 4.286 ( -0.559 -1.941 9.078) 9.300 4.286 ( -0.559 1.941 9.078) 9.300 4.871 ( -4.546 -9.107 -4.447) 11.108 4.871 ( -4.546 9.107 -4.447) 11.108 5.371 ( 0.344 -6.774 9.379) 11.575 5.371 ( 0.344 6.774 9.379) 11.575 5.825 ( 3.987 -7.267 -6.899) 10.784 5.825 ( 3.987 7.267 -6.899) 10.784 6.506 ( 8.829 -5.419 2.118) 10.574 6.506 ( 8.829 5.419 2.118) 10.574 7.167 ( -6.177 -5.823 7.965) 11.640 7.167 ( -6.177 5.823 7.965) 11.640 7.928 ( 0.796 -15.477 7.011) 17.009 7.928 ( 0.796 15.477 7.011) 17.009 8.825 ( -0.202 -5.811 1.667) 6.049 8.825 ( -0.202 5.811 1.667) 6.049 9.131 ( 7.127 -2.230 -1.147) 7.555 9.131 ( 7.127 2.230 -1.147) 7.555 9.942 ( -10.283 -5.039 -1.047) 11.499 9.942 ( -10.283 5.039 -1.047) 11.499 10.350 ( 4.604 -16.476 1.494) 17.172 10.350 ( 4.604 16.476 1.494) 17.172 10.842 ( 0.760 -8.452 -11.097) 13.970 10.842 ( 0.760 8.452 -11.097) 13.970 11.372 ( -0.505 -1.633 -4.676) 4.979 11.372 ( -0.505 1.633 -4.676) 4.979 12.267 ( 1.211 -7.760 -2.675) 8.297 12.267 ( 1.211 7.760 -2.675) 8.297 12.646 ( 0.547 -8.069 -1.221) 8.179 12.646 ( 0.547 8.069 -1.221) 8.179 13.110 ( -6.771 -13.160 0.740) 14.818 13.110 ( -6.771 13.160 0.740) 14.818 13.266 ( 0.573 -8.536 2.142) 8.820 13.266 ( 0.573 8.536 2.142) 8.820 13.947 ( -0.440 -4.436 -1.549) 4.719 13.947 ( -0.440 4.436 -1.549) 4.719 16.335 ( -2.824 -3.620 -4.629) 6.520 16.335 ( -2.824 3.620 -4.629) 6.520 16.606 ( -4.430 -2.964 -6.598) 8.482 16.606 ( -4.430 2.964 -6.598) 8.482 17.422 ( 1.732 -23.240 8.418) 24.778 17.422 ( 1.732 23.240 8.418) 24.778 19.896 ( 4.472 -11.950 -5.122) 13.749 19.896 ( 4.472 11.950 -5.122) 13.749 ======================= Grid point 119 (63/205) ======================= q-point: ( 0.11 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.779 ( 18.008 -4.816 8.225) 20.375 2.779 ( 18.008 4.816 8.225) 20.375 3.043 ( 3.924 -11.457 15.493) 19.665 3.043 ( 3.924 11.457 15.493) 19.665 4.274 ( -7.136 -12.636 4.793) 15.283 4.274 ( -7.136 12.636 4.793) 15.283 4.878 ( 6.109 -3.448 0.794) 7.060 4.878 ( 6.109 3.448 0.794) 7.060 5.399 ( -3.267 -7.666 0.622) 8.356 5.399 ( -3.267 7.666 0.622) 8.356 5.922 ( 9.678 -6.667 4.069) 12.436 5.922 ( 9.678 6.667 4.069) 12.436 6.741 ( 8.568 -4.746 8.058) 12.683 6.741 ( 8.568 4.746 8.058) 12.683 7.102 ( -6.635 -8.937 5.898) 12.597 7.102 ( -6.635 8.937 5.898) 12.597 8.089 ( 6.167 -13.471 10.309) 18.049 8.089 ( 6.167 13.471 10.309) 18.049 8.818 ( -2.173 -7.441 0.904) 7.804 8.818 ( -2.173 7.441 0.904) 7.804 9.205 ( -3.059 -2.774 1.866) 4.531 9.205 ( -3.059 2.774 1.866) 4.531 9.717 ( -3.871 -1.643 -8.335) 9.336 9.717 ( -3.871 1.643 -8.335) 9.336 10.356 ( -6.416 -21.774 -1.746) 22.767 10.356 ( -6.416 21.774 -1.746) 22.767 10.821 ( 7.728 -1.748 -7.744) 11.079 10.821 ( 7.728 1.748 -7.744) 11.079 11.319 ( -0.385 -0.857 -2.631) 2.794 11.319 ( -0.385 0.857 -2.631) 2.794 12.236 ( -1.481 -10.966 -4.410) 11.912 12.236 ( -1.481 10.966 -4.410) 11.912 12.624 ( -0.448 -9.544 -4.151) 10.418 12.624 ( -0.448 9.544 -4.151) 10.418 12.878 ( -9.013 -12.696 -7.903) 17.461 12.878 ( -9.013 12.696 -7.903) 17.461 13.414 ( 4.384 -7.516 11.124) 14.123 13.414 ( 4.384 7.516 11.124) 14.123 13.898 ( -2.182 -8.861 -2.851) 9.560 13.898 ( -2.182 8.861 -2.851) 9.560 16.190 ( -6.053 -1.491 -6.569) 9.056 16.190 ( -6.053 1.491 -6.569) 9.056 16.444 ( -3.795 -3.500 -8.678) 10.097 16.444 ( -3.795 3.500 -8.678) 10.097 17.593 ( 6.034 -19.762 8.883) 22.492 17.593 ( 6.034 19.762 8.883) 22.492 19.869 ( -1.712 -15.329 -4.834) 16.164 19.869 ( -1.712 15.329 -4.834) 16.164 ======================= Grid point 121 (64/205) ======================= q-point: ( 0.22 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.090 ( -0.935 -15.252 15.278) 21.608 3.090 ( -0.935 15.252 15.278) 21.608 3.308 ( 12.059 -10.474 7.815) 17.782 3.308 ( 12.059 10.474 7.815) 17.782 4.280 ( 11.528 -7.976 -4.811) 14.821 4.280 ( 11.528 7.976 -4.811) 14.821 4.959 ( -2.937 -5.750 3.820) 7.502 4.959 ( -2.937 5.750 3.820) 7.502 5.348 ( 0.802 -7.039 -2.243) 7.431 5.348 ( 0.802 7.039 -2.243) 7.431 6.217 ( 13.637 -4.438 9.229) 17.054 6.217 ( 13.637 4.438 9.229) 17.054 6.786 ( -14.766 -5.322 10.856) 19.084 6.786 ( -14.766 5.322 10.856) 19.084 7.206 ( 12.135 -11.027 3.489) 16.764 7.206 ( 12.135 11.027 3.489) 16.764 8.318 ( 4.862 -12.397 12.602) 18.334 8.318 ( 4.862 12.397 12.602) 18.334 8.730 ( -5.990 -10.528 -6.672) 13.828 8.730 ( -5.990 10.528 -6.672) 13.828 9.044 ( -10.154 -7.627 0.886) 12.730 9.044 ( -10.154 7.627 0.886) 12.730 9.702 ( 4.653 -5.508 -2.717) 7.705 9.702 ( 4.653 5.508 -2.717) 7.705 10.127 ( -10.521 -22.192 -8.851) 26.106 10.127 ( -10.521 22.192 -8.851) 26.106 10.894 ( 4.579 -2.647 -1.895) 5.618 10.894 ( 4.579 2.647 -1.895) 5.618 11.342 ( 4.301 -2.286 0.727) 4.925 11.342 ( 4.301 2.286 0.727) 4.925 12.093 ( -7.251 -7.572 -7.745) 13.034 12.093 ( -7.251 7.572 -7.745) 13.034 12.540 ( -0.795 -9.882 -8.850) 13.290 12.540 ( -0.795 9.882 -8.850) 13.290 12.727 ( -1.794 -12.706 -1.932) 12.977 12.727 ( -1.794 12.706 -1.932) 12.977 13.600 ( 2.711 -7.817 11.203) 13.927 13.600 ( 2.711 7.817 11.203) 13.927 13.827 ( -2.021 -13.441 -2.768) 13.871 13.827 ( -2.021 13.441 -2.768) 13.871 16.023 ( -5.094 -1.645 -5.035) 7.349 16.023 ( -5.094 1.645 -5.035) 7.349 16.306 ( -2.265 -6.660 -7.345) 10.170 16.306 ( -2.265 6.660 -7.345) 10.170 17.789 ( 6.159 -15.962 6.893) 18.445 17.789 ( 6.159 15.962 6.893) 18.445 19.750 ( -5.144 -16.683 -5.268) 18.236 19.750 ( -5.144 16.683 -5.268) 18.236 ======================= Grid point 123 (65/205) ======================= q-point: ( 0.33 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.079 ( -15.398 -11.275 14.908) 24.218 3.079 ( -15.398 11.276 14.908) 24.218 3.563 ( 11.499 -10.065 -0.394) 15.287 3.563 ( 11.499 10.065 -0.394) 15.287 4.603 ( 29.032 -4.226 -9.462) 30.826 4.603 ( 29.032 4.226 -9.462) 30.826 4.868 ( -8.758 -7.441 3.513) 12.017 4.868 ( -8.758 7.441 3.513) 12.017 5.367 ( 1.782 -5.041 -1.541) 5.564 5.367 ( 1.782 5.041 -1.541) 5.564 6.468 ( -2.840 -0.613 -3.479) 4.532 6.468 ( -2.840 0.613 -3.479) 4.532 6.613 ( -8.662 -7.233 19.439) 22.477 6.613 ( -8.662 7.233 19.439) 22.477 7.438 ( 10.824 -11.497 -2.730) 16.025 7.438 ( 10.824 11.497 -2.730) 16.025 8.363 ( -9.075 -12.373 -4.525) 15.998 8.363 ( -9.075 12.373 -4.525) 15.998 8.603 ( -1.000 -9.222 6.606) 11.389 8.603 ( -1.000 9.222 6.606) 11.389 8.984 ( 0.208 -4.124 3.067) 5.144 8.984 ( 0.208 4.124 3.067) 5.144 9.692 ( -2.122 -7.014 -6.967) 10.111 9.692 ( -2.122 7.014 -6.967) 10.111 9.906 ( -6.297 -5.575 1.513) 8.545 9.906 ( -6.297 5.575 1.513) 8.545 10.955 ( 3.421 -4.833 0.016) 5.922 10.955 ( 3.421 4.833 0.016) 5.922 11.465 ( 6.980 -3.595 1.786) 8.052 11.465 ( 6.980 3.595 1.786) 8.052 11.871 ( -7.456 -2.075 -6.813) 10.311 11.871 ( -7.456 2.075 -6.813) 10.311 12.454 ( 2.200 -6.456 -9.716) 11.871 12.454 ( 2.200 6.456 -9.716) 11.871 12.724 ( -0.262 -12.347 2.972) 12.703 12.724 ( -0.262 12.347 2.972) 12.703 13.715 ( -0.710 -11.094 6.929) 13.099 13.715 ( -0.710 11.094 6.929) 13.099 13.780 ( -0.684 -15.103 -1.398) 15.183 13.780 ( -0.684 15.103 -1.398) 15.183 15.919 ( -2.358 -1.567 -1.860) 3.387 15.919 ( -2.358 1.567 -1.860) 3.387 16.228 ( -0.244 -7.297 -2.679) 7.777 16.228 ( -0.244 7.297 -2.679) 7.777 17.941 ( 3.930 -9.886 4.594) 11.589 17.941 ( 3.930 9.886 4.594) 11.589 19.600 ( -4.432 -16.121 -5.968) 17.753 19.600 ( -4.432 16.121 -5.968) 17.753 ======================= Grid point 125 (66/205) ======================= q-point: ( 0.44 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.885 ( -15.730 -1.167 4.473) 16.396 2.885 ( -15.730 1.167 4.473) 16.396 3.715 ( 6.552 -4.248 -2.962) 8.351 3.715 ( 6.552 4.248 -2.962) 8.351 4.739 ( -7.273 -8.647 3.831) 11.931 4.739 ( -7.273 8.647 3.831) 11.931 5.058 ( 28.597 -7.087 -10.856) 31.398 5.058 ( 28.597 7.087 -10.856) 31.398 5.351 ( -1.259 -3.853 -3.161) 5.141 5.351 ( -1.259 3.853 -3.161) 5.141 6.160 ( -21.436 -6.646 2.153) 22.546 6.160 ( -21.436 6.646 2.153) 22.546 6.700 ( -2.096 -2.438 1.491) 3.544 6.700 ( -2.096 2.438 1.491) 3.544 7.505 ( 4.051 -11.625 -11.757) 17.023 7.505 ( 4.051 11.625 -11.757) 17.023 8.185 ( -0.900 -10.596 -4.771) 11.655 8.185 ( -0.900 10.596 -4.771) 11.655 8.656 ( -4.190 -3.910 11.705) 13.033 8.656 ( -4.190 3.910 11.705) 13.033 8.994 ( -2.085 -8.722 -4.326) 9.957 8.994 ( -2.085 8.722 -4.326) 9.957 9.649 ( 4.047 -16.762 1.488) 17.308 9.649 ( 4.047 16.762 1.489) 17.308 9.887 ( -3.422 -8.548 9.491) 13.223 9.887 ( -3.422 8.548 9.491) 13.223 11.008 ( 1.880 -5.062 0.323) 5.409 11.008 ( 1.880 5.062 0.323) 5.409 11.608 ( 4.692 -4.595 3.348) 7.372 11.608 ( 4.692 4.595 3.348) 7.372 11.730 ( -0.815 -4.602 -3.349) 5.750 11.730 ( -0.815 4.602 -3.349) 5.750 12.437 ( 5.112 -3.751 -6.112) 8.807 12.437 ( 5.112 3.751 -6.112) 8.807 12.755 ( -0.738 -11.889 4.294) 12.662 12.755 ( -0.738 11.889 4.294) 12.662 13.696 ( -4.883 -8.851 -0.663) 10.131 13.696 ( -4.883 8.851 -0.663) 10.131 13.781 ( 0.913 -16.353 1.256) 16.427 13.781 ( 0.913 16.353 1.256) 16.427 15.902 ( 0.548 -1.487 1.745) 2.357 15.902 ( 0.548 1.487 1.745) 2.357 16.251 ( 2.128 -6.695 3.549) 7.871 16.251 ( 2.128 6.695 3.549) 7.871 18.012 ( -0.425 -4.351 2.555) 5.063 18.012 ( -0.425 4.351 2.555) 5.063 19.491 ( 0.070 -14.048 -6.860) 15.634 19.491 ( 0.070 14.048 -6.860) 15.634 ======================= Grid point 127 (67/205) ======================= q-point: (-0.44 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.651 ( -8.373 -9.525 -4.773) 13.550 2.651 ( -8.373 9.525 -4.773) 13.550 3.697 ( -6.045 -11.979 -3.526) 13.873 3.697 ( -6.045 11.979 -3.526) 13.873 4.694 ( 1.257 -9.560 -0.951) 9.689 4.694 ( 1.257 9.560 -0.951) 9.689 5.151 ( -12.970 -2.127 -4.278) 13.822 5.151 ( -12.970 2.127 -4.278) 13.822 5.416 ( 12.542 -6.499 -5.344) 15.103 5.416 ( 12.542 6.499 -5.344) 15.103 5.866 ( -6.053 -13.678 -4.962) 15.759 5.866 ( -6.053 13.678 -4.962) 15.759 6.594 ( -5.437 -3.726 -2.861) 7.185 6.594 ( -5.437 3.726 -2.861) 7.185 7.355 ( -2.906 -10.510 -17.038) 20.229 7.355 ( -2.906 10.510 -17.038) 20.229 8.225 ( 4.104 -9.104 1.278) 10.068 8.225 ( 4.104 9.104 1.278) 10.068 8.708 ( -1.866 -8.945 7.823) 12.029 8.708 ( -1.866 8.945 7.823) 12.029 8.868 ( -2.599 -11.275 -4.961) 12.589 8.868 ( -2.599 11.275 -4.961) 12.589 9.725 ( -0.062 -11.846 1.060) 11.894 9.725 ( -0.062 11.846 1.060) 11.894 10.024 ( 5.037 -18.918 13.051) 23.529 10.024 ( 5.037 18.918 13.051) 23.529 11.037 ( 0.134 -7.751 3.133) 8.362 11.037 ( 0.134 7.751 3.133) 8.362 11.608 ( -4.392 -0.976 1.499) 4.742 11.608 ( -4.392 0.976 1.499) 4.742 11.849 ( 9.625 -4.144 3.324) 10.994 11.849 ( 9.625 4.144 3.324) 10.994 12.512 ( 7.479 -3.065 -2.360) 8.421 12.512 ( 7.479 3.065 -2.360) 8.421 12.786 ( -0.644 -10.808 5.076) 11.958 12.786 ( -0.644 10.808 5.076) 11.958 13.549 ( -6.487 -7.227 -6.410) 11.636 13.549 ( -6.487 7.227 -6.410) 11.636 13.828 ( 1.600 -15.916 3.038) 16.282 13.828 ( 1.600 15.916 3.038) 16.282 15.971 ( 3.188 -1.028 5.000) 6.018 15.971 ( 3.188 1.028 5.000) 6.018 16.361 ( 3.291 -5.356 7.480) 9.771 16.361 ( 3.291 5.356 7.480) 9.771 17.972 ( -5.919 -12.532 0.771) 13.881 17.972 ( -5.919 12.532 0.771) 13.881 19.474 ( 6.267 -11.789 -7.805) 15.466 19.474 ( 6.267 11.789 -7.805) 15.466 ======================= Grid point 129 (68/205) ======================= q-point: (-0.33 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.528 ( 2.108 -18.425 -7.677) 20.072 2.528 ( 2.108 18.425 -7.677) 20.072 3.421 ( -18.436 -17.368 -5.334) 25.884 3.421 ( -18.436 17.368 -5.334) 25.884 4.633 ( -14.090 -1.063 -5.176) 15.048 4.633 ( -14.090 1.063 -5.176) 15.048 4.897 ( -0.031 -6.894 -0.351) 6.903 4.897 ( -0.031 6.894 -0.351) 6.903 5.467 ( -1.857 -5.001 1.366) 5.507 5.467 ( -1.857 5.001 1.366) 5.507 5.795 ( 3.850 -2.404 -13.764) 14.493 5.795 ( 3.850 2.404 -13.764) 14.493 6.550 ( 2.217 -5.871 0.502) 6.295 6.550 ( 2.217 5.871 0.502) 6.295 7.121 ( -3.996 -10.783 -13.221) 17.522 7.121 ( -3.996 10.783 -13.221) 17.522 8.243 ( -5.035 -11.745 0.924) 12.812 8.243 ( -5.035 11.745 0.924) 12.812 8.704 ( 0.770 -10.590 -1.496) 10.723 8.704 ( 0.770 10.590 -1.496) 10.723 8.900 ( 4.704 -0.362 2.253) 5.229 8.900 ( 4.704 0.362 2.253) 5.229 9.721 ( 0.818 -8.592 -0.253) 8.635 9.721 ( 0.818 8.592 -0.253) 8.635 10.221 ( 4.428 -23.127 6.672) 24.474 10.221 ( 4.428 23.127 6.672) 24.474 11.090 ( 0.161 -9.312 5.509) 10.820 11.090 ( 0.161 9.312 5.509) 10.820 11.527 ( -7.853 -1.996 4.925) 9.482 11.527 ( -7.853 1.996 4.925) 9.482 12.045 ( 8.214 -1.755 1.212) 8.487 12.045 ( 8.214 1.755 1.212) 8.487 12.639 ( 8.523 -3.023 -2.129) 9.291 12.639 ( 8.523 3.023 -2.129) 9.291 12.844 ( 0.060 -10.207 6.531) 12.118 12.844 ( 0.060 10.207 6.531) 12.118 13.381 ( -4.086 -4.346 -4.660) 7.570 13.381 ( -4.086 4.346 -4.660) 7.570 13.889 ( 1.555 -11.592 2.643) 11.991 13.889 ( 1.555 11.592 2.643) 11.991 16.110 ( 5.176 -0.316 6.758) 8.518 16.110 ( 5.176 0.316 6.758) 8.518 16.499 ( 2.917 -3.144 7.651) 8.771 16.499 ( 2.917 3.144 7.651) 8.771 17.822 ( -10.328 -19.745 -0.616) 22.292 17.822 ( -10.328 19.745 -0.616) 22.292 19.551 ( 10.964 -9.658 -8.422) 16.865 19.551 ( 10.964 9.658 -8.422) 16.865 ======================= Grid point 131 (69/205) ======================= q-point: (-0.22 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.545 ( 5.481 -22.158 -5.591) 23.501 2.545 ( 5.481 22.158 -5.591) 23.501 2.980 ( -22.412 -19.936 -4.192) 30.287 2.980 ( -22.412 19.936 -4.192) 30.287 4.301 ( -12.877 -3.829 -0.908) 13.465 4.301 ( -12.877 3.829 -0.908) 13.465 4.993 ( 4.427 -8.007 2.196) 9.409 4.993 ( 4.427 8.007 2.196) 9.409 5.414 ( -5.441 -7.817 -1.308) 9.614 5.414 ( -5.441 7.817 -1.308) 9.614 5.730 ( 4.651 -5.834 -8.064) 10.986 5.730 ( 4.651 5.834 -8.064) 10.986 6.559 ( -1.700 -8.616 -5.425) 10.323 6.559 ( -1.700 8.616 -5.425) 10.323 7.032 ( 2.743 -7.914 0.275) 8.380 7.032 ( 2.743 7.914 0.275) 8.380 8.093 ( -10.174 -15.959 0.172) 18.926 8.093 ( -10.174 15.959 0.172) 18.926 8.739 ( 2.196 -8.756 1.552) 9.160 8.739 ( 2.196 8.756 1.552) 9.160 8.989 ( 5.373 -3.074 -3.824) 7.276 8.989 ( 5.373 3.074 -3.824) 7.276 9.788 ( 6.688 -6.979 0.825) 9.701 9.788 ( 6.688 6.979 0.825) 9.701 10.321 ( 1.600 -26.044 2.435) 26.206 10.321 ( 1.600 26.044 2.435) 26.206 11.094 ( -4.827 -6.464 1.305) 8.172 11.094 ( -4.827 6.464 1.305) 8.172 11.452 ( -4.515 -5.683 3.546) 8.078 11.452 ( -4.515 5.683 3.546) 8.078 12.166 ( 5.462 -5.061 -0.352) 7.454 12.166 ( 5.462 5.061 -0.352) 7.454 12.718 ( 1.414 -3.410 -3.887) 5.361 12.718 ( 1.414 3.410 -3.887) 5.361 12.916 ( 4.035 -12.461 3.011) 13.440 12.916 ( 4.035 12.461 3.011) 13.440 13.349 ( -0.889 -2.085 5.295) 5.760 13.349 ( -0.889 2.085 5.295) 5.760 13.929 ( 1.152 -6.153 0.425) 6.274 13.929 ( 1.152 6.153 0.425) 6.274 16.274 ( 5.213 -2.050 5.416) 7.792 16.274 ( 5.213 2.050 5.416) 7.792 16.612 ( 2.194 -1.802 5.339) 6.047 16.612 ( 2.194 1.802 5.339) 6.047 17.606 ( -11.949 -23.555 -0.809) 26.425 17.606 ( -11.949 23.555 -0.809) 26.425 19.683 ( 12.423 -7.540 -8.036) 16.606 19.683 ( 12.423 7.540 -8.036) 16.606 ======================= Grid point 133 (70/205) ======================= q-point: (-0.11 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.485 ( -8.223 -6.827 -3.069) 11.120 2.485 ( -8.223 6.827 -3.069) 11.120 2.726 ( -2.715 -12.039 6.442) 13.921 2.726 ( -2.715 12.039 6.442) 13.921 4.202 ( -0.625 -3.885 4.035) 5.636 4.202 ( -0.625 3.885 4.035) 5.636 5.022 ( -5.577 -5.389 1.220) 7.850 5.022 ( -5.577 5.389 1.220) 7.850 5.300 ( -2.818 -6.737 2.408) 7.690 5.300 ( -2.818 6.737 2.408) 7.690 5.800 ( 7.487 -0.782 -5.568) 9.363 5.800 ( 7.487 0.782 -5.568) 9.363 6.446 ( -0.733 -7.061 -5.514) 8.989 6.446 ( -0.733 7.061 -5.514) 8.989 7.133 ( 0.791 -4.608 7.841) 9.129 7.133 ( 0.791 4.608 7.841) 9.129 7.939 ( -7.117 -16.754 2.742) 18.409 7.939 ( -7.117 16.754 2.742) 18.409 8.793 ( 1.579 -6.246 1.831) 6.697 8.793 ( 1.579 6.246 1.831) 6.697 9.039 ( 6.120 -4.966 -4.878) 9.269 9.039 ( 6.120 4.966 -4.878) 9.269 9.951 ( 5.952 -6.402 4.591) 9.874 9.951 ( 5.952 6.402 4.591) 9.874 10.324 ( -1.310 -24.741 -1.388) 24.814 10.324 ( -1.310 24.741 -1.388) 24.814 10.970 ( -4.849 -6.199 -5.491) 9.597 10.970 ( -4.849 6.199 -5.491) 9.597 11.418 ( -0.741 -5.397 -2.154) 5.858 11.418 ( -0.741 5.397 -2.154) 5.858 12.245 ( 3.670 -5.514 -1.120) 6.718 12.245 ( 3.670 5.514 -1.120) 6.718 12.664 ( -1.481 -4.177 -2.142) 4.922 12.664 ( -1.481 4.177 -2.142) 4.922 13.043 ( 4.971 -14.070 3.940) 15.434 13.043 ( 4.971 14.070 3.940) 15.434 13.354 ( -5.347 -1.852 3.032) 6.420 13.354 ( -5.347 1.852 3.032) 6.420 13.947 ( 1.225 -2.529 -0.775) 2.915 13.947 ( 1.225 2.529 -0.775) 2.915 16.371 ( 1.634 -3.909 0.185) 4.241 16.371 ( 1.634 3.909 0.185) 4.241 16.677 ( 0.535 -3.184 0.728) 3.309 16.677 ( 0.535 3.184 0.728) 3.309 17.418 ( -7.930 -25.349 2.593) 26.687 17.418 ( -7.930 25.349 2.593) 26.687 19.818 ( 10.105 -8.082 -6.509) 14.484 19.818 ( 10.105 8.082 -6.509) 14.484 ======================= Grid point 162 (71/205) ======================= q-point: ( 0.00 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.417 ( -0.580 0.000 33.132) 33.137 1.480 ( 5.480 0.000 33.222) 33.671 2.668 ( 11.043 0.000 54.975) 56.073 3.353 ( -2.256 0.000 -2.809) 3.603 3.782 ( -2.435 0.000 7.740) 8.114 4.362 ( -1.987 0.000 3.424) 3.959 4.442 ( 4.517 0.000 15.942) 16.569 4.471 ( 8.805 0.000 9.786) 13.164 5.122 ( 3.695 0.000 -11.505) 12.084 5.398 ( 11.669 0.000 10.387) 15.622 5.736 ( -7.582 0.000 1.546) 7.738 6.143 ( -8.580 0.000 1.742) 8.755 6.446 ( -0.116 0.000 4.561) 4.562 6.570 ( 3.290 0.000 1.664) 3.687 6.761 ( -6.657 0.000 4.008) 7.770 7.211 ( 3.724 0.000 -13.511) 14.015 7.867 ( 4.191 0.000 -3.407) 5.402 8.231 ( -17.657 0.000 -5.742) 18.567 8.319 ( -4.060 0.000 13.694) 14.283 8.565 ( 15.438 0.000 1.956) 15.561 8.930 ( 5.046 0.000 2.980) 5.860 9.364 ( 0.057 0.000 3.769) 3.769 9.971 ( 20.644 0.000 -8.479) 22.318 10.128 ( -17.110 0.000 4.212) 17.621 10.149 ( 9.102 0.000 -18.250) 20.393 10.676 ( -37.309 0.000 0.817) 37.318 10.896 ( 5.819 0.000 -12.015) 13.350 11.190 ( -0.452 0.000 -0.944) 1.047 11.666 ( -1.549 0.000 2.950) 3.332 11.716 ( 4.627 0.000 3.506) 5.805 12.030 ( -4.282 0.000 3.114) 5.295 12.232 ( -7.341 0.000 -7.039) 10.170 12.426 ( 1.856 0.000 4.333) 4.714 12.647 ( -7.091 0.000 -13.819) 15.532 12.838 ( -1.312 0.000 -7.741) 7.851 13.189 ( -3.274 0.000 0.743) 3.358 13.541 ( -0.823 0.000 -4.397) 4.473 13.635 ( -5.751 0.000 -6.762) 8.877 14.746 ( -4.993 0.000 3.538) 6.119 15.009 ( 7.728 0.000 24.522) 25.711 15.277 ( 4.344 0.000 -2.703) 5.116 15.724 ( -9.653 0.000 -0.668) 9.676 16.607 ( 2.414 0.000 1.350) 2.766 16.650 ( -11.928 0.000 -10.079) 15.617 16.935 ( -2.699 0.000 -0.700) 2.789 18.141 ( 14.122 0.000 -2.448) 14.333 19.114 ( -5.201 0.000 10.157) 11.411 20.123 ( 56.650 0.000 -5.002) 56.870 ======================= Grid point 163 (72/205) ======================= q-point: ( 0.11 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.814 ( 9.678 0.000 26.718) 28.417 1.926 ( 5.048 0.000 35.529) 35.886 3.408 ( 13.380 0.000 -7.629) 15.403 3.415 ( 18.551 0.000 16.750) 24.994 3.929 ( 8.882 0.000 25.112) 26.637 4.317 ( -10.486 0.000 9.872) 14.402 4.698 ( 4.647 0.000 16.598) 17.236 4.777 ( 13.155 0.000 8.391) 15.603 4.965 ( -8.187 0.000 -9.175) 12.297 5.579 ( -6.762 0.000 -5.275) 8.576 5.776 ( 12.899 0.000 15.182) 19.922 5.983 ( -10.818 0.000 4.736) 11.809 6.333 ( -9.932 0.000 1.024) 9.985 6.732 ( 5.637 0.000 10.183) 11.639 6.800 ( 4.207 0.000 -1.916) 4.622 7.165 ( 5.614 0.000 -9.820) 11.311 7.830 ( -0.433 0.000 -9.629) 9.639 7.844 ( -17.751 0.000 -7.749) 19.369 8.369 ( -4.280 0.000 11.287) 12.071 8.910 ( 14.906 0.000 3.012) 15.208 9.099 ( 5.191 0.000 3.662) 6.353 9.486 ( 6.953 0.000 13.058) 14.794 9.744 ( -18.365 0.000 2.591) 18.547 10.042 ( -0.159 0.000 -16.716) 16.717 10.123 ( -12.144 0.000 -1.859) 12.286 10.410 ( 14.458 0.000 -3.011) 14.768 10.760 ( -1.635 0.000 -22.094) 22.154 11.177 ( -4.798 0.000 3.845) 6.148 11.727 ( 0.060 0.000 2.594) 2.594 11.808 ( 2.145 0.000 1.004) 2.369 11.966 ( -2.188 0.000 -0.152) 2.194 12.030 ( -8.267 0.000 1.077) 8.337 12.443 ( -3.780 0.000 4.771) 6.087 12.449 ( 0.377 0.000 -9.455) 9.463 12.880 ( 7.472 0.000 0.239) 7.476 13.095 ( -5.879 0.000 -2.488) 6.384 13.468 ( -5.371 0.000 -7.508) 9.231 13.485 ( -0.538 0.000 -4.175) 4.210 14.702 ( -3.800 0.000 4.095) 5.587 15.316 ( 3.049 0.000 -3.589) 4.709 15.415 ( 11.924 0.000 15.501) 19.557 15.580 ( -6.193 0.000 -0.247) 6.198 16.340 ( -11.619 0.000 -6.139) 13.141 16.674 ( 3.481 0.000 -2.601) 4.346 16.928 ( 0.358 0.000 9.356) 9.363 18.335 ( 13.249 0.000 -8.162) 15.562 19.033 ( -13.289 0.000 6.101) 14.622 20.632 ( 16.698 0.000 -14.560) 22.155 ======================= Grid point 164 (73/205) ======================= q-point: ( 0.22 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.277 ( 15.985 0.000 17.548) 23.737 2.362 ( 3.042 0.000 33.126) 33.265 3.585 ( 3.729 0.000 -7.152) 8.065 3.638 ( 22.311 0.000 -13.574) 26.116 4.090 ( -20.496 0.000 11.557) 23.530 4.589 ( -19.396 0.000 -8.874) 21.329 4.612 ( 26.552 0.000 5.856) 27.190 4.960 ( 3.310 0.000 27.349) 27.549 5.153 ( 15.376 0.000 7.939) 17.305 5.431 ( -4.528 0.000 -1.684) 4.831 5.877 ( -7.419 0.000 7.934) 10.863 6.031 ( 0.463 0.000 3.881) 3.909 6.206 ( -5.046 0.000 2.167) 5.492 6.792 ( 3.627 0.000 -12.123) 12.654 6.923 ( 2.518 0.000 10.929) 11.215 7.263 ( 9.623 0.000 -0.308) 9.628 7.439 ( -17.446 0.000 -7.648) 19.049 7.695 ( -0.638 0.000 -10.247) 10.267 8.360 ( -6.277 0.000 3.410) 7.143 9.062 ( 4.266 0.000 -4.114) 5.926 9.077 ( -11.432 0.000 4.329) 12.224 9.523 ( -15.572 0.000 15.161) 21.734 9.847 ( -2.892 0.000 -5.312) 6.048 9.923 ( 15.411 0.000 15.635) 21.953 10.063 ( 10.253 0.000 -4.432) 11.170 10.435 ( -5.435 0.000 -23.961) 24.569 10.637 ( 16.904 0.000 -11.008) 20.172 11.031 ( -13.469 0.000 1.889) 13.601 11.651 ( -7.278 0.000 -0.241) 7.282 11.847 ( 1.518 0.000 2.928) 3.299 11.980 ( 0.672 0.000 1.149) 1.332 11.986 ( -3.165 0.000 5.842) 6.644 12.435 ( -2.042 0.000 4.204) 4.674 12.448 ( 6.756 0.000 -7.103) 9.803 12.945 ( -5.731 0.000 -4.527) 7.303 13.030 ( 5.481 0.000 4.015) 6.794 13.309 ( -4.392 0.000 -4.156) 6.047 13.446 ( 0.006 0.000 -2.057) 2.057 14.694 ( -1.947 0.000 4.489) 4.894 15.304 ( -0.673 0.000 -3.374) 3.441 15.502 ( -1.183 0.000 -0.878) 1.473 15.704 ( 7.388 0.000 6.984) 10.167 16.133 ( -7.939 0.000 0.451) 7.952 16.654 ( -0.237 0.000 -3.807) 3.814 17.170 ( 9.845 0.000 15.028) 17.966 18.449 ( 12.202 0.000 -15.002) 19.338 18.756 ( -20.285 0.000 0.073) 20.285 20.607 ( -0.810 0.000 -13.567) 13.591 ======================= Grid point 165 (74/205) ======================= q-point: ( 0.33 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.638 ( -3.310 0.000 18.603) 18.895 2.736 ( 20.038 0.000 8.426) 21.737 3.430 ( -18.949 0.000 -0.438) 18.954 3.799 ( 2.043 0.000 -18.560) 18.672 3.885 ( -4.225 0.000 1.301) 4.421 4.186 ( -4.031 0.000 -8.658) 9.550 4.859 ( 9.875 0.000 -7.938) 12.670 5.280 ( -6.967 0.000 12.680) 14.468 5.392 ( 3.087 0.000 3.007) 4.309 5.475 ( 12.758 0.000 1.809) 12.885 5.911 ( -3.109 0.000 12.531) 12.911 5.926 ( -9.118 0.000 -1.398) 9.225 6.104 ( -8.542 0.000 -1.069) 8.609 6.716 ( 5.273 0.000 -19.316) 20.023 7.018 ( -0.820 0.000 5.452) 5.513 7.144 ( -7.469 0.000 1.963) 7.723 7.263 ( -2.147 0.000 -14.643) 14.800 7.834 ( 14.765 0.000 12.082) 19.079 8.199 ( -8.583 0.000 -6.235) 10.609 8.881 ( -14.334 0.000 6.782) 15.858 9.046 ( 1.318 0.000 -7.505) 7.620 9.494 ( -10.512 0.000 24.981) 27.103 9.719 ( -5.530 0.000 0.585) 5.561 9.930 ( -7.289 0.000 -24.976) 26.018 10.318 ( 19.896 0.000 -3.369) 20.179 10.556 ( 12.312 0.000 17.551) 21.439 10.802 ( 15.455 0.000 -13.328) 20.408 10.821 ( -7.504 0.000 3.961) 8.485 11.535 ( -6.513 0.000 3.797) 7.538 11.882 ( -6.198 0.000 1.095) 6.294 11.965 ( 1.146 0.000 0.994) 1.517 11.966 ( -2.041 0.000 -1.306) 2.423 12.429 ( -3.191 0.000 2.646) 4.145 12.521 ( 6.435 0.000 -0.579) 6.461 12.813 ( -2.985 0.000 -7.292) 7.880 13.145 ( 2.410 0.000 4.781) 5.354 13.279 ( 2.006 0.000 4.362) 4.801 13.455 ( 1.229 0.000 1.552) 1.980 14.718 ( -0.955 0.000 5.050) 5.139 15.239 ( -2.332 0.000 -2.579) 3.477 15.527 ( 3.903 0.000 0.567) 3.944 15.848 ( 3.092 0.000 3.914) 4.988 16.052 ( -4.689 0.000 5.438) 7.181 16.634 ( 0.677 0.000 0.032) 0.678 17.473 ( 6.971 0.000 7.480) 10.225 18.353 ( -19.211 0.000 -2.987) 19.441 18.468 ( 10.586 0.000 -21.929) 24.351 20.383 ( -7.080 0.000 -14.951) 16.543 ======================= Grid point 166 (75/205) ======================= q-point: (-0.56 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.554 ( -14.880 0.000 -6.169) 16.108 3.078 ( -20.820 0.000 16.471) 26.547 3.132 ( 6.479 0.000 -1.301) 6.608 3.341 ( -11.752 0.000 -10.468) 15.738 3.887 ( 3.982 0.000 -7.329) 8.341 4.293 ( 19.351 0.000 -17.959) 26.400 4.847 ( -6.333 0.000 -15.192) 16.459 5.127 ( -15.603 0.000 17.138) 23.177 5.466 ( -10.319 0.000 -10.424) 14.668 5.491 ( 4.548 0.000 -0.441) 4.569 5.720 ( -19.084 0.000 -5.690) 19.915 5.849 ( -4.043 0.000 -1.838) 4.441 5.940 ( -4.447 0.000 8.103) 9.243 6.572 ( 5.327 0.000 -26.981) 27.501 7.074 ( -2.884 0.000 4.000) 4.931 7.089 ( 2.359 0.000 -14.515) 14.705 7.305 ( 16.769 0.000 14.803) 22.369 7.993 ( -4.535 0.000 -8.381) 9.529 8.235 ( 10.554 0.000 12.668) 16.488 8.741 ( -10.844 0.000 11.485) 15.796 8.989 ( 2.980 0.000 -8.974) 9.456 9.498 ( -10.920 0.000 -15.463) 18.930 9.602 ( -7.161 0.000 24.973) 25.979 9.716 ( -1.675 0.000 2.628) 3.116 10.547 ( -9.160 0.000 0.407) 9.169 10.658 ( 19.706 0.000 -2.411) 19.853 10.940 ( 14.266 0.000 -11.935) 18.600 11.099 ( 12.246 0.000 9.926) 15.763 11.511 ( -3.752 0.000 10.499) 11.150 11.677 ( -7.411 0.000 -5.663) 9.327 11.895 ( -3.232 0.000 -2.116) 3.863 12.065 ( 2.822 0.000 6.320) 6.921 12.368 ( -4.933 0.000 0.481) 4.956 12.644 ( 3.236 0.000 1.329) 3.498 12.706 ( 1.479 0.000 -3.996) 4.261 13.218 ( -0.241 0.000 5.487) 5.492 13.448 ( 7.111 0.000 9.825) 12.128 13.510 ( 1.538 0.000 3.896) 4.189 14.758 ( -0.910 0.000 6.093) 6.161 15.186 ( -0.771 0.000 -1.737) 1.901 15.643 ( 6.126 0.000 3.339) 6.977 15.904 ( -1.300 0.000 3.116) 3.376 16.069 ( -1.095 0.000 8.762) 8.831 16.682 ( 2.698 0.000 2.970) 4.012 17.372 ( -16.293 0.000 -10.408) 19.333 18.216 ( 3.796 0.000 5.289) 6.511 18.378 ( 7.850 0.000 -29.213) 30.249 20.062 ( -9.295 0.000 -18.972) 21.127 ======================= Grid point 167 (76/205) ======================= q-point: (-0.44 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.107 ( -23.493 0.000 -2.954) 23.678 2.569 ( -33.288 0.000 -9.282) 34.558 3.050 ( -2.569 0.000 14.815) 15.036 3.675 ( 27.575 0.000 -2.447) 27.683 3.761 ( -12.589 0.000 -13.654) 18.573 4.364 ( -20.228 0.000 -14.649) 24.975 4.384 ( 11.523 0.000 -20.675) 23.670 4.842 ( -26.454 0.000 0.898) 26.469 5.076 ( -20.882 0.000 -7.370) 22.144 5.562 ( 0.899 0.000 7.246) 7.302 5.584 ( 6.310 0.000 2.476) 6.778 5.616 ( -12.254 0.000 -3.445) 12.729 6.058 ( 1.721 0.000 3.403) 3.813 6.472 ( 15.583 0.000 -21.432) 26.498 7.025 ( -2.966 0.000 -2.032) 3.595 7.069 ( 7.713 0.000 -9.362) 12.130 7.808 ( 18.292 0.000 15.074) 23.703 7.888 ( 0.618 0.000 -4.969) 5.007 8.337 ( -4.585 0.000 -2.927) 5.439 8.722 ( -6.010 0.000 14.590) 15.780 8.919 ( -2.445 0.000 -16.747) 16.924 9.328 ( 4.490 0.000 4.722) 6.516 9.704 ( -6.014 0.000 17.165) 18.188 9.740 ( -2.791 0.000 6.722) 7.278 10.395 ( -3.058 0.000 -6.375) 7.070 10.938 ( 13.820 0.000 -4.652) 14.582 11.078 ( 11.986 0.000 -7.296) 14.032 11.206 ( 1.772 0.000 -7.911) 8.107 11.622 ( 1.755 0.000 12.935) 13.054 11.635 ( 1.224 0.000 2.995) 3.236 11.842 ( -2.170 0.000 5.238) 5.669 12.143 ( 0.240 0.000 3.803) 3.811 12.278 ( -4.554 0.000 -0.195) 4.558 12.715 ( 6.477 0.000 4.805) 8.064 12.787 ( 4.029 0.000 1.603) 4.336 13.236 ( -3.651 0.000 4.871) 6.088 13.589 ( 1.731 0.000 6.001) 6.246 13.689 ( 7.066 0.000 10.581) 12.723 14.807 ( -1.586 0.000 7.819) 7.979 15.185 ( 1.551 0.000 0.381) 1.597 15.785 ( 4.125 0.000 4.979) 6.466 15.816 ( -11.925 0.000 -0.714) 11.946 16.211 ( 5.763 0.000 11.676) 13.021 16.771 ( 2.467 0.000 1.968) 3.155 16.935 ( -13.578 0.000 -9.762) 16.723 18.140 ( 2.958 0.000 -38.326) 38.440 18.419 ( 9.679 0.000 5.651) 11.208 19.661 ( -10.875 0.000 -24.252) 26.578 ======================= Grid point 168 (77/205) ======================= q-point: (-0.33 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.734 ( -22.126 0.000 9.305) 24.003 1.898 ( -33.118 0.000 -1.948) 33.175 3.013 ( -47.710 0.000 -8.591) 48.477 3.238 ( 8.253 0.000 10.348) 13.236 4.110 ( 1.555 0.000 -9.077) 9.209 4.135 ( 20.798 0.000 -1.389) 20.844 4.311 ( 2.776 0.000 -17.592) 17.809 4.431 ( -18.221 0.000 1.315) 18.268 4.621 ( -16.637 0.000 -5.087) 17.397 5.383 ( -10.709 0.000 -1.548) 10.821 5.684 ( 1.888 0.000 10.442) 10.612 5.761 ( 7.455 0.000 4.755) 8.842 6.055 ( 1.998 0.000 -4.828) 5.225 6.716 ( 23.644 0.000 -7.053) 24.674 6.937 ( -0.993 0.000 -8.306) 8.365 7.125 ( 4.535 0.000 -3.997) 6.046 7.903 ( 3.103 0.000 1.556) 3.471 8.117 ( -9.718 0.000 -10.422) 14.250 8.222 ( 9.961 0.000 14.462) 17.561 8.651 ( -5.271 0.000 -15.492) 16.364 8.828 ( 2.816 0.000 13.192) 13.489 9.548 ( 2.367 0.000 8.616) 8.935 9.699 ( -7.040 0.000 3.352) 7.797 9.710 ( 0.472 0.000 -0.837) 0.961 10.398 ( 13.720 0.000 -9.490) 16.682 11.017 ( -0.042 0.000 -4.716) 4.716 11.168 ( 2.846 0.000 -5.800) 6.461 11.230 ( 11.118 0.000 -6.986) 13.131 11.631 ( -1.643 0.000 -3.127) 3.533 11.727 ( 3.263 0.000 1.980) 3.817 12.032 ( 5.800 0.000 17.114) 18.070 12.210 ( 2.262 0.000 6.173) 6.575 12.243 ( 0.059 0.000 6.814) 6.814 12.835 ( 4.440 0.000 -3.933) 5.932 12.955 ( 6.361 0.000 11.777) 13.385 13.206 ( -3.408 0.000 4.130) 5.354 13.692 ( 0.887 0.000 9.397) 9.439 13.896 ( 5.324 0.000 7.590) 9.271 14.851 ( -3.161 0.000 8.740) 9.294 15.251 ( 3.105 0.000 3.709) 4.837 15.426 ( -25.676 0.000 -5.809) 26.325 15.916 ( 3.924 0.000 11.107) 11.779 16.498 ( 11.439 0.000 11.925) 16.525 16.661 ( -4.406 0.000 -3.435) 5.587 16.903 ( 3.848 0.000 1.639) 4.183 17.665 ( -6.786 0.000 -51.187) 51.635 18.648 ( 8.720 0.000 6.397) 10.815 19.174 ( -14.019 0.000 -26.475) 29.957 ======================= Grid point 169 (78/205) ======================= q-point: (-0.22 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.376 ( -29.421 0.000 9.061) 30.784 1.389 ( -27.682 0.000 13.271) 30.699 2.240 ( -40.605 0.000 27.834) 49.229 3.515 ( 10.453 0.000 7.721) 12.996 3.957 ( -23.161 0.000 -3.652) 23.447 4.119 ( 3.348 0.000 0.049) 3.348 4.234 ( 0.209 0.000 -2.280) 2.290 4.245 ( -3.937 0.000 3.572) 5.316 4.769 ( 26.087 0.000 -7.563) 27.161 5.205 ( -7.241 0.000 0.263) 7.246 5.788 ( -3.655 0.000 11.884) 12.433 5.969 ( 10.686 0.000 3.695) 11.307 6.094 ( 5.749 0.000 -0.190) 5.752 6.808 ( -1.361 0.000 -13.324) 13.393 7.077 ( 17.677 0.000 -1.604) 17.750 7.109 ( -2.677 0.000 -2.234) 3.486 7.847 ( -6.464 0.000 -9.857) 11.788 8.024 ( 4.003 0.000 8.846) 9.709 8.458 ( -1.104 0.000 -10.814) 10.871 8.460 ( 0.826 0.000 13.503) 13.528 9.104 ( 14.153 0.000 9.726) 17.173 9.455 ( -6.825 0.000 -2.046) 7.125 9.493 ( -11.024 0.000 -11.670) 16.053 9.887 ( 14.080 0.000 -3.422) 14.490 10.635 ( 20.701 0.000 -10.860) 23.377 10.848 ( -12.980 0.000 -4.332) 13.684 11.184 ( 3.333 0.000 -3.131) 4.573 11.288 ( 5.695 0.000 -10.740) 12.157 11.572 ( -0.419 0.000 -1.813) 1.861 11.855 ( 4.097 0.000 8.072) 9.052 12.152 ( 3.538 0.000 -3.128) 4.722 12.325 ( 2.987 0.000 4.974) 5.802 12.429 ( 2.606 0.000 3.465) 4.336 12.858 ( 4.334 0.000 -6.579) 7.878 13.141 ( 2.157 0.000 8.119) 8.401 13.249 ( 4.022 0.000 0.674) 4.078 13.791 ( -1.802 0.000 5.759) 6.034 14.013 ( 1.634 0.000 -0.262) 1.655 14.844 ( -7.475 0.000 0.007) 7.475 14.912 ( -24.391 0.000 10.892) 26.713 15.310 ( -0.420 0.000 -1.609) 1.663 16.383 ( 26.762 0.000 42.022) 49.820 16.598 ( -1.447 0.000 -0.630) 1.578 16.790 ( -3.316 0.000 -16.923) 17.245 16.841 ( -10.851 0.000 -27.606) 29.662 16.971 ( 2.597 0.000 -0.515) 2.648 18.687 ( -12.009 0.000 -15.454) 19.572 18.861 ( 5.999 0.000 8.975) 10.796 ======================= Grid point 170 (79/205) ======================= q-point: (-0.11 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.141 ( -10.342 0.000 30.112) 31.839 1.220 ( -14.903 0.000 29.966) 33.468 2.145 ( -17.294 0.000 53.710) 56.426 3.552 ( -17.118 0.000 -1.104) 17.153 3.716 ( 1.782 0.000 9.088) 9.261 4.222 ( 4.109 0.000 8.686) 9.609 4.280 ( 3.228 0.000 5.909) 6.733 4.322 ( 5.807 0.000 0.220) 5.811 5.064 ( 13.729 0.000 -9.046) 16.441 5.187 ( 5.571 0.000 1.290) 5.719 5.804 ( -5.785 0.000 8.432) 10.226 6.162 ( 3.650 0.000 4.792) 6.024 6.265 ( 8.849 0.000 6.479) 10.968 6.632 ( -1.910 0.000 -13.043) 13.182 6.948 ( -14.263 0.000 4.302) 14.898 7.258 ( 8.220 0.000 -12.666) 15.100 7.775 ( 5.052 0.000 -1.064) 5.162 8.201 ( 1.968 0.000 13.183) 13.329 8.402 ( 5.498 0.000 -6.644) 8.624 8.509 ( -8.177 0.000 5.700) 9.967 9.061 ( -15.546 0.000 -11.946) 19.606 9.363 ( -1.795 0.000 -0.640) 1.905 9.546 ( 23.629 0.000 2.324) 23.743 10.077 ( 14.848 0.000 -11.767) 18.945 10.501 ( -20.266 0.000 -2.177) 20.382 10.837 ( 13.264 0.000 -11.279) 17.412 11.205 ( 2.086 0.000 -3.342) 3.940 11.214 ( -5.245 0.000 -11.463) 12.606 11.605 ( 3.308 0.000 2.583) 4.197 11.927 ( -15.264 0.000 1.960) 15.389 12.060 ( -7.267 0.000 -3.580) 8.101 12.352 ( 0.580 0.000 -2.550) 2.615 12.366 ( -0.674 0.000 -3.341) 3.408 12.843 ( 1.590 0.000 -10.557) 10.676 13.112 ( -12.688 0.000 -15.688) 20.177 13.203 ( -1.193 0.000 3.732) 3.918 13.633 ( -6.697 0.000 -5.066) 8.397 13.866 ( -10.082 0.000 -9.229) 13.669 14.709 ( -3.204 0.000 15.254) 15.587 14.829 ( -9.584 0.000 12.599) 15.830 15.248 ( 0.754 0.000 -3.547) 3.627 16.013 ( -19.936 0.000 -11.546) 23.039 16.581 ( -0.159 0.000 0.232) 0.281 16.882 ( -1.964 0.000 -4.947) 5.323 16.980 ( -0.148 0.000 -1.971) 1.976 17.714 ( 41.932 0.000 20.995) 46.894 18.815 ( 45.425 0.000 21.463) 50.240 19.035 ( 1.478 0.000 10.949) 11.048 ======================= Grid point 171 (80/205) ======================= q-point: ( 0.00 0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.535 ( 3.483 13.157 26.369) 29.674 1.680 ( 8.093 15.070 30.793) 35.225 2.899 ( 4.306 20.287 39.092) 44.253 3.367 ( -2.478 1.851 4.682) 5.611 3.732 ( -0.130 -4.454 7.545) 8.763 4.379 ( -0.618 1.869 7.464) 7.719 4.530 ( 4.006 8.038 11.785) 14.817 4.591 ( 7.066 10.970 9.919) 16.391 5.167 ( 5.700 4.232 -9.711) 12.030 5.417 ( 8.753 1.679 7.814) 11.854 5.737 ( -3.580 -0.315 7.483) 8.301 5.961 ( -11.051 -12.131 0.801) 16.430 6.412 ( 7.667 -3.004 2.247) 8.536 6.662 ( 1.544 3.439 -3.685) 5.272 6.840 ( -9.424 7.395 6.250) 13.512 7.253 ( 3.204 4.719 -6.436) 8.600 7.834 ( 3.263 -2.611 -0.092) 4.179 8.346 ( -2.542 2.678 6.935) 7.857 8.360 ( -13.118 10.666 -7.795) 18.617 8.583 ( 5.453 3.412 5.739) 8.620 8.996 ( 8.930 5.030 2.482) 10.545 9.417 ( -0.343 3.649 4.023) 5.443 9.687 ( 13.325 -17.723 -10.342) 24.467 10.100 ( -18.481 -2.679 3.695) 19.036 10.292 ( 8.750 -0.657 -7.026) 11.241 10.483 ( -16.698 -5.533 -4.382) 18.128 10.843 ( 8.565 -4.794 -10.154) 14.123 11.296 ( -2.815 5.824 -2.017) 6.775 11.570 ( 0.715 -7.751 1.687) 7.964 11.753 ( -1.935 -1.648 3.429) 4.268 12.080 ( -2.931 4.760 -0.110) 5.591 12.155 ( -5.685 -1.278 -7.186) 9.252 12.379 ( -6.079 -14.926 -8.345) 18.149 12.599 ( 5.200 9.711 5.599) 12.357 12.898 ( -7.738 -3.547 -10.903) 13.832 13.187 ( 1.360 2.985 3.430) 4.746 13.466 ( 0.201 -6.155 -5.748) 8.424 13.632 ( -6.454 -0.709 -5.843) 8.735 14.432 ( -4.768 -21.246 9.269) 23.665 14.707 ( 5.641 -17.304 12.827) 22.266 15.627 ( 2.227 20.412 3.823) 20.886 15.939 ( -9.499 12.828 -7.929) 17.823 16.560 ( -4.823 -2.866 -2.945) 6.336 16.676 ( -4.694 0.439 -6.819) 8.290 16.910 ( -0.917 -1.133 3.848) 4.115 18.201 ( 9.725 3.231 -3.870) 10.954 19.143 ( -4.355 3.472 7.101) 9.024 20.139 ( 45.865 0.497 -6.867) 46.379 ======================= Grid point 172 (81/205) ======================= q-point: ( 0.11 0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.927 ( 10.911 11.407 24.136) 28.840 2.133 ( 6.048 16.927 30.388) 35.306 3.306 ( 16.238 -2.899 -1.612) 16.573 3.582 ( 11.247 8.694 6.394) 15.587 3.895 ( 9.311 -2.915 22.461) 24.489 4.359 ( -11.452 4.256 9.694) 15.596 4.763 ( 2.244 6.420 16.348) 17.706 4.870 ( 13.327 6.337 10.669) 18.210 5.067 ( -5.071 10.931 -9.255) 15.194 5.532 ( -1.752 -3.421 -3.155) 4.973 5.779 ( -8.620 -13.921 6.688) 17.687 5.882 ( 6.859 8.281 13.239) 17.056 6.476 ( -6.387 8.297 1.632) 10.597 6.659 ( 6.488 -4.797 -1.974) 8.307 6.869 ( 3.299 5.813 5.006) 8.351 7.254 ( 2.403 7.636 -2.538) 8.398 7.803 ( -4.049 0.147 -5.704) 6.996 7.982 ( -12.758 10.928 -11.926) 20.601 8.424 ( -2.758 4.536 9.837) 11.178 8.825 ( 11.616 -4.850 6.775) 14.295 9.142 ( 2.032 0.810 -0.154) 2.193 9.539 ( 5.119 3.745 11.346) 12.999 9.667 ( -9.277 -5.861 1.396) 11.062 9.859 ( 0.821 -8.422 -9.842) 12.980 10.112 ( -13.160 -7.798 1.237) 15.347 10.534 ( 16.960 10.232 -11.817) 23.065 10.776 ( -2.027 0.707 -17.203) 17.336 11.212 ( -6.457 3.115 1.463) 7.317 11.625 ( 1.066 -9.582 3.302) 10.191 11.812 ( 1.145 -3.049 4.110) 5.243 11.946 ( -5.395 -6.207 -5.371) 9.822 12.025 ( -2.336 4.530 -0.654) 5.139 12.210 ( -3.538 -7.006 -3.721) 8.686 12.640 ( -2.799 0.929 -7.238) 7.816 12.772 ( -0.218 -0.638 4.388) 4.439 13.228 ( 1.260 6.889 -0.498) 7.021 13.397 ( -2.389 -5.353 -6.327) 8.626 13.497 ( -2.350 1.105 -3.558) 4.405 14.421 ( -4.626 -21.524 7.308) 23.197 14.932 ( 7.856 -20.979 4.905) 22.932 15.711 ( -1.819 13.116 1.703) 13.351 15.766 ( 0.199 12.474 -2.077) 12.648 16.306 ( -11.219 -2.860 -5.867) 12.979 16.649 ( 1.788 -2.984 -4.556) 5.732 16.991 ( 2.683 6.419 12.459) 14.270 18.342 ( 10.861 -0.284 -7.032) 12.942 19.057 ( -11.571 2.971 4.018) 12.604 20.550 ( 14.341 -7.712 -13.013) 20.844 ======================= Grid point 173 (82/205) ======================= q-point: ( 0.22 0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.384 ( 15.157 9.467 17.121) 24.749 2.508 ( 2.187 13.668 28.199) 31.413 3.545 ( 12.583 -1.905 -8.997) 15.585 3.698 ( 11.436 3.133 -9.576) 15.242 4.130 ( -20.307 4.001 7.716) 22.089 4.431 ( 15.585 -8.206 4.145) 18.094 4.777 ( -7.394 6.937 0.048) 10.139 4.979 ( 0.536 3.865 15.210) 15.702 5.260 ( 9.964 7.609 9.202) 15.551 5.461 ( 3.127 2.818 0.115) 4.211 5.786 ( -1.119 -4.386 8.620) 9.736 6.051 ( -1.921 1.980 5.079) 5.780 6.344 ( -7.919 10.171 1.396) 12.965 6.740 ( 7.098 -2.631 -10.285) 12.770 6.997 ( 0.584 5.688 10.026) 11.541 7.316 ( 5.300 3.980 -0.524) 6.649 7.524 ( -15.561 8.249 -7.093) 18.987 7.764 ( 1.256 7.546 -9.347) 12.079 8.417 ( -5.937 5.030 2.107) 8.062 9.008 ( 3.216 -3.890 0.870) 5.122 9.057 ( -11.327 -2.770 2.044) 11.839 9.477 ( -11.152 -4.555 11.897) 16.931 9.795 ( 4.156 -3.340 0.824) 5.395 9.884 ( 0.954 -3.564 2.257) 4.325 10.079 ( 16.107 -0.720 3.332) 16.463 10.455 ( -8.208 2.150 -20.899) 22.556 10.707 ( 14.352 5.100 -11.665) 19.185 11.059 ( -10.991 3.446 0.779) 11.545 11.639 ( -3.209 -5.176 1.656) 6.311 11.776 ( -2.092 -2.316 -0.978) 3.271 11.913 ( -1.352 -4.591 6.487) 8.062 12.087 ( 3.736 2.751 2.190) 5.130 12.183 ( 3.397 -8.587 -0.431) 9.245 12.494 ( -3.824 -9.939 -7.943) 13.285 12.796 ( -1.772 2.126 1.924) 3.371 13.217 ( -2.301 -0.826 -2.002) 3.160 13.307 ( 1.015 3.198 -1.916) 3.864 13.451 ( -0.972 3.553 -1.629) 4.028 14.428 ( -2.896 -19.957 7.288) 21.443 15.075 ( 5.776 -19.764 -0.691) 20.602 15.617 ( -4.127 10.585 -0.498) 11.372 15.846 ( 3.634 7.719 1.474) 8.658 16.112 ( -6.829 -1.970 0.412) 7.119 16.615 ( 0.046 -3.718 -3.615) 5.186 17.256 ( 9.524 7.863 14.948) 19.391 18.419 ( 6.973 -3.135 -11.794) 14.055 18.816 ( -14.735 5.919 -2.299) 16.044 20.517 ( -1.040 -8.504 -12.895) 15.482 ======================= Grid point 174 (83/205) ======================= q-point: ( 0.33 0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.705 ( -2.799 6.327 15.479) 16.955 2.835 ( 16.752 8.999 7.932) 20.604 3.430 ( -19.616 0.192 0.549) 19.624 3.735 ( -8.047 -2.511 -9.080) 12.390 3.979 ( 14.824 5.589 -13.867) 21.054 4.329 ( -8.846 11.864 -1.154) 14.844 4.874 ( 11.809 0.605 -8.983) 14.850 5.187 ( -2.837 -5.970 15.752) 17.083 5.359 ( 2.842 -2.669 1.648) 4.233 5.610 ( 6.218 9.844 -0.306) 11.647 5.854 ( -7.117 -4.462 -0.037) 8.400 5.980 ( -1.641 6.475 3.742) 7.657 6.219 ( -11.032 9.038 4.538) 14.966 6.696 ( 4.140 -0.185 -17.432) 17.918 7.025 ( -6.523 -1.040 6.119) 9.004 7.235 ( -3.924 7.411 -2.160) 8.660 7.317 ( 0.057 7.209 -13.191) 15.032 7.932 ( 13.850 9.284 11.887) 20.477 8.245 ( -8.265 4.097 -7.452) 11.859 8.861 ( -12.721 -2.051 5.572) 14.038 9.012 ( -0.305 -2.659 -3.148) 4.132 9.467 ( -8.552 -2.974 20.474) 22.387 9.755 ( -4.803 2.886 2.754) 6.243 9.851 ( -5.533 -7.359 -18.908) 21.030 10.248 ( 9.861 -4.312 -3.586) 11.344 10.577 ( 18.874 -1.050 15.365) 24.361 10.773 ( -1.256 -0.448 -2.460) 2.798 10.936 ( 6.129 9.401 -9.262) 14.550 11.575 ( -4.796 1.112 3.374) 5.968 11.771 ( -1.185 -7.750 1.925) 8.073 11.899 ( -3.869 -1.124 -3.149) 5.113 12.127 ( 0.827 8.109 0.376) 8.160 12.276 ( 2.231 -9.284 2.550) 9.883 12.401 ( -0.029 -15.901 0.354) 15.905 12.747 ( -2.110 0.256 -4.025) 4.552 13.201 ( 1.799 -2.344 3.955) 4.937 13.351 ( 1.551 6.933 1.869) 7.346 13.433 ( 0.642 0.037 0.263) 0.694 14.446 ( -3.326 -19.148 6.326) 20.438 15.142 ( 3.679 -16.967 -2.364) 17.521 15.586 ( -0.110 10.649 2.851) 11.025 15.910 ( 1.445 3.229 2.884) 4.564 16.061 ( -2.255 0.614 4.801) 5.339 16.604 ( 1.000 -2.925 0.297) 3.106 17.553 ( 6.776 7.115 7.640) 12.446 18.278 ( -10.205 -4.263 -7.565) 13.399 18.596 ( 2.073 9.379 -15.213) 17.991 20.301 ( -6.748 -7.870 -14.440) 17.776 ======================= Grid point 175 (84/205) ======================= q-point: (-0.56 0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.602 ( -16.095 4.435 -5.819) 17.680 3.034 ( -23.389 -1.846 13.972) 27.307 3.157 ( 4.552 2.308 -3.621) 6.257 3.429 ( -2.561 6.878 -8.907) 11.541 4.051 ( 5.732 13.020 -8.066) 16.354 4.361 ( 14.967 6.688 -13.482) 21.225 4.907 ( -3.396 4.865 -13.923) 15.135 5.104 ( -14.166 -1.960 15.541) 21.120 5.400 ( -4.206 -2.812 -5.019) 7.126 5.501 ( -7.160 -1.316 -6.294) 9.624 5.806 ( -11.005 6.739 -3.120) 13.276 5.910 ( -5.261 6.676 -4.087) 9.431 5.965 ( -5.496 1.723 5.867) 8.222 6.571 ( 4.757 1.429 -23.565) 24.083 6.933 ( -4.132 -8.036 -2.608) 9.405 7.202 ( 0.720 5.765 -9.817) 11.408 7.411 ( 15.538 9.271 11.939) 21.677 8.048 ( -3.229 5.068 -8.196) 10.162 8.292 ( 8.493 5.183 9.974) 14.088 8.738 ( -10.084 -0.202 10.766) 14.753 8.983 ( 3.484 -0.280 -4.354) 5.583 9.471 ( -10.141 -3.702 -12.410) 16.449 9.568 ( -6.430 -2.469 18.610) 19.844 9.739 ( -3.141 2.349 6.198) 7.335 10.397 ( 0.905 -9.298 1.314) 9.434 10.767 ( 9.029 4.536 -2.226) 10.347 11.000 ( 9.465 -5.228 9.468) 14.372 11.020 ( 12.109 5.874 -10.761) 17.232 11.554 ( -2.142 -1.680 4.413) 5.185 11.704 ( -4.093 5.289 -1.062) 6.772 11.827 ( 0.048 -5.146 0.361) 5.159 12.153 ( 0.783 6.919 2.251) 7.318 12.275 ( -3.214 -6.479 0.087) 7.233 12.474 ( 3.365 -17.049 3.512) 17.730 12.683 ( -0.188 0.916 -1.215) 1.533 13.342 ( 4.005 2.195 5.191) 6.914 13.372 ( 0.601 0.849 3.298) 3.458 13.504 ( 4.001 -1.765 5.248) 6.831 14.428 ( -4.713 -21.874 4.720) 22.868 15.160 ( 0.986 -15.785 -2.798) 16.061 15.677 ( 4.264 11.620 7.249) 14.344 15.979 ( 1.803 2.980 5.723) 6.700 16.102 ( -0.513 2.928 7.065) 7.664 16.658 ( 2.740 -2.351 3.252) 4.859 17.443 ( -16.716 6.550 -10.591) 20.845 18.205 ( 6.559 0.305 3.060) 7.244 18.491 ( 6.121 9.258 -23.020) 25.556 19.996 ( -8.465 -6.267 -18.167) 20.999 ======================= Grid point 176 (85/205) ======================= q-point: (-0.44 0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.126 ( -27.154 1.968 -0.193) 27.226 2.633 ( -25.557 7.764 -9.458) 28.335 3.064 ( -2.622 -0.241 10.371) 10.700 3.693 ( 24.193 2.807 -4.487) 24.765 4.003 ( -7.385 19.804 -9.353) 23.114 4.372 ( -2.863 4.017 -19.023) 19.652 4.563 ( -4.501 12.960 -12.308) 18.431 4.781 ( -26.609 -3.893 -2.862) 27.044 5.109 ( -20.248 2.255 -4.724) 20.914 5.491 ( -1.482 -4.480 1.185) 4.865 5.551 ( -2.536 -0.882 5.884) 6.468 5.723 ( -5.130 6.609 -3.816) 9.196 6.157 ( 5.124 8.331 4.136) 10.620 6.460 ( 13.613 -0.564 -21.073) 25.094 6.870 ( 0.636 -10.307 -4.228) 11.159 7.139 ( 3.625 2.718 -9.252) 10.302 7.864 ( 16.687 5.013 13.714) 22.173 7.976 ( 2.121 7.995 -4.448) 9.392 8.340 ( -5.004 0.257 -4.477) 6.719 8.701 ( -6.439 -1.507 12.128) 13.814 8.964 ( -1.594 3.846 -14.850) 15.423 9.339 ( 4.036 0.678 7.912) 8.908 9.659 ( -5.345 -4.109 16.740) 18.047 9.752 ( -4.250 1.178 7.917) 9.062 10.328 ( -2.633 -6.060 -4.981) 8.274 10.964 ( 10.414 0.393 -4.180) 11.229 11.108 ( 7.158 1.781 -7.221) 10.322 11.119 ( 4.832 -4.471 -1.572) 6.768 11.601 ( 2.624 -0.898 3.056) 4.127 11.687 ( 0.154 4.114 3.794) 5.598 11.905 ( 1.426 3.284 9.782) 10.416 12.169 ( -1.343 2.277 0.328) 2.664 12.213 ( -1.883 -4.410 0.204) 4.799 12.571 ( 5.140 -13.926 2.085) 14.990 12.748 ( 3.534 -0.917 6.705) 7.635 13.321 ( -4.062 5.388 0.595) 6.774 13.507 ( 3.990 -6.064 5.766) 9.270 13.685 ( 6.493 -1.038 9.388) 11.462 14.381 ( -5.264 -26.420 4.224) 27.269 15.102 ( -3.773 -19.397 -5.001) 20.384 15.867 ( 5.090 17.791 11.661) 21.872 16.066 ( -1.058 10.333 5.010) 11.532 16.197 ( 3.462 -0.629 10.195) 10.785 16.754 ( 3.455 -2.114 3.396) 5.285 16.985 ( -16.082 5.703 -11.667) 20.671 18.286 ( 7.408 13.165 -32.026) 35.410 18.443 ( 7.128 1.794 4.684) 8.716 19.628 ( -8.998 -3.035 -22.961) 24.847 ======================= Grid point 177 (86/205) ======================= q-point: (-0.33 0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.708 ( -25.426 0.552 11.868) 28.065 2.081 ( -26.762 15.752 -2.966) 31.195 3.222 ( 8.177 -2.447 7.525) 11.379 3.355 ( -42.138 28.707 -8.785) 51.739 4.046 ( 15.039 -1.259 -4.556) 15.764 4.238 ( -1.718 4.885 -3.579) 6.295 4.373 ( -9.371 -1.761 -2.850) 9.952 4.471 ( 0.427 12.422 -13.776) 18.554 4.685 ( -12.706 5.919 -4.340) 14.673 5.384 ( -9.074 0.007 -0.766) 9.107 5.630 ( 1.430 -3.411 9.295) 10.004 5.742 ( 3.214 -1.690 4.252) 5.591 6.151 ( 1.564 7.702 -8.162) 11.331 6.706 ( 23.107 -0.932 -5.863) 23.858 6.846 ( 1.295 -6.754 -4.344) 8.134 7.146 ( 4.466 0.579 -5.794) 7.339 7.991 ( 0.091 4.243 -3.281) 5.365 8.101 ( -4.709 2.317 -2.932) 6.012 8.285 ( 8.644 5.374 11.134) 15.085 8.668 ( -3.868 1.508 -9.580) 10.441 8.843 ( 2.817 1.580 4.221) 5.315 9.519 ( -2.053 -2.562 8.260) 8.889 9.658 ( -5.461 -2.000 6.070) 8.407 9.759 ( -0.347 1.858 3.469) 3.951 10.315 ( 11.061 -7.786 -9.585) 16.578 11.012 ( -0.558 -2.708 -0.362) 2.788 11.133 ( 4.193 -2.382 -6.859) 8.385 11.194 ( 4.031 -0.270 -6.080) 7.300 11.691 ( 5.535 4.524 3.036) 7.766 11.762 ( 2.283 2.739 -0.763) 3.646 12.037 ( 1.492 -0.232 15.670) 15.743 12.153 ( -1.835 -3.516 1.679) 4.307 12.249 ( 4.251 -0.192 4.583) 6.254 12.674 ( 4.713 -12.498 -1.965) 13.501 12.880 ( -0.996 -6.271 8.100) 10.292 13.265 ( -0.992 3.695 2.241) 4.434 13.641 ( 2.929 -4.411 8.587) 10.088 13.880 ( 5.140 -1.752 7.304) 9.101 14.318 ( -7.219 -30.276 4.341) 31.426 14.896 ( -11.592 -23.386 -8.347) 27.403 15.914 ( -12.025 29.460 3.763) 32.041 16.174 ( 7.898 12.335 14.615) 20.692 16.430 ( 8.856 -4.876 9.303) 13.739 16.714 ( -3.539 3.976 -2.643) 5.943 16.854 ( 2.219 -4.040 1.499) 4.847 18.020 ( 6.622 29.618 -39.957) 50.176 18.614 ( 4.077 -3.515 3.893) 6.643 19.220 ( -8.374 4.231 -23.227) 25.050 ======================= Grid point 178 (87/205) ======================= q-point: (-0.22 0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.437 ( -21.357 6.856 18.636) 29.162 1.592 ( -29.022 18.416 5.991) 34.890 2.669 ( -33.172 35.396 19.081) 52.128 3.463 ( 9.168 -4.574 5.838) 11.792 3.893 ( -21.152 -6.592 -0.742) 22.168 4.223 ( 3.231 9.470 2.269) 10.260 4.268 ( -5.671 4.017 2.360) 7.339 4.374 ( 2.722 11.358 -3.438) 12.175 4.807 ( 22.664 4.227 -8.301) 24.504 5.229 ( -6.350 2.195 0.490) 6.737 5.734 ( -3.325 -4.128 11.520) 12.681 5.876 ( 6.588 -7.107 5.359) 11.075 6.138 ( 5.789 2.738 -5.984) 8.765 6.796 ( 0.965 -1.210 -8.777) 8.912 7.070 ( 18.949 -0.657 -3.417) 19.266 7.132 ( -4.247 1.733 1.039) 4.703 7.796 ( -6.764 -3.871 -7.388) 10.739 8.172 ( 4.674 12.466 7.171) 15.122 8.465 ( -1.060 1.907 -4.265) 4.791 8.548 ( 2.409 6.620 4.942) 8.605 9.059 ( 13.226 -4.118 5.056) 14.746 9.364 ( -11.450 -2.608 -4.390) 12.537 9.606 ( -6.674 3.280 -0.746) 7.474 9.854 ( 9.757 -2.584 -1.862) 10.263 10.500 ( 18.139 -11.849 -10.142) 23.923 10.870 ( -12.262 1.428 -4.494) 13.137 11.128 ( -1.572 -8.082 -9.123) 12.289 11.201 ( 6.261 -2.461 0.079) 6.728 11.703 ( -0.714 9.185 -7.125) 11.646 11.883 ( 6.611 3.482 6.998) 10.237 12.125 ( -1.278 -3.660 -2.493) 4.609 12.262 ( 3.393 -9.625 11.955) 15.718 12.403 ( 5.146 -2.202 3.418) 6.558 12.620 ( -6.794 -15.703 -8.562) 19.132 12.888 ( -3.197 -15.159 11.897) 19.533 13.339 ( 4.381 3.971 -0.882) 5.978 13.742 ( -3.009 -5.161 1.917) 6.274 13.984 ( 0.501 -3.030 -2.327) 3.853 14.217 ( -7.152 -26.827 10.747) 29.771 14.595 ( -14.182 -18.719 3.270) 23.711 15.717 ( -10.222 27.199 1.305) 29.085 16.488 ( 4.323 0.020 10.852) 11.681 16.620 ( 1.977 0.443 5.186) 5.568 16.712 ( 1.721 -4.788 -1.578) 5.327 16.851 ( 1.221 -0.226 -2.074) 2.417 17.913 ( 27.923 61.673 -27.619) 73.116 18.554 ( -7.753 -8.566 -3.383) 12.039 19.024 ( 2.570 11.172 -1.751) 11.597 ======================= Grid point 179 (88/205) ======================= q-point: (-0.11 0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.294 ( -10.662 14.015 23.186) 29.115 1.393 ( -10.343 16.800 25.880) 32.542 2.566 ( -14.999 35.114 41.784) 56.603 3.523 ( -16.700 -3.027 2.451) 17.148 3.644 ( 2.459 -6.198 6.345) 9.204 4.278 ( 1.292 -0.007 6.940) 7.060 4.374 ( 6.526 11.278 5.689) 14.217 4.418 ( 2.361 12.082 4.107) 12.978 5.075 ( 14.048 0.932 -8.239) 16.313 5.225 ( 5.507 3.808 1.811) 6.936 5.750 ( -5.649 -4.635 8.928) 11.536 6.027 ( 0.833 -9.618 6.161) 11.452 6.246 ( 9.106 -1.624 -0.806) 9.285 6.700 ( -0.150 2.562 -9.091) 9.446 7.008 ( -12.814 5.623 5.863) 15.172 7.248 ( 7.744 -0.228 -9.089) 11.942 7.736 ( 3.563 -3.244 1.395) 5.017 8.298 ( -0.518 8.004 5.028) 9.466 8.439 ( 6.110 3.725 -1.288) 7.271 8.628 ( -3.866 10.700 4.694) 12.307 9.032 ( -13.836 -1.612 -7.918) 16.023 9.352 ( 10.023 -4.258 1.630) 11.012 9.524 ( 5.695 -0.429 -5.003) 7.593 10.039 ( 12.844 -4.157 -2.638) 13.755 10.528 ( -17.645 2.076 -5.834) 18.700 10.700 ( 11.568 -11.189 -7.091) 17.587 10.921 ( -11.427 -17.009 -10.652) 23.095 11.306 ( 4.118 1.128 -0.725) 4.331 11.610 ( -2.707 1.841 -4.285) 5.393 11.904 ( -14.437 -9.986 -3.941) 17.991 12.055 ( 0.523 7.900 7.643) 11.004 12.311 ( -4.538 -2.270 -4.261) 6.626 12.425 ( 4.712 -4.585 1.114) 6.668 12.526 ( 0.345 -10.686 -2.250) 10.925 13.001 ( 1.411 -13.681 7.665) 15.745 13.274 ( -5.647 7.328 -12.307) 15.397 13.547 ( -5.403 -7.015 -5.653) 10.505 13.843 ( -7.849 -1.645 -8.066) 11.374 14.350 ( 0.463 -18.791 15.406) 24.303 14.536 ( -4.780 -15.830 16.623) 23.447 15.604 ( -3.734 24.209 2.180) 24.592 16.277 ( -14.760 10.338 -15.034) 23.469 16.572 ( -0.170 -0.231 1.275) 1.307 16.850 ( 0.135 -3.896 -0.976) 4.018 16.880 ( 0.731 -4.975 0.143) 5.030 18.124 ( 7.738 16.355 -12.419) 21.945 18.997 ( 39.985 17.588 12.233) 45.363 19.151 ( 19.951 12.558 8.391) 25.023 ======================= Grid point 180 (89/205) ======================= q-point: ( 0.00 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( 9.399 20.534 16.612) 28.035 2.035 ( 7.910 19.052 22.911) 30.830 3.171 ( -0.406 0.050 0.227) 0.468 3.530 ( 2.739 1.863 14.493) 14.867 3.700 ( -6.566 16.126 21.959) 28.024 4.440 ( 0.836 3.927 13.641) 14.219 4.701 ( 8.023 6.999 5.761) 12.106 4.885 ( 0.034 15.648 5.578) 16.613 5.285 ( 10.826 6.928 -1.970) 13.003 5.466 ( 3.076 2.856 0.945) 4.302 5.591 ( -12.853 -11.785 10.326) 20.266 5.880 ( 1.648 2.921 6.202) 7.051 6.360 ( 12.243 -0.880 -5.210) 13.335 6.652 ( 4.852 -3.078 -3.582) 6.771 7.034 ( -11.233 10.883 9.508) 18.304 7.373 ( 1.070 5.102 4.008) 6.576 7.795 ( 3.460 -0.147 6.224) 7.123 8.369 ( 3.516 0.005 -0.426) 3.542 8.626 ( -6.651 10.697 -3.429) 13.055 8.752 ( -10.292 13.688 3.193) 17.421 9.098 ( 8.415 5.668 1.249) 10.222 9.343 ( 9.332 -13.334 -7.960) 18.118 9.435 ( 4.270 -4.979 4.702) 8.070 10.025 ( -16.506 -3.731 4.629) 17.544 10.176 ( -11.174 -1.944 -5.474) 12.594 10.523 ( 11.632 1.882 -11.376) 16.379 10.718 ( 13.035 -6.997 -5.057) 15.634 11.271 ( -0.545 -11.456 2.444) 11.727 11.446 ( -6.097 -1.254 -5.075) 8.031 11.733 ( -1.093 2.370 -0.774) 2.722 11.846 ( -3.061 -21.669 -11.132) 24.552 12.217 ( 0.510 1.097 -1.050) 1.602 12.345 ( -3.687 9.974 -3.960) 11.347 12.767 ( -5.729 -1.920 -7.611) 9.718 12.807 ( 1.324 5.496 5.886) 8.162 13.226 ( 2.060 -1.943 5.074) 5.811 13.369 ( 0.118 -1.166 -6.633) 6.736 13.591 ( -6.496 -3.852 -3.389) 8.278 14.033 ( -6.200 -16.130 6.317) 18.399 14.391 ( 3.822 -13.794 6.156) 15.582 15.976 ( -0.872 12.276 -2.981) 12.662 16.131 ( -8.602 6.559 -8.650) 13.850 16.505 ( -7.553 -2.542 -5.532) 9.701 16.627 ( -3.151 -5.016 -8.039) 9.985 16.972 ( 2.874 8.654 13.828) 16.564 18.181 ( 4.126 -5.859 0.619) 7.193 19.277 ( -2.030 9.395 -0.878) 9.652 20.105 ( 27.946 -4.281 -8.411) 29.496 ======================= Grid point 181 (90/205) ======================= q-point: ( 0.11 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.251 ( 11.931 18.986 15.608) 27.321 2.502 ( 12.168 17.138 23.710) 31.685 3.278 ( 15.031 -0.520 -5.652) 16.067 3.668 ( 3.450 -3.888 0.735) 5.250 3.899 ( 4.572 6.710 21.537) 23.017 4.482 ( -11.045 6.793 8.490) 15.499 4.919 ( -3.917 7.104 7.984) 11.382 4.990 ( 9.642 5.490 13.232) 17.268 5.357 ( -3.520 8.640 -2.096) 9.563 5.409 ( -1.006 -6.022 -5.082) 7.944 5.583 ( 5.031 0.273 10.068) 11.258 6.056 ( 3.089 6.805 12.440) 14.512 6.568 ( 13.702 3.049 -1.613) 14.130 6.660 ( -1.435 4.819 -3.222) 5.972 7.022 ( -1.610 8.784 11.826) 14.819 7.392 ( -3.351 3.613 4.247) 6.506 7.869 ( 0.909 7.002 -0.789) 7.105 8.275 ( -12.484 15.761 -12.631) 23.744 8.520 ( 3.379 5.334 5.539) 8.400 8.784 ( 2.666 1.138 8.056) 8.562 9.085 ( -4.170 -5.576 -2.494) 7.396 9.502 ( -1.732 -6.281 1.686) 6.730 9.635 ( 13.289 -0.605 6.271) 14.707 9.715 ( -4.980 -5.868 -5.764) 9.616 9.945 ( -11.099 -4.982 -1.767) 12.294 10.676 ( 12.155 1.963 -12.224) 17.350 10.786 ( 0.836 0.648 -8.912) 8.975 11.262 ( -2.870 -6.505 -0.965) 7.175 11.342 ( -1.353 -9.867 2.050) 10.168 11.693 ( -1.457 -15.557 -5.391) 16.529 11.742 ( 1.728 -1.376 0.936) 2.399 12.130 ( -6.726 7.128 -2.845) 10.205 12.291 ( 0.652 8.664 -1.388) 8.798 12.485 ( -8.439 -8.082 -12.001) 16.750 12.874 ( -0.495 1.582 0.987) 1.929 13.255 ( -3.378 -4.096 -5.223) 7.448 13.305 ( -0.434 -1.156 -0.245) 1.259 13.574 ( 2.569 5.675 3.005) 6.917 13.992 ( -4.700 -17.701 8.616) 20.240 14.519 ( 5.098 -19.083 2.814) 19.952 15.916 ( -4.492 6.908 -5.088) 9.684 15.971 ( 0.301 7.246 -2.946) 7.828 16.243 ( -10.824 -2.880 -6.162) 12.784 16.550 ( 0.250 -6.325 -5.875) 8.636 17.187 ( 4.984 12.285 15.192) 20.163 18.277 ( 5.825 -6.667 -1.849) 9.044 19.180 ( -7.091 9.130 -1.997) 11.732 20.333 ( 9.242 -12.886 -10.803) 19.188 ======================= Grid point 182 (91/205) ======================= q-point: ( 0.22 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.635 ( 13.923 14.498 11.632) 23.224 2.856 ( 1.050 18.427 22.137) 28.822 3.530 ( 14.586 0.607 -7.651) 16.482 3.710 ( 6.069 -2.655 -3.813) 7.643 4.187 ( -9.019 -3.653 -0.850) 9.768 4.308 ( 9.394 0.580 5.334) 10.819 4.873 ( -10.178 3.620 8.683) 13.860 5.105 ( -4.065 5.825 4.684) 8.508 5.289 ( -1.195 -2.981 0.645) 3.276 5.543 ( 10.297 -1.444 2.220) 10.632 5.839 ( 11.617 13.240 9.458) 19.993 6.144 ( -3.401 6.940 4.827) 9.112 6.559 ( -8.179 10.710 3.351) 13.886 6.760 ( 10.309 5.411 -8.201) 14.241 7.119 ( -6.255 5.535 13.143) 15.572 7.367 ( 1.020 0.711 -3.759) 3.959 7.788 ( -8.554 16.997 -4.053) 19.455 8.013 ( 1.930 15.736 -7.381) 17.488 8.543 ( -5.481 7.099 -0.728) 8.998 8.898 ( 0.631 -6.756 -4.671) 8.238 9.001 ( -6.969 -2.468 11.632) 13.783 9.337 ( -8.479 -8.282 6.562) 13.548 9.754 ( 0.889 -7.017 -1.942) 7.335 9.762 ( -1.957 -2.081 0.923) 3.001 10.020 ( 19.051 -4.608 5.974) 20.491 10.471 ( -12.308 -2.206 -14.694) 19.294 10.792 ( 7.067 3.048 -8.218) 11.259 11.171 ( -2.792 4.720 -3.079) 6.289 11.413 ( 3.402 -13.028 3.244) 13.850 11.668 ( 1.453 -9.898 -2.991) 10.442 11.807 ( 0.443 -5.363 3.311) 6.319 12.029 ( -2.239 2.452 4.477) 5.574 12.258 ( -4.098 -8.669 -11.023) 14.610 12.299 ( 1.411 8.628 -0.640) 8.766 12.805 ( -4.192 -5.440 -4.813) 8.387 13.182 ( -0.554 -3.637 -0.490) 3.712 13.280 ( -0.810 1.520 -0.378) 1.763 13.599 ( -2.025 6.338 0.479) 6.671 14.059 ( -0.851 -13.347 10.928) 17.271 14.624 ( 4.882 -22.936 -0.235) 23.451 15.806 ( -2.748 6.907 -1.952) 7.685 15.969 ( 0.134 4.813 -1.098) 4.938 16.060 ( -4.604 -2.877 -0.036) 5.429 16.507 ( 0.528 -6.608 -3.244) 7.380 17.461 ( 8.337 11.349 14.031) 19.879 18.316 ( 1.457 -6.837 -5.363) 8.811 18.994 ( -7.867 11.176 -6.069) 14.954 20.275 ( -1.659 -14.576 -11.645) 18.730 ======================= Grid point 183 (92/205) ======================= q-point: ( 0.33 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.884 ( -2.432 10.705 9.577) 14.568 3.060 ( 8.154 11.598 6.035) 15.409 3.453 ( -19.364 2.225 3.965) 19.891 3.703 ( -7.381 -1.349 -6.472) 9.909 4.091 ( 22.188 5.079 -18.467) 29.311 4.565 ( 2.202 8.632 1.351) 9.010 4.834 ( 8.433 -3.860 -2.682) 9.654 5.105 ( -5.924 -1.995 12.129) 13.645 5.304 ( 1.563 -2.100 0.492) 2.664 5.652 ( 1.219 -7.649 -0.204) 7.748 5.933 ( -3.648 13.907 -9.263) 17.103 6.176 ( 2.626 10.478 -0.565) 10.817 6.433 ( -15.196 12.232 10.981) 22.386 6.769 ( 5.362 7.954 -15.084) 17.876 6.995 ( -15.831 -1.252 6.117) 17.018 7.340 ( 4.679 3.927 -8.537) 10.497 7.595 ( -2.639 16.634 -9.568) 19.370 8.194 ( 10.981 15.290 10.366) 21.490 8.339 ( -7.113 4.243 -10.423) 13.313 8.808 ( -7.275 -1.928 5.737) 9.464 8.970 ( -5.063 -1.082 3.073) 6.020 9.355 ( -4.816 -7.873 13.726) 16.540 9.651 ( -2.961 -9.993 -9.134) 13.859 9.828 ( -2.503 2.502 5.786) 6.783 10.164 ( -0.630 -4.625 -6.124) 7.700 10.458 ( 11.569 -9.329 15.959) 21.807 10.825 ( 5.155 3.870 -3.821) 7.493 11.138 ( 6.110 8.456 -9.311) 13.983 11.472 ( 0.037 -9.476 -0.174) 9.478 11.625 ( -2.237 -6.425 -0.027) 6.804 11.850 ( 2.810 -6.867 -0.401) 7.430 12.082 ( -2.001 -12.976 -0.830) 13.155 12.136 ( 0.271 1.601 3.738) 4.076 12.334 ( 2.728 9.478 -0.140) 9.863 12.679 ( -2.963 -7.791 -4.902) 9.670 13.213 ( 1.389 1.595 4.324) 4.813 13.298 ( 2.325 -3.024 1.674) 4.165 13.550 ( -2.695 4.984 0.027) 5.666 14.106 ( -4.850 -12.075 6.702) 14.637 14.690 ( 3.514 -24.562 -1.744) 24.874 15.789 ( 0.681 6.990 2.666) 7.512 15.959 ( -1.246 1.899 4.104) 4.690 16.068 ( 1.905 0.478 3.351) 3.884 16.516 ( 1.745 -5.617 1.070) 5.978 17.729 ( 5.991 9.194 7.668) 13.387 18.202 ( -6.253 -3.287 -4.542) 8.398 18.821 ( -0.143 12.402 -12.435) 17.563 20.075 ( -5.781 -13.681 -13.182) 19.858 ======================= Grid point 184 (93/205) ======================= q-point: (-0.56 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.721 ( -21.188 6.665 -3.935) 22.558 3.025 ( -17.609 0.127 13.250) 22.037 3.243 ( -2.895 6.562 -9.489) 11.894 3.588 ( 6.756 8.019 -6.109) 12.135 4.296 ( 16.072 9.715 -15.349) 24.254 4.558 ( 3.146 11.356 -3.237) 12.220 4.941 ( -4.426 -3.111 -8.501) 10.076 5.088 ( -0.846 0.471 10.853) 10.896 5.360 ( 4.077 -2.561 -3.092) 5.722 5.471 ( -15.298 -1.561 -6.136) 16.556 5.934 ( -4.532 6.455 -2.701) 8.336 5.992 ( -5.724 2.966 -1.065) 6.534 6.156 ( -12.375 15.339 -7.978) 21.262 6.685 ( 2.530 9.775 -17.146) 19.898 6.778 ( -10.295 -6.121 0.109) 11.978 7.301 ( 1.307 3.097 -15.693) 16.049 7.649 ( 12.227 13.302 7.142) 19.428 8.179 ( 0.636 6.917 -7.968) 10.571 8.416 ( 2.765 6.122 2.371) 7.124 8.740 ( -9.917 0.508 8.749) 13.234 9.004 ( 4.640 3.090 8.589) 10.240 9.324 ( -6.555 -9.618 -3.898) 12.275 9.514 ( -5.055 -3.243 7.437) 9.559 9.814 ( -6.020 4.831 9.611) 12.326 10.209 ( 1.481 -9.080 1.398) 9.306 10.718 ( 4.570 -8.771 10.744) 14.603 10.962 ( 6.597 0.758 -0.003) 6.641 11.176 ( 9.293 7.193 -11.722) 16.598 11.466 ( 3.601 -4.777 2.026) 6.316 11.667 ( 2.684 -6.089 6.912) 9.595 11.829 ( 1.015 0.260 -8.363) 8.428 12.059 ( -3.057 -14.037 4.457) 15.041 12.222 ( 3.263 -0.207 4.956) 5.937 12.371 ( 1.165 10.097 -0.992) 10.212 12.627 ( 0.416 -6.288 -0.006) 6.302 13.302 ( 2.981 0.341 4.001) 5.001 13.386 ( 2.880 -4.901 4.081) 6.997 13.532 ( 0.809 4.089 1.813) 4.546 14.018 ( -9.492 -16.604 2.853) 19.337 14.708 ( 0.755 -24.647 -3.118) 24.855 15.883 ( 4.453 5.261 6.356) 9.376 16.023 ( 1.105 1.520 8.364) 8.572 16.173 ( 3.356 4.506 7.747) 9.569 16.586 ( 2.816 -4.611 3.958) 6.697 17.624 ( -15.296 10.741 -8.580) 20.566 18.226 ( 7.399 0.822 6.349) 9.784 18.721 ( 5.451 12.761 -18.158) 22.853 19.817 ( -5.996 -10.819 -16.069) 20.279 ======================= Grid point 185 (94/205) ======================= q-point: (-0.44 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.206 ( -28.364 6.189 1.252) 29.059 2.891 ( -15.186 16.187 -7.163) 23.322 3.003 ( -3.573 -5.723 4.668) 8.204 3.789 ( 17.552 5.725 -5.515) 19.268 4.366 ( 2.267 9.884 -5.406) 11.492 4.509 ( -2.712 8.674 -17.248) 19.496 4.659 ( -11.441 0.931 -9.973) 15.206 4.974 ( -15.306 18.251 -5.201) 24.381 5.145 ( -15.262 1.735 -1.073) 15.398 5.439 ( -6.055 0.162 2.409) 6.518 5.532 ( -2.550 -1.000 1.053) 2.934 5.870 ( -8.970 7.423 -8.737) 14.557 6.306 ( 17.686 3.358 5.143) 18.722 6.516 ( 0.430 7.482 -19.947) 21.308 6.663 ( -0.645 -7.341 -1.239) 7.473 7.167 ( 2.942 -0.100 -14.927) 15.215 7.998 ( 12.282 7.283 9.556) 17.182 8.171 ( 4.738 10.076 -5.665) 12.493 8.350 ( -4.672 1.125 -5.883) 7.596 8.689 ( -5.105 1.039 10.327) 11.567 9.027 ( -2.612 0.161 -11.346) 11.644 9.335 ( 0.836 -1.809 15.532) 15.659 9.559 ( -1.907 -3.819 11.557) 12.320 9.800 ( -7.073 3.930 9.760) 12.678 10.171 ( -3.568 -8.792 -2.358) 9.777 10.902 ( 6.730 -7.469 -2.500) 10.360 10.989 ( -0.869 -3.815 6.940) 7.967 11.223 ( 7.951 4.783 -8.922) 12.873 11.645 ( 8.487 5.089 4.714) 10.961 11.764 ( -2.640 3.107 -1.902) 4.499 11.866 ( 7.593 -5.705 10.343) 14.042 12.026 ( -2.622 -13.547 2.026) 13.947 12.319 ( 1.554 8.815 -4.386) 9.967 12.373 ( 3.440 -1.003 2.484) 4.360 12.695 ( 2.819 -4.076 5.930) 7.729 13.385 ( 0.157 -0.666 2.438) 2.533 13.416 ( 0.860 -0.726 -0.865) 1.419 13.638 ( 4.472 -4.658 6.480) 9.148 13.882 ( -7.304 -20.275 4.480) 22.011 14.638 ( -3.678 -23.037 -6.016) 24.092 16.068 ( 7.145 2.179 8.126) 11.038 16.155 ( 2.978 -0.788 9.573) 10.057 16.338 ( 2.874 10.861 12.368) 16.709 16.682 ( 2.787 -4.530 4.143) 6.741 17.208 ( -17.356 16.323 -9.945) 25.818 18.428 ( 5.402 -2.380 5.927) 8.365 18.640 ( 9.380 17.883 -22.751) 30.420 19.545 ( -3.650 -4.967 -19.467) 20.420 ======================= Grid point 186 (95/205) ======================= q-point: (-0.33 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.819 ( -19.393 10.345 9.569) 23.972 2.477 ( -22.586 21.519 -1.594) 31.237 3.098 ( 5.011 -9.670 3.668) 11.492 3.941 ( -7.843 4.835 -2.152) 9.461 3.996 ( -23.454 13.042 -10.962) 28.989 4.312 ( 8.018 5.487 -4.096) 10.544 4.502 ( -4.475 9.842 -4.142) 11.578 4.691 ( -11.970 10.243 -6.020) 16.865 4.927 ( 3.980 17.474 -6.218) 18.969 5.380 ( -5.373 -0.258 1.967) 5.727 5.610 ( 0.307 2.063 8.227) 8.487 5.690 ( -3.333 -3.100 -2.301) 5.101 6.308 ( -1.395 6.025 -15.209) 16.418 6.689 ( 15.799 -0.839 -3.049) 16.113 6.725 ( 9.130 -3.088 5.103) 10.906 7.125 ( 5.859 -2.728 -9.480) 11.474 7.976 ( -10.595 -1.375 -6.977) 12.760 8.268 ( 7.105 8.893 -1.188) 11.445 8.414 ( 7.932 6.188 8.642) 13.263 8.725 ( 0.229 4.914 0.762) 4.978 8.885 ( 0.630 1.545 -7.028) 7.224 9.422 ( -9.662 -8.983 17.100) 21.597 9.625 ( -2.835 0.919 1.894) 3.531 9.778 ( -1.537 0.441 6.761) 6.948 10.114 ( 3.964 -10.438 -6.390) 12.865 10.951 ( 3.276 -2.408 0.651) 4.117 11.032 ( -1.458 -5.597 -0.861) 5.847 11.268 ( 1.073 4.247 -4.802) 6.500 11.713 ( -0.146 -5.629 1.934) 5.953 11.839 ( 6.187 6.320 6.195) 10.798 11.993 ( -1.044 -5.983 3.876) 7.205 12.069 ( 0.731 -4.109 2.143) 4.692 12.277 ( 3.551 5.074 -3.822) 7.278 12.497 ( 5.616 -1.879 0.768) 5.972 12.752 ( -4.997 -4.529 3.189) 7.460 13.313 ( -0.514 0.051 -1.974) 2.040 13.532 ( 4.216 -5.835 7.817) 10.626 13.765 ( 1.068 -14.940 7.674) 16.829 13.873 ( 0.497 -7.527 3.361) 8.258 14.457 ( -7.808 -18.947 -7.823) 21.935 16.240 ( 1.269 2.077 5.969) 6.446 16.337 ( 7.665 -3.830 8.080) 11.777 16.488 ( -0.708 15.581 11.502) 19.380 16.761 ( 1.761 -4.635 3.120) 5.858 16.865 ( -10.826 14.940 -4.718) 19.044 18.474 ( -4.750 -7.181 3.360) 9.243 18.658 ( 19.254 25.629 -24.739) 40.492 19.322 ( 1.354 4.848 -17.830) 18.527 ======================= Grid point 187 (96/205) ======================= q-point: (-0.22 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.688 ( -10.132 17.210 14.729) 24.815 2.044 ( -25.771 23.811 4.742) 35.406 3.158 ( -5.120 -3.203 8.680) 10.574 3.612 ( -6.939 23.517 0.165) 24.520 3.702 ( -19.368 -5.298 6.898) 21.231 4.293 ( -9.966 2.137 3.569) 10.800 4.572 ( 16.226 12.423 -1.022) 20.461 4.586 ( -0.938 13.743 -0.870) 13.803 4.997 ( 9.850 14.749 -8.218) 19.547 5.294 ( -3.058 4.371 1.391) 5.513 5.653 ( -3.074 -5.451 4.431) 7.668 5.732 ( 2.378 -3.881 9.571) 10.598 6.189 ( 4.247 2.089 -11.805) 12.718 6.739 ( 1.093 -4.850 -5.986) 7.781 7.063 ( 15.888 0.452 0.894) 15.920 7.166 ( 0.829 1.240 3.546) 3.847 7.731 ( -8.075 -1.088 -3.554) 8.889 8.395 ( 7.652 4.324 -1.388) 8.898 8.536 ( -3.245 6.523 1.934) 7.538 8.719 ( 4.810 9.009 0.892) 10.251 8.981 ( 9.779 -2.220 1.251) 10.106 9.329 ( -12.901 -4.294 4.461) 14.310 9.564 ( -5.485 -2.094 4.849) 7.615 9.833 ( 3.902 -0.089 -1.346) 4.129 10.219 ( 13.821 -13.811 -5.150) 20.206 10.889 ( -11.179 -0.166 -4.076) 11.900 10.963 ( -4.110 -4.726 -8.553) 10.601 11.192 ( 0.309 0.280 -0.930) 1.019 11.776 ( 0.042 -14.031 0.881) 14.059 11.861 ( -6.082 -6.200 -0.212) 8.687 12.017 ( -1.890 -6.030 -5.608) 8.449 12.083 ( 5.642 7.997 6.043) 11.503 12.390 ( 7.066 1.813 3.294) 8.004 12.505 ( -1.980 1.396 -5.934) 6.409 12.698 ( -2.497 -2.446 10.226) 10.807 13.359 ( 4.602 -2.867 -1.400) 5.600 13.594 ( -5.091 -7.566 -2.506) 9.458 13.880 ( 2.776 -9.373 10.796) 14.564 13.912 ( 0.686 -5.495 -0.647) 5.575 14.260 ( -6.737 -13.582 0.127) 15.162 16.197 ( -6.106 13.186 -2.715) 14.782 16.553 ( 4.628 -2.603 4.117) 6.719 16.571 ( 0.882 8.138 13.104) 15.450 16.673 ( -8.629 3.612 -4.641) 10.443 16.820 ( 1.987 -2.585 1.140) 3.454 18.342 ( -9.517 -11.184 -2.910) 14.971 18.904 ( 34.108 32.733 -16.648) 50.120 19.256 ( 4.763 10.804 -7.516) 13.997 ======================= Grid point 188 (97/205) ======================= q-point: (-0.11 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.677 ( -5.753 22.234 13.770) 26.778 1.827 ( -7.476 23.238 17.892) 30.266 3.199 ( -6.930 9.881 17.356) 21.139 3.429 ( -8.660 -8.729 3.872) 12.891 3.634 ( -6.308 20.397 15.342) 26.291 4.292 ( -0.348 1.619 11.316) 11.437 4.581 ( 1.772 9.011 0.897) 9.227 4.792 ( 6.414 19.254 2.784) 20.485 5.114 ( 10.404 4.020 -3.943) 11.830 5.346 ( 5.900 8.064 2.077) 10.205 5.640 ( -5.317 -5.540 8.128) 11.182 5.849 ( -0.799 -7.015 7.241) 10.113 6.225 ( 9.987 -0.053 -7.906) 12.737 6.657 ( 0.189 -6.326 -7.968) 10.176 7.156 ( -10.258 8.024 9.130) 15.904 7.273 ( 7.817 2.579 -0.187) 8.234 7.677 ( 1.008 -1.332 5.182) 5.445 8.386 ( -0.644 -0.594 -6.821) 6.877 8.593 ( 2.690 9.522 7.429) 12.374 8.873 ( 8.136 7.966 4.782) 12.350 9.059 ( -16.338 6.919 -2.585) 17.931 9.189 ( 12.885 -8.249 -3.464) 15.686 9.481 ( -7.438 -4.451 1.553) 8.806 9.963 ( 10.616 -1.047 0.825) 10.699 10.452 ( 10.976 -11.297 -0.322) 15.754 10.565 ( -13.403 0.088 -10.539) 17.050 10.680 ( -9.390 -5.368 -12.101) 16.231 11.241 ( 1.227 -6.058 2.622) 6.714 11.631 ( -7.536 -6.995 -5.887) 11.848 11.784 ( -1.808 4.630 -4.091) 6.437 11.958 ( 0.839 -23.845 -6.280) 24.672 12.196 ( 1.902 4.235 1.194) 4.794 12.422 ( -2.140 5.876 -1.035) 6.338 12.602 ( 7.778 8.691 8.794) 14.607 12.805 ( 2.131 -4.547 7.649) 9.150 13.350 ( -9.033 -2.062 -10.953) 14.346 13.401 ( 1.389 -4.147 -3.449) 5.570 13.792 ( -7.454 -4.505 -6.471) 10.850 14.029 ( -1.759 -13.205 10.568) 17.004 14.268 ( 1.303 -10.720 7.568) 13.187 16.057 ( -4.472 16.198 -3.698) 17.206 16.410 ( -11.340 5.006 -9.014) 15.327 16.580 ( -0.874 0.140 0.141) 0.896 16.770 ( 2.233 -0.689 8.699) 9.008 16.809 ( -1.324 -1.360 -1.830) 2.637 18.172 ( -3.542 -6.724 -2.384) 7.965 19.281 ( 3.715 11.429 -3.469) 12.508 19.520 ( 40.757 15.509 -5.205) 43.918 ======================= Grid point 189 (98/205) ======================= q-point: ( 0.00 0.38 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.309 ( 12.166 18.124 10.529) 24.235 2.429 ( 5.912 17.707 12.523) 22.479 3.079 ( 0.840 -5.956 5.148) 7.917 3.355 ( 6.120 -12.433 6.896) 15.479 4.208 ( -13.823 23.575 16.662) 32.008 4.524 ( 2.491 3.682 15.902) 16.512 4.780 ( 7.985 1.029 4.391) 9.171 5.060 ( -6.988 -4.623 2.824) 8.842 5.370 ( -4.485 3.607 4.473) 7.289 5.524 ( -2.000 5.776 6.397) 8.848 5.547 ( 5.797 6.306 -4.196) 9.538 5.907 ( 7.062 -2.070 7.383) 10.424 6.403 ( 15.737 4.548 -3.683) 16.790 6.584 ( 11.862 -3.072 -1.652) 12.364 7.260 ( -11.989 10.151 13.252) 20.552 7.428 ( -4.731 0.648 10.234) 11.293 7.867 ( 4.824 7.719 10.246) 13.705 8.312 ( 3.789 -6.563 2.843) 8.094 8.776 ( -2.809 5.490 2.576) 6.683 8.932 ( -3.105 0.921 3.522) 4.785 9.141 ( 13.896 -5.842 -2.538) 15.286 9.239 ( 0.115 -8.934 -0.513) 8.950 9.404 ( -3.109 21.078 -9.694) 23.408 9.974 ( -19.512 -2.281 -1.226) 19.683 10.229 ( -9.177 6.082 -4.617) 11.938 10.514 ( 14.962 -2.140 -7.453) 16.852 10.583 ( 15.217 -5.087 -2.704) 16.271 10.961 ( -7.643 -19.362 -4.072) 21.210 11.376 ( -1.642 -5.693 -3.793) 7.035 11.405 ( 1.124 -14.389 -4.759) 15.198 11.910 ( -0.391 11.578 -7.759) 13.943 12.238 ( 2.800 -0.787 -5.409) 6.141 12.513 ( -1.405 6.244 -1.163) 6.505 12.772 ( -4.487 0.386 -3.669) 5.809 12.822 ( -6.919 -1.602 -6.417) 9.572 13.255 ( -0.912 0.520 5.435) 5.535 13.309 ( -5.270 -2.764 0.184) 5.954 13.494 ( 2.991 -2.946 6.009) 7.330 13.841 ( -3.612 -2.404 -1.909) 4.740 14.124 ( 1.226 -12.363 1.718) 12.542 16.134 ( -1.942 4.859 -6.534) 8.371 16.228 ( -7.880 2.475 -7.889) 11.422 16.453 ( -6.115 -2.359 -7.231) 9.759 16.510 ( -4.461 -5.337 -8.996) 11.372 17.255 ( 2.630 17.613 15.842) 23.835 17.972 ( 1.294 -13.931 6.518) 15.435 19.504 ( 1.411 12.115 -6.477) 13.810 19.966 ( 14.833 -8.940 -8.823) 19.437 ======================= Grid point 190 (99/205) ======================= q-point: ( 0.11 0.38 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.656 ( 13.334 19.121 6.803) 24.283 2.799 ( 18.423 11.489 15.261) 26.539 3.254 ( 14.743 -2.070 0.303) 14.891 3.491 ( 4.446 -11.493 1.021) 12.365 4.112 ( -11.399 12.716 13.398) 21.706 4.561 ( -13.729 -1.468 6.032) 15.067 4.985 ( -1.877 -0.767 5.541) 5.900 5.050 ( 5.425 -1.885 12.339) 13.610 5.256 ( -4.061 2.189 1.812) 4.957 5.447 ( -2.891 -1.599 -5.205) 6.165 5.821 ( 14.267 15.077 7.960) 22.231 6.124 ( 7.111 0.106 8.347) 10.966 6.700 ( 16.762 7.909 -0.592) 18.543 6.774 ( 7.182 5.670 0.994) 9.204 7.205 ( -9.005 8.186 15.921) 20.039 7.393 ( -8.855 -2.389 8.485) 12.495 8.068 ( 6.043 11.533 7.937) 15.249 8.448 ( 3.027 0.038 2.106) 3.688 8.694 ( -3.191 6.639 -2.373) 7.739 8.905 ( -5.196 10.214 4.110) 12.175 8.960 ( -9.553 -3.024 -8.605) 13.208 9.345 ( 0.828 -7.978 1.117) 8.099 9.567 ( 15.575 -3.552 -3.990) 16.466 9.612 ( -7.258 -4.267 -4.108) 9.368 9.969 ( -12.130 6.453 -3.565) 14.195 10.617 ( -3.423 -10.342 -14.691) 18.289 10.782 ( 7.375 -1.382 -2.082) 7.787 10.872 ( 7.068 -16.230 3.233) 17.995 11.324 ( -1.025 -1.464 -0.180) 1.796 11.421 ( 2.479 -9.480 1.206) 9.873 11.818 ( -0.360 8.453 -7.874) 11.558 12.225 ( 2.956 -4.756 -9.495) 11.023 12.384 ( -15.306 7.748 -4.159) 17.652 12.510 ( -0.988 8.577 -5.885) 10.449 12.775 ( -4.058 -8.542 -1.627) 9.595 13.038 ( -5.032 -14.510 -7.406) 17.050 13.449 ( 0.251 11.502 8.540) 14.328 13.672 ( 5.486 3.134 7.354) 9.695 13.757 ( -2.828 -4.983 2.890) 6.417 14.151 ( 0.985 -16.834 0.021) 16.863 16.015 ( -5.021 3.359 -5.720) 8.319 16.065 ( -1.661 1.961 -4.726) 5.379 16.210 ( -8.464 0.432 -7.417) 11.262 16.406 ( -0.551 -7.243 -6.568) 9.793 17.473 ( 4.610 15.128 13.873) 21.037 18.075 ( 3.099 -12.442 4.336) 13.535 19.418 ( -3.152 13.628 -6.973) 15.630 20.040 ( 4.176 -15.326 -9.843) 18.687 ======================= Grid point 191 (100/205) ======================= q-point: ( 0.22 0.38 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.954 ( 12.912 16.081 4.087) 21.024 3.207 ( 3.592 14.867 17.160) 22.987 3.524 ( 5.743 -5.189 -0.893) 7.791 3.599 ( 15.152 -5.688 -1.783) 16.282 4.094 ( -0.808 -0.910 -0.691) 1.400 4.321 ( -4.863 -3.135 -1.654) 6.018 4.959 ( -8.141 5.182 8.879) 13.114 5.141 ( -5.213 -1.798 4.514) 7.126 5.273 ( 0.563 1.448 0.432) 1.612 5.426 ( 4.799 -6.889 -0.834) 8.437 6.157 ( 13.629 13.248 3.468) 19.321 6.286 ( 4.037 5.427 2.402) 7.178 6.799 ( -7.657 12.721 8.852) 17.286 6.940 ( 10.346 10.194 -4.239) 15.130 7.194 ( -14.985 1.514 15.258) 21.439 7.354 ( 4.234 -2.323 -3.892) 6.202 8.161 ( -7.375 17.520 -4.967) 19.647 8.334 ( 3.374 13.860 -0.364) 14.270 8.658 ( -10.713 -2.106 -12.497) 16.594 8.824 ( 4.915 5.935 2.513) 8.105 8.919 ( -2.464 -5.903 16.038) 17.267 9.185 ( -9.640 -5.898 1.323) 11.378 9.593 ( -0.321 -5.374 -6.108) 8.142 9.728 ( 2.291 -3.432 -0.618) 4.173 9.929 ( 10.512 -2.325 5.925) 12.289 10.310 ( -11.788 -13.949 -10.112) 20.876 10.841 ( 3.603 1.887 -3.491) 5.360 11.032 ( 5.106 -10.763 1.657) 12.028 11.356 ( 3.577 1.634 1.493) 4.207 11.499 ( 3.291 -6.165 2.635) 7.469 11.747 ( 0.042 1.710 -7.043) 7.248 12.022 ( -9.943 -5.294 -8.444) 14.079 12.217 ( 1.213 5.015 -5.670) 7.666 12.494 ( 0.005 8.698 -0.100) 8.699 12.626 ( -5.454 -8.720 -4.877) 11.383 12.991 ( 1.606 -11.492 0.685) 11.624 13.472 ( -2.660 13.126 2.879) 13.698 13.685 ( -2.588 3.695 2.121) 4.985 13.897 ( 2.598 -4.626 8.577) 10.085 14.168 ( 1.628 -20.923 -1.015) 21.011 15.899 ( -2.695 2.803 -2.503) 4.624 16.000 ( -3.455 -2.788 -1.103) 4.575 16.071 ( -0.215 5.515 -1.873) 5.828 16.356 ( 0.718 -7.830 -2.882) 8.375 17.700 ( 6.113 11.756 11.468) 17.524 18.146 ( 1.040 -9.473 1.239) 9.610 19.263 ( -4.740 14.754 -8.510) 17.679 19.944 ( -2.459 -17.210 -10.684) 20.405 ======================= Grid point 192 (101/205) ======================= q-point: ( 0.33 0.38 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.122 ( -4.877 11.815 6.003) 14.122 3.266 ( -5.713 7.775 2.685) 10.015 3.499 ( -13.291 1.402 9.104) 16.171 3.654 ( -1.594 -3.920 -4.207) 5.967 4.195 ( 28.163 6.034 -18.603) 34.287 4.555 ( 26.995 -8.047 -7.367) 29.117 4.867 ( -12.019 6.450 8.668) 16.161 5.063 ( -8.298 -2.653 7.124) 11.254 5.282 ( 0.903 0.125 -1.562) 1.809 5.472 ( 0.718 -8.620 -2.226) 8.931 6.217 ( -1.053 11.495 -8.710) 14.460 6.330 ( -2.429 4.286 -5.777) 7.593 6.723 ( -12.986 14.278 12.159) 22.811 6.980 ( -18.757 1.713 5.996) 19.767 7.008 ( 5.213 11.722 -10.193) 16.385 7.375 ( 7.086 -1.679 -13.439) 15.285 7.920 ( -4.800 14.166 -8.770) 17.339 8.327 ( -4.188 -4.682 -10.572) 12.298 8.554 ( 4.180 17.476 5.948) 18.927 8.858 ( -4.596 6.432 11.699) 14.120 8.969 ( -6.141 1.131 3.433) 7.126 9.167 ( -0.704 -10.112 7.532) 12.628 9.479 ( -2.840 -4.720 -3.552) 6.555 9.823 ( 4.899 -4.930 3.781) 7.912 10.045 ( -5.706 -5.483 -0.141) 7.915 10.235 ( 5.441 -11.611 14.483) 19.344 10.885 ( 5.350 2.065 -2.451) 6.237 11.109 ( 3.931 -9.305 -0.762) 10.131 11.440 ( 5.586 5.875 -5.924) 10.040 11.539 ( 0.331 -0.360 -0.496) 0.697 11.701 ( 1.260 -5.975 0.335) 6.116 11.858 ( -1.661 -9.019 -4.030) 10.017 12.222 ( 3.084 4.149 -0.854) 5.240 12.462 ( -0.416 -6.462 -2.390) 6.902 12.571 ( 0.208 8.458 0.851) 8.503 13.056 ( 1.764 -11.158 4.879) 12.305 13.467 ( -0.970 13.037 3.637) 13.570 13.635 ( -4.180 5.169 -0.279) 6.654 13.936 ( -4.286 -6.658 1.374) 8.037 14.194 ( 2.082 -22.788 -0.622) 22.891 15.872 ( 0.235 2.302 1.568) 2.795 15.964 ( -1.135 -1.648 3.271) 3.835 16.122 ( 3.645 4.798 4.276) 7.389 16.383 ( 2.513 -7.026 2.312) 7.812 17.906 ( 4.252 7.772 7.008) 11.296 18.134 ( -2.273 -3.685 0.860) 4.415 19.101 ( -1.439 14.822 -11.111) 18.580 19.762 ( -4.350 -16.369 -11.794) 20.639 ======================= Grid point 193 (102/205) ======================= q-point: (-0.56 0.38 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.855 ( -26.037 6.023 -0.829) 26.738 3.012 ( -18.243 -1.603 7.584) 19.822 3.426 ( 0.514 10.710 -8.114) 13.447 3.709 ( 9.105 2.079 -2.773) 9.742 4.468 ( 17.078 8.045 -18.228) 26.241 4.771 ( -0.612 8.377 0.960) 8.454 4.834 ( 1.629 -6.026 -10.643) 12.338 5.080 ( 9.835 -1.920 8.640) 13.231 5.280 ( 2.476 -3.652 -3.761) 5.798 5.392 ( -7.061 -5.561 -2.623) 9.363 6.036 ( -21.444 4.284 -3.800) 22.196 6.114 ( 0.033 4.731 -6.728) 8.225 6.488 ( -14.073 15.551 -7.855) 22.396 6.712 ( -13.442 0.246 3.716) 13.949 6.935 ( 1.545 12.757 -16.083) 20.586 7.296 ( 2.516 -3.850 -20.315) 20.829 7.924 ( 8.076 12.534 3.208) 15.252 8.250 ( 4.199 -1.883 -5.291) 7.013 8.587 ( -2.002 12.054 -4.178) 12.914 8.767 ( -9.607 3.145 6.799) 12.182 9.057 ( -4.219 -2.405 12.079) 13.019 9.122 ( -2.241 -9.368 1.259) 9.714 9.493 ( 2.060 4.798 6.195) 8.102 9.926 ( -3.157 4.874 10.211) 11.746 10.010 ( -1.079 -9.527 2.818) 9.993 10.467 ( 2.735 -15.261 15.192) 21.706 10.960 ( 2.816 0.236 -0.700) 2.911 11.184 ( 5.066 -6.989 -1.392) 8.743 11.469 ( 10.936 5.710 -5.715) 13.596 11.624 ( 4.256 2.367 5.223) 7.141 11.719 ( 3.193 -7.457 -4.456) 9.255 11.866 ( 0.831 -6.283 3.409) 7.196 12.294 ( 3.500 4.807 2.132) 6.318 12.477 ( 2.697 -6.688 -0.620) 7.238 12.594 ( 1.372 11.235 1.618) 11.434 13.151 ( 1.947 -13.236 7.950) 15.562 13.458 ( -4.474 9.228 -0.294) 10.260 13.592 ( 1.111 3.335 1.489) 3.817 13.781 ( -9.814 -7.079 -4.297) 12.841 14.220 ( 1.173 -22.040 -0.888) 22.089 15.937 ( 3.142 1.653 5.115) 6.226 16.019 ( 1.291 -1.642 6.409) 6.740 16.275 ( 5.100 4.770 9.464) 11.761 16.479 ( 3.241 -5.508 5.342) 8.329 17.861 ( -9.957 11.745 -2.506) 15.601 18.204 ( 3.745 -3.497 7.138) 8.787 19.000 ( 4.581 14.124 -14.017) 20.420 19.568 ( -2.202 -13.090 -13.639) 19.032 ======================= Grid point 194 (103/205) ======================= q-point: (-0.44 0.38 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.378 ( -22.928 10.198 0.574) 25.100 2.832 ( -6.889 -10.126 2.531) 12.506 3.261 ( -10.714 18.626 -5.884) 22.278 3.837 ( 5.109 -3.866 -2.947) 7.052 4.431 ( -1.907 3.642 -8.481) 9.425 4.672 ( -2.374 1.712 -10.710) 11.102 4.765 ( 4.712 9.307 -17.466) 20.344 5.103 ( -14.509 -2.439 -7.275) 16.414 5.273 ( 2.043 5.985 4.876) 7.986 5.454 ( 10.264 -2.649 1.584) 10.718 5.591 ( -19.070 9.476 1.145) 21.326 5.978 ( -11.308 -1.307 -8.410) 14.153 6.334 ( 8.033 5.525 -4.081) 10.569 6.582 ( -2.561 1.161 0.089) 2.813 6.778 ( -0.898 12.299 -12.714) 17.712 7.125 ( 2.109 -4.204 -18.515) 19.103 8.125 ( 5.225 5.077 2.310) 7.643 8.318 ( 7.329 0.877 -4.934) 8.879 8.439 ( -2.978 9.816 -5.226) 11.512 8.772 ( -2.158 6.677 11.806) 13.734 8.934 ( -2.579 -7.393 -7.669) 10.960 9.201 ( -8.494 -10.491 18.233) 22.686 9.593 ( 2.765 5.859 3.059) 7.165 9.932 ( -8.059 5.877 8.195) 12.910 9.989 ( -3.086 -4.968 3.546) 6.839 10.639 ( 4.511 -17.158 5.525) 18.581 10.993 ( 0.156 3.353 4.238) 5.407 11.234 ( 4.627 -4.007 -4.046) 7.337 11.696 ( 4.962 -5.117 6.106) 9.386 11.753 ( -0.148 -3.623 3.446) 5.002 11.798 ( 11.091 1.937 3.491) 11.788 11.891 ( 1.583 4.347 1.679) 4.921 12.398 ( 6.548 3.449 1.585) 7.569 12.472 ( 1.461 1.163 -8.066) 8.279 12.685 ( 3.274 6.553 5.966) 9.447 13.291 ( 1.214 -18.215 10.829) 21.226 13.371 ( -2.006 0.398 -0.629) 2.140 13.463 ( -8.808 -2.575 -9.172) 12.975 13.729 ( 2.894 2.259 4.842) 6.077 14.204 ( -1.011 -18.809 -2.917) 19.061 16.083 ( 5.638 0.417 7.222) 9.172 16.128 ( 2.597 -1.554 7.527) 8.112 16.471 ( 4.362 3.210 10.657) 11.954 16.588 ( 2.520 -4.154 5.182) 7.104 17.608 ( -13.867 20.908 -2.391) 25.202 18.297 ( -2.094 -10.377 5.583) 11.968 18.989 ( 11.268 15.264 -15.656) 24.598 19.426 ( 3.239 -6.810 -15.314) 17.070 ======================= Grid point 195 (104/205) ======================= q-point: (-0.33 0.38 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.107 ( -9.616 16.904 5.165) 20.122 2.818 ( 1.417 -11.826 2.651) 12.202 2.941 ( -19.321 17.756 -1.920) 26.311 3.701 ( -17.029 -15.298 -0.428) 22.896 4.396 ( -13.138 12.763 -8.552) 20.215 4.449 ( 12.991 7.897 -7.116) 16.787 4.610 ( -11.517 3.342 -8.787) 14.867 4.888 ( 5.992 3.178 -6.080) 9.109 5.323 ( 0.702 17.255 0.779) 17.287 5.401 ( -5.132 4.210 4.560) 8.053 5.588 ( -2.581 -3.721 -4.741) 6.556 5.738 ( -4.445 5.547 3.189) 7.791 6.353 ( 0.869 0.677 -13.951) 13.994 6.645 ( 4.311 -4.113 -3.287) 6.805 6.783 ( 10.986 7.133 4.918) 13.992 7.043 ( 6.336 -4.710 -9.925) 12.682 8.018 ( -10.014 6.285 -4.679) 12.715 8.369 ( 4.529 -1.069 -6.415) 7.925 8.532 ( 6.767 7.126 6.198) 11.618 8.855 ( 2.673 -0.546 -7.579) 8.055 8.872 ( 1.343 3.266 6.674) 7.551 9.169 ( -13.850 -12.759 17.476) 25.691 9.669 ( 4.848 1.069 -0.265) 4.972 9.823 ( -4.879 -0.082 -1.353) 5.064 9.984 ( -3.456 5.103 5.655) 8.364 10.758 ( 4.829 -16.802 1.305) 17.531 11.032 ( -1.230 4.255 3.503) 5.647 11.278 ( 2.005 -4.589 -2.213) 5.474 11.588 ( -12.128 -2.105 -1.632) 12.418 11.778 ( -5.273 -8.689 5.883) 11.744 11.987 ( 4.781 4.137 1.959) 6.619 12.059 ( 9.902 0.876 1.829) 10.108 12.429 ( 5.162 8.679 -6.768) 12.157 12.549 ( 6.235 4.501 0.614) 7.714 12.748 ( -1.289 4.419 1.003) 4.711 13.189 ( -3.645 -12.510 -3.839) 13.584 13.438 ( 2.697 -2.965 6.342) 7.502 13.493 ( 4.107 -8.703 10.102) 13.952 13.821 ( 2.892 0.620 1.430) 3.285 14.124 ( -3.017 -13.491 -4.941) 14.680 16.242 ( 2.720 -0.457 5.365) 6.032 16.276 ( 6.450 -2.201 6.987) 9.760 16.613 ( 1.231 1.068 5.434) 5.673 16.676 ( 2.137 -3.343 4.685) 6.139 17.338 ( -14.611 26.209 0.682) 30.015 18.230 ( -9.468 -15.542 2.892) 18.427 19.100 ( 18.253 16.212 -15.032) 28.670 19.386 ( 8.720 0.719 -13.936) 16.456 ======================= Grid point 196 (105/205) ======================= q-point: (-0.22 0.38 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.100 ( -0.783 21.775 8.339) 23.330 2.517 ( -24.314 21.162 2.816) 32.357 2.940 ( 4.963 -13.762 6.582) 16.042 3.370 ( -18.432 -17.265 3.241) 25.462 4.177 ( -7.036 15.734 3.970) 17.687 4.330 ( -9.183 1.166 3.157) 9.781 4.722 ( 16.241 10.592 -4.535) 19.913 4.949 ( 0.671 12.654 -0.165) 12.673 5.274 ( -2.183 8.364 -5.091) 10.032 5.443 ( 6.004 11.823 2.625) 13.518 5.483 ( -2.081 -8.399 1.142) 8.728 5.767 ( -3.407 3.639 8.135) 9.541 6.224 ( 3.015 2.297 -13.366) 13.893 6.589 ( -1.434 -9.755 -9.895) 13.969 7.094 ( 12.056 2.287 7.278) 14.267 7.170 ( 7.179 -0.795 6.693) 9.847 7.811 ( -8.303 9.562 -0.850) 12.693 8.345 ( -0.171 -7.888 -5.293) 9.501 8.686 ( 2.166 7.189 6.438) 9.891 8.837 ( 1.989 2.791 -2.885) 4.480 8.965 ( 5.090 -1.170 -0.634) 5.261 9.102 ( -10.153 -13.667 13.593) 21.787 9.747 ( 4.200 13.693 -4.302) 14.955 9.812 ( 5.212 -1.390 0.568) 5.425 10.013 ( 3.681 -1.684 3.769) 5.530 10.782 ( -4.444 -11.937 -2.267) 12.937 10.964 ( -8.259 2.970 -5.005) 10.103 11.204 ( -5.329 -1.942 -1.851) 5.966 11.392 ( -4.040 -12.220 -4.954) 13.791 11.657 ( -6.328 -12.063 -2.894) 13.926 12.048 ( 1.849 5.181 -3.393) 6.463 12.195 ( 5.445 0.449 -1.657) 5.709 12.506 ( 2.977 8.177 -1.323) 8.802 12.617 ( 5.569 7.527 2.700) 9.744 12.746 ( -0.718 6.568 4.517) 8.004 13.217 ( 5.227 -9.821 1.635) 11.244 13.478 ( -3.851 -3.679 -0.972) 5.414 13.658 ( -0.214 -10.970 10.081) 14.900 13.861 ( 2.670 -0.211 -2.659) 3.774 14.035 ( -1.083 -8.598 -1.631) 8.818 16.293 ( 0.093 1.598 -1.093) 1.939 16.435 ( 4.261 -5.544 2.433) 7.404 16.640 ( -0.864 0.977 0.306) 1.340 16.746 ( 1.093 -3.639 1.402) 4.050 17.112 ( -12.894 27.448 6.351) 30.984 18.057 ( -10.808 -16.851 2.023) 20.121 19.348 ( 23.010 12.679 -10.428) 28.266 19.440 ( 10.724 6.327 -11.323) 16.830 ======================= Grid point 197 (106/205) ======================= q-point: (-0.11 0.38 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.155 ( -3.292 23.066 6.381) 24.158 2.279 ( -5.675 19.651 12.652) 24.051 3.097 ( -6.080 -10.528 12.466) 17.413 3.174 ( 0.493 -14.830 4.168) 15.413 4.191 ( -3.172 19.808 13.516) 24.189 4.342 ( 0.220 2.923 12.060) 12.411 4.747 ( -5.978 9.902 -0.032) 11.566 5.068 ( 7.483 7.058 2.816) 10.665 5.243 ( 2.912 5.314 -0.932) 6.131 5.506 ( 3.185 -1.569 0.968) 3.680 5.581 ( 0.478 7.977 3.117) 8.578 5.763 ( -2.588 -0.680 7.666) 8.120 6.238 ( 10.631 1.041 -9.208) 14.103 6.481 ( 3.019 -9.870 -8.344) 13.272 7.300 ( -4.196 5.054 12.736) 14.330 7.337 ( 3.696 3.030 8.670) 9.900 7.740 ( -1.322 8.770 5.779) 10.586 8.287 ( -1.331 -9.331 -1.296) 9.514 8.755 ( 1.377 6.622 2.844) 7.337 8.906 ( 3.498 -0.703 5.028) 6.165 8.990 ( 0.351 -6.170 -1.217) 6.299 9.134 ( 4.545 -9.343 2.266) 10.634 9.669 ( -8.894 24.589 -4.617) 26.553 9.992 ( 11.852 3.574 2.329) 12.597 10.227 ( 12.298 -10.031 4.009) 16.368 10.539 ( -11.500 -4.816 -9.708) 15.802 10.658 ( -11.104 2.801 -13.103) 17.403 11.097 ( -5.487 -10.689 -0.922) 12.050 11.372 ( 5.306 -14.326 -5.150) 16.122 11.518 ( -4.604 -12.862 -6.260) 15.027 11.992 ( -0.085 10.718 -7.989) 13.368 12.239 ( 2.824 -0.011 -3.834) 4.762 12.525 ( 0.289 4.389 0.560) 4.434 12.742 ( 2.185 -2.764 2.311) 4.214 12.869 ( 5.845 14.718 9.147) 18.288 13.266 ( -8.189 -0.930 -2.234) 8.540 13.360 ( 2.690 -3.511 -1.069) 4.551 13.588 ( -10.467 -13.883 -1.190) 17.427 13.884 ( 0.799 -1.349 -0.990) 1.854 14.068 ( 2.189 -8.872 2.724) 9.535 16.235 ( -1.790 4.431 -5.820) 7.531 16.429 ( -3.964 -4.084 -5.562) 7.958 16.570 ( -3.147 1.119 -5.160) 6.147 16.703 ( -4.269 -4.353 -5.607) 8.283 17.081 ( -2.566 22.487 15.377) 27.363 17.938 ( -5.054 -15.485 4.933) 17.019 19.500 ( 6.247 9.663 -6.801) 13.366 19.696 ( 23.887 2.489 -9.220) 25.725 ======================= Grid point 198 (107/205) ======================= q-point: ( 0.00 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.587 ( 9.001 -6.039 6.225) 12.500 2.587 ( 9.001 6.039 6.225) 12.500 3.091 ( 3.927 -10.231 9.906) 14.773 3.091 ( 3.927 10.231 9.906) 14.773 4.539 ( -3.978 -5.679 13.868) 15.505 4.539 ( -3.978 5.679 13.868) 15.505 4.844 ( -4.702 -9.207 3.680) 10.974 4.844 ( -4.702 9.207 3.680) 10.974 5.495 ( -3.205 -5.197 0.454) 6.123 5.495 ( -3.205 5.197 0.454) 6.123 5.778 ( 7.994 -10.131 4.221) 13.578 5.778 ( 7.994 10.131 4.221) 13.578 6.507 ( 17.023 -4.830 -0.947) 17.720 6.507 ( 17.023 4.830 -0.947) 17.720 7.404 ( -10.216 -3.595 14.404) 18.021 7.404 ( -10.216 3.595 14.404) 18.021 8.097 ( 4.460 -13.045 8.221) 16.051 8.097 ( 4.460 13.045 8.221) 16.051 8.880 ( -2.966 -4.694 3.663) 6.652 8.880 ( -2.966 4.694 3.663) 6.652 9.099 ( 11.314 -2.282 -2.065) 11.725 9.099 ( 11.314 2.282 -2.065) 11.725 9.826 ( -16.435 -14.734 -10.662) 24.513 9.826 ( -16.435 14.734 -10.662) 24.513 10.429 ( 4.399 -10.089 5.247) 12.193 10.429 ( 4.399 10.089 5.247) 12.193 10.573 ( 3.194 -8.873 -13.008) 16.066 10.573 ( 3.194 8.873 -13.008) 16.066 11.292 ( 0.593 -1.731 -2.022) 2.727 11.292 ( 0.593 1.731 -2.022) 2.727 12.139 ( 1.751 -9.054 -10.207) 13.756 12.139 ( 1.751 9.054 -10.207) 13.756 12.632 ( -0.038 -6.701 0.506) 6.721 12.632 ( -0.038 6.701 0.506) 6.721 13.011 ( -14.397 -13.457 -7.956) 21.252 13.011 ( -14.397 13.457 -7.956) 21.252 13.435 ( 5.917 -4.863 11.216) 13.581 13.435 ( 5.917 4.863 11.216) 13.581 13.903 ( -1.271 -7.990 -2.466) 8.458 13.903 ( -1.271 7.990 -2.466) 8.458 16.217 ( -4.118 -3.100 -6.454) 8.259 16.217 ( -4.118 3.100 -6.454) 8.259 16.437 ( -5.779 -1.483 -9.171) 10.941 16.437 ( -5.779 1.483 -9.171) 10.941 17.635 ( 1.047 -18.314 11.578) 21.692 17.635 ( 1.047 18.314 11.578) 21.692 19.752 ( 6.567 -11.641 -8.529) 15.855 19.752 ( 6.567 11.641 -8.529) 15.855 ======================= Grid point 200 (108/205) ======================= q-point: ( 0.11 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.925 ( 19.811 -2.668 4.740) 20.544 2.925 ( 19.811 2.668 4.740) 20.544 3.264 ( 6.943 -7.010 5.291) 11.196 3.264 ( 6.943 7.010 5.291) 11.196 4.390 ( -17.779 -13.148 7.465) 23.338 4.390 ( -17.779 13.148 7.465) 23.338 4.990 ( 5.630 -2.366 8.854) 10.756 4.990 ( 5.630 2.366 8.854) 10.756 5.371 ( -5.684 -5.777 -2.092) 8.370 5.371 ( -5.684 5.777 -2.092) 8.370 6.056 ( 12.978 -7.233 7.120) 16.475 6.056 ( 12.978 7.233 7.120) 16.475 6.820 ( 15.666 -2.469 1.063) 15.895 6.820 ( 15.666 2.469 1.063) 15.895 7.328 ( -13.381 -3.944 14.451) 20.086 7.328 ( -13.381 3.944 14.451) 20.086 8.317 ( 8.489 -11.390 10.331) 17.564 8.317 ( 8.489 11.390 10.331) 17.564 8.804 ( -7.684 -6.269 -2.689) 10.274 8.804 ( -7.684 6.269 -2.689) 10.274 9.193 ( -3.444 -8.908 -3.300) 10.105 9.193 ( -3.444 8.908 -3.300) 10.105 9.546 ( 2.692 -1.751 -6.932) 7.639 9.546 ( 2.692 1.751 -6.932) 7.639 10.227 ( -10.746 -19.330 -9.206) 23.956 10.227 ( -10.746 19.330 -9.206) 23.956 10.761 ( 10.247 -0.948 1.319) 10.375 10.761 ( 10.247 0.948 1.319) 10.375 11.311 ( 1.596 -1.675 1.999) 3.058 11.311 ( 1.596 1.675 1.999) 3.058 12.034 ( 0.121 -11.258 -13.540) 17.610 12.034 ( 0.121 11.258 -13.540) 17.610 12.588 ( -9.098 -9.522 -1.997) 13.320 12.588 ( -9.098 9.522 -1.997) 13.320 12.736 ( -3.042 -13.559 -3.558) 14.345 12.736 ( -3.042 13.559 -3.558) 14.345 13.643 ( 4.530 -5.047 9.621) 11.771 13.643 ( 4.530 5.047 9.621) 11.771 13.842 ( -2.281 -12.017 -1.978) 12.390 13.842 ( -2.281 12.017 -1.978) 12.390 16.064 ( -5.211 -1.451 -5.406) 7.648 16.064 ( -5.211 1.451 -5.406) 7.648 16.273 ( -2.649 -5.277 -7.399) 9.466 16.273 ( -2.649 5.277 -7.399) 9.466 17.788 ( 3.266 -15.132 9.674) 18.255 17.788 ( 3.266 15.132 9.674) 18.255 19.721 ( 0.168 -15.503 -9.131) 17.993 19.721 ( 0.168 15.503 -9.131) 17.993 ======================= Grid point 202 (109/205) ======================= q-point: ( 0.22 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.273 ( 12.062 -14.091 0.801) 18.566 3.273 ( 12.062 14.091 0.801) 18.566 3.471 ( 6.838 -8.680 8.074) 13.685 3.471 ( 6.838 8.680 8.074) 13.685 4.186 ( -3.657 -8.001 -2.330) 9.101 4.186 ( -3.657 8.001 -2.330) 9.101 5.071 ( -5.566 -4.949 6.550) 9.919 5.071 ( -5.566 4.949 6.550) 9.919 5.318 ( 1.337 -3.382 -0.955) 3.760 5.318 ( 1.337 3.382 -0.955) 3.760 6.321 ( 9.839 -2.749 0.574) 10.232 6.321 ( 9.839 2.749 0.574) 10.232 7.019 ( -1.619 -5.863 8.771) 10.674 7.019 ( -1.619 5.863 8.771) 10.674 7.255 ( -2.644 -6.313 2.429) 7.262 7.255 ( -2.644 6.313 2.429) 7.262 8.436 ( -7.725 -8.270 -11.090) 15.845 8.436 ( -7.725 8.270 -11.090) 15.845 8.685 ( 3.459 -11.836 13.096) 17.987 8.685 ( 3.459 11.836 13.096) 17.987 9.059 ( -5.742 -8.335 0.181) 10.123 9.059 ( -5.742 8.335 0.181) 10.123 9.611 ( 4.085 -6.368 -6.827) 10.190 9.611 ( 4.085 6.368 -6.827) 10.190 10.007 ( -4.569 -11.026 -0.473) 11.945 10.007 ( -4.569 11.026 -0.473) 11.945 10.892 ( 4.009 -3.860 0.337) 5.575 10.892 ( 4.009 3.860 0.337) 5.575 11.395 ( 4.072 -3.501 4.267) 6.859 11.395 ( 4.072 3.501 4.267) 6.859 11.872 ( -3.001 -8.269 -12.813) 15.542 11.872 ( -3.001 8.269 -12.813) 15.542 12.379 ( -5.081 -9.983 -5.951) 12.684 12.379 ( -5.081 9.983 -5.951) 12.684 12.754 ( 0.983 -11.569 3.883) 12.243 12.754 ( 0.983 11.569 3.883) 12.243 13.756 ( 0.904 -7.998 1.041) 8.115 13.756 ( 0.904 7.998 1.041) 8.115 13.813 ( -1.227 -3.989 3.809) 5.650 13.813 ( -1.227 3.989 3.809) 5.650 15.948 ( -3.027 -2.334 -2.096) 4.359 15.948 ( -3.027 2.334 -2.096) 4.359 16.200 ( 0.393 -7.083 -2.436) 7.501 16.200 ( 0.393 7.083 -2.436) 7.501 17.935 ( 3.287 -11.001 7.086) 13.492 17.935 ( 3.287 11.001 7.086) 13.492 19.590 ( -3.355 -16.922 -9.846) 19.863 19.590 ( -3.355 16.922 -9.846) 19.863 ======================= Grid point 204 (110/205) ======================= q-point: ( 0.33 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.315 ( -15.031 -4.887 5.240) 16.651 3.315 ( -15.031 4.887 5.240) 16.651 3.546 ( 2.489 -5.087 1.522) 5.864 3.546 ( 2.489 5.087 1.522) 5.864 4.361 ( 28.281 -9.672 -13.113) 32.639 4.361 ( 28.281 9.672 -13.113) 32.639 4.989 ( -10.422 -4.767 8.002) 13.978 4.989 ( -10.422 4.767 8.002) 13.978 5.329 ( 0.975 -4.833 -2.861) 5.700 5.329 ( 0.975 4.833 -2.861) 5.700 6.356 ( -2.555 -2.127 -7.391) 8.104 6.356 ( -2.555 2.127 -7.391) 8.104 6.940 ( -16.628 -5.899 11.489) 21.055 6.940 ( -16.628 5.899 11.489) 21.055 7.255 ( 7.069 -9.720 -15.337) 19.486 7.255 ( 7.069 9.720 -15.337) 19.486 8.166 ( -4.847 -9.980 -8.371) 13.899 8.166 ( -4.847 9.980 -8.371) 13.899 8.883 ( -2.707 -11.622 13.318) 17.882 8.883 ( -2.707 11.622 13.318) 17.882 8.988 ( -2.648 -3.340 -1.351) 4.471 8.988 ( -2.648 3.340 -1.351) 4.471 9.585 ( 3.643 -14.063 -0.972) 14.559 9.585 ( 3.643 14.063 -0.972) 14.559 10.044 ( -0.463 -5.460 10.272) 11.642 10.044 ( -0.463 5.460 10.272) 11.642 10.953 ( 3.579 -5.364 -0.353) 6.458 10.953 ( 3.579 5.364 -0.353) 6.458 11.531 ( 6.158 -3.832 2.727) 7.749 11.531 ( 6.158 3.832 2.727) 7.749 11.700 ( -2.089 -6.490 -8.814) 11.143 11.700 ( -2.089 6.490 -8.814) 11.143 12.313 ( 2.092 -5.731 -2.479) 6.585 12.313 ( 2.092 5.731 -2.479) 6.585 12.811 ( -0.134 -12.455 5.238) 13.512 12.811 ( -0.134 12.455 5.238) 13.512 13.750 ( -1.204 -11.169 -2.191) 11.445 13.750 ( -1.204 11.169 -2.191) 11.445 13.810 ( -2.593 -10.542 2.554) 11.153 13.810 ( -2.593 10.542 2.554) 11.153 15.918 ( -0.184 -2.413 1.939) 3.101 15.918 ( -0.184 2.413 1.939) 3.101 16.241 ( 3.142 -6.564 3.758) 8.190 16.241 ( 3.142 6.564 3.758) 8.190 18.042 ( 1.448 -5.473 5.001) 7.554 18.042 ( 1.448 5.473 5.001) 7.554 19.422 ( -2.808 -16.391 -10.940) 19.906 19.422 ( -2.808 16.391 -10.940) 19.906 ======================= Grid point 206 (111/205) ======================= q-point: (-0.56 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.957 ( -24.002 -3.792 2.634) 24.442 2.957 ( -24.002 3.792 2.634) 24.442 3.637 ( 6.456 -8.387 -4.098) 11.349 3.637 ( 6.456 8.387 -4.098) 11.349 4.652 ( 9.985 -9.590 -14.694) 20.188 4.652 ( 9.985 9.590 -14.694) 20.188 4.963 ( 7.383 -8.604 2.949) 11.715 4.963 ( 7.383 8.604 2.949) 11.715 5.288 ( -2.001 -3.875 -2.089) 4.836 5.288 ( -2.001 3.875 -2.089) 4.836 6.118 ( -14.706 -3.092 -5.416) 15.974 6.118 ( -14.706 3.092 -5.416) 15.974 6.706 ( -12.698 -4.223 -1.249) 13.440 6.706 ( -12.698 4.223 -1.249) 13.440 7.160 ( 2.711 -8.896 -19.565) 21.663 7.160 ( 2.711 8.896 -19.565) 21.663 8.136 ( 4.790 -8.147 -0.557) 9.468 8.136 ( 4.790 8.147 -0.557) 9.468 8.833 ( -5.072 -7.809 -6.654) 11.445 8.833 ( -5.072 7.809 -6.654) 11.445 8.950 ( -5.901 -5.470 12.879) 15.186 8.950 ( -5.901 5.470 12.879) 15.186 9.717 ( 4.562 -14.237 3.808) 15.428 9.717 ( 4.562 14.237 3.808) 15.428 10.150 ( -1.937 -13.742 14.842) 20.320 10.150 ( -1.937 13.742 14.842) 20.320 11.027 ( 3.773 -6.413 1.559) 7.602 11.027 ( 3.773 6.413 1.559) 7.602 11.590 ( 4.933 -5.538 -6.468) 9.841 11.590 ( 4.933 5.538 -6.468) 9.841 11.733 ( 6.226 -6.751 4.676) 10.306 11.733 ( 6.226 6.751 4.676) 10.306 12.375 ( 4.859 -3.587 0.230) 6.045 12.375 ( 4.859 3.587 0.230) 6.045 12.856 ( -0.880 -14.304 6.189) 15.610 12.856 ( -0.880 14.304 6.189) 15.610 13.614 ( -7.392 -5.281 -6.864) 11.386 13.614 ( -7.392 5.281 -6.864) 11.386 13.831 ( 1.177 -14.902 2.729) 15.196 13.831 ( 1.177 14.902 2.729) 15.196 15.976 ( 2.249 -2.161 5.420) 6.253 15.976 ( 2.249 2.161 5.420) 6.253 16.371 ( 4.217 -4.878 7.533) 9.916 16.371 ( 4.217 4.878 7.533) 9.916 18.077 ( -2.787 -8.744 3.763) 9.919 18.077 ( -2.787 8.744 3.763) 9.919 19.290 ( 1.850 -13.966 -12.440) 18.794 19.290 ( 1.850 13.966 -12.440) 18.794 ======================= Grid point 208 (112/205) ======================= q-point: (-0.44 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.605 ( -14.666 -11.533 0.624) 18.668 2.605 ( -14.666 11.533 0.624) 18.668 3.620 ( -6.035 -15.495 -3.366) 16.966 3.620 ( -6.035 15.495 -3.366) 16.966 4.577 ( 3.146 -8.280 -10.537) 13.766 4.577 ( 3.146 8.280 -10.537) 13.766 4.977 ( -5.873 -9.306 -12.988) 17.023 4.977 ( -5.873 9.306 -12.988) 17.023 5.373 ( 9.094 -4.507 3.585) 10.764 5.373 ( 9.094 4.507 3.585) 10.764 5.811 ( -12.207 -11.093 -1.188) 16.536 5.811 ( -12.207 11.093 -1.188) 16.536 6.529 ( -2.826 -7.939 -4.377) 9.496 6.529 ( -2.826 7.939 -4.377) 9.496 6.997 ( 0.390 -8.349 -15.580) 17.681 6.997 ( 0.390 8.349 -15.580) 17.681 8.239 ( 4.902 -6.192 -1.042) 7.966 8.239 ( 4.902 6.192 -1.042) 7.966 8.689 ( -1.767 -12.373 -5.563) 13.680 8.689 ( -1.767 12.373 -5.563) 13.680 8.987 ( -5.522 -9.510 12.957) 16.995 8.987 ( -5.522 9.510 12.957) 16.995 9.756 ( -2.442 -10.064 1.707) 10.496 9.756 ( -2.442 10.064 1.707) 10.496 10.258 ( -0.409 -18.193 9.583) 20.567 10.258 ( -0.409 18.193 9.583) 20.567 11.106 ( 2.619 -6.977 1.918) 7.695 11.106 ( 2.619 6.977 1.918) 7.695 11.661 ( 1.830 -1.646 4.564) 5.185 11.661 ( 1.830 1.646 4.564) 5.185 11.906 ( 7.995 -3.402 2.182) 8.958 11.906 ( 7.995 3.402 2.182) 8.958 12.457 ( 6.173 -1.720 -3.061) 7.102 12.457 ( 6.173 1.720 -3.061) 7.102 12.918 ( -0.666 -15.458 7.183) 17.058 12.918 ( -0.666 15.458 7.183) 17.058 13.414 ( -5.093 -2.965 -5.553) 8.097 13.414 ( -5.093 2.965 -5.553) 8.097 13.882 ( 1.604 -12.152 1.452) 12.343 13.882 ( 1.604 12.152 1.452) 12.343 16.099 ( 3.941 -1.164 7.073) 8.180 16.099 ( 3.941 1.164 7.073) 8.180 16.521 ( 3.319 -2.462 7.414) 8.488 16.521 ( 3.319 2.462 7.414) 8.488 18.009 ( -8.513 -17.376 3.005) 19.582 18.009 ( -8.513 17.376 3.005) 19.582 19.252 ( 8.678 -10.426 -13.299) 18.997 19.252 ( 8.678 10.426 -13.299) 18.997 ======================= Grid point 210 (113/205) ======================= q-point: (-0.33 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.475 ( -1.630 -18.228 2.403) 18.458 2.475 ( -1.630 18.228 2.403) 18.458 3.348 ( -19.687 -18.929 -0.874) 27.325 3.348 ( -19.687 18.929 -0.874) 27.325 4.515 ( -8.163 -2.402 -5.397) 10.076 4.515 ( -8.163 2.402 -5.397) 10.076 4.788 ( 8.709 -10.619 -10.552) 17.319 4.788 ( 8.709 10.619 -10.552) 17.319 5.460 ( -1.465 -3.982 -0.126) 4.245 5.460 ( -1.465 3.982 -0.126) 4.245 5.697 ( -3.247 -9.939 2.853) 10.838 5.697 ( -3.247 9.939 2.853) 10.838 6.480 ( 1.692 -10.458 -8.885) 13.826 6.480 ( 1.692 10.458 -8.885) 13.826 6.936 ( 6.024 -6.364 -2.890) 9.227 6.936 ( 6.024 6.364 -2.890) 9.227 8.219 ( -4.026 -11.405 -3.566) 12.609 8.219 ( -4.026 11.405 -3.566) 12.609 8.712 ( 6.236 -9.212 0.250) 11.127 8.712 ( 6.236 9.212 0.250) 11.127 8.985 ( -6.895 -5.590 8.140) 12.043 8.985 ( -6.895 5.590 8.140) 12.043 9.723 ( -0.603 -4.954 0.343) 5.003 9.723 ( -0.603 4.954 0.343) 5.003 10.331 ( 0.802 -22.198 4.610) 22.686 10.331 ( 0.802 22.198 4.610) 22.686 11.147 ( 0.172 -6.504 -0.164) 6.508 11.147 ( 0.172 6.504 -0.164) 6.508 11.635 ( -10.350 -5.157 3.239) 12.009 11.635 ( -10.350 5.157 3.239) 12.009 12.048 ( 7.155 -2.077 -0.617) 7.476 12.048 ( 7.155 2.077 -0.617) 7.476 12.579 ( 8.902 -3.472 -1.379) 9.654 12.579 ( 8.902 3.472 -1.379) 9.654 12.915 ( -1.760 -11.716 -0.808) 11.875 12.915 ( -1.760 11.716 -0.808) 11.875 13.402 ( 1.935 -0.542 6.685) 6.981 13.402 ( 1.935 0.542 6.685) 6.981 13.906 ( 0.965 -7.628 -1.465) 7.827 13.906 ( 0.965 7.628 -1.465) 7.827 16.245 ( 4.299 -0.863 5.771) 7.248 16.245 ( 4.299 0.863 5.771) 7.248 16.629 ( 1.728 -1.295 4.662) 5.138 16.629 ( 1.728 1.295 4.662) 5.138 17.842 ( -12.564 -22.132 2.711) 25.594 17.842 ( -12.564 22.132 2.711) 25.594 19.330 ( 13.946 -6.614 -12.370) 19.780 19.330 ( 13.946 6.614 -12.370) 19.780 ======================= Grid point 212 (114/205) ======================= q-point: (-0.22 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.534 ( 1.578 -19.088 3.446) 19.460 2.534 ( 1.579 19.088 3.446) 19.460 2.993 ( -18.373 -18.801 5.800) 26.920 2.993 ( -18.373 18.801 5.800) 26.920 4.325 ( -7.294 -2.191 3.987) 8.596 4.325 ( -7.294 2.191 3.987) 8.596 4.968 ( 14.867 -9.462 -5.792) 18.550 4.968 ( 14.867 9.462 -5.792) 18.550 5.369 ( -7.115 -3.204 -0.026) 7.803 5.369 ( -7.115 3.204 -0.026) 7.803 5.713 ( 0.552 -10.325 5.111) 11.534 5.713 ( 0.552 10.325 5.111) 11.534 6.361 ( -0.813 -10.966 -12.768) 16.850 6.361 ( -0.813 10.966 -12.768) 16.850 7.141 ( 9.758 -1.979 8.797) 13.286 7.141 ( 9.758 1.979 8.797) 13.286 8.090 ( -6.232 -15.491 -0.911) 16.722 8.090 ( -6.232 15.491 -0.911) 16.722 8.839 ( 4.224 -6.798 3.290) 8.653 8.839 ( 4.224 6.798 3.290) 8.653 8.921 ( -4.608 -0.817 2.173) 5.159 8.921 ( -4.608 0.817 2.173) 5.159 9.799 ( 9.374 -1.309 0.502) 9.478 9.799 ( 9.374 1.309 0.502) 9.478 10.369 ( -1.521 -25.405 1.936) 25.524 10.369 ( -1.521 25.405 1.936) 25.524 11.055 ( -9.041 -6.293 -4.671) 11.965 11.055 ( -9.041 6.293 -4.671) 11.965 11.439 ( -6.478 -8.842 -5.077) 12.080 11.439 ( -6.478 8.842 -5.077) 12.080 12.148 ( 5.010 -4.108 -2.238) 6.855 12.148 ( 5.010 4.108 -2.238) 6.855 12.647 ( 0.732 -4.273 -2.272) 4.894 12.647 ( 0.732 4.273 -2.272) 4.894 12.980 ( 6.889 -13.224 4.876) 15.688 12.980 ( 6.889 13.224 4.876) 15.688 13.481 ( -3.148 -4.957 4.924) 7.663 13.481 ( -3.148 4.957 4.924) 7.663 13.903 ( 1.822 -4.303 -2.508) 5.303 13.903 ( 1.822 4.303 -2.508) 5.303 16.341 ( 1.965 -3.469 0.648) 4.040 16.341 ( 1.965 3.469 0.648) 4.040 16.677 ( 0.270 -2.747 0.759) 2.863 16.677 ( 0.270 2.747 0.759) 2.863 17.644 ( -12.150 -23.444 4.705) 26.821 17.644 ( -12.150 23.444 4.705) 26.821 19.489 ( 15.614 -1.898 -10.170) 18.730 19.489 ( 15.614 1.898 -10.170) 18.730 ======================= Grid point 214 (115/205) ======================= q-point: (-0.11 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.509 ( -5.149 -4.473 4.150) 7.984 2.509 ( -5.149 4.473 4.150) 7.984 2.934 ( -0.460 -1.712 12.238) 12.366 2.934 ( -0.460 1.712 12.238) 12.366 4.365 ( 1.954 -2.043 11.872) 12.204 4.365 ( 1.954 2.043 11.872) 12.204 5.014 ( -8.395 -11.679 -0.993) 14.417 5.014 ( -8.395 11.679 -0.993) 14.417 5.371 ( 8.404 -8.175 2.846) 12.065 5.371 ( 8.404 8.175 2.846) 12.065 5.757 ( -2.562 -3.631 2.708) 5.204 5.757 ( -2.562 3.631 2.708) 5.204 6.298 ( 8.715 -6.354 -8.174) 13.534 6.298 ( 8.715 6.354 -8.174) 13.534 7.361 ( 0.295 -1.012 13.337) 13.379 7.361 ( 0.295 1.012 13.337) 13.379 8.016 ( -2.514 -15.718 3.817) 16.369 8.016 ( -2.514 15.718 3.817) 16.369 8.878 ( -3.105 -4.094 6.051) 7.939 8.878 ( -3.105 4.094 6.051) 7.939 8.950 ( 7.565 -5.074 -3.291) 9.685 8.950 ( 7.565 5.074 -3.291) 9.685 10.038 ( 9.824 -7.901 2.649) 12.883 10.038 ( 9.824 7.901 2.649) 12.883 10.273 ( -5.470 -21.357 -3.649) 22.346 10.273 ( -5.470 21.357 -3.649) 22.346 10.790 ( -8.565 -11.337 -10.439) 17.631 10.790 ( -8.565 11.337 -10.439) 17.631 11.330 ( -0.832 -6.035 -5.104) 7.948 11.330 ( -0.832 6.035 -5.104) 7.948 12.177 ( 2.971 -6.372 -5.906) 9.182 12.177 ( 2.971 6.372 -5.906) 9.182 12.633 ( 0.338 -6.275 -1.314) 6.420 12.633 ( 0.338 6.275 -1.314) 6.420 13.179 ( 5.119 -13.610 8.427) 16.807 13.179 ( 5.119 13.610 8.427) 16.807 13.352 ( -9.856 -7.399 -2.621) 12.600 13.352 ( -9.856 7.399 -2.621) 12.600 13.922 ( 1.494 -4.797 -1.501) 5.243 13.922 ( 1.494 4.797 -1.501) 5.243 16.324 ( -1.304 -4.913 -4.412) 6.731 16.324 ( -1.304 4.913 -4.412) 6.731 16.621 ( -4.189 -3.431 -5.941) 8.038 16.621 ( -4.189 3.431 -5.941) 8.038 17.552 ( -5.259 -21.750 9.908) 24.472 17.552 ( -5.259 21.750 9.908) 24.472 19.659 ( 12.838 -5.358 -8.598) 16.354 19.659 ( 12.838 5.358 -8.598) 16.354 ======================= Grid point 243 (116/205) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.058 ( -3.534 0.000 28.973) 29.188 2.098 ( 9.746 0.000 26.598) 28.327 3.277 ( -6.106 0.000 -4.531) 7.603 3.517 ( -5.750 0.000 19.296) 20.135 3.798 ( 18.255 0.000 2.227) 18.390 4.602 ( -7.918 0.000 22.433) 23.789 4.659 ( 9.705 0.000 5.587) 11.199 4.856 ( 6.882 0.000 -10.052) 12.182 4.912 ( 1.577 0.000 25.618) 25.666 5.614 ( 16.082 0.000 6.825) 17.471 5.638 ( -7.140 0.000 -8.286) 10.938 6.251 ( -9.961 0.000 8.267) 12.945 6.443 ( -0.491 0.000 -5.454) 5.476 6.745 ( 7.390 0.000 13.155) 15.089 6.830 ( -8.068 0.000 -1.581) 8.221 6.945 ( 4.224 0.000 -7.754) 8.830 7.767 ( 0.441 0.000 -4.780) 4.801 8.056 ( -16.128 0.000 -10.933) 19.484 8.578 ( -3.269 0.000 10.325) 10.831 8.661 ( 17.665 0.000 6.251) 18.739 9.052 ( 2.862 0.000 10.118) 10.515 9.487 ( 5.333 0.000 7.958) 9.579 9.761 ( 11.744 0.000 -10.509) 15.760 9.780 ( 5.897 0.000 -16.465) 17.489 10.158 ( -14.609 0.000 -2.804) 14.875 10.488 ( 5.277 0.000 -24.383) 24.947 10.781 ( -24.986 0.000 9.353) 26.679 11.225 ( 3.209 0.000 1.778) 3.669 11.730 ( 1.089 0.000 3.122) 3.307 11.766 ( 3.434 0.000 1.294) 3.669 12.023 ( -5.582 0.000 -2.709) 6.205 12.136 ( -4.253 0.000 -4.307) 6.053 12.424 ( -7.108 0.000 -6.657) 9.739 12.545 ( -2.986 0.000 2.738) 4.051 12.719 ( 10.273 0.000 0.014) 10.273 13.162 ( -4.819 0.000 -3.421) 5.910 13.448 ( -0.340 0.000 -4.360) 4.373 13.496 ( -5.180 0.000 -6.322) 8.173 14.824 ( -4.432 0.000 4.498) 6.315 15.192 ( 4.450 0.000 -5.460) 7.044 15.412 ( 5.709 0.000 14.168) 15.275 15.713 ( -7.815 0.000 -0.602) 7.838 16.479 ( -10.424 0.000 -5.906) 11.980 16.580 ( 3.132 0.000 -4.201) 5.240 17.055 ( -1.782 0.000 13.016) 13.138 18.024 ( 10.663 0.000 -9.191) 14.078 19.342 ( -10.344 0.000 11.711) 15.625 19.992 ( 36.564 0.000 -7.834) 37.394 ======================= Grid point 244 (117/205) ======================= q-point: ( 0.11 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.305 ( 3.046 0.000 20.037) 20.268 2.586 ( 12.007 0.000 27.907) 30.381 3.232 ( 7.829 0.000 -8.562) 11.602 3.466 ( -2.555 0.000 -6.600) 7.077 4.193 ( 17.397 0.000 -0.777) 17.415 4.604 ( -16.317 0.000 18.421) 24.609 4.682 ( -3.134 0.000 -13.691) 14.045 5.018 ( 10.301 0.000 10.552) 14.746 5.174 ( 1.742 0.000 18.424) 18.506 5.526 ( -2.501 0.000 8.653) 9.007 5.901 ( 11.741 0.000 -5.766) 13.081 6.141 ( -10.918 0.000 9.610) 14.545 6.299 ( -5.417 0.000 -7.217) 9.024 6.655 ( -4.024 0.000 -11.185) 11.887 7.002 ( 4.490 0.000 13.975) 14.679 7.063 ( 11.313 0.000 1.086) 11.365 7.667 ( -16.009 0.000 -8.658) 18.200 7.691 ( -4.040 0.000 -1.715) 4.389 8.550 ( -8.848 0.000 4.672) 10.006 8.927 ( 7.332 0.000 -1.563) 7.497 9.219 ( 2.258 0.000 8.442) 8.739 9.698 ( 5.867 0.000 -13.627) 14.836 9.701 ( -6.990 0.000 -4.294) 8.203 9.803 ( 13.216 0.000 12.624) 18.276 10.014 ( 6.218 0.000 -8.648) 10.651 10.263 ( -0.643 0.000 -22.325) 22.335 10.535 ( -14.389 0.000 13.906) 20.010 11.235 ( -5.866 0.000 0.795) 5.919 11.744 ( -3.660 0.000 -0.681) 3.723 11.819 ( 2.715 0.000 0.651) 2.792 11.971 ( 1.250 0.000 1.041) 1.627 12.111 ( 1.470 0.000 4.975) 5.188 12.282 ( -1.566 0.000 -6.257) 6.450 12.496 ( -1.528 0.000 0.431) 1.588 12.953 ( 8.593 0.000 6.317) 10.665 13.002 ( -6.701 0.000 -6.572) 9.386 13.354 ( -4.562 0.000 -3.280) 5.619 13.418 ( 0.684 0.000 -1.929) 2.047 14.799 ( -3.690 0.000 5.484) 6.610 15.209 ( 3.899 0.000 -6.274) 7.386 15.580 ( -6.177 0.000 -0.225) 6.181 15.650 ( 7.083 0.000 7.978) 10.668 16.282 ( -7.870 0.000 0.480) 7.885 16.589 ( 2.709 0.000 -4.151) 4.957 17.219 ( 2.847 0.000 16.689) 16.930 18.081 ( 10.005 0.000 -16.350) 19.168 19.154 ( -20.134 0.000 5.461) 20.861 20.318 ( 14.754 0.000 -15.974) 21.745 ======================= Grid point 245 (118/205) ======================= q-point: ( 0.22 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.569 ( 9.413 0.000 9.744) 13.548 2.991 ( -4.945 0.000 27.359) 27.803 3.340 ( 15.012 0.000 -14.237) 20.689 3.362 ( 7.577 0.000 -15.340) 17.109 4.232 ( -17.649 0.000 3.446) 17.982 4.378 ( -14.678 0.000 -11.546) 18.674 4.525 ( 8.429 0.000 -7.335) 11.174 5.305 ( 9.962 0.000 5.876) 11.566 5.316 ( 3.116 0.000 3.011) 4.333 5.670 ( -6.967 0.000 22.236) 23.302 5.914 ( 3.410 0.000 -13.517) 13.941 6.116 ( -4.077 0.000 14.954) 15.500 6.136 ( -1.898 0.000 -11.884) 12.034 6.467 ( -2.063 0.000 -15.891) 16.025 7.131 ( -3.982 0.000 5.105) 6.474 7.175 ( -0.280 0.000 -10.180) 10.184 7.347 ( -11.572 0.000 2.481) 11.835 7.757 ( 8.324 0.000 16.195) 18.209 8.338 ( -13.210 0.000 -5.555) 14.330 8.940 ( 1.249 0.000 -8.043) 8.139 9.200 ( -11.560 0.000 6.772) 13.398 9.659 ( 4.561 0.000 -11.132) 12.030 9.659 ( 6.444 0.000 -1.260) 6.566 9.838 ( -5.025 0.000 -17.672) 18.373 10.163 ( 9.848 0.000 7.855) 12.597 10.431 ( 18.666 0.000 16.065) 24.627 10.493 ( -1.332 0.000 2.815) 3.114 11.045 ( -12.782 0.000 -0.615) 12.797 11.656 ( -4.449 0.000 1.011) 4.562 11.917 ( 4.965 0.000 4.521) 6.716 11.991 ( -1.024 0.000 0.327) 1.075 12.078 ( -11.543 0.000 -0.873) 11.576 12.346 ( 12.332 0.000 1.304) 12.401 12.497 ( -1.035 0.000 2.130) 2.368 12.811 ( -5.512 0.000 -8.479) 10.113 13.132 ( 4.719 0.000 5.389) 7.164 13.300 ( -0.171 0.000 2.859) 2.864 13.442 ( 2.094 0.000 1.922) 2.843 14.805 ( -2.248 0.000 6.210) 6.605 15.200 ( 1.788 0.000 -6.027) 6.286 15.512 ( -1.049 0.000 1.167) 1.569 15.821 ( 4.860 0.000 4.732) 6.784 16.199 ( -5.123 0.000 5.537) 7.543 16.608 ( 2.293 0.000 -0.327) 2.316 17.453 ( 5.198 0.000 11.731) 12.831 18.055 ( 9.017 0.000 -22.740) 24.462 18.743 ( -25.931 0.000 -1.470) 25.973 20.270 ( 0.835 0.000 -18.600) 18.619 ======================= Grid point 246 (119/205) ======================= q-point: ( 0.33 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.848 ( -19.169 0.000 -0.484) 19.175 2.851 ( 15.216 0.000 2.430) 15.409 3.364 ( 3.085 0.000 -22.703) 22.912 3.453 ( 1.644 0.000 2.412) 2.919 3.893 ( -17.954 0.000 3.230) 18.242 4.031 ( -8.116 0.000 -6.494) 10.394 4.650 ( 11.832 0.000 -9.915) 15.438 5.378 ( 2.532 0.000 -1.011) 2.726 5.396 ( 1.438 0.000 -11.512) 11.601 5.641 ( -14.534 0.000 17.732) 22.928 5.866 ( 2.267 0.000 -5.575) 6.018 6.026 ( 1.950 0.000 -5.301) 5.648 6.063 ( -19.646 0.000 1.122) 19.678 6.226 ( -2.350 0.000 -24.461) 24.574 6.958 ( -5.254 0.000 -13.836) 14.800 7.114 ( 3.521 0.000 5.838) 6.818 7.315 ( -3.127 0.000 11.963) 12.365 8.033 ( -10.065 0.000 -9.018) 13.514 8.170 ( 12.439 0.000 17.081) 21.131 8.853 ( 0.833 0.000 -10.636) 10.668 9.071 ( -10.710 0.000 11.200) 15.497 9.477 ( -5.692 0.000 -17.966) 18.846 9.747 ( 2.760 0.000 2.022) 3.422 9.815 ( 6.859 0.000 4.357) 8.126 10.458 ( 5.442 0.000 16.282) 17.167 10.528 ( 12.781 0.000 -12.532) 17.899 10.748 ( -8.175 0.000 2.468) 8.539 10.948 ( 10.379 0.000 4.917) 11.484 11.631 ( -1.408 0.000 4.508) 4.723 11.800 ( -12.196 0.000 -5.132) 13.231 11.954 ( -3.234 0.000 1.996) 3.800 12.075 ( 4.526 0.000 8.061) 9.245 12.465 ( -4.480 0.000 1.107) 4.614 12.578 ( 5.788 0.000 1.827) 6.069 12.657 ( -0.122 0.000 -3.540) 3.542 13.252 ( 2.784 0.000 5.457) 6.126 13.418 ( 6.359 0.000 8.554) 10.658 13.521 ( 2.350 0.000 4.870) 5.408 14.842 ( -1.030 0.000 6.890) 6.967 15.160 ( 0.438 0.000 -4.690) 4.710 15.573 ( 4.913 0.000 3.083) 5.801 15.932 ( 2.393 0.000 4.387) 4.997 16.198 ( -2.913 0.000 8.565) 9.047 16.668 ( 2.488 0.000 3.152) 4.016 17.521 ( -7.914 0.000 -3.352) 8.595 17.941 ( 6.860 0.000 -28.346) 29.164 18.322 ( -13.158 0.000 0.256) 13.161 20.011 ( -6.695 0.000 -20.502) 21.567 ======================= Grid point 247 (120/205) ======================= q-point: (-0.56 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.438 ( -20.113 0.000 -4.968) 20.717 2.951 ( -20.215 0.000 -16.619) 26.169 3.194 ( 21.798 0.000 -2.825) 21.980 3.391 ( -12.132 0.000 8.965) 15.085 3.727 ( -2.553 0.000 -1.943) 3.208 3.993 ( 9.069 0.000 -10.814) 14.113 4.602 ( -10.543 0.000 -7.190) 12.761 5.199 ( -5.890 0.000 -15.219) 16.319 5.305 ( -24.846 0.000 -4.660) 25.279 5.486 ( -0.431 0.000 -3.180) 3.209 5.768 ( -7.930 0.000 18.115) 19.775 5.770 ( -8.404 0.000 -4.434) 9.502 5.917 ( 6.378 0.000 -33.514) 34.116 6.151 ( 4.824 0.000 9.732) 10.862 6.806 ( 4.920 0.000 -13.175) 14.064 7.099 ( -7.652 0.000 -2.088) 7.932 7.610 ( 16.684 0.000 12.963) 21.128 7.851 ( -1.928 0.000 -3.222) 3.754 8.358 ( -1.708 0.000 -3.036) 3.483 8.790 ( 0.616 0.000 -10.192) 10.211 9.056 ( -8.210 0.000 18.300) 20.058 9.305 ( 1.949 0.000 0.049) 1.949 9.844 ( 1.598 0.000 7.339) 7.511 9.932 ( -1.547 0.000 6.806) 6.980 10.529 ( -14.228 0.000 -2.071) 14.378 10.606 ( 13.004 0.000 -8.052) 15.295 10.760 ( 13.492 0.000 -1.032) 13.531 11.054 ( 3.121 0.000 -10.874) 11.313 11.665 ( 0.850 0.000 0.962) 1.284 11.667 ( -1.573 0.000 3.020) 3.405 11.970 ( -1.492 0.000 12.062) 12.154 12.170 ( -0.601 0.000 1.816) 1.913 12.374 ( -5.645 0.000 0.424) 5.661 12.613 ( 7.030 0.000 0.323) 7.038 12.776 ( 3.049 0.000 7.129) 7.754 13.325 ( -0.896 0.000 3.765) 3.870 13.627 ( 2.425 0.000 8.282) 8.630 13.662 ( 8.117 0.000 10.733) 13.457 14.908 ( -0.321 0.000 8.400) 8.407 15.146 ( 2.236 0.000 -1.789) 2.864 15.724 ( 7.070 0.000 3.777) 8.016 15.974 ( -3.930 0.000 3.632) 5.351 16.274 ( 0.764 0.000 10.933) 10.960 16.748 ( 2.480 0.000 2.922) 3.833 17.111 ( -19.430 0.000 -14.530) 24.262 17.714 ( 2.319 0.000 -33.643) 33.723 18.336 ( 5.973 0.000 6.580) 8.887 19.632 ( -10.892 0.000 -22.105) 24.643 ======================= Grid point 248 (121/205) ======================= q-point: (-0.44 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.110 ( -14.242 0.000 3.175) 14.592 2.396 ( -25.062 0.000 -7.094) 26.047 3.249 ( -9.505 0.000 -0.970) 9.554 3.616 ( 27.174 0.000 -3.481) 27.397 3.699 ( -8.051 0.000 12.471) 14.844 4.039 ( 8.497 0.000 -12.043) 14.739 4.156 ( -25.240 0.000 -4.280) 25.601 4.769 ( -19.506 0.000 -4.032) 19.919 4.886 ( -14.614 0.000 -10.023) 17.720 5.533 ( -8.267 0.000 -5.307) 9.824 5.584 ( 7.773 0.000 0.730) 7.807 5.824 ( 12.288 0.000 -22.192) 25.367 5.905 ( -2.399 0.000 19.364) 19.512 6.357 ( 8.610 0.000 7.090) 11.154 6.875 ( 14.334 0.000 -8.849) 16.846 6.901 ( -5.941 0.000 -9.749) 11.417 7.842 ( 5.049 0.000 1.196) 5.189 8.078 ( 16.136 0.000 11.834) 20.010 8.164 ( -8.188 0.000 -12.168) 14.666 8.586 ( -5.600 0.000 -15.283) 16.276 9.115 ( -8.374 0.000 21.837) 23.388 9.508 ( 8.648 0.000 10.235) 13.399 9.877 ( -8.996 0.000 1.141) 9.068 9.908 ( -7.723 0.000 9.522) 12.261 10.217 ( -7.711 0.000 -10.947) 13.389 10.784 ( 15.117 0.000 -9.930) 18.087 10.950 ( 11.242 0.000 -5.592) 12.556 11.012 ( 5.543 0.000 -9.028) 10.594 11.648 ( -3.064 0.000 -1.427) 3.380 11.687 ( 2.566 0.000 -0.217) 2.575 12.100 ( 0.130 0.000 8.715) 8.715 12.196 ( 3.434 0.000 2.060) 4.004 12.328 ( -1.052 0.000 7.451) 7.525 12.723 ( 3.864 0.000 -3.505) 5.217 12.959 ( 6.702 0.000 12.401) 14.097 13.286 ( -4.057 0.000 -1.084) 4.199 13.773 ( 2.057 0.000 10.963) 11.155 13.881 ( 5.071 0.000 7.522) 9.072 14.986 ( -1.650 0.000 8.860) 9.012 15.214 ( 4.607 0.000 2.288) 5.144 15.782 ( -18.390 0.000 -2.398) 18.545 15.899 ( 7.877 0.000 6.295) 10.084 16.458 ( 6.453 0.000 11.775) 13.427 16.712 ( -6.472 0.000 -5.594) 8.555 16.847 ( 2.676 0.000 -0.797) 2.793 17.324 ( -5.864 0.000 -37.332) 37.789 18.564 ( 9.327 0.000 9.251) 13.137 19.184 ( -13.347 0.000 -21.814) 25.573 ======================= Grid point 249 (122/205) ======================= q-point: (-0.33 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.923 ( -18.047 0.000 11.790) 21.557 1.963 ( -22.255 0.000 8.526) 23.833 2.986 ( -15.777 0.000 1.803) 15.880 3.616 ( -17.761 0.000 24.565) 30.313 3.975 ( 13.105 0.000 -12.985) 18.449 3.989 ( 8.077 0.000 -0.824) 8.119 4.157 ( 17.712 0.000 0.140) 17.712 4.508 ( -16.249 0.000 -4.378) 16.828 4.514 ( -12.599 0.000 8.965) 15.463 5.360 ( -8.490 0.000 -0.678) 8.517 5.778 ( 11.970 0.000 2.507) 12.230 5.900 ( 13.815 0.000 -9.078) 16.531 6.009 ( -5.199 0.000 13.896) 14.837 6.613 ( 17.695 0.000 -4.805) 18.335 6.713 ( -2.564 0.000 -11.970) 12.242 7.092 ( 11.667 0.000 1.678) 11.787 7.873 ( -8.842 0.000 -12.292) 15.141 8.000 ( 7.074 0.000 7.631) 10.405 8.361 ( -2.136 0.000 -13.482) 13.650 8.451 ( 12.707 0.000 8.861) 15.492 9.192 ( -5.739 0.000 19.034) 19.880 9.630 ( -14.768 0.000 -1.933) 14.894 9.632 ( -14.483 0.000 -7.222) 16.184 9.733 ( 2.819 0.000 3.577) 4.554 10.221 ( 12.387 0.000 -6.432) 13.958 10.878 ( 3.672 0.000 -7.461) 8.315 11.054 ( 8.530 0.000 -8.975) 12.382 11.058 ( 6.434 0.000 -4.988) 8.141 11.574 ( -1.862 0.000 -1.424) 2.344 11.791 ( 7.427 0.000 3.380) 8.160 12.121 ( -0.358 0.000 0.314) 0.476 12.310 ( 4.557 0.000 3.340) 5.650 12.441 ( 0.664 0.000 5.635) 5.674 12.718 ( 2.843 0.000 -7.453) 7.977 13.181 ( 3.748 0.000 9.438) 10.155 13.200 ( -1.132 0.000 -4.898) 5.027 13.872 ( -1.609 0.000 3.867) 4.189 13.984 ( 1.460 0.000 0.108) 1.464 14.982 ( -6.457 0.000 2.469) 6.913 15.287 ( 0.822 0.000 -2.392) 2.529 15.395 ( -20.144 0.000 4.501) 20.641 16.264 ( 21.221 0.000 19.128) 28.569 16.618 ( -1.814 0.000 -1.375) 2.276 16.705 ( 5.845 0.000 4.708) 7.505 16.775 ( -12.147 0.000 -24.446) 27.297 16.909 ( 3.722 0.000 -0.163) 3.725 18.742 ( -12.210 0.000 -16.589) 20.598 18.842 ( 8.498 0.000 12.748) 15.321 ======================= Grid point 250 (123/205) ======================= q-point: (-0.22 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.712 ( -20.400 0.000 22.869) 30.646 1.790 ( -15.653 0.000 24.625) 29.179 2.897 ( -9.924 0.000 27.995) 29.702 3.634 ( 1.158 0.000 5.069) 5.200 3.882 ( -14.572 0.000 -2.805) 14.839 4.227 ( 9.103 0.000 12.710) 15.634 4.269 ( 0.745 0.000 3.169) 3.255 4.470 ( -8.401 0.000 19.016) 20.789 4.565 ( 22.879 0.000 -11.323) 25.528 5.236 ( -4.472 0.000 2.516) 5.131 5.996 ( -6.375 0.000 4.915) 8.050 6.051 ( 12.351 0.000 4.888) 13.283 6.121 ( 13.164 0.000 2.486) 13.397 6.568 ( -2.556 0.000 -6.485) 6.970 6.847 ( 16.578 0.000 -12.578) 20.810 7.228 ( -4.067 0.000 4.361) 5.963 7.688 ( 1.329 0.000 -4.196) 4.401 8.231 ( 7.288 0.000 10.927) 13.134 8.244 ( 2.746 0.000 -10.234) 10.596 8.675 ( 1.192 0.000 6.250) 6.362 9.206 ( -13.187 0.000 -12.470) 18.149 9.347 ( 0.614 0.000 11.245) 11.262 9.389 ( -5.093 0.000 -3.255) 6.044 9.812 ( 4.635 0.000 -4.421) 6.405 10.401 ( 15.757 0.000 -10.939) 19.181 10.759 ( -10.256 0.000 -3.162) 10.732 11.093 ( 5.470 0.000 -7.202) 9.044 11.118 ( 4.669 0.000 -3.570) 5.877 11.581 ( 1.995 0.000 2.358) 3.089 11.993 ( 9.410 0.000 -0.536) 9.425 12.116 ( -2.866 0.000 5.966) 6.619 12.373 ( -0.193 0.000 -1.033) 1.051 12.377 ( -6.614 0.000 -5.304) 8.478 12.696 ( 3.543 0.000 -8.431) 9.145 13.103 ( -3.669 0.000 -12.203) 12.743 13.267 ( -1.405 0.000 3.997) 4.237 13.729 ( -10.123 0.000 -8.048) 12.932 13.903 ( -5.257 0.000 -9.410) 10.778 14.859 ( -6.006 0.000 3.148) 6.781 15.206 ( -1.563 0.000 -6.495) 6.681 15.217 ( -12.512 0.000 14.927) 19.477 16.188 ( -14.210 0.000 -15.049) 20.697 16.582 ( -0.514 0.000 -1.636) 1.715 16.832 ( 3.968 0.000 -0.174) 3.972 16.965 ( 1.315 0.000 1.955) 2.356 17.237 ( 37.169 0.000 28.496) 46.835 18.530 ( 5.452 0.000 -1.035) 5.549 19.112 ( 5.000 0.000 15.217) 16.017 ======================= Grid point 251 (124/205) ======================= q-point: (-0.11 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.751 ( -3.735 0.000 27.958) 28.206 1.861 ( -9.410 0.000 31.738) 33.104 3.170 ( -1.409 0.000 42.843) 42.866 3.535 ( -18.069 0.000 -1.054) 18.099 3.688 ( 6.037 0.000 -8.595) 10.503 4.423 ( 8.126 0.000 6.827) 10.613 4.481 ( -1.568 0.000 18.988) 19.053 4.617 ( 1.249 0.000 24.361) 24.393 4.786 ( 15.777 0.000 -14.461) 21.402 5.306 ( 7.567 0.000 6.970) 10.288 5.860 ( -7.811 0.000 -5.500) 9.553 6.270 ( 2.379 0.000 6.224) 6.664 6.368 ( 9.608 0.000 2.004) 9.815 6.537 ( 1.913 0.000 5.741) 6.051 6.935 ( 5.928 0.000 -10.562) 12.112 7.063 ( -11.565 0.000 -0.714) 11.587 7.760 ( 4.428 0.000 -1.634) 4.720 8.315 ( 13.134 0.000 -0.333) 13.138 8.448 ( -0.736 0.000 8.428) 8.460 8.492 ( -12.890 0.000 -6.983) 14.660 8.975 ( -4.585 0.000 5.768) 7.368 9.374 ( 2.569 0.000 1.836) 3.157 9.567 ( 14.104 0.000 -1.090) 14.146 9.820 ( 6.141 0.000 -12.639) 14.052 10.480 ( -17.530 0.000 -0.289) 17.533 10.529 ( 13.327 0.000 -17.618) 22.091 11.072 ( -5.756 0.000 -2.344) 6.215 11.160 ( 3.336 0.000 -1.566) 3.685 11.670 ( 3.963 0.000 3.235) 5.115 11.842 ( -14.793 0.000 -3.213) 15.138 12.155 ( -6.831 0.000 1.252) 6.945 12.284 ( -4.538 0.000 -6.055) 7.567 12.365 ( 10.113 0.000 6.802) 12.187 12.622 ( -3.304 0.000 -9.247) 9.819 12.814 ( -7.938 0.000 -13.764) 15.889 13.243 ( -2.736 0.000 0.080) 2.737 13.525 ( -3.438 0.000 -5.538) 6.518 13.678 ( -6.894 0.000 -8.921) 11.274 14.845 ( -2.496 0.000 4.800) 5.410 15.169 ( 3.134 0.000 -4.507) 5.489 15.221 ( -4.195 0.000 17.431) 17.929 15.887 ( -9.997 0.000 -3.380) 10.553 16.569 ( 1.435 0.000 -2.438) 2.829 16.733 ( -7.571 0.000 -8.305) 11.238 16.999 ( -1.738 0.000 6.148) 6.388 17.862 ( 14.991 0.000 -0.247) 14.993 19.158 ( 48.809 0.000 10.502) 49.926 19.305 ( -1.354 0.000 15.065) 15.126 ======================= Grid point 252 (125/205) ======================= q-point: ( 0.00 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.062 ( 4.290 4.720 24.567) 25.381 2.282 ( 5.821 11.936 26.991) 30.082 3.175 ( -4.055 -5.765 -2.739) 7.562 3.615 ( -1.339 2.594 -2.093) 3.592 3.895 ( 5.866 11.776 18.806) 22.951 4.618 ( -4.634 2.490 16.146) 16.982 4.782 ( 9.145 9.281 15.101) 19.945 4.902 ( 7.506 5.132 -10.336) 13.766 4.976 ( 1.729 5.822 19.976) 20.879 5.502 ( 2.379 -4.051 -3.011) 5.580 5.824 ( 6.885 11.557 3.111) 13.808 6.081 ( -12.363 -12.192 8.827) 19.478 6.479 ( 7.690 -10.878 3.115) 13.681 6.533 ( 1.901 0.925 -8.283) 8.549 6.998 ( -7.605 9.912 8.284) 14.990 7.169 ( 4.483 16.410 -1.582) 17.085 7.774 ( -0.617 1.002 -4.087) 4.252 8.146 ( -15.934 8.587 -12.294) 21.881 8.502 ( 9.220 -4.808 8.595) 13.491 8.742 ( 4.131 5.874 6.617) 9.765 9.080 ( 2.701 2.009 7.094) 7.852 9.480 ( 10.015 -13.521 -6.281) 17.961 9.560 ( 5.559 4.719 7.681) 10.591 9.938 ( -4.099 2.050 -15.016) 15.700 10.192 ( -1.937 4.326 -5.903) 7.570 10.381 ( -4.059 -10.036 -13.467) 17.279 10.716 ( -7.651 -3.774 5.441) 10.118 11.273 ( 0.153 2.982 -1.190) 3.214 11.616 ( 2.431 -7.457 2.580) 8.257 11.838 ( 0.734 -1.877 4.661) 5.078 11.947 ( -4.885 -11.686 -10.052) 16.170 12.068 ( -4.671 5.045 -2.478) 7.308 12.262 ( -3.619 -9.151 -2.782) 10.227 12.613 ( -3.105 -0.100 -8.838) 9.368 12.804 ( 2.748 6.446 5.936) 9.184 13.204 ( -1.110 3.350 -2.849) 4.535 13.382 ( -0.108 -4.314 -1.731) 4.650 13.508 ( -3.967 0.809 -5.665) 6.963 14.585 ( -5.071 -18.705 6.603) 20.474 14.862 ( 4.001 -20.378 2.357) 20.901 15.696 ( 3.054 15.153 2.760) 15.702 15.830 ( -7.150 8.052 -3.248) 11.248 16.443 ( -9.993 -3.025 -5.500) 11.800 16.559 ( 1.964 -2.556 -5.954) 6.770 17.113 ( -0.345 5.895 15.287) 16.388 18.075 ( 8.786 4.073 -9.082) 13.277 19.326 ( -9.317 -1.182 10.360) 13.983 19.980 ( 32.335 -1.543 -8.843) 33.558 ======================= Grid point 253 (126/205) ======================= q-point: ( 0.11 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.383 ( 5.363 6.810 19.752) 21.570 2.696 ( 11.006 10.060 22.148) 26.699 3.178 ( 9.847 -3.967 -7.307) 12.888 3.536 ( -0.966 4.636 -8.877) 10.061 4.166 ( 10.112 -1.174 2.732) 10.540 4.602 ( -15.908 1.155 14.781) 21.746 4.832 ( -1.789 11.262 -12.271) 16.751 5.066 ( 6.499 4.313 9.933) 12.629 5.252 ( 4.760 7.829 17.689) 19.922 5.479 ( 0.322 -4.104 6.633) 7.807 5.930 ( -4.442 -9.460 4.067) 11.215 6.036 ( 2.819 8.278 -0.303) 8.750 6.433 ( -1.764 3.709 -9.367) 10.228 6.570 ( 1.098 -3.097 -1.079) 3.458 7.041 ( 2.490 7.299 7.732) 10.921 7.265 ( 4.181 13.518 4.297) 14.788 7.703 ( -2.736 1.864 -0.890) 3.428 7.747 ( -15.441 7.746 -10.169) 20.046 8.581 ( -7.297 2.821 4.118) 8.841 8.899 ( 6.479 -2.822 -1.629) 7.253 9.208 ( 2.270 -1.370 8.463) 8.869 9.604 ( 8.605 -5.496 -10.361) 14.547 9.641 ( -8.943 -5.291 -3.728) 11.039 9.818 ( 10.232 1.406 10.287) 14.577 10.068 ( -1.044 -3.141 -6.840) 7.599 10.290 ( 8.178 7.110 -16.036) 19.355 10.568 ( -12.755 2.367 6.029) 14.305 11.237 ( -5.449 0.247 -0.245) 5.460 11.680 ( 0.459 -8.778 1.908) 8.995 11.782 ( -1.967 -4.133 -4.837) 6.659 11.957 ( 4.350 -8.557 4.842) 10.752 12.035 ( 3.637 3.659 1.011) 5.257 12.179 ( -4.672 -5.100 0.716) 6.954 12.467 ( -2.297 -6.812 -7.969) 10.733 12.875 ( -3.368 1.508 3.514) 5.095 13.178 ( 3.798 3.948 -2.794) 6.150 13.322 ( -4.315 -1.739 -1.173) 4.797 13.446 ( 0.069 4.943 -1.581) 5.190 14.568 ( -4.106 -18.300 7.127) 20.063 14.954 ( 5.686 -19.298 -2.081) 20.225 15.698 ( -5.307 8.434 -0.889) 10.005 15.794 ( 4.287 8.714 2.540) 10.038 16.248 ( -7.652 -3.063 0.293) 8.247 16.550 ( 2.592 -3.724 -4.180) 6.170 17.303 ( 3.258 7.731 16.561) 18.565 18.112 ( 8.771 2.583 -15.205) 17.742 19.154 ( -18.406 0.238 5.090) 19.099 20.254 ( 13.057 -6.251 -15.537) 21.236 ======================= Grid point 254 (127/205) ======================= q-point: ( 0.22 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.649 ( 8.170 6.844 8.709) 13.764 3.029 ( -0.695 4.100 15.942) 16.476 3.331 ( 12.588 1.127 -6.978) 14.437 3.449 ( 7.468 5.798 -13.606) 16.568 4.175 ( -14.926 -2.206 -3.312) 15.447 4.436 ( -4.745 -0.887 0.161) 4.830 4.643 ( -3.564 13.222 -8.234) 15.979 5.263 ( 5.121 -1.753 4.816) 7.245 5.378 ( 2.969 2.551 5.851) 7.039 5.668 ( -2.109 0.292 14.464) 14.620 5.885 ( -1.195 -8.365 -6.807) 10.851 5.995 ( -0.984 5.588 -5.108) 7.635 6.351 ( 2.029 8.104 -4.875) 9.673 6.508 ( -4.770 6.073 -3.998) 8.695 7.142 ( 3.848 1.225 -7.163) 8.223 7.246 ( -10.523 5.928 1.043) 12.123 7.410 ( -12.700 6.517 -0.495) 14.283 7.841 ( 10.887 8.446 15.579) 20.799 8.366 ( -13.134 2.267 -7.110) 15.106 8.911 ( 1.190 -2.798 -6.315) 7.009 9.201 ( -11.987 0.334 7.372) 14.076 9.583 ( 8.357 -6.727 -2.602) 11.039 9.660 ( 3.901 -1.193 -11.846) 12.528 9.817 ( -2.079 -0.786 -6.118) 6.509 10.244 ( -0.662 5.844 6.312) 8.627 10.387 ( 16.862 -2.999 11.734) 20.760 10.522 ( 6.244 1.824 -0.843) 6.559 11.060 ( -11.796 1.781 -0.714) 11.951 11.653 ( -2.056 -2.940 0.056) 3.588 11.787 ( 1.447 -8.192 2.548) 8.700 12.012 ( -10.113 -5.657 -1.652) 11.704 12.091 ( 4.654 5.090 0.951) 6.962 12.208 ( 7.671 -7.137 3.306) 10.987 12.406 ( 0.343 -11.276 1.094) 11.334 12.780 ( -5.454 1.127 -2.888) 6.273 13.224 ( -0.234 0.108 2.053) 2.069 13.314 ( 4.092 1.573 2.404) 5.000 13.436 ( -0.175 3.611 0.388) 3.636 14.575 ( -3.385 -16.786 6.558) 18.337 15.027 ( 5.515 -17.542 -3.382) 18.697 15.631 ( -2.025 10.331 1.730) 10.669 15.895 ( 3.627 4.846 3.324) 6.905 16.174 ( -4.100 -2.364 5.360) 7.151 16.575 ( 2.657 -3.216 0.008) 4.172 17.536 ( 5.157 7.469 11.673) 14.786 18.076 ( 7.294 1.909 -20.831) 22.154 18.783 ( -23.159 3.880 -1.287) 23.517 20.194 ( 0.461 -7.291 -17.932) 19.362 ======================= Grid point 255 (128/205) ======================= q-point: ( 0.33 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.796 ( -2.981 0.142 -3.645) 4.711 3.001 ( 0.781 9.685 2.208) 9.965 3.390 ( -2.081 1.871 -10.194) 10.571 3.512 ( 3.797 5.311 -6.212) 9.012 3.784 ( -14.543 -3.626 -0.670) 15.003 4.287 ( -7.839 15.738 -3.110) 17.855 4.680 ( 12.054 2.783 -8.575) 15.052 5.334 ( 2.348 -3.772 -1.031) 4.561 5.422 ( -2.918 2.416 -9.584) 10.305 5.625 ( -12.806 -0.869 11.702) 17.369 5.840 ( 4.921 -8.761 2.921) 10.464 5.923 ( -1.463 4.820 -8.931) 10.254 6.244 ( -2.760 2.499 -23.702) 23.993 6.300 ( -17.040 14.005 -0.298) 22.059 6.947 ( -5.993 -0.879 -13.491) 14.789 7.171 ( -1.089 3.682 1.888) 4.278 7.356 ( 1.032 5.320 11.743) 12.933 8.059 ( -8.667 2.294 -9.485) 13.052 8.237 ( 10.627 6.168 14.175) 18.759 8.868 ( 2.214 1.921 -5.965) 6.646 9.057 ( -11.134 -1.319 9.370) 14.612 9.461 ( -5.695 -2.070 -15.598) 16.734 9.739 ( 7.376 -5.521 2.016) 9.431 9.821 ( 1.351 5.580 5.249) 7.779 10.389 ( 1.503 -5.797 15.267) 16.400 10.579 ( 12.869 4.767 -11.333) 17.798 10.820 ( 0.165 5.140 0.794) 5.203 10.905 ( 5.974 -3.313 6.564) 9.473 11.632 ( -2.134 -2.466 1.280) 3.504 11.763 ( -8.604 -2.026 -5.991) 10.678 11.854 ( 1.342 -7.927 6.473) 10.321 12.174 ( 1.693 6.963 4.431) 8.425 12.315 ( -0.338 -7.181 0.766) 7.230 12.464 ( 1.244 -14.800 3.174) 15.188 12.688 ( -0.934 3.590 0.569) 3.753 13.302 ( 5.146 -2.789 4.725) 7.522 13.393 ( 1.093 4.418 2.348) 5.121 13.492 ( 3.493 -2.645 5.900) 7.349 14.561 ( -4.435 -18.142 4.347) 19.175 15.083 ( 3.999 -16.543 -3.209) 17.319 15.675 ( 3.066 12.466 5.542) 13.983 16.001 ( 3.052 4.467 5.945) 8.038 16.195 ( -1.384 -0.527 8.117) 8.251 16.645 ( 2.783 -2.313 3.513) 5.044 17.597 ( -8.624 6.760 -4.530) 11.857 17.977 ( 7.585 3.945 -21.142) 22.806 18.405 ( -11.919 7.377 -2.241) 14.195 19.943 ( -6.342 -6.508 -19.606) 21.610 ======================= Grid point 256 (129/205) ======================= q-point: (-0.56 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.504 ( -17.483 6.292 -3.698) 18.945 2.964 ( -20.183 1.509 -12.058) 23.559 3.239 ( 15.028 4.470 -3.923) 16.162 3.394 ( -12.372 0.311 11.745) 17.062 3.786 ( 12.095 5.686 -12.721) 18.451 4.169 ( -0.225 13.796 -6.739) 15.356 4.686 ( -5.399 7.152 -6.625) 11.145 5.118 ( -14.707 -3.340 -14.989) 21.263 5.324 ( -8.091 -1.195 -1.646) 8.343 5.536 ( -8.528 3.702 -0.763) 9.328 5.718 ( -4.094 0.404 2.057) 4.599 5.820 ( -13.833 2.197 -5.067) 14.895 6.018 ( 7.687 5.200 -19.567) 21.656 6.150 ( 4.425 3.027 7.343) 9.092 6.762 ( 0.627 -3.417 -11.532) 12.044 7.072 ( -6.588 -2.650 -5.374) 8.905 7.679 ( 16.017 6.199 11.932) 20.913 7.907 ( -0.282 5.187 -3.473) 6.249 8.360 ( -2.680 0.254 -4.226) 5.011 8.851 ( -0.306 5.641 -9.738) 11.258 9.007 ( -8.401 -3.881 14.289) 17.024 9.339 ( 3.341 2.248 4.904) 6.346 9.856 ( 1.215 -4.020 5.047) 6.566 9.909 ( -1.692 3.377 9.915) 10.610 10.453 ( -9.243 -5.856 3.484) 11.483 10.689 ( 11.771 6.175 -8.534) 15.796 10.805 ( 8.473 3.742 -4.968) 10.511 11.041 ( 3.010 -1.268 -6.533) 7.304 11.604 ( -0.140 -3.117 1.956) 3.682 11.693 ( 1.406 0.538 1.637) 2.224 11.987 ( 2.347 -1.272 12.208) 12.497 12.199 ( -2.783 3.071 -0.033) 4.145 12.270 ( -3.141 -6.391 0.506) 7.139 12.504 ( 3.662 -11.068 0.538) 11.671 12.768 ( 2.834 -0.028 8.471) 8.932 13.381 ( -1.363 3.558 0.140) 3.813 13.498 ( 5.176 -8.403 8.340) 12.921 13.662 ( 6.303 -1.848 9.208) 11.311 14.513 ( -4.606 -22.722 3.379) 23.429 15.084 ( -0.061 -19.137 -5.051) 19.793 15.852 ( 7.721 14.947 9.428) 19.285 16.130 ( 2.206 9.065 9.409) 13.250 16.276 ( 0.065 0.649 9.437) 9.459 16.734 ( 2.709 -1.637 3.645) 4.827 17.176 ( -19.721 6.885 -15.064) 25.754 17.849 ( 4.445 12.700 -29.718) 32.622 18.386 ( 4.709 4.203 6.200) 8.847 19.586 ( -9.887 -4.361 -20.922) 23.547 ======================= Grid point 257 (130/205) ======================= q-point: (-0.44 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( -17.485 6.221 6.244) 19.581 2.477 ( -20.592 9.194 -4.740) 23.044 3.276 ( -6.447 -0.130 6.582) 9.214 3.606 ( 22.279 1.124 -3.930) 22.651 3.797 ( -4.709 8.449 -6.962) 11.918 4.098 ( 2.688 9.303 -8.006) 12.565 4.427 ( -14.252 20.494 -0.061) 24.963 4.653 ( -18.287 -7.756 -6.107) 20.781 4.950 ( -17.550 3.882 -8.539) 19.899 5.502 ( -3.503 -1.960 -0.475) 4.042 5.626 ( 1.328 3.315 -2.438) 4.324 5.792 ( 4.799 -2.781 -1.084) 5.652 5.983 ( 3.632 6.659 -3.479) 8.345 6.375 ( 8.051 1.992 7.165) 10.960 6.750 ( 6.328 -7.730 -6.175) 11.744 6.924 ( 3.913 -1.345 -11.904) 12.602 7.920 ( 5.716 6.517 -0.415) 8.679 8.079 ( 6.704 -0.326 2.499) 7.162 8.200 ( 0.862 3.980 -2.308) 4.681 8.633 ( -5.991 4.418 -15.010) 16.755 9.048 ( -6.802 -4.907 18.591) 20.395 9.551 ( 5.998 2.162 8.862) 10.917 9.855 ( -7.334 -1.347 4.288) 8.601 9.943 ( -6.487 2.719 10.360) 12.523 10.205 ( -10.457 -1.311 -6.939) 12.618 10.849 ( 13.335 4.792 -8.813) 16.687 10.918 ( 9.275 -1.478 -6.560) 11.457 11.027 ( 5.075 0.994 -7.628) 9.216 11.644 ( 2.745 1.511 2.272) 3.870 11.742 ( 0.085 3.066 -0.520) 3.111 12.131 ( -0.152 2.992 7.933) 8.480 12.191 ( 1.074 -1.927 1.228) 2.524 12.230 ( 1.155 -7.569 4.835) 9.055 12.574 ( 3.420 -12.034 -2.696) 12.798 12.946 ( 4.453 -2.067 11.602) 12.598 13.309 ( -3.852 1.245 -2.815) 4.931 13.687 ( 3.741 -7.255 11.514) 14.114 13.860 ( 5.279 -2.310 6.847) 8.949 14.479 ( -4.288 -29.023 5.959) 29.938 14.956 ( -5.785 -24.543 -9.438) 26.924 16.136 ( 9.222 20.534 13.984) 26.500 16.176 ( -7.909 19.227 4.901) 21.360 16.408 ( 4.538 -3.607 10.171) 11.707 16.766 ( -6.454 5.462 -5.110) 9.879 16.825 ( 1.483 -2.219 -0.277) 2.683 17.555 ( 0.952 21.716 -35.546) 41.665 18.583 ( 6.860 1.205 8.677) 11.127 19.182 ( -10.693 -0.209 -20.097) 22.766 ======================= Grid point 258 (131/205) ======================= q-point: (-0.33 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.968 ( -17.826 3.924 12.824) 22.307 2.146 ( -21.847 16.135 9.483) 28.767 3.202 ( -5.407 17.672 -2.650) 18.670 3.500 ( -12.876 -7.092 10.753) 18.213 4.006 ( 15.638 4.675 3.848) 16.770 4.187 ( 3.832 7.706 -5.694) 10.319 4.275 ( 2.062 13.438 -0.169) 13.596 4.408 ( -7.593 -1.902 5.318) 9.463 4.613 ( -13.005 5.990 0.478) 14.326 5.373 ( -7.838 1.316 -0.018) 7.948 5.750 ( 9.759 -2.646 1.413) 10.210 5.880 ( 6.228 -2.051 1.349) 6.694 6.007 ( -1.848 0.206 2.324) 2.976 6.584 ( 13.938 -0.434 -6.190) 15.257 6.744 ( 3.615 1.165 -7.312) 8.240 7.076 ( 13.958 -1.852 0.920) 14.110 7.848 ( -8.416 -1.553 -9.347) 12.673 8.099 ( 8.314 7.588 4.285) 12.044 8.397 ( -3.173 3.930 -13.911) 14.800 8.498 ( 12.575 4.415 8.751) 15.944 9.116 ( -5.435 -5.592 16.450) 18.204 9.529 ( -10.802 -3.716 -5.323) 12.603 9.769 ( -13.952 6.575 -2.103) 15.567 9.808 ( -2.244 4.963 6.636) 8.585 10.157 ( 8.970 -5.352 -4.139) 11.235 10.915 ( 1.641 2.881 -7.463) 8.167 10.992 ( 6.057 -5.105 -7.573) 10.959 11.070 ( 6.709 1.353 -4.411) 8.143 11.661 ( -1.368 7.132 -4.135) 8.357 11.799 ( 7.213 1.172 3.642) 8.165 12.119 ( -0.972 -0.708 -0.358) 1.254 12.302 ( 3.983 -2.182 6.175) 7.666 12.355 ( 3.206 -7.530 3.553) 8.922 12.563 ( 0.965 -11.439 -7.106) 13.501 13.061 ( -3.442 -8.588 6.631) 11.383 13.265 ( 2.530 2.347 -1.418) 3.731 13.807 ( -1.462 -5.698 3.241) 6.717 13.952 ( 0.563 -3.554 -2.124) 4.178 14.450 ( -7.306 -31.343 8.413) 33.265 14.770 ( -4.516 -25.164 -1.119) 25.590 15.949 ( -13.877 27.141 -0.257) 30.484 16.501 ( 9.281 4.600 12.800) 16.466 16.604 ( 6.504 -2.641 9.289) 11.643 16.705 ( -1.434 2.125 0.557) 2.624 16.811 ( -2.794 1.160 -8.140) 8.684 17.315 ( 13.342 40.595 -19.959) 47.163 18.663 ( -7.819 -4.947 -3.127) 9.767 18.951 ( 4.512 7.384 0.082) 8.653 ======================= Grid point 259 (132/205) ======================= q-point: (-0.22 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.835 ( -21.942 8.253 19.411) 30.436 1.871 ( -14.047 11.325 21.408) 27.997 3.185 ( -6.002 24.732 22.358) 33.876 3.540 ( 3.605 -7.902 4.481) 9.773 3.892 ( -18.395 -0.605 0.231) 18.407 4.351 ( 7.653 10.422 10.976) 16.960 4.372 ( 3.255 8.536 5.282) 10.552 4.490 ( -6.124 3.383 17.647) 18.983 4.601 ( 19.673 4.793 -10.769) 22.934 5.268 ( -3.711 3.041 2.926) 5.620 5.921 ( -2.168 -6.623 3.706) 7.893 6.004 ( 8.163 -3.642 2.982) 9.423 6.061 ( 8.144 -4.358 3.929) 10.038 6.608 ( -0.065 1.449 -7.717) 7.852 6.891 ( 17.341 4.330 -8.658) 19.860 7.254 ( -2.105 2.501 4.779) 5.790 7.694 ( 1.101 0.401 -1.432) 1.850 8.245 ( 0.818 2.211 -10.757) 11.012 8.329 ( 9.393 6.721 7.236) 13.629 8.734 ( 3.148 5.458 5.918) 8.644 9.165 ( -5.297 -2.616 0.335) 5.917 9.266 ( -7.791 -4.674 0.444) 9.096 9.505 ( -5.707 7.965 -6.235) 11.614 9.850 ( 2.633 1.924 0.181) 3.266 10.320 ( 14.084 -6.811 -7.341) 17.281 10.765 ( -11.138 0.503 -4.227) 11.924 10.958 ( -1.134 -10.009 -6.703) 12.099 11.172 ( 7.571 1.893 -2.888) 8.321 11.608 ( -0.724 2.484 -1.742) 3.120 11.940 ( 4.042 -4.895 -3.338) 7.172 12.134 ( -0.260 1.702 5.856) 6.103 12.326 ( -2.388 -8.798 -5.374) 10.583 12.397 ( -1.184 0.641 -2.630) 2.954 12.502 ( 1.284 -9.401 -1.471) 9.602 13.051 ( -1.070 -9.469 -0.100) 9.530 13.257 ( -2.979 2.534 -3.251) 5.086 13.624 ( -10.394 -8.684 -9.277) 16.417 13.857 ( -3.685 -3.369 -8.076) 9.495 14.478 ( -0.399 -18.152 10.407) 20.927 14.768 ( -3.797 -25.068 9.889) 27.214 15.736 ( -8.858 25.619 0.365) 27.109 16.386 ( -14.156 9.380 -15.498) 22.991 16.580 ( -0.120 0.093 -1.098) 1.109 16.820 ( 2.556 -1.834 0.612) 3.205 16.868 ( 3.967 -4.068 6.647) 8.744 17.704 ( 27.897 33.405 1.899) 43.563 18.578 ( 10.344 5.026 4.243) 12.258 19.138 ( 5.136 2.613 11.034) 12.448 ======================= Grid point 260 (133/205) ======================= q-point: (-0.11 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.798 ( -5.412 6.022 24.588) 25.887 1.975 ( -4.816 9.943 29.967) 31.939 3.299 ( -10.776 6.972 16.598) 20.982 3.616 ( -2.560 0.579 6.917) 7.398 3.680 ( -1.521 9.671 6.448) 11.723 4.490 ( 3.118 4.750 9.778) 11.309 4.539 ( -0.365 5.875 15.792) 16.853 4.703 ( 3.784 8.466 21.500) 23.414 4.818 ( 16.529 3.406 -13.762) 21.776 5.345 ( 6.915 3.561 6.110) 9.891 5.840 ( -4.488 -0.479 -2.413) 5.118 6.163 ( -3.105 -8.530 7.784) 11.958 6.263 ( 10.859 -9.287 3.812) 14.788 6.547 ( 2.467 0.075 -6.149) 6.626 7.080 ( 9.503 11.328 -3.487) 15.192 7.129 ( -11.392 6.459 2.726) 13.376 7.779 ( 2.960 1.625 0.964) 3.512 8.253 ( 9.101 -2.706 -1.453) 9.605 8.548 ( -1.846 4.520 -2.538) 5.503 8.600 ( -6.854 12.192 -0.699) 14.004 9.007 ( -4.392 2.952 7.023) 8.794 9.357 ( 9.537 -11.317 -1.789) 14.907 9.456 ( 1.044 3.139 0.388) 3.331 9.934 ( 10.795 5.854 -8.018) 14.666 10.437 ( -6.239 -3.986 -7.936) 10.853 10.493 ( 0.842 -3.283 -8.379) 9.039 10.823 ( -9.557 -16.306 0.886) 18.921 11.260 ( 4.657 4.167 -2.772) 6.836 11.590 ( -1.277 -5.520 1.148) 5.781 11.854 ( -5.991 -3.898 -0.423) 7.160 12.137 ( -4.552 -2.566 -3.058) 6.055 12.179 ( -4.378 -3.749 -5.807) 8.182 12.351 ( 0.006 -9.601 -5.773) 11.203 12.573 ( 4.318 7.381 5.380) 10.103 12.908 ( -6.412 1.155 -12.437) 14.040 13.205 ( -0.310 -1.131 2.817) 3.051 13.438 ( -3.034 -6.253 -4.900) 8.504 13.675 ( -5.910 -0.632 -8.435) 10.319 14.575 ( -0.889 -16.255 7.999) 18.138 14.792 ( -2.310 -22.386 7.339) 23.671 15.653 ( -1.807 21.653 2.198) 21.839 16.040 ( -10.302 9.819 -8.167) 16.408 16.558 ( 0.643 -1.228 -3.619) 3.876 16.714 ( -7.220 -2.054 -8.604) 11.418 16.991 ( -0.116 0.674 10.947) 10.968 17.985 ( 9.285 9.195 -4.740) 13.900 19.236 ( 32.535 4.976 9.324) 34.209 19.323 ( 11.917 3.302 9.137) 15.375 ======================= Grid point 261 (134/205) ======================= q-point: ( 0.00 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.237 ( 7.812 11.359 16.457) 21.468 2.518 ( 7.984 10.477 23.614) 27.039 3.095 ( -2.734 -1.999 -7.327) 8.072 3.570 ( 4.545 -5.689 -5.773) 9.292 4.234 ( -11.898 18.314 21.992) 30.994 4.691 ( -2.002 4.055 11.108) 11.993 4.932 ( 7.253 4.808 13.432) 16.005 5.075 ( 6.966 8.684 8.280) 13.874 5.146 ( 7.717 10.916 -1.639) 13.468 5.486 ( -0.758 3.390 -0.846) 3.576 5.794 ( -15.232 -13.230 9.161) 22.158 6.124 ( 8.827 14.747 11.664) 20.771 6.229 ( 11.788 -10.435 -4.368) 16.338 6.565 ( 7.230 0.174 -4.454) 8.494 7.255 ( -7.347 14.643 11.334) 19.921 7.481 ( 1.509 12.238 5.578) 13.534 7.835 ( -0.910 5.805 -2.428) 6.358 8.367 ( -5.596 7.149 -9.246) 12.958 8.457 ( 3.314 5.912 1.881) 7.034 8.876 ( -2.033 7.141 2.893) 7.968 9.068 ( 1.888 -4.801 -2.494) 5.730 9.272 ( 12.695 -4.832 2.095) 13.744 9.580 ( 2.181 -5.954 9.291) 11.249 9.920 ( -15.654 -1.899 -11.619) 19.587 10.154 ( -10.464 -7.613 -6.337) 14.409 10.309 ( 12.409 4.665 -5.181) 14.234 10.653 ( 7.343 -3.061 0.782) 7.994 11.256 ( -1.504 -9.793 -5.165) 11.173 11.429 ( -3.594 -6.518 3.010) 8.028 11.634 ( -0.384 -14.980 -7.920) 16.949 11.749 ( 1.102 -4.932 2.858) 5.806 12.164 ( -1.820 -1.154 -4.404) 4.903 12.267 ( -1.257 10.364 -3.021) 10.869 12.543 ( -9.675 -2.950 -11.362) 15.212 12.884 ( 2.028 -0.835 1.874) 2.885 13.219 ( -3.851 -2.721 -8.278) 9.527 13.376 ( 0.938 4.930 7.252) 8.819 13.545 ( 0.901 2.982 -0.858) 3.231 14.172 ( -5.927 -20.012 7.228) 22.088 14.468 ( 3.118 -17.530 1.263) 17.850 15.921 ( -0.198 6.623 -2.267) 7.003 15.980 ( -6.259 6.486 -5.803) 10.720 16.371 ( -9.843 -3.751 -5.937) 12.091 16.469 ( 0.901 -5.921 -7.368) 9.495 17.299 ( 1.196 11.971 17.340) 21.105 18.139 ( 4.699 0.889 -5.462) 7.259 19.318 ( -6.009 1.224 5.110) 7.982 19.912 ( 23.027 -5.321 -10.310) 25.785 ======================= Grid point 262 (135/205) ======================= q-point: ( 0.11 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.553 ( 8.657 9.267 14.237) 19.066 2.944 ( 12.303 12.291 15.701) 23.430 3.108 ( 14.741 -2.150 -8.370) 17.088 3.558 ( 4.001 -3.767 -11.193) 12.469 4.210 ( -7.707 6.187 9.955) 14.027 4.656 ( -14.852 3.410 9.107) 17.752 5.028 ( -0.976 6.320 -0.067) 6.396 5.186 ( 1.042 6.796 -0.624) 6.904 5.377 ( -3.419 -4.771 4.282) 7.266 5.441 ( 5.113 5.087 14.574) 16.261 5.758 ( 3.501 -1.465 4.648) 6.001 6.261 ( -4.158 5.346 5.293) 8.595 6.407 ( 14.163 5.339 -10.890) 18.646 6.654 ( 5.201 6.644 0.183) 8.440 7.258 ( -4.775 12.214 7.746) 15.231 7.504 ( -7.070 7.661 7.350) 12.755 7.835 ( 4.803 12.640 1.357) 13.589 7.984 ( -13.335 15.196 -14.033) 24.610 8.651 ( -2.566 3.771 4.178) 6.185 8.820 ( 0.856 -4.523 -4.282) 6.287 9.148 ( 4.297 -4.490 8.790) 10.765 9.483 ( -3.839 -7.462 -12.789) 15.296 9.538 ( 5.381 -3.787 1.286) 6.705 9.851 ( 9.548 -2.449 12.481) 15.904 9.900 ( -8.999 -6.568 -4.296) 11.940 10.451 ( 12.436 3.998 -10.772) 16.931 10.621 ( -10.636 3.641 -3.454) 11.761 11.205 ( 1.388 -8.105 -4.036) 9.160 11.403 ( -1.668 -11.001 2.479) 11.400 11.616 ( 2.008 -8.481 -1.572) 8.856 11.831 ( 2.318 -7.256 6.715) 10.155 12.088 ( 0.501 1.890 -2.881) 3.481 12.202 ( -6.628 1.738 -7.155) 9.907 12.321 ( -2.046 -0.376 -1.370) 2.491 12.868 ( -5.662 -3.990 -1.164) 7.024 13.119 ( 2.873 -7.074 -4.281) 8.753 13.368 ( -5.035 6.731 3.231) 9.005 13.604 ( 1.907 7.765 -0.080) 7.996 14.187 ( -1.842 -16.749 9.462) 19.325 14.531 ( 4.210 -20.909 -1.635) 21.391 15.845 ( -3.501 5.516 -1.572) 6.720 15.934 ( 2.002 4.931 -0.648) 5.361 16.172 ( -7.320 -3.947 -0.533) 8.333 16.443 ( 2.445 -6.480 -3.944) 7.970 17.507 ( 3.347 11.439 15.449) 19.512 18.156 ( 5.500 0.803 -10.161) 11.582 19.181 ( -13.264 3.047 2.277) 13.799 20.069 ( 9.014 -11.417 -14.364) 20.443 ======================= Grid point 263 (136/205) ======================= q-point: ( 0.22 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.799 ( 6.618 7.119 4.927) 10.897 3.179 ( 10.601 10.383 -3.759) 15.308 3.388 ( 9.528 3.993 0.839) 10.365 3.544 ( 7.125 2.152 -5.483) 9.244 4.137 ( -9.692 -1.927 -3.605) 10.519 4.405 ( -10.682 -1.142 4.660) 11.710 4.920 ( -8.109 11.516 -2.463) 14.298 5.228 ( 1.082 -1.690 1.742) 2.657 5.378 ( 0.025 -2.216 11.626) 11.835 5.607 ( 0.467 -8.014 1.291) 8.130 5.864 ( 3.797 8.510 -7.877) 12.202 6.161 ( -4.564 8.484 -3.421) 10.223 6.485 ( 7.641 8.118 -13.334) 17.380 6.725 ( -2.500 12.833 7.885) 15.268 7.171 ( -3.316 1.804 -12.481) 13.040 7.378 ( -14.074 6.138 9.091) 17.844 7.635 ( -10.719 15.020 -6.901) 19.700 8.100 ( 12.326 16.039 12.637) 23.851 8.399 ( -12.548 0.237 -11.950) 17.329 8.860 ( 2.239 -0.550 1.078) 2.545 9.206 ( -12.139 -0.522 5.203) 13.217 9.400 ( 6.526 -10.459 1.035) 12.372 9.600 ( 3.550 -3.850 -11.874) 12.978 9.820 ( 1.805 -0.435 5.183) 5.505 10.219 ( 5.744 -7.673 12.485) 15.740 10.392 ( -1.157 -0.277 5.213) 5.347 10.579 ( 13.386 5.347 -11.164) 18.232 11.119 ( -7.021 3.188 -1.988) 7.963 11.439 ( 2.964 -14.514 -0.227) 14.815 11.636 ( 1.007 -6.954 0.042) 7.027 11.872 ( -6.166 -7.816 -2.068) 10.168 12.044 ( 3.660 -10.887 -3.260) 11.939 12.158 ( 2.398 1.607 6.622) 7.224 12.335 ( 0.004 7.461 3.899) 8.419 12.723 ( -6.000 -7.219 -2.513) 9.717 13.198 ( 4.375 -5.208 2.995) 7.433 13.319 ( -2.226 6.337 2.419) 7.139 13.588 ( -1.860 6.878 -1.522) 7.286 14.245 ( -2.611 -14.179 6.941) 16.001 14.590 ( 4.772 -23.062 -2.930) 23.732 15.813 ( -0.371 6.141 2.376) 6.595 15.990 ( 2.738 4.770 3.259) 6.393 16.107 ( -2.282 -3.937 4.631) 6.493 16.481 ( 3.380 -5.768 0.941) 6.751 17.723 ( 4.679 9.904 11.113) 15.604 18.119 ( 3.867 1.795 -13.912) 14.551 18.902 ( -16.360 7.714 -2.561) 18.267 19.983 ( -0.465 -12.850 -16.113) 20.615 ======================= Grid point 264 (137/205) ======================= q-point: ( 0.33 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.860 ( 0.663 6.066 -6.955) 9.253 3.241 ( -3.911 12.843 4.038) 14.019 3.432 ( -0.181 2.478 -6.782) 7.223 3.627 ( -4.618 4.879 -4.032) 7.835 3.761 ( -6.298 0.694 -5.058) 8.108 4.515 ( 10.472 3.422 -5.164) 12.168 4.760 ( -1.669 5.748 -4.388) 7.422 5.256 ( 1.177 -2.998 0.620) 3.280 5.435 ( -9.873 -3.138 4.037) 11.119 5.591 ( -3.691 -7.823 -1.185) 8.731 5.761 ( 4.817 8.772 -3.370) 10.560 6.065 ( -1.188 7.476 -9.450) 12.108 6.343 ( -6.139 7.769 -19.728) 22.073 6.623 ( -16.150 16.883 1.081) 23.388 6.933 ( -5.500 -0.157 -13.615) 14.685 7.204 ( -9.372 -0.545 -3.018) 9.861 7.562 ( 4.363 13.626 7.664) 16.231 8.116 ( -4.421 2.941 -9.857) 11.196 8.388 ( 4.940 7.792 5.924) 10.964 8.966 ( 6.048 8.487 6.187) 12.120 9.021 ( -11.410 -1.952 4.543) 12.436 9.351 ( -4.920 -8.907 -8.753) 13.423 9.641 ( 4.588 -3.068 4.018) 6.827 9.938 ( 2.724 3.714 5.928) 7.507 10.246 ( -2.720 -7.286 11.863) 14.185 10.697 ( 11.159 5.131 -8.854) 15.141 10.775 ( 15.313 -6.409 12.100) 20.542 10.970 ( -3.908 6.813 -5.404) 9.534 11.460 ( -0.336 -13.164 0.206) 13.170 11.674 ( 2.305 -6.562 0.720) 6.992 11.721 ( -0.763 -4.798 -4.549) 6.655 12.128 ( 1.372 -13.044 3.842) 13.667 12.255 ( 0.600 -0.040 6.021) 6.051 12.375 ( -0.949 10.293 3.622) 10.953 12.646 ( -1.388 -7.192 2.151) 7.634 13.284 ( 2.283 2.005 2.182) 3.740 13.375 ( 3.422 -2.781 4.872) 6.571 13.546 ( -0.851 4.575 0.252) 4.660 14.204 ( -7.372 -16.377 2.981) 18.206 14.633 ( 3.359 -23.987 -3.970) 24.544 15.879 ( 2.969 5.414 5.685) 8.393 16.096 ( 1.514 3.408 9.178) 9.907 16.181 ( 3.836 0.708 7.552) 8.499 16.574 ( 3.410 -4.499 4.377) 7.143 17.772 ( -8.092 9.849 -4.922) 13.665 18.092 ( 8.668 6.073 -6.696) 12.524 18.601 ( -9.679 11.479 -6.684) 16.436 19.755 ( -5.371 -11.539 -17.269) 21.453 ======================= Grid point 265 (138/205) ======================= q-point: (-0.56 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.676 ( -16.864 9.544 -0.668) 19.389 3.023 ( -12.273 3.985 -10.400) 16.573 3.298 ( -16.597 0.228 10.662) 19.728 3.484 ( 7.579 9.511 -1.282) 12.229 3.921 ( 21.913 6.425 -18.141) 29.164 4.438 ( -5.036 11.414 -8.899) 15.324 4.748 ( -1.856 -3.101 -9.547) 10.208 5.176 ( -11.254 5.397 -11.931) 17.266 5.282 ( -1.052 -1.027 2.416) 2.828 5.531 ( -3.577 -3.224 11.436) 12.408 5.851 ( -23.924 9.653 -8.686) 27.221 5.887 ( -4.201 5.798 -9.697) 12.054 6.012 ( 13.665 -0.704 -1.890) 13.813 6.382 ( -2.636 15.841 -7.940) 17.915 6.714 ( -6.692 -0.242 -6.962) 9.660 6.990 ( -3.969 -5.417 -12.680) 14.348 7.837 ( 13.198 8.539 8.046) 17.659 8.044 ( 2.921 7.544 -3.333) 8.749 8.373 ( -4.429 1.409 -5.592) 7.271 8.935 ( -6.573 -1.992 11.024) 12.988 8.970 ( -4.948 3.044 -11.706) 13.068 9.373 ( 6.803 2.296 10.397) 12.636 9.752 ( -0.798 -4.970 9.868) 11.078 10.019 ( -2.796 5.809 9.754) 11.692 10.299 ( -6.282 -8.756 7.512) 13.136 10.780 ( 4.491 0.202 -2.276) 5.039 10.912 ( 8.892 7.112 -12.480) 16.894 11.007 ( 3.521 -1.819 -0.066) 3.963 11.546 ( 7.317 -3.051 5.273) 9.521 11.692 ( 5.422 -1.277 -2.069) 5.942 11.843 ( 6.058 -9.395 8.713) 14.173 12.116 ( -4.741 -9.596 0.853) 10.737 12.314 ( -0.431 2.455 3.776) 4.524 12.360 ( -1.350 4.629 -0.149) 4.824 12.715 ( 2.559 -5.175 7.683) 9.610 13.363 ( 4.266 -2.247 2.869) 5.610 13.431 ( -1.647 -0.138 -0.292) 1.678 13.617 ( 4.955 -1.949 6.524) 8.421 14.071 ( -9.033 -20.669 2.398) 22.684 14.607 ( -0.548 -23.720 -7.073) 24.758 16.031 ( 5.975 3.073 7.910) 10.378 16.219 ( 1.216 -1.179 9.888) 10.032 16.384 ( 6.148 8.035 12.408) 16.010 16.677 ( 2.629 -3.753 4.533) 6.445 17.427 ( -17.135 17.484 -9.985) 26.438 18.171 ( 9.470 15.902 -18.551) 26.205 18.482 ( 0.376 5.326 2.440) 5.871 19.458 ( -6.953 -7.987 -18.091) 20.962 ======================= Grid point 266 (139/205) ======================= q-point: (-0.44 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.313 ( -23.198 5.863 7.995) 25.227 2.774 ( -9.280 17.494 -2.055) 19.910 3.178 ( -7.679 -8.108 9.756) 14.828 3.698 ( 15.999 7.271 -2.614) 17.767 4.051 ( 6.018 14.902 -17.361) 23.658 4.260 ( 1.597 1.445 -12.212) 12.400 4.501 ( -11.530 -2.560 -3.660) 12.365 4.858 ( -12.013 10.126 -8.773) 17.995 5.106 ( -18.936 17.519 2.608) 25.929 5.482 ( -3.854 0.680 2.144) 4.463 5.705 ( -1.196 2.876 4.052) 5.110 5.724 ( -1.436 -1.867 -0.034) 2.355 6.126 ( 4.560 5.074 -13.130) 14.797 6.452 ( 7.256 5.863 6.129) 11.162 6.624 ( 6.227 -2.560 -1.573) 6.914 6.850 ( 5.542 -5.256 -15.811) 17.560 8.053 ( -4.267 3.239 -5.296) 7.533 8.078 ( 8.840 3.458 -3.227) 10.026 8.318 ( 7.860 6.626 5.579) 11.697 8.735 ( -5.213 4.161 -13.145) 14.741 8.974 ( -4.694 -1.257 14.306) 15.109 9.551 ( 3.821 -1.303 0.413) 4.058 9.808 ( -6.768 -4.515 14.771) 16.863 10.024 ( -9.359 5.257 11.807) 15.957 10.145 ( -11.421 -4.762 -0.038) 12.374 10.834 ( 5.253 -3.896 -2.787) 7.109 10.995 ( 7.229 4.247 -9.444) 12.629 11.057 ( 8.757 2.566 -5.568) 10.689 11.732 ( 6.677 6.620 3.743) 10.120 11.776 ( 0.537 0.482 2.535) 2.636 12.023 ( 3.131 -8.515 4.014) 9.921 12.068 ( 1.746 -11.491 2.363) 11.861 12.254 ( -4.239 6.728 -0.835) 7.996 12.399 ( 3.983 -1.851 -1.053) 4.516 12.854 ( 1.450 -6.400 9.455) 11.509 13.312 ( -4.033 -1.369 -6.759) 7.989 13.537 ( 5.369 -6.023 10.420) 13.179 13.784 ( 5.037 -5.546 6.302) 9.790 13.962 ( -6.211 -20.518 3.598) 21.737 14.469 ( -4.119 -21.299 -10.307) 24.018 16.243 ( 7.078 0.337 8.729) 11.243 16.325 ( 0.992 -3.281 5.837) 6.769 16.592 ( 1.934 7.858 10.382) 13.163 16.756 ( 1.979 -3.859 2.620) 5.067 17.062 ( -14.013 25.294 -1.803) 28.973 18.093 ( 11.639 27.176 -27.477) 40.361 18.577 ( 0.182 -2.540 7.665) 8.076 19.173 ( -3.347 -0.931 -16.259) 16.626 ======================= Grid point 267 (140/205) ======================= q-point: (-0.33 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.082 ( -14.664 7.778 14.452) 22.009 2.552 ( -21.204 21.864 8.084) 31.512 3.208 ( 1.692 -12.145 5.860) 13.591 3.741 ( -2.723 22.739 -9.942) 24.967 4.003 ( -2.374 -7.359 4.175) 8.788 4.239 ( 8.076 3.102 -1.036) 8.713 4.470 ( 3.015 5.813 2.053) 6.863 4.592 ( -4.665 10.118 -4.757) 12.115 4.909 ( -8.689 24.569 6.590) 26.880 5.413 ( -6.243 2.543 1.705) 6.954 5.677 ( 2.692 -3.966 -0.018) 4.793 5.837 ( 0.093 -1.033 11.768) 11.813 6.025 ( -0.056 1.203 -10.503) 10.572 6.608 ( 7.567 0.281 -4.723) 8.925 6.754 ( 10.224 1.760 -5.669) 11.822 7.019 ( 19.186 -3.016 2.194) 19.545 7.834 ( -8.661 1.046 -5.927) 10.547 8.222 ( 9.041 3.503 -1.443) 9.803 8.526 ( -1.874 6.954 -10.560) 12.782 8.613 ( 11.519 6.315 6.574) 14.689 9.029 ( -4.925 -1.742 13.251) 14.244 9.490 ( -5.159 0.135 -7.665) 9.240 9.797 ( -10.339 -5.613 12.797) 17.383 9.890 ( -10.007 2.169 2.116) 10.456 10.063 ( 0.195 -2.223 2.933) 3.685 10.886 ( 2.202 -4.531 -6.000) 7.834 10.975 ( -0.522 2.742 -4.772) 5.528 11.116 ( 4.490 3.004 -8.269) 9.877 11.708 ( -0.878 -5.961 -3.244) 6.843 11.900 ( 2.563 5.607 -2.605) 6.692 12.062 ( 0.216 -5.618 1.782) 5.897 12.073 ( -2.939 -9.956 -0.400) 10.388 12.300 ( 6.782 0.903 5.831) 8.989 12.442 ( 2.662 0.132 -2.991) 4.007 12.883 ( -6.509 -6.839 6.590) 11.514 13.263 ( 4.132 -3.124 -1.873) 5.508 13.660 ( -3.425 -7.878 0.309) 8.596 13.846 ( 0.276 -5.420 -4.700) 7.179 13.991 ( 1.952 -14.875 14.401) 20.796 14.319 ( -2.119 -18.662 -4.501) 19.314 16.272 ( -5.554 3.788 -3.190) 7.441 16.478 ( 7.050 -4.982 4.687) 9.823 16.657 ( -1.161 2.480 3.554) 4.487 16.794 ( 1.565 -1.541 -0.021) 2.196 16.888 ( -11.386 21.817 7.601) 25.756 18.136 ( 20.451 32.664 -21.491) 44.125 18.560 ( -5.641 -4.031 4.504) 8.268 19.095 ( 6.513 5.893 -5.019) 10.117 ======================= Grid point 268 (141/205) ======================= q-point: (-0.22 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.026 ( -12.192 12.015 17.512) 24.488 2.233 ( -19.196 20.686 12.972) 31.058 3.340 ( 6.574 -11.073 3.545) 13.357 3.645 ( -14.726 6.446 6.800) 17.455 3.921 ( -2.441 13.373 11.132) 17.570 4.458 ( -5.210 2.218 13.426) 14.571 4.525 ( 16.881 4.010 -1.593) 17.423 4.700 ( 5.831 14.139 7.890) 17.209 4.865 ( 0.612 19.707 -0.669) 19.728 5.359 ( -1.220 5.927 3.774) 7.132 5.769 ( 2.152 -7.262 7.180) 10.437 5.935 ( 1.425 -2.533 3.162) 4.295 5.993 ( 4.052 -1.528 -0.843) 4.412 6.551 ( -0.345 -7.266 -11.024) 13.207 7.027 ( 18.435 8.466 -0.561) 20.294 7.323 ( 4.452 3.786 6.695) 8.887 7.708 ( -0.281 1.654 1.965) 2.584 8.285 ( 1.596 0.568 -8.725) 8.888 8.488 ( 7.643 8.063 -1.916) 11.274 8.864 ( 6.896 5.615 6.587) 11.067 9.070 ( -2.013 -5.674 6.853) 9.122 9.293 ( -9.718 8.206 -3.762) 13.264 9.650 ( -9.594 3.853 -2.887) 10.734 9.817 ( -0.166 -4.750 4.202) 6.344 10.174 ( 9.741 -6.429 -0.198) 11.673 10.748 ( -8.243 -4.788 -7.038) 11.849 10.793 ( -12.526 -0.986 -7.325) 14.544 11.171 ( 6.564 -1.621 -1.303) 6.886 11.651 ( -1.957 -2.434 -8.313) 8.881 11.788 ( -2.886 -10.251 -6.623) 12.541 11.937 ( -5.530 -18.197 -4.113) 19.458 12.161 ( 2.528 0.200 0.988) 2.722 12.434 ( 0.450 3.191 -1.295) 3.473 12.534 ( 8.785 8.094 7.530) 14.121 12.859 ( -1.183 -6.484 3.941) 7.679 13.308 ( 0.650 1.313 -3.599) 3.886 13.454 ( -8.536 -6.549 -7.084) 12.882 13.790 ( -1.616 -3.133 -6.876) 7.727 14.173 ( 0.177 -15.097 12.565) 19.643 14.307 ( 0.891 -17.783 2.958) 18.049 16.108 ( -5.994 9.589 -5.346) 12.508 16.508 ( -8.222 0.621 -8.474) 11.823 16.564 ( -1.261 -1.051 -5.137) 5.393 16.794 ( -1.194 -3.373 -3.867) 5.269 16.905 ( -0.663 14.370 18.423) 23.374 18.173 ( 0.567 7.400 -9.337) 11.928 18.803 ( 28.400 17.411 3.478) 33.493 19.215 ( 6.525 4.519 2.112) 8.213 ======================= Grid point 269 (142/205) ======================= q-point: (-0.11 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.009 ( -4.462 13.939 17.830) 23.067 2.241 ( -3.086 15.207 21.943) 26.875 3.321 ( -13.289 -3.965 -4.765) 14.664 3.508 ( 2.699 -7.103 3.958) 8.568 4.126 ( -2.527 25.338 26.410) 36.686 4.568 ( -0.375 3.225 14.672) 15.027 4.690 ( 1.715 6.637 9.585) 11.784 4.923 ( 5.628 11.243 11.000) 16.705 4.954 ( 14.102 10.369 -8.271) 19.359 5.442 ( 3.995 5.993 3.488) 8.002 5.881 ( 0.101 1.545 13.067) 13.159 5.983 ( -8.496 -5.828 6.594) 12.232 6.058 ( 11.697 -8.839 -6.334) 15.971 6.491 ( 5.800 -5.728 -7.379) 10.995 7.302 ( -0.185 10.844 3.425) 11.374 7.333 ( 2.994 11.599 7.050) 13.900 7.817 ( 2.012 2.038 6.618) 7.211 8.244 ( 5.362 1.289 -5.432) 7.741 8.633 ( 5.897 3.519 -3.876) 7.886 8.917 ( -7.016 16.032 -3.426) 17.832 9.049 ( 0.230 -2.046 0.847) 2.226 9.145 ( -1.436 -2.142 2.460) 3.564 9.518 ( -4.434 -1.103 4.504) 6.416 9.984 ( 14.993 -0.169 -1.508) 15.070 10.338 ( 8.157 -4.937 -10.213) 13.972 10.410 ( -19.207 -3.841 -5.252) 20.279 10.554 ( -5.801 -8.450 0.635) 10.269 11.265 ( 3.538 -4.669 -0.212) 5.862 11.500 ( -4.610 -3.717 -4.057) 7.178 11.732 ( 0.313 -7.667 -2.295) 8.010 11.783 ( -4.107 -19.676 -9.394) 22.187 12.181 ( 1.444 -1.013 -1.901) 2.594 12.378 ( -4.058 7.228 -3.591) 9.034 12.724 ( 4.439 6.932 -0.963) 8.288 12.851 ( -2.271 -4.226 -2.721) 5.515 13.241 ( 1.392 3.206 2.393) 4.236 13.342 ( -3.035 -1.738 -2.056) 4.057 13.647 ( -5.096 -2.380 -7.015) 8.992 14.216 ( -5.735 -19.920 7.533) 22.055 14.387 ( 2.893 -15.136 3.896) 15.895 15.977 ( -2.962 9.593 -3.896) 10.769 16.212 ( -10.352 6.759 -9.440) 15.555 16.507 ( 0.032 -3.871 -6.321) 7.412 16.643 ( -7.476 -4.566 -8.880) 12.474 17.103 ( 0.745 11.285 18.316) 21.527 18.119 ( 1.538 2.136 -3.350) 4.260 19.295 ( 4.541 2.816 5.159) 7.427 19.455 ( 31.352 6.514 -2.868) 32.149 ======================= Grid point 270 (143/205) ======================= q-point: ( 0.00 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.484 ( 9.864 11.697 7.340) 16.970 2.686 ( 6.908 4.813 11.006) 13.857 3.094 ( 0.498 2.482 -2.013) 3.234 3.412 ( 3.139 -9.264 -1.512) 9.897 4.564 ( -15.594 12.876 15.290) 25.352 4.767 ( -1.237 2.824 8.108) 8.675 4.982 ( 4.985 1.148 11.192) 12.305 5.189 ( 0.724 0.561 11.875) 11.910 5.344 ( 4.050 7.426 -5.652) 10.173 5.539 ( -16.259 -6.177 5.015) 18.101 5.672 ( 6.843 9.486 5.494) 12.922 6.037 ( 11.948 -7.855 -0.149) 14.299 6.409 ( 14.144 10.435 7.833) 19.243 6.560 ( 13.447 -0.034 0.175) 13.448 7.558 ( -9.455 13.182 15.235) 22.254 7.653 ( -5.328 5.609 10.619) 13.138 8.009 ( 5.549 10.082 1.515) 11.608 8.364 ( 8.722 -3.105 4.059) 10.109 8.719 ( -3.373 11.591 -7.594) 14.262 8.966 ( 3.465 -2.139 -3.858) 5.609 9.051 ( -9.608 6.818 -5.092) 12.835 9.246 ( 8.449 4.574 -2.658) 9.969 9.327 ( 0.182 -15.583 7.800) 17.427 9.818 ( -17.550 -8.150 -11.279) 22.397 10.144 ( -10.161 4.946 -4.194) 12.054 10.380 ( 12.461 1.679 -6.957) 14.370 10.574 ( 13.970 -4.260 2.472) 14.813 10.889 ( -6.742 -20.341 -3.210) 21.669 11.340 ( 1.459 -4.860 1.322) 5.243 11.402 ( 0.976 -6.224 3.369) 7.144 11.743 ( 0.346 4.206 -7.319) 8.448 12.079 ( 1.165 -7.748 -10.195) 12.858 12.466 ( 0.646 9.196 -2.847) 9.648 12.599 ( -13.459 7.647 -8.035) 17.441 12.802 ( 1.835 -5.136 0.855) 5.520 13.095 ( -10.754 -9.695 -9.595) 17.369 13.530 ( 0.492 8.083 8.542) 11.771 13.623 ( 6.809 4.790 5.479) 9.966 13.839 ( -2.675 -10.753 3.076) 11.500 14.139 ( 0.283 -14.856 -0.396) 14.864 16.018 ( -1.173 3.882 -4.611) 6.140 16.079 ( -6.366 2.918 -6.416) 9.498 16.298 ( -8.708 -3.180 -6.855) 11.530 16.338 ( -0.167 -6.149 -7.560) 9.746 17.578 ( 0.604 14.484 15.320) 21.091 18.077 ( 0.999 -7.099 2.676) 7.652 19.398 ( -0.608 6.560 -2.992) 7.236 19.764 ( 13.533 -8.804 -10.542) 19.282 ======================= Grid point 271 (144/205) ======================= q-point: ( 0.11 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.749 ( 12.187 9.651 3.166) 15.865 3.045 ( 22.850 -2.201 2.971) 23.147 3.186 ( 11.472 7.852 -0.723) 13.920 3.422 ( 3.445 -7.449 -6.875) 10.706 4.386 ( -19.290 9.784 12.328) 24.896 4.692 ( -16.583 -1.381 7.034) 18.066 5.097 ( 0.447 1.565 3.576) 3.929 5.257 ( -6.454 -1.421 3.519) 7.487 5.347 ( -4.774 1.984 3.465) 6.224 5.373 ( 1.260 -5.283 5.604) 7.804 5.925 ( 14.137 11.609 -0.094) 18.293 6.231 ( 7.199 -3.505 0.945) 8.062 6.664 ( 10.057 12.750 -2.260) 16.396 6.796 ( 11.338 6.303 -0.259) 12.975 7.481 ( -13.566 8.680 8.286) 18.111 7.607 ( -11.869 3.266 12.913) 17.840 8.163 ( 8.138 17.019 3.156) 19.127 8.312 ( -9.480 13.450 -12.470) 20.647 8.734 ( -7.529 -2.994 -6.980) 10.695 8.745 ( 4.451 5.245 2.989) 7.500 9.056 ( 2.942 -2.451 4.910) 6.226 9.318 ( -6.276 -8.687 -4.235) 11.523 9.436 ( 10.650 -6.207 -3.249) 12.748 9.630 ( 3.289 -10.554 3.686) 11.653 9.950 ( -6.380 4.592 1.695) 8.042 10.365 ( -2.163 -11.882 -8.946) 15.030 10.718 ( 1.765 4.390 -4.642) 6.629 10.917 ( 9.815 -11.437 1.111) 15.112 11.360 ( -1.035 0.911 2.571) 2.918 11.482 ( 2.405 -4.830 3.045) 6.196 11.696 ( 0.335 -3.163 -1.998) 3.757 11.963 ( -0.638 -10.578 -14.001) 17.559 12.299 ( -10.690 8.527 -1.876) 13.802 12.487 ( 1.421 10.369 0.690) 10.489 12.741 ( -9.861 -7.242 -2.136) 12.420 12.951 ( 3.362 -8.634 0.166) 9.267 13.552 ( -3.294 10.184 2.300) 10.948 13.718 ( 1.239 3.400 0.747) 3.695 13.929 ( 2.754 -8.178 8.385) 12.032 14.129 ( 0.869 -17.601 -2.126) 17.751 15.930 ( -3.396 3.056 -2.375) 5.149 16.001 ( 1.158 1.260 -1.291) 2.144 16.112 ( -5.686 -0.750 -1.962) 6.061 16.299 ( 2.020 -7.171 -3.279) 8.139 17.748 ( 2.432 11.633 12.595) 17.317 18.118 ( 2.223 -4.767 -1.014) 5.357 19.299 ( -6.375 8.574 -3.853) 11.358 19.804 ( 4.303 -13.900 -12.508) 19.187 ======================= Grid point 272 (145/205) ======================= q-point: ( 0.22 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.960 ( 9.538 9.259 -2.250) 13.481 3.366 ( 18.102 -0.044 -14.389) 23.124 3.445 ( 10.607 4.196 -6.203) 12.984 3.553 ( 14.280 1.560 11.466) 18.380 4.129 ( -17.249 2.169 2.767) 17.603 4.360 ( -21.133 -4.345 5.246) 22.204 5.097 ( -4.959 6.446 1.190) 8.219 5.211 ( -2.523 0.397 2.530) 3.595 5.312 ( 0.377 -3.691 4.549) 5.870 5.434 ( -2.293 -7.947 1.682) 8.441 6.087 ( 7.246 10.762 -8.997) 15.789 6.277 ( -0.624 2.254 -3.224) 3.983 6.716 ( 6.074 13.063 -16.380) 21.814 6.951 ( 7.386 6.524 -3.209) 10.364 7.250 ( -15.342 6.807 -0.464) 16.791 7.462 ( -18.068 1.079 10.015) 20.686 7.963 ( -9.538 15.059 -8.642) 19.809 8.306 ( -4.732 -2.762 -9.242) 10.744 8.521 ( 3.778 18.326 2.799) 18.919 8.943 ( 5.078 7.957 9.819) 13.620 9.146 ( -4.629 -6.466 -4.392) 9.084 9.206 ( -0.945 -5.679 7.310) 9.304 9.515 ( 2.284 -4.941 -0.351) 5.455 9.718 ( 3.465 -10.552 1.652) 11.229 10.071 ( 8.719 -4.086 8.329) 12.731 10.269 ( -0.003 -10.178 4.258) 11.033 10.728 ( 6.753 7.685 -7.218) 12.520 11.051 ( 3.650 -9.561 0.660) 10.255 11.330 ( -1.468 5.143 -5.651) 7.780 11.529 ( 1.512 -2.904 0.981) 3.418 11.701 ( -2.082 -8.048 -0.966) 8.369 11.813 ( 0.547 -10.432 -6.013) 12.053 12.218 ( -0.862 4.018 4.732) 6.267 12.484 ( -2.698 -3.312 0.259) 4.279 12.617 ( -2.660 6.949 3.131) 8.073 13.064 ( 3.922 -7.711 6.034) 10.548 13.516 ( -1.755 10.869 1.771) 11.151 13.699 ( -3.437 5.545 -1.555) 6.706 13.993 ( -0.858 -11.700 0.382) 11.738 14.149 ( 2.107 -18.229 -0.396) 18.354 15.892 ( -0.457 2.547 1.760) 3.130 16.022 ( -0.911 -4.113 3.356) 5.386 16.096 ( 3.394 5.447 4.214) 7.677 16.349 ( 3.905 -6.790 2.294) 8.162 17.917 ( 3.469 8.558 9.229) 13.056 18.129 ( 1.744 -1.239 -3.608) 4.195 19.101 ( -9.130 11.721 -6.332) 16.150 19.688 ( -1.842 -15.356 -13.528) 20.547 ======================= Grid point 273 (146/205) ======================= q-point: ( 0.33 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.034 ( 4.481 10.358 -8.435) 14.089 3.375 ( -10.553 -1.743 -1.753) 10.839 3.570 ( -0.882 9.376 2.464) 9.734 3.689 ( -17.701 1.102 4.068) 18.196 3.824 ( 12.466 7.727 -13.363) 19.841 4.408 ( 21.623 -11.816 -6.505) 25.485 4.925 ( -10.787 9.364 -3.854) 14.795 5.229 ( 0.687 0.556 2.648) 2.792 5.310 ( -10.781 -8.251 2.767) 13.855 5.409 ( 1.906 -8.059 2.802) 8.742 6.020 ( -0.716 11.977 -9.320) 15.193 6.179 ( -3.327 3.105 -9.161) 10.229 6.565 ( -2.584 13.138 -20.323) 24.338 6.942 ( -1.847 6.043 -9.303) 11.246 6.945 ( -12.570 6.734 -6.437) 15.646 7.147 ( -19.598 -4.375 -2.161) 20.196 7.858 ( 2.012 13.870 2.697) 14.273 8.152 ( -0.082 -0.279 -5.977) 5.985 8.580 ( -0.971 11.829 -2.709) 12.174 8.987 ( -7.981 -1.523 1.880) 8.339 9.128 ( -5.645 -5.121 -5.984) 9.690 9.217 ( 6.494 7.902 16.492) 19.406 9.580 ( -0.847 -3.362 8.695) 9.360 9.865 ( 9.449 -10.270 2.525) 14.182 10.180 ( -2.410 1.488 10.117) 10.506 10.548 ( 9.297 -13.289 13.907) 21.364 10.823 ( 10.329 5.258 -2.783) 11.920 11.079 ( 0.446 -0.798 -3.461) 3.580 11.249 ( 4.417 -0.924 -6.686) 8.066 11.557 ( 2.803 -6.914 -7.944) 10.898 11.632 ( 1.270 -0.876 2.582) 3.008 11.881 ( 2.886 -10.563 5.420) 12.218 12.293 ( 1.474 2.375 5.611) 6.269 12.474 ( -0.586 -7.874 3.254) 8.540 12.630 ( -1.133 14.371 5.177) 15.317 13.198 ( 2.645 -8.702 8.874) 12.707 13.508 ( -2.269 11.675 -1.938) 12.050 13.602 ( -2.070 1.641 -1.253) 2.924 13.901 ( -7.345 -12.360 -3.808) 14.873 14.178 ( 1.873 -19.403 -1.283) 19.536 15.944 ( 2.129 2.320 5.242) 6.115 16.071 ( 0.562 -3.413 6.925) 7.741 16.265 ( 6.631 4.898 9.126) 12.298 16.469 ( 4.215 -5.406 5.710) 8.921 17.978 ( -4.094 9.533 -0.407) 10.383 18.175 ( 6.048 1.262 2.512) 6.670 18.869 ( -6.330 14.428 -10.221) 18.781 19.485 ( -4.285 -14.392 -14.459) 20.846 ======================= Grid point 274 (147/205) ======================= q-point: (-0.56 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.858 ( -22.673 7.752 1.017) 23.983 3.068 ( -10.293 -1.261 -4.735) 11.399 3.360 ( -14.011 7.812 4.794) 16.743 3.659 ( 7.520 3.253 -1.501) 8.330 4.058 ( 23.088 9.373 -19.559) 31.678 4.600 ( 3.695 -6.887 -9.932) 12.638 4.667 ( -8.873 7.538 -11.357) 16.265 5.111 ( -3.520 -8.819 -12.479) 15.681 5.315 ( 1.304 1.934 8.869) 9.171 5.455 ( -1.899 -4.074 10.663) 11.572 5.950 ( -14.051 2.610 -3.925) 14.820 5.976 ( 1.984 1.714 -6.115) 6.653 6.240 ( -7.717 18.012 -15.020) 24.690 6.698 ( -7.023 12.866 -5.345) 15.602 6.758 ( -13.458 1.752 0.361) 13.576 6.854 ( 3.953 -5.764 -21.535) 22.641 8.001 ( 8.326 6.983 1.947) 11.040 8.165 ( 4.738 2.434 -1.985) 5.684 8.457 ( -5.206 7.808 -6.203) 11.249 8.890 ( -4.386 -7.915 -6.250) 10.997 8.987 ( -5.225 6.844 7.649) 11.517 9.463 ( 2.583 1.519 12.475) 12.830 9.632 ( -3.532 -3.964 8.658) 10.156 10.030 ( 3.860 -9.681 2.585) 10.738 10.221 ( -7.856 6.637 14.154) 17.495 10.679 ( -2.392 -9.506 5.221) 11.106 10.982 ( 4.611 0.820 1.045) 4.799 11.044 ( 6.099 3.272 -10.800) 12.828 11.471 ( 18.266 -2.779 4.593) 19.039 11.607 ( 11.257 -6.149 -2.369) 13.043 11.753 ( 4.506 1.069 7.056) 8.440 11.961 ( -1.042 -5.372 4.217) 6.908 12.354 ( 0.931 2.400 3.005) 3.957 12.457 ( -3.513 -1.312 -0.322) 3.764 12.704 ( 1.520 9.355 6.913) 11.730 13.347 ( 2.922 -5.190 8.645) 10.498 13.404 ( -2.513 -1.193 -1.793) 3.310 13.541 ( -7.076 -6.981 -6.725) 12.001 13.751 ( -2.478 -4.310 1.734) 5.266 14.174 ( 0.176 -18.220 -4.056) 18.666 16.068 ( 4.295 1.627 7.337) 8.656 16.170 ( 1.575 -2.926 7.845) 8.519 16.486 ( 5.933 2.537 10.057) 11.949 16.595 ( 2.866 -3.851 5.538) 7.329 17.825 ( -10.569 19.365 -0.483) 22.067 18.328 ( 5.926 -1.979 3.058) 6.956 18.692 ( 0.692 15.264 -13.651) 20.489 19.263 ( -2.615 -11.014 -15.429) 19.136 ======================= Grid point 275 (148/205) ======================= q-point: (-0.44 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.463 ( -20.866 9.000 7.078) 23.802 2.908 ( -6.363 -9.688 4.070) 12.285 3.216 ( -9.269 16.992 2.044) 19.463 3.796 ( 7.516 -2.487 -0.852) 7.963 4.192 ( 6.212 1.794 -12.231) 13.835 4.390 ( -1.063 14.653 -17.575) 22.907 4.486 ( -0.295 -2.309 -6.151) 6.577 4.865 ( -8.361 -5.252 -13.625) 16.827 5.411 ( -0.736 5.933 7.607) 9.675 5.546 ( -3.893 0.837 3.327) 5.189 5.705 ( -9.119 5.189 10.841) 15.087 5.840 ( -6.521 6.802 -4.275) 10.347 6.155 ( 5.397 2.268 -11.821) 13.191 6.555 ( -0.903 -2.158 -4.028) 4.658 6.675 ( 4.100 6.859 0.606) 8.014 6.776 ( 7.642 1.090 -13.243) 15.329 8.090 ( -2.532 3.337 -4.224) 5.949 8.198 ( 5.479 4.517 -5.956) 9.268 8.434 ( 6.676 5.073 3.672) 9.154 8.741 ( -0.998 -4.495 -9.891) 10.911 9.036 ( -4.043 7.977 13.301) 16.028 9.551 ( -1.337 -2.779 3.192) 4.439 9.629 ( -7.682 -6.995 11.144) 15.235 10.011 ( -8.609 -8.865 2.647) 12.637 10.180 ( -9.743 10.296 11.517) 18.264 10.694 ( 1.804 -10.590 1.459) 10.841 11.035 ( 2.567 1.434 -2.551) 3.893 11.101 ( 10.236 0.138 -8.034) 13.013 11.778 ( -1.765 0.080 1.362) 2.231 11.829 ( 4.494 -0.745 3.777) 5.918 11.875 ( 9.525 -3.235 3.995) 10.823 11.947 ( 2.170 1.225 1.670) 3.000 12.349 ( -1.950 3.579 -1.818) 4.462 12.464 ( 4.002 3.932 3.912) 6.840 12.766 ( 0.727 1.151 2.192) 2.580 13.217 ( -7.778 -9.322 -11.720) 16.875 13.456 ( 2.944 -2.498 7.269) 8.230 13.546 ( 2.684 -11.954 12.761) 17.691 13.778 ( 1.888 -0.368 -0.765) 2.070 14.100 ( -1.513 -14.801 -7.394) 16.614 16.234 ( 5.279 -0.379 7.019) 8.790 16.268 ( 1.376 -2.149 5.337) 5.915 16.642 ( 1.670 -0.043 5.170) 5.433 16.682 ( 2.032 -3.011 3.752) 5.223 17.623 ( -13.501 26.433 4.545) 30.027 18.398 ( -2.276 -8.102 1.534) 8.555 18.639 ( 10.186 17.984 -14.389) 25.183 19.123 ( 4.873 -4.564 -13.707) 15.247 ======================= Grid point 276 (149/205) ======================= q-point: (-0.33 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.298 ( -8.824 13.047 12.114) 19.871 2.917 ( -3.480 -13.639 5.258) 15.026 3.003 ( -15.602 19.474 8.314) 26.302 3.747 ( -15.229 -14.847 4.727) 21.787 4.185 ( 12.177 18.742 -12.527) 25.622 4.348 ( 6.989 6.251 -0.143) 9.378 4.513 ( -2.002 -0.578 0.975) 2.301 4.689 ( 10.279 -2.101 -11.685) 15.704 5.408 ( -8.660 15.782 6.265) 19.061 5.484 ( -2.757 6.080 3.634) 7.600 5.625 ( -7.469 1.055 7.866) 10.898 5.868 ( 1.466 2.968 7.956) 8.617 6.049 ( 0.195 2.504 -13.771) 13.998 6.492 ( -0.108 -10.486 -11.345) 15.449 6.867 ( 14.671 6.864 1.231) 16.244 6.984 ( 18.723 -0.258 4.667) 19.297 7.926 ( -7.080 8.349 -3.491) 11.490 8.248 ( 4.038 -1.311 -4.807) 6.413 8.615 ( 5.625 2.541 -1.848) 6.443 8.710 ( 8.447 1.516 -1.882) 8.786 9.061 ( -7.066 4.598 10.490) 13.458 9.500 ( -8.565 -7.718 5.553) 12.797 9.607 ( -2.377 -2.319 4.728) 5.777 9.864 ( -7.841 -4.500 2.857) 9.481 10.125 ( -7.266 9.166 7.940) 14.137 10.753 ( 2.885 -11.040 -1.440) 11.501 11.033 ( -0.885 3.039 -3.029) 4.381 11.171 ( 4.439 0.009 -8.269) 9.386 11.494 ( -14.111 -6.268 -6.319) 16.683 11.795 ( -11.229 -10.376 -5.618) 16.288 11.983 ( 1.874 0.662 -2.495) 3.190 12.076 ( 6.657 -0.868 -0.001) 6.713 12.423 ( 5.453 10.412 3.203) 12.182 12.538 ( 5.308 8.233 1.761) 9.952 12.805 ( -1.580 -1.341 2.696) 3.400 13.124 ( 6.161 -9.942 0.340) 11.701 13.541 ( -2.723 -2.831 1.545) 4.221 13.736 ( 2.948 -10.860 11.067) 15.783 13.780 ( 2.442 -0.613 -3.664) 4.445 14.006 ( 0.247 -11.900 -5.855) 13.264 16.292 ( -1.083 0.403 -0.910) 1.471 16.383 ( 4.196 -4.034 2.588) 6.370 16.664 ( -1.419 -0.021 0.300) 1.451 16.738 ( 1.032 -3.167 0.658) 3.395 17.435 ( -14.036 27.038 8.480) 31.623 18.277 ( -10.327 -11.831 0.468) 15.711 18.795 ( 20.953 19.500 -10.846) 30.609 19.165 ( 10.684 0.322 -8.128) 13.428 ======================= Grid point 277 (150/205) ======================= q-point: (-0.22 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.321 ( -4.916 16.047 12.397) 20.865 2.639 ( -19.350 16.113 8.136) 26.462 3.108 ( 5.620 -9.522 7.530) 13.377 3.493 ( -18.865 -13.394 8.262) 24.567 4.315 ( 6.119 16.072 8.278) 19.086 4.495 ( -4.058 1.134 13.210) 13.866 4.606 ( 19.376 5.633 -4.891) 20.763 4.886 ( 16.338 1.749 -6.501) 17.670 5.247 ( -12.205 14.251 5.668) 19.601 5.526 ( 0.737 7.475 3.743) 8.392 5.663 ( -1.092 0.488 14.459) 14.508 5.932 ( -2.662 2.843 1.730) 4.262 5.986 ( 5.327 -0.392 -3.110) 6.181 6.340 ( -0.819 -12.272 -13.031) 17.918 7.206 ( 16.851 8.086 5.695) 19.539 7.375 ( 12.984 0.398 9.599) 16.152 7.815 ( -3.038 9.846 1.415) 10.400 8.243 ( 1.188 -4.954 -4.318) 6.678 8.642 ( 4.863 6.939 -5.371) 10.033 8.905 ( 8.208 -2.110 2.837) 8.937 9.006 ( -7.045 0.759 5.439) 8.932 9.387 ( -13.434 -10.252 12.460) 20.996 9.665 ( 6.073 9.000 -1.384) 10.945 9.815 ( 0.443 2.813 -2.204) 3.601 10.102 ( 0.373 1.963 4.458) 4.885 10.682 ( -7.521 -5.142 -7.046) 11.517 10.807 ( -16.638 2.644 -8.534) 18.885 11.152 ( 1.606 -0.288 -2.196) 2.736 11.281 ( -3.952 -21.332 -5.898) 22.482 11.540 ( -6.087 -12.861 -7.416) 16.045 11.915 ( -1.423 6.996 -8.106) 10.802 12.140 ( 3.351 -2.280 -3.922) 5.640 12.497 ( 2.862 3.644 -0.288) 4.642 12.708 ( 3.275 -1.489 0.170) 3.602 12.845 ( 5.802 12.007 7.169) 15.141 13.295 ( 5.402 -2.776 4.930) 7.823 13.396 ( -8.040 1.005 -4.425) 9.233 13.695 ( -4.612 -8.892 -6.218) 11.790 13.871 ( 1.091 -8.614 3.261) 9.275 14.037 ( 3.991 -10.657 2.017) 11.557 16.218 ( -2.714 3.514 -5.584) 7.134 16.413 ( -0.131 -6.172 -4.134) 7.430 16.586 ( -4.756 1.692 -5.660) 7.584 16.712 ( -2.512 -4.196 -4.513) 6.655 17.340 ( -8.208 23.828 14.694) 29.173 18.109 ( -8.433 -10.580 2.632) 13.784 19.137 ( 25.021 12.562 -6.984) 28.856 19.297 ( 10.348 2.714 -4.734) 11.699 ======================= Grid point 278 (151/205) ======================= q-point: (-0.11 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.330 ( -3.712 16.256 10.251) 19.573 2.545 ( -3.870 12.456 12.362) 17.971 3.187 ( -5.658 -7.273 -1.117) 9.282 3.341 ( -1.676 -9.185 8.181) 12.414 4.550 ( 1.214 13.169 18.737) 22.934 4.625 ( 1.683 2.316 13.367) 13.671 4.810 ( 2.210 7.245 5.843) 9.566 5.082 ( 7.479 2.434 0.428) 7.877 5.204 ( 6.562 12.528 0.678) 14.159 5.586 ( 1.189 3.772 4.659) 6.112 5.755 ( -11.320 -3.891 10.911) 16.197 5.892 ( 1.961 -4.217 -0.350) 4.664 6.099 ( 10.326 6.342 2.596) 12.393 6.338 ( 11.450 -8.055 -4.314) 14.649 7.519 ( 6.339 8.976 9.499) 14.526 7.561 ( -2.099 9.805 11.257) 15.076 7.879 ( 4.099 5.329 6.677) 9.475 8.237 ( 3.516 -3.747 -2.732) 5.820 8.716 ( 8.131 5.495 -4.500) 10.796 8.943 ( -1.514 -0.495 -0.463) 1.659 9.048 ( 4.250 -4.039 3.649) 6.906 9.296 ( -9.301 -9.999 11.941) 18.140 9.493 ( -13.691 19.855 -12.184) 27.020 10.025 ( 20.141 3.930 -1.234) 20.558 10.248 ( 6.654 -4.624 -3.612) 8.872 10.338 ( -16.827 -4.022 -7.342) 18.794 10.468 ( -8.993 0.617 -3.941) 9.838 11.065 ( -7.280 -19.751 -2.817) 21.238 11.275 ( 5.373 -9.733 -2.680) 11.436 11.417 ( -2.749 -9.001 -2.236) 9.673 11.817 ( 0.332 8.178 -8.637) 11.899 12.134 ( 2.036 -4.059 -6.627) 8.034 12.502 ( -0.270 4.860 -3.101) 5.771 12.737 ( 3.027 -6.764 -1.861) 7.641 12.906 ( -5.982 11.254 -6.813) 14.452 13.329 ( -0.394 3.083 6.890) 7.558 13.361 ( -0.698 3.151 -0.185) 3.233 13.543 ( -3.557 -8.328 0.339) 9.062 13.881 ( -1.847 -8.811 0.451) 9.014 14.114 ( 1.891 -12.508 1.624) 12.754 16.106 ( -2.358 4.729 -6.328) 8.244 16.287 ( -6.937 -0.578 -7.692) 10.374 16.430 ( -2.377 -1.658 -8.234) 8.729 16.546 ( -7.684 -4.620 -8.715) 12.504 17.422 ( -2.022 18.070 17.139) 24.987 18.048 ( -2.716 -8.841 4.662) 10.357 19.381 ( 6.225 5.304 -3.546) 8.914 19.530 ( 21.661 0.507 -7.552) 22.945 ======================= Grid point 279 (152/205) ======================= q-point: ( 0.00 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.674 ( 8.513 -5.811 2.079) 10.515 2.674 ( 8.513 5.811 2.079) 10.515 3.217 ( 1.883 -8.854 2.956) 9.523 3.217 ( 1.883 8.854 2.956) 9.523 4.748 ( -6.437 -5.235 6.788) 10.720 4.748 ( -6.437 5.235 6.788) 10.720 5.076 ( -3.366 -8.099 16.330) 18.536 5.076 ( -3.366 8.099 16.330) 18.536 5.459 ( -5.562 -3.735 -1.831) 6.946 5.459 ( -5.562 3.735 -1.831) 6.946 5.874 ( 12.088 -8.727 1.377) 14.973 5.874 ( 12.088 8.727 1.377) 14.973 6.541 ( 15.953 -3.058 5.839) 17.261 6.541 ( 15.953 3.058 5.839) 17.261 7.713 ( -10.112 -1.257 14.405) 17.645 7.713 ( -10.112 1.257 14.405) 17.645 8.226 ( 9.726 -10.083 4.520) 14.721 8.226 ( 9.726 10.083 4.520) 14.721 8.922 ( -4.022 -8.205 -3.729) 9.869 8.922 ( -4.022 8.205 -3.729) 9.869 9.066 ( 6.317 -5.064 1.566) 8.246 9.066 ( 6.317 5.064 1.566) 8.246 9.561 ( -11.854 -17.338 -13.065) 24.735 9.561 ( -11.854 17.338 -13.065) 24.735 10.296 ( -4.804 -8.961 -9.783) 14.109 10.296 ( -4.804 8.961 -9.783) 14.109 10.587 ( 9.028 -7.551 5.884) 13.158 10.587 ( 9.028 7.551 5.884) 13.158 11.312 ( 1.618 -2.335 3.945) 4.861 11.312 ( 1.618 2.335 3.945) 4.861 11.891 ( 0.006 -9.241 -12.652) 15.667 11.891 ( 0.006 9.241 -12.652) 15.667 12.638 ( 2.299 -6.636 -1.280) 7.139 12.638 ( 2.299 6.636 -1.280) 7.139 12.854 ( -13.772 -11.850 -5.872) 19.093 12.854 ( -13.772 11.850 -5.872) 19.093 13.644 ( 4.910 -3.978 7.997) 10.193 13.644 ( 4.910 3.978 7.997) 10.193 13.860 ( -1.329 -11.600 -1.168) 11.734 13.860 ( -1.329 11.600 -1.168) 11.734 16.088 ( -3.473 -2.261 -5.747) 7.086 16.088 ( -3.473 2.261 -5.747) 7.086 16.261 ( -4.780 -0.469 -7.502) 8.908 16.261 ( -4.780 0.469 -7.502) 8.908 17.865 ( -0.190 -12.861 10.203) 16.418 17.865 ( -0.190 12.861 10.203) 16.418 19.570 ( 5.765 -9.572 -8.556) 14.074 19.570 ( 5.765 9.572 -8.556) 14.074 ======================= Grid point 281 (153/205) ======================= q-point: ( 0.11 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.937 ( 19.191 -8.080 -3.461) 21.108 2.937 ( 19.191 8.080 -3.461) 21.108 3.304 ( 7.327 -4.454 0.416) 8.585 3.304 ( 7.327 4.454 0.416) 8.585 4.581 ( -20.766 -8.524 10.104) 24.617 4.581 ( -20.766 8.524 10.104) 24.617 5.161 ( -0.841 -5.189 5.842) 7.859 5.161 ( -0.841 5.189 5.842) 7.859 5.357 ( -4.033 -1.116 1.816) 4.562 5.357 ( -4.033 1.116 1.816) 4.562 6.124 ( 12.904 -7.394 -1.759) 14.976 6.124 ( 12.904 7.394 -1.759) 14.976 6.839 ( 12.207 -3.323 0.074) 12.652 6.839 ( 12.207 3.323 0.074) 12.652 7.609 ( -15.439 -3.515 11.933) 19.827 7.609 ( -15.439 3.515 11.933) 19.827 8.416 ( 1.591 -4.274 -2.874) 5.391 8.416 ( 1.591 4.274 -2.874) 5.391 8.749 ( -2.305 -4.308 -0.417) 4.903 8.749 ( -2.305 4.308 -0.417) 4.903 9.133 ( -1.029 -7.842 0.296) 7.915 9.133 ( -1.029 7.842 0.296) 7.915 9.433 ( 5.867 -7.695 -5.298) 11.032 9.433 ( 5.867 7.695 -5.298) 11.032 10.095 ( -6.924 -10.721 -2.218) 12.954 10.095 ( -6.924 10.721 -2.218) 12.954 10.789 ( 7.826 -3.290 -0.089) 8.490 10.789 ( 7.826 3.290 -0.089) 8.490 11.394 ( 1.867 -3.139 5.516) 6.615 11.394 ( 1.867 3.139 5.516) 6.615 11.760 ( -0.528 -8.074 -12.046) 14.512 11.760 ( -0.528 8.074 -12.046) 14.512 12.493 ( -11.013 -9.395 -4.564) 15.178 12.493 ( -11.013 9.395 -4.564) 15.178 12.766 ( 2.094 -9.316 4.223) 10.441 12.766 ( 2.094 9.316 4.223) 10.441 13.743 ( 1.004 -4.453 0.274) 4.573 13.743 ( 1.004 4.453 0.274) 4.573 13.857 ( 0.269 -4.831 2.944) 5.664 13.857 ( 0.269 4.831 2.944) 5.664 15.982 ( -3.080 -2.164 -2.319) 4.421 15.982 ( -3.080 2.164 -2.319) 4.421 16.167 ( 0.252 -5.248 -2.497) 5.817 16.167 ( 0.252 5.248 -2.497) 5.817 17.968 ( 1.456 -9.449 7.320) 12.041 17.968 ( 1.456 9.449 7.320) 12.041 19.524 ( -0.553 -12.893 -9.323) 15.921 19.524 ( -0.553 12.893 -9.323) 15.921 ======================= Grid point 283 (154/205) ======================= q-point: ( 0.22 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.181 ( 12.742 -11.753 -8.095) 19.132 3.181 ( 12.742 11.753 -8.095) 19.132 3.560 ( 19.513 -2.828 0.379) 19.721 3.560 ( 19.513 2.828 0.379) 19.721 4.231 ( -25.050 -6.992 6.110) 26.716 4.231 ( -25.050 6.992 6.110) 26.716 5.201 ( 0.481 -3.307 3.570) 4.890 5.201 ( 0.481 3.307 3.570) 4.890 5.298 ( -5.376 -4.378 0.773) 6.976 5.298 ( -5.376 4.378 0.773) 6.976 6.251 ( 5.157 -4.774 -6.628) 9.660 6.251 ( 5.157 4.774 -6.628) 9.660 6.941 ( 7.256 -6.988 -15.315) 18.331 6.941 ( 7.256 6.988 -15.315) 18.331 7.405 ( -19.367 -6.248 9.234) 22.347 7.405 ( -19.367 6.248 9.234) 22.347 8.197 ( -8.165 -7.634 -8.489) 14.036 8.197 ( -8.165 7.634 -8.489) 14.036 8.890 ( 4.731 -14.038 0.042) 14.814 8.890 ( 4.731 14.038 0.042) 14.814 9.145 ( -2.578 -3.613 12.133) 12.920 9.145 ( -2.578 3.613 12.133) 12.920 9.483 ( 5.460 -7.435 -3.345) 9.812 9.483 ( 5.460 7.435 -3.345) 9.812 10.085 ( 3.700 -5.449 6.210) 9.052 10.085 ( 3.700 5.449 6.210) 9.052 10.879 ( 4.347 -7.354 -1.744) 8.719 10.879 ( 4.347 7.354 -1.744) 8.719 11.463 ( 1.255 -5.773 -1.742) 6.159 11.463 ( 1.255 5.773 -1.742) 6.159 11.643 ( -0.356 -4.635 -5.069) 6.878 11.643 ( -0.356 4.635 -5.069) 6.878 12.332 ( -4.255 -7.190 1.748) 8.536 12.332 ( -4.255 7.190 1.748) 8.536 12.861 ( 1.603 -12.075 6.382) 13.751 12.861 ( 1.603 12.075 6.382) 13.751 13.738 ( -0.200 -11.706 -1.803) 11.845 13.738 ( -0.200 11.706 -1.803) 11.845 13.869 ( -1.682 -10.668 0.443) 10.809 13.869 ( -1.682 10.668 0.443) 10.809 15.947 ( -0.603 -3.128 2.181) 3.860 15.947 ( -0.603 3.128 2.181) 3.860 16.214 ( 3.959 -6.191 3.642) 8.202 16.214 ( 3.959 6.191 3.642) 8.202 18.061 ( 2.034 -5.320 4.725) 7.400 18.061 ( 2.034 5.320 4.725) 7.400 19.375 ( -4.322 -14.714 -10.325) 18.487 19.375 ( -4.322 14.714 -10.325) 18.487 ======================= Grid point 285 (155/205) ======================= q-point: ( 0.33 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.249 ( 2.190 -9.504 -8.513) 12.946 3.249 ( 2.190 9.504 -8.513) 12.946 3.676 ( -18.108 -2.297 8.057) 19.952 3.676 ( -18.108 2.297 8.057) 19.952 4.103 ( 21.344 -16.434 -11.138) 29.149 4.103 ( 21.344 16.434 -11.138) 29.149 5.122 ( -10.702 -9.634 -1.874) 14.521 5.122 ( -10.702 9.634 -1.874) 14.521 5.281 ( 1.379 -4.413 4.066) 6.157 5.281 ( 1.379 4.413 4.066) 6.157 6.180 ( -3.195 -3.478 -9.347) 10.472 6.180 ( -3.195 3.478 -9.347) 10.472 6.831 ( 2.921 -11.318 -22.902) 25.713 6.831 ( 2.921 11.318 -22.902) 25.713 7.091 ( -20.038 -2.532 2.717) 20.380 7.091 ( -20.038 2.532 2.717) 20.380 8.081 ( -0.052 -7.164 -1.052) 7.241 8.081 ( -0.052 7.164 -1.052) 7.241 8.834 ( -3.722 -11.637 -7.388) 14.278 8.834 ( -3.722 11.637 -7.388) 14.278 9.198 ( -5.114 -10.454 12.118) 16.801 9.198 ( -5.114 10.454 12.118) 16.801 9.644 ( 7.956 -9.933 5.018) 13.680 9.644 ( 7.956 9.933 5.018) 13.680 10.288 ( 5.559 -9.724 12.659) 16.903 10.288 ( 5.559 9.724 12.659) 16.903 10.952 ( 4.966 -7.319 0.672) 8.870 10.952 ( 4.966 7.319 0.672) 8.870 11.387 ( 3.115 -9.016 -12.190) 15.479 11.387 ( 3.115 9.016 -12.190) 15.479 11.700 ( 3.818 -6.681 5.547) 9.486 11.700 ( 3.818 6.681 5.547) 9.486 12.353 ( 1.016 -4.000 4.942) 6.439 12.353 ( 1.016 4.000 4.942) 6.439 12.944 ( -0.381 -15.246 8.229) 17.329 12.944 ( -0.381 15.246 8.229) 17.329 13.654 ( -5.108 -3.125 -7.447) 9.556 13.654 ( -5.108 3.125 -7.447) 9.556 13.845 ( -0.417 -12.100 1.183) 12.165 13.845 ( -0.417 12.100 1.183) 12.165 16.000 ( 1.630 -3.225 5.847) 6.874 16.000 ( 1.630 3.225 5.847) 6.874 16.362 ( 5.337 -4.913 7.503) 10.436 16.362 ( 5.337 4.913 7.503) 10.436 18.134 ( 1.160 -5.144 3.613) 6.392 18.134 ( 1.160 5.144 3.613) 6.392 19.178 ( -4.212 -15.340 -12.187) 20.039 19.178 ( -4.212 15.340 -12.187) 20.039 ======================= Grid point 287 (156/205) ======================= q-point: (-0.56 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.991 ( -21.396 -5.329 0.417) 22.054 2.991 ( -21.396 5.329 0.417) 22.054 3.566 ( 2.725 -9.831 -2.640) 10.538 3.566 ( 2.725 9.831 -2.640) 10.538 4.337 ( 13.025 -15.468 -13.334) 24.222 4.337 ( 13.025 15.468 -13.334) 24.222 4.890 ( -5.904 -11.702 -11.000) 17.112 4.890 ( -5.904 11.702 -11.000) 17.112 5.372 ( 1.369 -3.676 9.830) 10.584 5.372 ( 1.369 3.676 9.830) 10.584 5.986 ( -8.242 -0.893 -6.399) 10.473 5.986 ( -8.242 0.893 -6.399) 10.473 6.575 ( -7.873 -14.000 -13.793) 21.171 6.575 ( -7.873 14.000 -13.793) 21.171 6.858 ( -3.546 -1.630 -6.477) 7.562 6.858 ( -3.546 1.630 -6.477) 7.562 8.125 ( 4.876 -5.060 -0.809) 7.073 8.125 ( 4.876 5.060 -0.809) 7.073 8.674 ( -4.403 -11.841 -7.143) 14.512 8.674 ( -4.403 11.841 -7.143) 14.512 9.244 ( -4.863 -15.681 14.005) 21.580 9.244 ( -4.863 15.681 14.005) 21.580 9.774 ( 2.598 -12.503 1.294) 12.835 9.774 ( 2.598 12.503 1.294) 12.835 10.439 ( -4.385 -12.556 12.656) 18.359 10.439 ( -4.385 12.556 12.656) 18.359 11.033 ( 4.040 -3.156 -2.897) 5.889 11.033 ( 4.040 3.156 -2.897) 5.889 11.490 ( 16.059 -4.252 -0.418) 16.618 11.490 ( 16.059 4.252 -0.418) 16.618 11.843 ( 4.756 -6.208 5.747) 9.705 11.843 ( 4.756 6.208 5.747) 9.705 12.402 ( -0.208 -2.432 1.666) 2.955 12.402 ( -0.208 2.432 1.666) 2.955 13.021 ( -1.731 -18.995 8.392) 20.838 13.021 ( -1.731 18.995 8.392) 20.838 13.447 ( -6.067 -3.360 -7.564) 10.263 13.447 ( -6.067 3.360 -7.564) 10.263 13.864 ( 1.000 -11.721 -0.090) 11.764 13.864 ( 1.000 11.721 -0.090) 11.764 16.111 ( 2.934 -2.583 7.330) 8.307 16.111 ( 2.934 2.583 7.330) 8.307 16.530 ( 4.111 -2.429 7.311) 8.732 16.530 ( 4.111 2.429 7.311) 8.732 18.164 ( -3.045 -12.957 4.710) 14.118 18.164 ( -3.045 12.957 4.710) 14.118 19.005 ( 1.213 -14.208 -14.612) 20.417 19.005 ( 1.213 14.208 -14.612) 20.417 ======================= Grid point 289 (157/205) ======================= q-point: (-0.44 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.676 ( -14.597 -11.431 5.891) 19.453 2.676 ( -14.597 11.431 5.891) 19.453 3.573 ( -2.600 -16.008 -1.470) 16.285 3.573 ( -2.600 16.008 -1.470) 16.285 4.345 ( 6.007 -9.401 -9.509) 14.659 4.345 ( 6.007 9.401 -9.509) 14.659 4.684 ( -3.692 -12.021 -14.316) 19.054 4.684 ( -3.692 12.021 -14.316) 19.054 5.494 ( 0.645 -3.580 6.221) 7.206 5.494 ( 0.645 3.580 6.221) 7.206 5.828 ( -5.530 -5.421 3.605) 8.542 5.828 ( -5.530 5.421 3.605) 8.542 6.360 ( -1.428 -13.178 -12.122) 17.963 6.360 ( -1.428 13.178 -12.122) 17.963 6.799 ( 3.701 -2.363 -3.623) 5.693 6.799 ( 3.701 2.363 -3.623) 5.693 8.188 ( 2.324 -4.754 -3.218) 6.193 8.188 ( 2.324 4.754 -3.218) 6.193 8.585 ( 2.703 -9.158 -4.335) 10.487 8.585 ( 2.703 9.158 -4.335) 10.487 9.274 ( -8.203 -14.413 13.915) 21.648 9.274 ( -8.203 14.413 13.915) 21.648 9.778 ( -2.364 -12.337 -0.001) 12.561 9.778 ( -2.364 12.337 -0.001) 12.561 10.432 ( -5.945 -13.521 7.989) 16.792 10.432 ( -5.945 13.521 7.989) 16.792 11.074 ( 5.250 -2.104 -4.748) 7.385 11.074 ( 5.250 2.104 -4.748) 7.385 11.782 ( 5.042 -1.608 5.704) 7.781 11.782 ( 5.042 1.608 5.704) 7.781 11.925 ( 1.562 -3.998 -1.370) 4.506 11.925 ( 1.562 3.998 -1.370) 4.506 12.445 ( 5.544 -4.478 4.164) 8.254 12.445 ( 5.544 4.478 4.164) 8.254 12.948 ( -5.870 -13.949 -6.304) 16.394 12.948 ( -5.870 13.949 -6.304) 16.394 13.430 ( 2.894 -1.004 8.223) 8.775 13.430 ( 2.894 1.004 8.223) 8.775 13.862 ( 0.772 -8.224 -3.802) 9.093 13.862 ( 0.772 8.224 -3.802) 9.093 16.238 ( 3.097 -0.806 5.851) 6.669 16.238 ( 3.097 0.806 5.851) 6.669 16.643 ( 1.795 -0.752 4.187) 4.617 16.643 ( 1.795 0.752 4.187) 4.617 18.098 ( -10.271 -19.397 5.731) 22.684 18.098 ( -10.271 19.397 5.731) 22.684 18.960 ( 10.568 -11.781 -14.315) 21.340 18.960 ( 10.568 11.781 -14.315) 21.340 ======================= Grid point 291 (158/205) ======================= q-point: (-0.33 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.598 ( -3.392 -15.702 8.691) 18.264 2.598 ( -3.392 15.702 8.691) 18.264 3.405 ( -17.009 -18.334 6.205) 25.767 3.405 ( -17.009 18.334 6.205) 25.767 4.455 ( 6.071 -4.086 -0.888) 7.372 4.455 ( 6.071 4.086 -0.888) 7.372 4.525 ( 8.627 -11.945 -12.099) 19.066 4.525 ( 8.627 11.945 -12.099) 19.066 5.516 ( -3.740 -2.542 5.447) 7.080 5.516 ( -3.740 2.542 5.447) 7.080 5.811 ( -3.694 -8.903 6.589) 11.676 5.811 ( -3.694 8.903 6.589) 11.676 6.233 ( 0.080 -13.438 -12.739) 18.517 6.233 ( 0.080 13.438 -12.739) 18.517 6.968 ( 14.540 -2.525 4.078) 15.311 6.968 ( 14.540 2.525 4.078) 15.311 8.135 ( -2.498 -9.656 -3.813) 10.678 8.135 ( -2.498 9.656 -3.813) 10.678 8.676 ( 8.870 -3.457 -2.475) 9.837 8.676 ( 8.870 3.457 -2.475) 9.837 9.224 ( -11.958 -11.828 12.818) 21.147 9.224 ( -11.958 11.828 12.818) 21.147 9.730 ( -1.139 -7.813 0.227) 7.899 9.730 ( -1.139 7.813 0.227) 7.899 10.423 ( -2.434 -18.218 4.511) 18.925 10.423 ( -2.434 18.218 4.511) 18.925 11.103 ( 1.045 -3.930 -3.588) 5.423 11.103 ( 1.045 3.930 -3.588) 5.423 11.576 ( -16.115 -9.819 -8.837) 20.837 11.576 ( -16.115 9.819 -8.837) 20.837 12.027 ( 5.842 -2.935 -1.542) 6.717 12.027 ( 5.842 2.935 -1.542) 6.717 12.606 ( 2.371 -5.184 0.708) 5.744 12.606 ( 2.371 5.184 0.708) 5.744 12.893 ( 7.085 -11.007 2.977) 13.425 12.893 ( 7.085 11.007 2.977) 13.425 13.563 ( -0.074 -5.219 6.112) 8.037 13.563 ( -0.074 5.219 6.112) 8.037 13.829 ( 2.054 -5.459 -5.048) 7.714 13.829 ( 2.054 5.459 -5.048) 7.714 16.318 ( 1.364 -2.228 0.812) 2.735 16.318 ( 1.364 2.228 0.812) 2.735 16.682 ( -0.057 -1.926 0.467) 1.982 16.682 ( -0.057 1.926 0.467) 1.982 17.934 ( -13.285 -20.970 6.163) 25.578 17.934 ( -13.285 20.970 6.163) 25.578 19.085 ( 16.264 -8.654 -10.603) 21.256 19.085 ( 16.264 8.654 -10.603) 21.256 ======================= Grid point 293 (159/205) ======================= q-point: (-0.22 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.643 ( -3.115 -13.492 6.680) 15.374 2.643 ( -3.115 13.492 6.680) 15.374 3.186 ( -13.964 -14.881 11.338) 23.345 3.186 ( -13.964 14.881 11.338) 23.345 4.488 ( -1.003 -2.574 11.979) 12.293 4.488 ( -1.003 2.574 11.979) 12.293 4.786 ( 22.758 -9.545 -10.257) 26.726 4.786 ( 22.758 9.545 -10.257) 26.726 5.460 ( -9.152 -7.824 7.670) 14.276 5.460 ( -9.152 7.824 7.670) 14.276 5.870 ( 0.965 -10.011 9.519) 13.848 5.870 ( 0.965 10.011 9.519) 13.848 6.093 ( 0.009 -10.581 -12.090) 16.067 6.093 ( 0.009 10.581 -12.090) 16.067 7.334 ( 15.798 -4.210 9.079) 18.701 7.334 ( 15.798 4.210 9.079) 18.701 8.067 ( -1.824 -12.106 -0.861) 12.273 8.067 ( -1.824 12.106 -0.861) 12.273 8.790 ( 6.242 -7.587 -2.806) 10.218 8.790 ( 6.242 7.587 -2.806) 10.218 9.126 ( -11.728 -10.487 11.318) 19.381 9.126 ( -11.728 10.487 11.318) 19.381 9.809 ( 10.226 -3.794 0.092) 10.908 9.809 ( 10.226 3.794 0.092) 10.908 10.381 ( -6.275 -21.024 -1.094) 21.968 10.381 ( -6.275 21.024 -1.094) 21.968 10.929 ( -14.729 -9.071 -6.800) 18.587 10.929 ( -14.729 9.071 -6.800) 18.587 11.297 ( -2.214 -9.843 -6.840) 12.189 11.297 ( -2.214 9.843 -6.840) 12.189 12.057 ( 2.651 -5.903 -6.718) 9.328 12.057 ( 2.651 5.903 -6.718) 9.328 12.598 ( 1.016 -6.071 -2.842) 6.780 12.598 ( 1.016 6.071 -2.842) 6.780 13.145 ( 8.662 -12.792 10.104) 18.459 13.145 ( 8.662 12.792 10.104) 18.459 13.484 ( -7.646 -7.657 -4.548) 11.738 13.484 ( -7.646 7.657 -4.548) 11.738 13.865 ( 3.340 -5.263 -0.615) 6.264 13.865 ( 3.340 5.263 -0.615) 6.264 16.299 ( -1.053 -4.754 -4.484) 6.620 16.299 ( -1.053 4.754 -4.484) 6.620 16.634 ( -3.421 -3.162 -4.875) 6.743 16.634 ( -3.421 3.162 -4.875) 6.743 17.794 ( -9.763 -19.467 9.442) 23.737 17.794 ( -9.763 19.467 9.442) 23.737 19.297 ( 16.570 -3.357 -8.034) 18.719 19.297 ( 16.570 3.357 -8.034) 18.719 ======================= Grid point 295 (160/205) ======================= q-point: (-0.11 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.609 ( -4.391 -8.131 5.036) 10.524 2.609 ( -4.391 8.131 5.036) 10.524 3.158 ( -2.303 -6.385 8.566) 10.929 3.158 ( -2.303 6.385 8.566) 10.929 4.654 ( 2.632 -0.382 14.087) 14.336 4.654 ( 2.632 0.382 14.087) 14.336 5.006 ( 4.456 -8.818 1.121) 9.944 5.006 ( 4.456 8.818 1.121) 9.944 5.445 ( 2.114 -10.960 5.571) 12.475 5.445 ( 2.114 10.960 5.571) 12.475 5.835 ( -8.051 -3.507 0.951) 8.833 5.835 ( -8.051 3.507 0.951) 8.833 6.200 ( 15.427 -5.126 2.177) 16.402 6.200 ( 15.427 5.126 2.177) 16.402 7.641 ( 3.710 -2.167 13.191) 13.873 7.641 ( 3.710 2.167 13.191) 13.873 8.073 ( 2.911 -11.299 1.781) 11.803 8.073 ( 2.911 11.299 1.781) 11.803 8.877 ( 7.495 -9.619 -2.778) 12.507 8.877 ( 7.495 9.619 -2.778) 12.507 9.047 ( -7.830 -8.919 8.292) 14.478 9.047 ( -7.830 8.919 8.292) 14.478 9.937 ( -3.735 -16.509 -13.152) 21.435 9.937 ( -3.735 16.509 -13.152) 21.435 10.235 ( 5.016 -4.996 -0.360) 7.089 10.235 ( 5.016 4.996 -0.360) 7.089 10.626 ( -10.941 -16.052 -3.765) 19.787 10.626 ( -10.941 16.052 -3.765) 19.787 11.266 ( 1.125 -5.019 -0.301) 5.153 11.266 ( 1.125 5.019 -0.301) 5.153 12.002 ( 1.215 -8.565 -10.706) 13.764 12.002 ( 1.215 8.565 -10.706) 13.764 12.604 ( 2.229 -5.636 -1.774) 6.315 12.604 ( 2.229 5.636 -1.774) 6.315 13.174 ( -10.836 -13.862 -8.022) 19.337 13.174 ( -10.836 13.862 -8.022) 19.337 13.446 ( 4.929 -2.171 10.725) 12.001 13.446 ( 4.929 2.171 10.725) 12.001 13.889 ( 0.435 -7.856 -1.610) 8.031 13.889 ( 0.435 7.856 -1.610) 8.031 16.207 ( -2.394 -5.211 -6.652) 8.783 16.207 ( -2.394 5.211 -6.652) 8.783 16.462 ( -6.876 -3.411 -8.810) 11.684 16.462 ( -6.876 3.411 -8.810) 11.684 17.784 ( -3.779 -16.156 11.675) 20.288 17.784 ( -3.779 16.156 11.675) 20.288 19.486 ( 12.440 -4.236 -7.785) 15.275 19.486 ( 12.440 4.236 -7.785) 15.275 ======================= Grid point 324 (161/205) ======================= q-point: ( 0.00 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.531 ( 12.641 0.000 14.148) 18.973 2.543 ( -8.743 0.000 15.073) 17.425 3.201 ( -7.610 0.000 -0.265) 7.614 3.381 ( 4.662 0.000 -14.946) 15.656 4.123 ( -1.318 0.000 17.766) 17.814 4.465 ( 7.962 0.000 -15.914) 17.794 4.957 ( 10.353 0.000 11.024) 15.123 5.076 ( -16.429 0.000 11.622) 20.124 5.266 ( 0.689 0.000 9.239) 9.265 5.573 ( 12.201 0.000 -11.256) 16.600 5.699 ( 0.862 0.000 21.470) 21.487 6.191 ( -1.018 0.000 -20.279) 20.305 6.426 ( -8.252 0.000 8.252) 11.670 6.606 ( 3.543 0.000 -10.751) 11.319 7.004 ( 7.682 0.000 9.104) 11.912 7.025 ( -5.276 0.000 5.916) 7.927 7.712 ( 2.696 0.000 0.056) 2.696 7.819 ( -11.068 0.000 -10.357) 15.158 8.726 ( -5.148 0.000 4.500) 6.837 8.757 ( 12.014 0.000 1.910) 12.165 9.321 ( -2.078 0.000 12.306) 12.481 9.477 ( 4.104 0.000 -8.147) 9.122 9.628 ( 8.675 0.000 1.913) 8.883 9.726 ( 6.807 0.000 9.251) 11.486 9.992 ( 4.346 0.000 -20.920) 21.367 10.015 ( -17.182 0.000 -10.282) 20.023 11.011 ( -15.729 0.000 11.573) 19.528 11.196 ( 8.351 0.000 -5.414) 9.953 11.776 ( -0.647 0.000 0.909) 1.115 11.777 ( 2.379 0.000 0.208) 2.388 11.983 ( -2.805 0.000 0.080) 2.806 12.035 ( 1.065 0.000 -4.566) 4.689 12.389 ( -6.517 0.000 2.202) 6.879 12.474 ( 1.764 0.000 -5.422) 5.702 12.870 ( 9.141 0.000 9.839) 13.430 13.050 ( -6.602 0.000 -7.383) 9.904 13.383 ( 1.272 0.000 -1.544) 2.000 13.397 ( -3.547 0.000 -2.978) 4.632 14.933 ( -4.393 0.000 6.044) 7.472 15.065 ( 4.301 0.000 -6.655) 7.924 15.608 ( 5.722 0.000 5.906) 8.223 15.687 ( -6.641 0.000 -2.281) 7.022 16.423 ( -7.049 0.000 0.363) 7.059 16.479 ( 4.240 0.000 -4.599) 6.256 17.401 ( -2.523 0.000 18.854) 19.022 17.766 ( 6.165 0.000 -15.813) 16.972 19.582 ( -16.956 0.000 11.568) 20.526 19.806 ( 25.199 0.000 -10.196) 27.183 ======================= Grid point 325 (162/205) ======================= q-point: ( 0.11 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.521 ( 1.252 0.000 -2.494) 2.791 2.913 ( 18.944 0.000 -5.457) 19.714 3.162 ( -1.871 0.000 5.073) 5.408 3.321 ( -0.115 0.000 2.333) 2.335 4.222 ( -0.120 0.000 5.333) 5.335 4.363 ( -0.428 0.000 -17.542) 17.548 4.770 ( -19.629 0.000 -1.935) 19.725 5.233 ( 6.917 0.000 8.602) 11.038 5.336 ( -2.401 0.000 5.752) 6.233 5.579 ( 9.669 0.000 -23.086) 25.029 5.933 ( 0.184 0.000 -24.555) 24.556 5.972 ( -0.673 0.000 23.095) 23.104 6.365 ( -7.282 0.000 12.810) 14.735 6.501 ( -7.191 0.000 -4.661) 8.569 7.034 ( 3.345 0.000 -7.460) 8.176 7.177 ( 3.911 0.000 0.338) 3.926 7.578 ( -9.994 0.000 2.359) 10.269 7.830 ( 4.446 0.000 14.659) 15.319 8.543 ( -14.731 0.000 -4.686) 15.459 8.841 ( 1.496 0.000 -6.849) 7.011 9.372 ( -1.909 0.000 4.410) 4.805 9.462 ( 3.526 0.000 -8.731) 9.416 9.655 ( -10.197 0.000 -1.994) 10.390 9.685 ( 0.432 0.000 -17.454) 17.459 9.902 ( 13.878 0.000 3.366) 14.280 10.236 ( 19.032 0.000 12.595) 22.822 10.857 ( -15.242 0.000 15.304) 21.599 11.198 ( -4.182 0.000 -4.067) 5.834 11.728 ( -3.456 0.000 -0.381) 3.477 11.841 ( 6.082 0.000 0.923) 6.152 12.006 ( 0.900 0.000 2.673) 2.820 12.094 ( 7.165 0.000 -3.752) 8.088 12.326 ( -5.264 0.000 8.723) 10.188 12.492 ( 2.994 0.000 -0.139) 2.998 12.829 ( -7.115 0.000 -10.224) 12.456 13.093 ( 6.113 0.000 6.572) 8.975 13.340 ( -1.423 0.000 1.808) 2.301 13.422 ( 2.545 0.000 2.497) 3.565 14.924 ( -3.553 0.000 6.617) 7.510 15.076 ( 4.107 0.000 -6.471) 7.664 15.560 ( -4.106 0.000 -2.074) 4.600 15.768 ( 6.009 0.000 4.092) 7.270 16.346 ( -4.880 0.000 5.215) 7.142 16.538 ( 5.087 0.000 -0.337) 5.099 17.546 ( -0.722 0.000 14.248) 14.266 17.689 ( 6.225 0.000 -21.184) 22.080 19.246 ( -28.144 0.000 3.259) 28.333 19.981 ( 10.210 0.000 -16.892) 19.738 ======================= Grid point 326 (163/205) ======================= q-point: ( 0.22 0.00 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.578 ( 12.800 0.000 -10.907) 16.817 2.907 ( 2.545 0.000 -25.383) 25.511 3.155 ( -2.537 0.000 -1.874) 3.154 3.513 ( -0.284 0.000 20.317) 20.319 4.125 ( -6.836 0.000 -13.023) 14.708 4.275 ( 1.264 0.000 0.674) 1.433 4.392 ( -13.418 0.000 -4.067) 14.021 5.228 ( -0.328 0.000 -19.279) 19.282 5.330 ( 0.293 0.000 -0.800) 0.852 5.558 ( 9.932 0.000 -23.751) 25.744 5.823 ( 8.825 0.000 -5.100) 10.193 6.034 ( -10.778 0.000 12.707) 16.662 6.261 ( -12.645 0.000 -6.304) 14.129 6.401 ( -10.163 0.000 10.719) 14.771 6.917 ( -3.079 0.000 -13.945) 14.281 7.148 ( -1.773 0.000 1.586) 2.378 7.531 ( -5.266 0.000 10.725) 11.948 8.169 ( 9.537 0.000 20.935) 23.005 8.174 ( -15.478 0.000 -8.804) 17.807 8.741 ( -0.752 0.000 -10.792) 10.819 9.308 ( -6.339 0.000 3.134) 7.072 9.360 ( -1.204 0.000 -15.012) 15.060 9.633 ( 6.949 0.000 -4.907) 8.507 9.640 ( 6.851 0.000 1.178) 6.951 10.169 ( 12.215 0.000 -1.014) 12.257 10.681 ( 15.786 0.000 6.929) 17.240 10.781 ( -11.014 0.000 16.317) 19.686 11.017 ( -10.105 0.000 -1.567) 10.226 11.680 ( -1.906 0.000 0.316) 1.932 11.945 ( -3.560 0.000 -3.672) 5.114 12.040 ( -1.188 0.000 6.203) 6.316 12.080 ( 1.007 0.000 6.772) 6.847 12.485 ( 7.271 0.000 5.579) 9.165 12.533 ( -0.769 0.000 1.568) 1.747 12.632 ( -1.726 0.000 -4.806) 5.106 13.237 ( 4.257 0.000 4.612) 6.276 13.402 ( 3.892 0.000 6.606) 7.667 13.523 ( 3.546 0.000 5.956) 6.932 14.940 ( -2.120 0.000 6.776) 7.100 15.073 ( 2.623 0.000 -6.189) 6.722 15.525 ( 2.170 0.000 -0.558) 2.241 15.908 ( 5.083 0.000 4.045) 6.496 16.341 ( -3.229 0.000 7.860) 8.497 16.647 ( 4.252 0.000 4.023) 5.854 17.562 ( 5.078 0.000 -24.085) 24.614 17.620 ( -3.895 0.000 4.061) 5.627 18.691 ( -28.886 0.000 -3.806) 29.136 19.870 ( -0.775 0.000 -20.086) 20.101 ======================= Grid point 327 (164/205) ======================= q-point: ( 0.33 0.00 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.626 ( -7.472 0.000 -18.031) 19.518 2.737 ( 17.359 0.000 -18.496) 25.366 3.012 ( -5.001 0.000 -5.690) 7.575 3.551 ( -8.885 0.000 7.347) 11.529 3.923 ( -4.971 0.000 -4.010) 6.387 4.025 ( -18.468 0.000 6.887) 19.710 4.507 ( 12.591 0.000 -3.532) 13.077 5.002 ( 3.375 0.000 -25.975) 26.194 5.360 ( 4.096 0.000 -0.353) 4.111 5.411 ( 7.230 0.000 -31.852) 32.662 5.813 ( -25.745 0.000 -3.440) 25.974 5.931 ( -11.891 0.000 -5.068) 12.926 6.076 ( 11.002 0.000 5.512) 12.306 6.170 ( -16.372 0.000 13.757) 21.384 6.705 ( -5.042 0.000 -10.809) 11.927 7.217 ( -2.617 0.000 2.780) 3.818 7.550 ( 0.572 0.000 7.938) 7.959 7.909 ( -6.251 0.000 0.548) 6.275 8.368 ( -3.117 0.000 -1.908) 3.655 8.696 ( 2.543 0.000 -2.744) 3.741 9.239 ( 3.260 0.000 -3.562) 4.829 9.311 ( -1.388 0.000 11.562) 11.645 9.769 ( 10.301 0.000 -1.255) 10.377 9.818 ( 11.338 0.000 -1.370) 11.420 10.300 ( 8.734 0.000 -9.013) 12.551 10.768 ( -10.057 0.000 0.364) 10.064 10.778 ( -5.641 0.000 11.932) 13.198 10.923 ( 1.152 0.000 -4.857) 4.992 11.649 ( -0.539 0.000 -2.506) 2.563 11.771 ( -7.327 0.000 1.882) 7.565 12.120 ( -0.656 0.000 12.695) 12.712 12.208 ( -0.931 0.000 2.355) 2.533 12.478 ( 5.958 0.000 -3.441) 6.880 12.483 ( -5.329 0.000 0.981) 5.419 12.803 ( 4.648 0.000 10.932) 11.879 13.342 ( 2.350 0.000 2.286) 3.279 13.614 ( 9.020 0.000 10.279) 13.675 13.666 ( 3.623 0.000 9.649) 10.307 14.994 ( 0.013 0.000 7.873) 7.873 15.064 ( 3.186 0.000 -4.271) 5.328 15.615 ( 7.230 0.000 0.019) 7.230 16.035 ( 2.675 0.000 5.950) 6.523 16.387 ( -1.192 0.000 9.439) 9.514 16.745 ( 1.630 0.000 3.643) 3.991 17.336 ( -21.813 0.000 -14.502) 26.193 17.375 ( 1.638 0.000 -25.089) 25.142 18.362 ( -3.893 0.000 3.590) 5.295 19.577 ( -7.547 0.000 -21.288) 22.586 ======================= Grid point 328 (165/205) ======================= q-point: ( 0.44 0.00 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.343 ( -9.193 0.000 -4.095) 10.064 2.570 ( -7.053 0.000 -18.519) 19.816 3.169 ( 19.033 0.000 -0.156) 19.034 3.420 ( -9.987 0.000 0.820) 10.021 3.849 ( -7.886 0.000 6.506) 10.223 3.856 ( 0.945 0.000 -2.707) 2.867 4.585 ( -5.767 0.000 4.673) 7.423 4.855 ( 4.573 0.000 -18.813) 19.361 5.159 ( -33.174 0.000 -3.369) 33.345 5.227 ( 10.528 0.000 -30.840) 32.587 5.469 ( 6.370 0.000 1.210) 6.484 5.682 ( -8.499 0.000 -4.002) 9.394 6.174 ( -4.905 0.000 17.964) 18.621 6.383 ( 9.859 0.000 12.073) 15.588 6.549 ( 2.472 0.000 -11.946) 12.199 6.980 ( -14.107 0.000 -9.152) 16.816 7.737 ( 8.716 0.000 4.321) 9.729 7.998 ( 6.710 0.000 13.660) 15.219 8.173 ( -7.230 0.000 -12.006) 14.015 8.559 ( -7.369 0.000 -12.018) 14.097 9.439 ( -3.081 0.000 17.745) 18.010 9.442 ( 10.262 0.000 9.341) 13.877 9.942 ( 8.686 0.000 -0.345) 8.693 9.955 ( 3.215 0.000 -2.094) 3.837 10.372 ( 13.846 0.000 -12.357) 18.558 10.481 ( -21.338 0.000 -0.851) 21.355 10.806 ( 0.309 0.000 2.784) 2.801 10.852 ( 0.870 0.000 -5.639) 5.705 11.630 ( 1.996 0.000 -2.067) 2.873 11.710 ( -4.113 0.000 0.538) 4.148 12.159 ( 0.448 0.000 -1.067) 1.157 12.209 ( -3.204 0.000 6.148) 6.932 12.430 ( -2.084 0.000 6.974) 7.279 12.610 ( 5.692 0.000 -2.059) 6.053 12.979 ( 4.486 0.000 11.487) 12.332 13.330 ( -3.102 0.000 -3.417) 4.615 13.837 ( 2.907 0.000 10.281) 10.684 13.860 ( 6.082 0.000 7.656) 9.778 15.091 ( 0.204 0.000 8.894) 8.897 15.129 ( 6.178 0.000 0.240) 6.182 15.768 ( 9.927 0.000 0.130) 9.928 16.046 ( -10.413 0.000 2.942) 10.821 16.495 ( 2.308 0.000 9.905) 10.170 16.770 ( -1.872 0.000 -1.949) 2.702 16.816 ( -9.536 0.000 -11.943) 15.283 17.105 ( -4.245 0.000 -23.304) 23.688 18.505 ( 8.390 0.000 10.586) 13.508 19.190 ( -11.157 0.000 -20.498) 23.338 ======================= Grid point 329 (166/205) ======================= q-point: (-0.44 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.254 ( -5.434 0.000 11.448) 12.673 2.306 ( -9.206 0.000 -1.220) 9.287 3.186 ( -14.375 0.000 -2.160) 14.537 3.507 ( 19.762 0.000 -6.503) 20.805 3.857 ( 3.489 0.000 -0.761) 3.571 3.913 ( 8.692 0.000 -1.811) 8.878 4.382 ( -26.972 0.000 24.866) 36.685 4.708 ( -6.999 0.000 -6.926) 9.846 4.804 ( -9.725 0.000 9.546) 13.627 5.302 ( 23.770 0.000 -15.550) 28.405 5.529 ( -3.309 0.000 -5.365) 6.303 5.615 ( 8.304 0.000 2.380) 8.638 6.267 ( -5.865 0.000 15.307) 16.392 6.432 ( 0.933 0.000 -4.967) 5.054 6.657 ( -6.588 0.000 -13.159) 14.716 6.800 ( 19.735 0.000 4.718) 20.291 7.906 ( -8.482 0.000 -11.637) 14.400 7.947 ( 7.785 0.000 8.860) 11.794 8.287 ( -6.305 0.000 -14.239) 15.572 8.316 ( 11.796 0.000 11.704) 16.617 9.494 ( -7.662 0.000 10.025) 12.618 9.655 ( 5.258 0.000 0.726) 5.308 9.857 ( -12.087 0.000 1.266) 12.153 9.984 ( -9.769 0.000 -8.744) 13.111 10.126 ( -9.907 0.000 11.487) 15.169 10.575 ( 18.690 0.000 -9.181) 20.823 10.846 ( 4.739 0.000 -3.721) 6.025 10.873 ( 6.300 0.000 -4.557) 7.775 11.617 ( -4.135 0.000 -0.854) 4.223 11.698 ( 5.570 0.000 1.117) 5.681 12.152 ( -3.284 0.000 -0.014) 3.284 12.234 ( 5.843 0.000 1.299) 5.986 12.513 ( -0.549 0.000 7.530) 7.550 12.605 ( 1.004 0.000 -7.844) 7.907 13.188 ( -4.750 0.000 -8.095) 9.386 13.194 ( 5.515 0.000 9.578) 11.052 13.927 ( -1.128 0.000 2.138) 2.417 13.960 ( 0.979 0.000 -0.735) 1.224 15.119 ( -5.237 0.000 2.988) 6.029 15.225 ( 3.034 0.000 -2.925) 4.214 15.751 ( -17.037 0.000 0.250) 17.039 16.034 ( 17.380 0.000 5.328) 18.178 16.635 ( -2.872 0.000 -3.264) 4.348 16.660 ( 5.778 0.000 6.863) 8.972 16.784 ( -8.741 0.000 -11.495) 14.441 16.839 ( 5.257 0.000 2.788) 5.951 18.785 ( -11.578 0.000 -16.835) 20.432 18.817 ( 10.343 0.000 15.518) 18.649 ======================= Grid point 330 (167/205) ======================= q-point: (-0.33 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.239 ( -7.760 0.000 17.672) 19.301 2.278 ( -14.254 0.000 22.050) 26.256 2.994 ( -0.139 0.000 -0.668) 0.682 3.736 ( 16.076 0.000 -10.419) 19.157 3.866 ( -3.167 0.000 2.076) 3.787 4.126 ( 16.188 0.000 -3.355) 16.532 4.371 ( -7.317 0.000 33.150) 33.948 4.477 ( -14.604 0.000 0.463) 14.611 4.837 ( -6.772 0.000 22.451) 23.450 5.357 ( -6.538 0.000 0.219) 6.542 5.764 ( 27.820 0.000 -2.253) 27.911 5.839 ( 13.056 0.000 3.711) 13.573 6.183 ( -11.326 0.000 -0.122) 11.326 6.451 ( 11.015 0.000 -11.446) 15.886 6.557 ( 1.827 0.000 0.539) 1.905 7.185 ( 13.447 0.000 5.410) 14.495 7.662 ( -5.574 0.000 -7.218) 9.120 8.087 ( 0.465 0.000 -13.033) 13.042 8.195 ( 8.180 0.000 10.765) 13.520 8.612 ( 8.914 0.000 6.759) 11.187 9.328 ( -11.642 0.000 -7.712) 13.964 9.519 ( -11.306 0.000 -8.278) 14.013 9.645 ( -15.047 0.000 10.211) 18.184 9.789 ( -4.397 0.000 1.703) 4.716 10.178 ( 2.370 0.000 2.390) 3.366 10.773 ( 6.929 0.000 -1.737) 7.143 10.908 ( 6.792 0.000 -4.343) 8.062 10.951 ( 7.592 0.000 -6.021) 9.690 11.587 ( 0.013 0.000 2.464) 2.464 11.817 ( 7.324 0.000 -1.276) 7.434 12.161 ( 2.558 0.000 3.916) 4.678 12.321 ( 2.846 0.000 -3.918) 4.843 12.477 ( -7.740 0.000 -0.818) 7.783 12.551 ( 3.371 0.000 -7.115) 7.873 13.034 ( -2.255 0.000 -10.611) 10.848 13.322 ( 0.342 0.000 4.146) 4.160 13.813 ( -8.129 0.000 -7.987) 11.396 13.882 ( -3.458 0.000 -9.485) 10.096 15.002 ( -6.904 0.000 1.480) 7.061 15.161 ( -1.658 0.000 -8.239) 8.404 15.544 ( -11.101 0.000 6.934) 13.089 16.203 ( -2.124 0.000 -11.407) 11.604 16.555 ( -0.686 0.000 -5.967) 6.006 16.771 ( 3.390 0.000 3.132) 4.615 16.951 ( 23.038 0.000 20.882) 31.094 16.992 ( 2.631 0.000 11.002) 11.312 18.483 ( -4.869 0.000 -8.881) 10.128 19.165 ( 8.316 0.000 18.488) 20.272 ======================= Grid point 331 (168/205) ======================= q-point: (-0.22 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.202 ( -15.893 0.000 23.052) 27.999 2.344 ( -7.889 0.000 28.421) 29.495 3.169 ( 14.697 0.000 1.031) 14.733 3.806 ( -4.872 0.000 -7.334) 8.805 3.845 ( -7.098 0.000 14.143) 15.825 4.286 ( 0.808 0.000 -1.840) 2.010 4.390 ( 16.423 0.000 -3.453) 16.782 4.670 ( 2.862 0.000 28.917) 29.059 4.977 ( -7.042 0.000 28.755) 29.605 5.293 ( -0.745 0.000 2.594) 2.699 5.931 ( -9.363 0.000 -8.617) 12.724 6.148 ( 13.911 0.000 4.958) 14.768 6.163 ( 14.636 0.000 -0.107) 14.637 6.599 ( 15.949 0.000 -10.914) 19.326 6.643 ( -0.156 0.000 11.392) 11.393 7.223 ( -5.734 0.000 -3.906) 6.938 7.671 ( 5.213 0.000 -1.192) 5.348 8.083 ( 10.411 0.000 -2.750) 10.768 8.435 ( 6.971 0.000 4.956) 8.553 8.625 ( -9.077 0.000 -7.793) 11.963 9.125 ( -3.519 0.000 6.355) 7.264 9.344 ( -1.023 0.000 -1.307) 1.660 9.534 ( -6.733 0.000 6.283) 9.209 9.710 ( -2.628 0.000 -4.943) 5.598 10.221 ( 3.724 0.000 -6.112) 7.157 10.734 ( -10.284 0.000 -0.090) 10.284 11.008 ( 7.256 0.000 -1.359) 7.382 11.018 ( 7.384 0.000 -7.181) 10.300 11.645 ( 2.415 0.000 3.203) 4.012 11.926 ( 3.960 0.000 -2.313) 4.586 12.234 ( -3.178 0.000 -6.455) 7.195 12.243 ( -1.058 0.000 -11.017) 11.068 12.339 ( -0.351 0.000 10.590) 10.596 12.573 ( 2.018 0.000 -3.096) 3.696 12.819 ( -8.052 0.000 -14.273) 16.388 13.299 ( -3.707 0.000 -0.918) 3.819 13.556 ( -7.541 0.000 -8.236) 11.167 13.689 ( -5.242 0.000 -10.122) 11.399 14.952 ( -3.275 0.000 5.509) 6.409 15.075 ( 1.074 0.000 -6.384) 6.474 15.453 ( -6.732 0.000 7.333) 9.955 16.001 ( -7.480 0.000 -5.659) 9.380 16.497 ( 1.425 0.000 -6.667) 6.817 16.755 ( -3.095 0.000 -5.688) 6.476 17.138 ( -1.467 0.000 15.617) 15.685 17.593 ( 19.038 0.000 7.751) 20.555 18.592 ( 23.769 0.000 5.285) 24.350 19.466 ( 3.143 0.000 18.980) 19.238 ======================= Grid point 332 (169/205) ======================= q-point: (-0.11 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.253 ( -2.214 0.000 20.436) 20.556 2.485 ( -9.486 0.000 28.343) 29.889 3.382 ( 12.537 0.000 -12.647) 17.808 3.474 ( -17.381 0.000 -5.945) 18.370 3.937 ( -4.588 0.000 25.291) 25.704 4.405 ( 13.124 0.000 -10.565) 16.848 4.662 ( 12.974 0.000 5.085) 13.935 4.990 ( -1.649 0.000 28.700) 28.748 5.155 ( -3.833 0.000 24.054) 24.358 5.400 ( 9.727 0.000 0.939) 9.772 5.684 ( -7.308 0.000 -6.091) 9.513 6.299 ( 6.316 0.000 -9.162) 11.128 6.399 ( 5.170 0.000 5.779) 7.753 6.663 ( 5.117 0.000 -14.811) 15.670 6.782 ( 1.661 0.000 14.893) 14.986 7.106 ( -7.211 0.000 3.865) 8.181 7.685 ( 3.058 0.000 -5.388) 6.195 8.183 ( -13.046 0.000 -17.641) 21.941 8.402 ( 18.420 0.000 7.462) 19.874 8.667 ( 2.536 0.000 9.556) 9.887 9.211 ( -2.045 0.000 14.890) 15.030 9.417 ( 6.704 0.000 0.708) 6.741 9.527 ( 2.772 0.000 -0.811) 2.888 9.624 ( -0.301 0.000 -3.957) 3.969 10.161 ( 2.545 0.000 -17.428) 17.613 10.435 ( -18.291 0.000 -5.579) 19.122 11.090 ( 8.878 0.000 -6.725) 11.137 11.101 ( -0.994 0.000 4.274) 4.388 11.719 ( 3.053 0.000 1.220) 3.287 11.829 ( -9.085 0.000 1.303) 9.178 12.099 ( -5.307 0.000 -3.636) 6.434 12.115 ( -1.497 0.000 -8.334) 8.467 12.510 ( -5.418 0.000 -2.333) 5.899 12.527 ( 4.882 0.000 -6.712) 8.300 12.608 ( 2.154 0.000 7.023) 7.346 13.203 ( -4.159 0.000 -3.914) 5.711 13.414 ( -1.423 0.000 -4.974) 5.174 13.516 ( -4.348 0.000 -6.501) 7.821 14.951 ( -3.800 0.000 5.666) 6.822 15.058 ( 3.545 0.000 -6.190) 7.133 15.472 ( 0.740 0.000 7.406) 7.443 15.833 ( -6.929 0.000 -2.505) 7.368 16.471 ( 3.013 0.000 -6.345) 7.024 16.588 ( -7.652 0.000 -5.165) 9.232 17.265 ( -3.415 0.000 18.643) 18.953 17.776 ( 6.742 0.000 -7.923) 10.403 19.270 ( 37.659 0.000 1.401) 37.685 19.635 ( -5.436 0.000 16.793) 17.651 ======================= Grid point 333 (170/205) ======================= q-point: ( 0.00 0.12 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.512 ( 5.983 1.605 18.374) 19.390 2.692 ( -2.432 9.922 7.211) 12.505 3.113 ( -2.439 -7.328 3.161) 8.345 3.375 ( 2.923 -0.690 -16.017) 16.296 4.270 ( -6.613 13.007 16.339) 21.906 4.588 ( 10.269 10.958 -14.932) 21.178 4.925 ( 2.439 -1.694 12.135) 12.493 5.096 ( -6.809 0.460 1.515) 6.990 5.346 ( 1.024 7.762 14.185) 16.202 5.517 ( 5.478 -2.641 6.381) 8.815 5.842 ( 7.168 10.285 3.412) 12.992 6.111 ( -5.790 -7.282 -10.889) 14.322 6.419 ( -5.825 -1.001 1.067) 6.006 6.491 ( 5.922 -6.457 -2.927) 9.237 7.134 ( 4.198 11.829 6.898) 14.322 7.215 ( -2.400 15.373 1.974) 15.684 7.737 ( 1.300 2.505 1.827) 3.361 7.885 ( -10.281 5.995 -11.696) 16.687 8.677 ( 6.162 -2.913 7.451) 10.098 8.781 ( 1.190 1.466 -2.282) 2.962 9.270 ( 1.168 -5.442 8.979) 10.564 9.411 ( 1.950 -5.016 -2.301) 5.853 9.689 ( 4.973 4.270 -0.498) 6.574 9.791 ( 3.898 4.736 10.703) 12.336 9.946 ( -2.309 -2.499 -16.593) 16.938 10.067 ( -6.151 3.610 -13.475) 15.246 10.949 ( -9.468 -5.596 13.404) 17.338 11.185 ( 4.522 -1.830 -8.357) 9.677 11.674 ( 3.222 -6.981 3.232) 8.340 11.765 ( -3.754 -8.788 -6.306) 11.449 11.940 ( 2.765 -2.153 4.340) 5.578 12.014 ( -4.053 1.962 -3.010) 5.416 12.272 ( -0.033 -7.185 3.995) 8.221 12.414 ( -2.291 -4.979 -9.144) 10.661 12.953 ( 3.771 3.677 7.310) 9.010 13.096 ( -3.332 1.304 -6.639) 7.542 13.379 ( -0.234 1.691 0.943) 1.950 13.418 ( -0.886 3.127 -3.015) 4.433 14.717 ( -4.391 -17.472 6.334) 19.096 14.832 ( 3.772 -18.189 -4.346) 19.077 15.743 ( 3.994 9.004 1.974) 10.046 15.782 ( -5.402 6.570 -1.944) 8.725 16.387 ( -7.106 -3.323 0.164) 7.846 16.442 ( 4.043 -3.576 -4.791) 7.218 17.473 ( -1.855 6.652 18.478) 19.726 17.824 ( 5.264 5.291 -15.183) 16.918 19.551 ( -15.504 -2.876 11.358) 19.433 19.779 ( 22.899 -2.757 -10.672) 25.414 ======================= Grid point 334 (171/205) ======================= q-point: ( 0.11 0.12 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.592 ( 2.244 6.399 -5.931) 9.009 2.936 ( 16.294 -0.394 6.011) 17.372 3.087 ( -2.696 -1.745 -9.302) 9.841 3.385 ( 7.979 2.693 4.259) 9.437 4.225 ( -9.451 3.809 3.897) 10.910 4.572 ( 2.937 15.372 -12.028) 19.738 4.778 ( -17.654 1.534 0.500) 17.728 5.202 ( 6.829 -2.307 5.678) 9.176 5.414 ( -2.180 6.138 3.322) 7.312 5.604 ( 6.616 2.104 -15.618) 17.091 5.847 ( -4.224 -7.628 -11.496) 14.429 6.026 ( 0.021 5.377 10.120) 11.460 6.314 ( -5.066 -1.472 1.184) 5.407 6.582 ( 2.921 2.829 1.208) 4.242 7.044 ( -4.369 5.825 -6.357) 9.666 7.342 ( 1.891 12.382 -1.153) 12.578 7.636 ( -9.754 5.462 1.492) 11.279 7.868 ( 5.261 4.121 15.908) 17.255 8.549 ( -13.979 0.405 -7.281) 15.767 8.819 ( 2.056 -1.348 -4.407) 5.046 9.346 ( 4.601 -7.011 -8.049) 11.624 9.415 ( -0.652 0.368 5.778) 5.826 9.603 ( -8.635 -2.528 -8.368) 12.287 9.767 ( -0.838 3.952 -1.908) 4.468 9.998 ( 12.457 8.829 -6.142) 16.457 10.214 ( 17.863 -2.191 12.491) 21.907 10.802 ( -15.541 -5.469 11.138) 19.887 11.196 ( -2.346 -0.464 -2.767) 3.658 11.659 ( -0.814 -7.704 -2.421) 8.116 11.780 ( 3.043 -8.559 4.007) 9.928 11.976 ( 3.563 1.599 -2.888) 4.857 12.100 ( 8.138 -1.610 4.053) 9.233 12.199 ( -8.679 -7.461 0.207) 11.447 12.403 ( 2.881 -6.426 3.978) 8.088 12.874 ( -7.960 2.212 -3.324) 8.905 13.176 ( 7.357 2.276 2.505) 8.098 13.330 ( -2.961 0.495 1.365) 3.298 13.434 ( 1.330 3.663 1.035) 4.032 14.700 ( -3.825 -16.582 4.985) 17.733 14.882 ( 6.045 -17.686 -3.961) 19.106 15.688 ( -3.280 9.463 -0.209) 10.018 15.850 ( 4.867 5.518 2.966) 7.933 16.309 ( -4.597 -3.374 5.268) 7.764 16.503 ( 5.310 -3.340 -0.023) 6.273 17.622 ( -0.196 6.946 13.907) 15.546 17.741 ( 5.505 4.946 -20.309) 21.615 19.252 ( -25.971 0.456 4.119) 26.300 19.924 ( 9.146 -5.446 -16.435) 19.581 ======================= Grid point 335 (172/205) ======================= q-point: ( 0.22 0.12 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.629 ( 12.159 5.030 -12.630) 18.238 2.874 ( -1.560 -1.988 -20.986) 21.138 3.203 ( 9.732 3.610 -1.066) 10.435 3.603 ( -5.158 7.765 17.018) 19.404 4.053 ( -3.719 -2.767 -8.056) 9.294 4.417 ( -12.893 2.532 -2.578) 13.389 4.515 ( -4.173 17.197 -3.420) 18.023 5.262 ( -1.027 2.180 -11.677) 11.923 5.322 ( 0.270 0.092 -10.252) 10.256 5.573 ( 9.161 1.349 -18.781) 20.940 5.762 ( 5.363 -5.405 -1.401) 7.742 6.037 ( -10.091 -0.086 11.162) 15.048 6.181 ( -8.556 -0.275 -7.452) 11.350 6.591 ( -7.612 9.992 2.542) 12.816 6.897 ( -4.435 0.233 -11.007) 11.869 7.234 ( -4.102 7.616 0.038) 8.651 7.566 ( -7.213 3.501 10.592) 13.285 8.170 ( -12.120 -0.186 -8.669) 14.902 8.225 ( 7.133 5.013 17.351) 19.418 8.771 ( 0.941 3.401 -6.802) 7.663 9.304 ( -5.743 -3.459 -1.451) 6.859 9.365 ( -2.097 2.012 -7.399) 7.949 9.511 ( 7.982 -4.484 -5.291) 10.574 9.789 ( 4.685 7.722 1.684) 9.188 10.207 ( 12.731 3.839 -3.547) 13.762 10.651 ( 14.347 -3.316 8.586) 17.045 10.696 ( -7.268 -7.366 11.290) 15.315 11.048 ( -9.893 2.429 0.385) 10.194 11.648 ( 0.039 -4.082 -0.887) 4.177 11.883 ( -3.181 -9.087 1.415) 9.731 11.903 ( -2.852 -7.567 1.826) 8.290 12.164 ( 3.617 3.020 4.704) 6.658 12.288 ( 5.282 -5.383 2.741) 8.024 12.502 ( -0.067 -8.336 5.784) 10.146 12.729 ( -3.092 6.150 0.124) 6.885 13.266 ( 2.422 -1.567 1.408) 3.210 13.375 ( 3.553 1.140 3.106) 4.855 13.501 ( 2.752 -0.935 6.455) 7.079 14.669 ( -3.724 -16.096 1.794) 16.618 14.960 ( 5.806 -17.719 -2.724) 18.844 15.678 ( 1.318 13.263 2.645) 13.589 15.982 ( 5.364 5.233 5.350) 9.207 16.316 ( -2.461 -2.450 8.085) 8.799 16.621 ( 4.627 -2.548 4.370) 6.856 17.595 ( 2.034 4.168 -21.999) 22.483 17.726 ( -0.332 8.866 3.578) 9.566 18.749 ( -27.149 5.240 -2.397) 27.754 19.810 ( -0.949 -5.725 -19.104) 19.966 ======================= Grid point 336 (173/205) ======================= q-point: ( 0.33 0.12 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.590 ( -3.034 -0.342 -15.362) 15.663 2.819 ( 18.815 8.063 -17.232) 26.757 3.207 ( -10.544 14.684 -4.577) 18.648 3.478 ( -5.793 -5.030 2.271) 8.002 3.909 ( -15.552 0.016 8.365) 17.659 4.218 ( -7.215 12.582 -3.065) 14.824 4.547 ( 9.867 4.037 -4.876) 11.723 5.027 ( 0.176 3.571 -23.155) 23.429 5.302 ( 3.458 -3.524 -7.042) 8.600 5.490 ( 7.326 5.226 -21.932) 23.706 5.800 ( -14.356 -1.061 -3.631) 14.846 5.906 ( -9.742 -0.622 -4.018) 10.557 6.048 ( 5.986 -2.238 9.990) 11.860 6.296 ( -20.893 10.614 4.033) 23.779 6.688 ( -4.074 -1.609 -10.885) 11.734 7.210 ( -8.170 -1.141 0.431) 8.260 7.598 ( 2.978 4.865 8.382) 10.139 7.933 ( -4.296 2.417 0.599) 4.966 8.376 ( -3.450 0.809 -2.290) 4.219 8.776 ( 1.420 7.397 -3.175) 8.174 9.207 ( -1.882 -2.952 2.115) 4.090 9.340 ( 1.841 1.600 7.606) 7.988 9.678 ( 14.580 -4.178 -5.092) 15.998 9.933 ( 6.703 7.339 3.811) 10.645 10.344 ( 10.709 4.174 -10.349) 15.466 10.678 ( -6.850 -6.598 9.941) 13.758 10.824 ( -3.314 2.343 -0.429) 4.081 10.945 ( -0.835 1.374 -0.600) 1.716 11.624 ( -0.922 -2.507 -1.409) 3.020 11.731 ( -4.347 -3.776 2.886) 6.441 12.062 ( 3.432 -8.024 12.602) 15.328 12.264 ( -4.269 3.704 -0.957) 5.733 12.306 ( 2.302 -5.134 2.423) 6.126 12.473 ( -1.744 -6.620 -1.052) 6.926 12.818 ( 2.578 0.802 10.241) 10.591 13.355 ( 3.921 -1.186 -0.010) 4.097 13.489 ( 5.322 -6.303 7.974) 11.473 13.656 ( 4.807 -2.315 9.238) 10.668 14.607 ( -3.538 -18.749 0.028) 19.080 15.009 ( 2.653 -20.271 -4.432) 20.919 15.797 ( 6.935 16.367 5.990) 18.758 16.163 ( 5.854 8.943 10.424) 14.930 16.377 ( -0.660 -1.199 9.126) 9.228 16.732 ( 2.142 -1.487 4.354) 5.075 17.314 ( -10.391 3.525 -21.582) 24.211 17.596 ( -7.587 15.851 -14.767) 22.954 18.427 ( -4.915 5.790 3.308) 8.284 19.532 ( -7.116 -4.357 -19.911) 21.589 ======================= Grid point 337 (174/205) ======================= q-point: ( 0.44 0.12 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.428 ( -2.481 8.111 -3.979) 9.369 2.700 ( -13.786 9.959 -13.008) 21.411 3.197 ( 14.430 3.758 1.869) 15.028 3.462 ( -0.260 4.326 -4.518) 6.261 3.759 ( -6.902 -2.820 8.908) 11.617 4.050 ( -6.323 9.931 -5.758) 13.106 4.619 ( 1.309 1.145 -2.098) 2.725 4.812 ( -5.115 0.614 -12.825) 13.821 5.219 ( -9.771 4.620 -9.210) 14.200 5.360 ( -4.054 11.874 -19.063) 22.822 5.484 ( 3.758 1.883 -0.713) 4.263 5.690 ( -7.778 0.788 -4.270) 8.908 6.180 ( -6.296 0.992 16.264) 17.468 6.346 ( 13.891 -3.971 9.201) 17.129 6.534 ( -1.630 -0.542 -9.230) 9.388 6.924 ( -13.846 -5.062 -9.064) 17.306 7.784 ( 8.884 4.014 2.609) 10.092 8.034 ( 5.016 3.054 11.099) 12.557 8.195 ( -5.784 2.406 -8.459) 10.526 8.613 ( -7.704 4.900 -12.273) 15.297 9.304 ( -0.443 -6.868 14.164) 15.748 9.511 ( 5.782 -0.427 5.342) 7.883 9.890 ( 8.770 0.449 2.116) 9.033 10.061 ( 2.468 6.090 2.932) 7.195 10.433 ( 11.375 5.593 -11.276) 16.965 10.518 ( -15.830 2.024 0.920) 15.985 10.787 ( 1.120 -0.502 0.836) 1.485 10.888 ( -0.268 2.258 -4.862) 5.367 11.625 ( 1.757 0.493 1.346) 2.268 11.744 ( -0.646 2.138 1.085) 2.483 12.162 ( -0.689 -0.082 -1.754) 1.886 12.237 ( -0.620 1.047 8.193) 8.282 12.287 ( -2.188 -10.616 3.001) 11.247 12.496 ( 2.438 -9.626 -1.952) 10.120 12.979 ( 4.267 -0.960 11.092) 11.923 13.334 ( -2.943 -0.125 -4.863) 5.686 13.727 ( 6.081 -9.047 12.606) 16.666 13.832 ( 4.868 -3.195 6.338) 8.607 14.578 ( -0.574 -25.138 3.778) 25.427 14.933 ( -3.293 -25.873 -9.980) 27.925 16.044 ( 11.691 16.869 8.889) 22.366 16.374 ( -0.905 20.721 13.038) 24.498 16.461 ( 0.848 -2.723 8.830) 9.279 16.786 ( 1.729 0.285 0.951) 1.994 16.856 ( -12.942 6.904 -14.681) 20.753 17.272 ( -5.126 16.821 -24.860) 30.451 18.548 ( 7.353 3.616 9.857) 12.818 19.172 ( -10.176 -1.821 -18.959) 21.595 ======================= Grid point 338 (175/205) ======================= q-point: (-0.44 0.12 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.338 ( -12.979 7.000 5.849) 15.864 2.479 ( -1.953 14.621 6.231) 16.013 3.283 ( -9.894 9.343 -3.765) 14.119 3.457 ( 9.562 -3.541 -6.174) 11.920 3.879 ( 7.719 -1.181 8.408) 11.475 3.953 ( 7.574 6.025 -6.689) 11.765 4.536 ( -15.744 10.256 7.009) 20.055 4.629 ( -4.785 -4.335 4.080) 7.638 4.900 ( -15.631 10.103 8.361) 20.404 5.400 ( 16.254 8.431 -10.954) 21.337 5.539 ( -0.637 1.201 -6.724) 6.860 5.620 ( 8.714 0.764 2.062) 8.987 6.235 ( -7.928 -3.135 13.664) 16.105 6.426 ( -0.081 0.204 -5.401) 5.405 6.641 ( -2.910 -1.746 -11.978) 12.449 6.747 ( 20.475 -4.810 4.933) 21.603 7.907 ( -8.407 0.350 -8.451) 11.926 7.989 ( 8.751 3.150 5.444) 10.777 8.337 ( -6.597 5.022 -13.506) 15.848 8.371 ( 11.126 5.092 11.011) 16.461 9.397 ( -5.719 -7.446 13.120) 16.133 9.558 ( 0.024 -6.973 -7.686) 10.378 9.975 ( -5.574 7.913 6.699) 11.771 10.037 ( -8.100 4.007 -7.526) 11.760 10.183 ( -14.876 5.203 12.037) 19.831 10.637 ( 17.703 5.384 -9.745) 20.913 10.833 ( 2.852 -1.008 -3.173) 4.383 10.885 ( 6.671 1.001 -4.400) 8.054 11.671 ( -3.175 4.959 -2.095) 6.250 11.723 ( 4.517 2.446 1.788) 5.439 12.154 ( -3.753 -0.464 -0.753) 3.856 12.235 ( 6.368 -0.560 2.242) 6.774 12.391 ( -0.798 -10.445 5.344) 11.760 12.472 ( 1.562 -10.446 -5.898) 12.097 13.155 ( -2.307 -3.010 2.551) 4.571 13.212 ( 2.176 0.072 -1.062) 2.423 13.865 ( -1.229 -5.558 3.204) 6.532 13.915 ( 0.901 -4.544 -2.667) 5.345 14.643 ( -5.409 -30.340 6.223) 31.441 14.763 ( 1.685 -28.052 -4.039) 28.392 16.190 ( -15.044 21.445 -4.367) 26.557 16.391 ( 14.611 11.248 9.552) 20.766 16.632 ( 2.241 3.178 10.025) 10.753 16.701 ( 1.255 6.232 -3.356) 7.189 16.829 ( -6.907 5.107 -3.731) 9.365 16.981 ( 7.118 19.671 -9.776) 23.091 18.768 ( -6.901 -0.897 -2.351) 7.345 18.865 ( 5.789 3.287 1.275) 6.778 ======================= Grid point 339 (176/205) ======================= q-point: (-0.33 0.12 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.255 ( -7.490 4.080 15.722) 17.886 2.440 ( -19.780 12.348 17.979) 29.444 3.171 ( 4.338 15.357 -0.323) 15.962 3.552 ( 9.789 -9.903 -3.308) 14.312 4.050 ( 6.674 5.944 -5.318) 10.399 4.178 ( 11.799 6.117 2.314) 13.490 4.394 ( -6.882 2.582 12.269) 14.302 4.594 ( -9.056 10.494 14.613) 20.141 4.850 ( -8.202 3.514 22.369) 24.083 5.382 ( -6.216 2.206 0.341) 6.605 5.718 ( 17.387 -2.767 -0.391) 17.610 5.871 ( 13.544 1.413 1.523) 13.702 6.131 ( -8.276 -3.511 1.944) 9.197 6.491 ( 14.079 4.040 -6.768) 16.135 6.556 ( 1.169 -1.117 -3.782) 4.113 7.160 ( 16.246 -2.199 4.968) 17.131 7.692 ( -5.291 2.589 -4.907) 7.666 8.112 ( -0.659 2.616 -12.953) 13.231 8.240 ( 8.590 3.902 7.980) 12.357 8.663 ( 8.852 4.796 7.450) 12.524 9.310 ( -8.920 -0.806 -4.332) 9.949 9.450 ( -5.749 -9.743 2.518) 11.590 9.644 ( -17.855 6.694 -6.354) 20.099 9.931 ( -7.100 8.296 4.067) 11.652 10.178 ( -1.009 0.456 5.339) 5.453 10.800 ( 5.054 2.239 -2.745) 6.171 10.843 ( 4.117 -4.761 -6.027) 8.714 10.990 ( 8.064 1.887 -3.826) 9.123 11.609 ( -0.903 1.939 -0.608) 2.223 11.808 ( 4.550 -1.106 -2.892) 5.504 12.167 ( 2.863 0.132 4.969) 5.736 12.303 ( -3.067 -10.943 -8.859) 14.410 12.365 ( 3.352 -0.715 -0.555) 3.472 12.462 ( -0.003 -6.445 -1.065) 6.532 13.025 ( -2.029 -2.562 -8.418) 9.031 13.308 ( -0.616 -1.018 4.110) 4.279 13.705 ( -9.776 -9.481 -11.250) 17.665 13.833 ( -3.044 -3.937 -7.492) 8.994 14.570 ( -1.432 -20.885 3.331) 21.198 14.879 ( 0.847 -26.938 8.205) 28.173 15.904 ( -11.062 21.663 -4.009) 24.652 16.446 ( -10.189 13.104 -17.251) 23.940 16.539 ( 0.526 -1.589 -5.775) 6.012 16.785 ( 1.539 0.827 0.448) 1.803 16.887 ( 8.595 1.020 17.770) 19.766 17.312 ( 20.915 25.635 12.093) 35.226 18.528 ( -3.879 3.780 -6.592) 8.532 19.157 ( 8.071 -0.753 15.910) 17.856 ======================= Grid point 340 (177/205) ======================= q-point: (-0.22 0.12 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.257 ( -17.798 5.157 20.899) 27.931 2.369 ( -4.667 4.055 25.991) 26.716 3.283 ( 6.353 6.456 -4.952) 10.323 3.803 ( 13.616 3.901 8.943) 16.751 3.874 ( -18.998 0.405 0.215) 19.004 4.414 ( 14.534 4.603 -4.643) 15.937 4.461 ( 3.938 13.487 3.006) 14.368 4.741 ( 1.116 6.294 26.221) 26.989 4.994 ( -5.560 1.915 27.911) 28.523 5.322 ( -0.660 2.747 2.206) 3.584 5.874 ( -5.338 -3.510 -7.000) 9.477 6.036 ( 13.677 -7.035 5.068) 16.194 6.194 ( 8.975 -0.004 0.241) 8.978 6.539 ( -1.373 -4.754 2.273) 5.445 6.788 ( 17.887 11.079 -0.287) 21.042 7.272 ( -3.140 4.574 -2.117) 5.938 7.713 ( 6.120 3.572 -0.895) 7.143 8.067 ( 7.893 -0.579 -3.072) 8.490 8.450 ( 6.371 0.914 0.777) 6.483 8.721 ( -6.313 9.178 -4.447) 11.994 9.151 ( -4.038 1.789 4.392) 6.228 9.383 ( -6.814 -9.476 5.473) 12.892 9.408 ( 0.398 5.648 -2.352) 6.131 9.835 ( -4.154 7.401 -1.831) 8.682 10.206 ( 2.084 -1.114 -3.347) 4.097 10.721 ( -11.362 -1.203 -0.876) 11.459 10.853 ( 2.723 -10.413 -4.549) 11.685 11.098 ( 8.540 3.102 -3.842) 9.864 11.616 ( 0.111 -2.923 1.726) 3.396 11.863 ( 4.406 -6.190 -2.215) 7.914 12.124 ( -4.125 -12.083 -12.519) 17.881 12.239 ( -4.274 -3.470 0.832) 5.567 12.312 ( -0.084 2.366 -2.537) 3.470 12.530 ( 4.643 -0.808 1.879) 5.074 12.875 ( -3.984 2.107 -11.923) 12.747 13.268 ( -4.083 -3.349 1.279) 5.434 13.463 ( -5.337 -5.178 -5.982) 9.544 13.672 ( -4.377 -1.716 -9.448) 10.553 14.632 ( 1.952 -15.654 4.981) 16.543 14.907 ( -3.916 -22.538 3.640) 23.164 15.725 ( -5.238 19.444 -1.563) 20.198 16.129 ( -9.096 8.711 -9.442) 15.741 16.482 ( 1.147 -1.720 -7.430) 7.712 16.737 ( -3.693 -1.883 -6.172) 7.435 17.147 ( 0.224 2.679 19.184) 19.371 17.761 ( 13.350 13.869 1.280) 19.293 18.677 ( 24.728 7.738 4.599) 26.316 19.434 ( 3.200 -3.008 17.102) 17.657 ======================= Grid point 341 (178/205) ======================= q-point: (-0.11 0.12 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.270 ( -3.985 2.914 20.990) 21.562 2.576 ( -4.471 6.796 27.765) 28.932 3.242 ( -1.837 -7.277 -11.974) 14.132 3.537 ( -10.557 1.202 -6.067) 12.235 4.122 ( 4.012 15.702 17.742) 24.030 4.522 ( 9.235 10.973 -8.110) 16.476 4.690 ( 10.970 2.749 5.877) 12.745 5.034 ( -1.890 3.324 28.963) 29.214 5.176 ( -1.932 1.904 19.149) 19.340 5.397 ( 5.225 0.683 0.565) 5.299 5.737 ( 0.536 4.798 -4.330) 6.486 6.231 ( 2.625 -7.806 -2.805) 8.700 6.342 ( 9.819 -1.395 -1.940) 10.106 6.527 ( -6.118 -8.550 7.256) 12.774 6.990 ( 7.110 14.388 -3.393) 16.404 7.236 ( -2.368 10.943 6.487) 12.940 7.729 ( 1.695 4.262 -4.928) 6.732 8.236 ( -8.952 3.998 -16.883) 19.523 8.358 ( 12.897 -1.881 7.887) 15.234 8.720 ( 3.463 4.667 5.685) 8.130 9.193 ( -1.141 -4.263 7.876) 9.028 9.358 ( -1.402 -5.987 5.641) 8.345 9.523 ( 8.605 7.204 3.036) 11.626 9.760 ( 0.240 6.684 -5.731) 8.808 10.146 ( 0.631 -1.111 -14.659) 14.714 10.412 ( -17.250 -2.214 -5.852) 18.350 10.882 ( 2.574 -13.037 2.665) 13.554 11.201 ( 4.745 3.128 -2.986) 6.420 11.622 ( -0.798 -6.556 1.641) 6.805 11.892 ( -1.743 -0.404 3.332) 3.782 11.925 ( -4.267 -13.083 -9.825) 16.909 12.149 ( -5.004 2.028 -1.522) 5.610 12.247 ( -0.347 -8.875 -4.286) 9.862 12.566 ( -1.712 -2.332 -8.723) 9.190 12.786 ( 4.413 8.528 3.290) 10.150 13.227 ( -3.288 1.221 -1.212) 3.711 13.362 ( -0.516 -2.833 -2.209) 3.629 13.514 ( -3.469 0.277 -6.597) 7.459 14.705 ( 0.132 -15.563 4.523) 16.207 14.850 ( -2.975 -20.100 -0.243) 20.321 15.682 ( 0.656 14.378 0.635) 14.407 15.920 ( -6.747 6.061 -4.160) 9.978 16.441 ( 2.531 -2.904 -6.908) 7.909 16.560 ( -7.782 -2.699 -5.581) 9.950 17.319 ( -2.465 5.547 19.749) 20.661 17.855 ( 5.059 6.921 -8.641) 12.173 19.306 ( 34.580 2.937 -0.645) 34.711 19.593 ( -4.731 -3.874 15.599) 16.755 ======================= Grid point 342 (179/205) ======================= q-point: ( 0.00 0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.572 ( 5.844 3.554 16.082) 17.476 2.877 ( -4.680 2.078 -12.525) 13.531 2.980 ( 5.332 0.317 19.941) 20.644 3.349 ( 0.612 -1.824 -15.071) 15.194 4.581 ( -12.946 15.300 13.807) 24.338 4.828 ( 8.550 7.624 -8.182) 14.077 4.940 ( 2.204 6.561 6.842) 9.733 5.096 ( 0.483 0.412 -4.245) 4.293 5.476 ( 2.885 0.215 15.524) 15.791 5.554 ( -0.618 9.223 7.179) 11.704 5.919 ( -15.465 -10.181 2.071) 18.631 6.003 ( 18.899 1.220 -7.995) 20.556 6.408 ( -5.604 5.389 6.287) 9.999 6.479 ( 9.129 3.577 -3.447) 10.393 7.454 ( 0.700 18.231 8.148) 19.981 7.565 ( 0.306 17.001 0.066) 17.004 7.820 ( -0.069 5.999 5.038) 7.834 8.057 ( -9.076 11.085 -15.675) 21.236 8.643 ( 9.743 -0.158 10.454) 14.291 8.819 ( -4.186 2.219 -6.458) 8.009 9.112 ( 6.371 -8.559 6.604) 12.548 9.280 ( -0.732 -8.243 -5.785) 10.097 9.723 ( -9.057 -1.770 2.207) 9.489 9.805 ( 8.187 -6.128 2.670) 10.569 9.972 ( -7.641 6.169 -2.866) 10.230 10.152 ( 4.116 3.981 -11.583) 12.921 10.807 ( 1.608 -7.466 12.023) 14.243 11.065 ( -1.817 -11.068 -12.170) 16.550 11.503 ( -2.820 -7.541 3.044) 8.607 11.546 ( 2.753 -8.190 -1.865) 8.840 11.860 ( 2.459 -7.492 7.682) 11.008 12.032 ( -2.374 -4.220 -8.166) 9.494 12.249 ( 1.709 5.973 1.732) 6.449 12.345 ( -6.290 1.283 -7.509) 9.879 12.932 ( 3.580 -4.382 3.673) 6.746 13.049 ( -5.178 -4.903 -7.585) 10.410 13.488 ( -2.920 7.637 3.704) 8.976 13.534 ( 4.149 6.800 -0.974) 8.025 14.322 ( -3.587 -19.523 7.095) 21.079 14.440 ( 2.656 -18.679 -3.900) 19.265 15.888 ( 0.991 4.521 -0.762) 4.690 15.900 ( -3.256 5.058 -2.096) 6.371 16.299 ( -7.175 -4.848 -0.750) 8.692 16.341 ( 3.743 -5.905 -4.593) 8.365 17.652 ( -1.028 10.228 16.556) 19.488 17.953 ( 3.342 6.422 -12.362) 14.326 19.475 ( -11.455 -4.150 9.631) 15.531 19.691 ( 17.165 -5.781 -11.055) 21.220 ======================= Grid point 343 (180/205) ======================= q-point: ( 0.11 0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.747 ( 6.427 7.618 -12.350) 15.870 2.854 ( 5.465 -4.802 7.081) 10.152 3.158 ( 6.601 5.660 -11.621) 14.514 3.384 ( 14.860 -2.420 5.695) 16.097 4.384 ( -19.735 10.536 7.795) 23.690 4.778 ( -12.176 3.352 0.182) 12.631 4.948 ( 0.591 13.504 -4.712) 14.315 5.157 ( 6.313 -0.814 -0.312) 6.372 5.535 ( -4.371 2.945 7.626) 9.270 5.640 ( -2.959 -0.527 -1.505) 3.361 5.668 ( -0.205 -5.225 -11.624) 12.746 6.206 ( 6.328 10.387 -6.164) 13.636 6.302 ( -4.716 0.006 0.422) 4.735 6.618 ( 9.812 3.393 -5.827) 11.905 7.287 ( -13.394 15.362 -1.134) 20.412 7.622 ( -4.289 13.846 -0.965) 14.527 7.787 ( -8.987 9.114 -1.720) 12.915 8.029 ( 10.088 12.076 16.042) 22.471 8.538 ( -14.742 -1.979 -11.509) 18.807 8.822 ( 2.803 2.458 2.683) 4.593 9.192 ( 5.656 -6.709 -10.883) 13.980 9.336 ( 6.554 -8.697 3.148) 11.336 9.579 ( -10.880 -0.482 3.531) 11.449 9.837 ( 0.727 2.236 0.452) 2.394 10.120 ( 12.634 -4.852 8.526) 15.995 10.213 ( 13.458 7.596 -6.587) 16.798 10.642 ( -15.608 -8.671 1.236) 17.898 11.149 ( 5.740 -5.995 0.347) 8.307 11.431 ( -3.763 -9.964 0.878) 10.687 11.600 ( 2.836 -7.451 -0.655) 7.999 11.913 ( -2.176 -9.125 -10.077) 13.768 11.992 ( 2.078 -8.104 8.111) 11.652 12.197 ( -1.477 5.432 3.093) 6.423 12.366 ( 2.991 4.561 5.997) 8.106 12.831 ( -7.755 -5.723 -1.617) 9.773 13.127 ( 7.482 -4.693 4.400) 9.867 13.412 ( -5.804 7.143 0.885) 9.246 13.575 ( 1.152 7.568 -2.483) 8.048 14.348 ( -1.760 -17.170 5.755) 18.194 14.463 ( 4.809 -20.853 -4.583) 21.886 15.849 ( -1.197 5.385 1.682) 5.767 15.952 ( 4.223 4.445 2.538) 6.636 16.219 ( -4.025 -5.037 4.918) 8.109 16.409 ( 5.628 -5.552 0.902) 7.957 17.797 ( 0.544 9.258 12.418) 15.498 17.874 ( 4.190 7.419 -16.623) 18.679 19.261 ( -20.143 0.496 4.987) 20.757 19.767 ( 6.304 -9.514 -14.718) 18.625 ======================= Grid point 344 (181/205) ======================= q-point: ( 0.22 0.25 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.756 ( 4.035 5.544 -12.318) 14.098 2.891 ( 12.326 5.502 -16.173) 21.065 3.265 ( 10.920 2.001 -3.422) 11.617 3.749 ( 6.727 3.705 11.997) 14.244 4.052 ( -15.473 3.791 -3.955) 16.414 4.482 ( -17.716 3.070 2.523) 18.156 4.845 ( -7.348 12.297 -4.680) 15.070 5.224 ( 2.371 -3.250 -2.267) 4.618 5.404 ( -2.897 2.442 -19.347) 19.715 5.612 ( 5.434 4.391 1.893) 7.239 5.664 ( 4.726 -1.775 -5.845) 7.723 6.075 ( -10.439 3.979 0.414) 11.180 6.246 ( -3.141 5.267 -10.480) 12.143 6.651 ( 6.708 -2.579 -16.618) 18.105 7.051 ( -17.035 13.606 1.958) 21.889 7.428 ( -10.404 10.228 -1.910) 14.714 7.681 ( -7.377 7.820 8.951) 13.989 8.150 ( -10.365 -1.459 -9.814) 14.348 8.369 ( 5.579 8.433 10.258) 14.404 8.904 ( 5.153 10.104 3.145) 11.770 9.190 ( -0.059 -6.029 -4.038) 7.257 9.329 ( -1.553 -6.491 -6.696) 9.454 9.516 ( 0.906 4.386 2.762) 5.262 9.915 ( 4.893 2.566 3.328) 6.450 10.328 ( 14.070 6.367 -9.457) 18.109 10.469 ( -5.703 -10.563 9.859) 15.534 10.578 ( 16.687 -5.681 7.601) 19.196 11.101 ( -8.548 2.575 0.557) 8.945 11.453 ( 2.058 -15.730 2.194) 16.015 11.637 ( 0.822 -9.576 -0.849) 9.649 11.755 ( -3.798 -7.352 -2.286) 8.584 12.102 ( 3.654 -8.813 3.684) 10.227 12.291 ( 2.811 2.245 6.202) 7.170 12.470 ( -1.251 7.283 8.556) 11.305 12.720 ( -3.947 -6.318 2.508) 7.860 13.268 ( 1.619 2.236 1.426) 3.107 13.366 ( 1.812 0.370 2.875) 3.418 13.558 ( -0.172 4.491 -0.138) 4.497 14.339 ( -4.457 -17.186 2.314) 17.904 14.509 ( 5.096 -22.368 -4.897) 23.458 15.889 ( 1.965 5.857 4.659) 7.737 16.104 ( 6.929 6.642 7.920) 12.444 16.242 ( -1.206 -4.602 8.117) 9.408 16.546 ( 5.320 -4.641 5.144) 8.735 17.742 ( 1.242 9.726 -18.726) 21.137 17.930 ( 2.619 9.771 5.647) 11.586 18.881 ( -22.635 7.108 -0.087) 23.725 19.646 ( -1.646 -9.899 -16.189) 19.047 ======================= Grid point 345 (182/205) ======================= q-point: ( 0.33 0.25 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.655 ( 2.083 6.315 -12.483) 14.144 3.065 ( 21.332 15.575 -15.193) 30.471 3.372 ( -5.543 -5.449 -3.007) 8.335 3.505 ( -13.788 13.118 0.022) 19.031 3.905 ( -18.263 -0.894 9.775) 20.734 4.402 ( 5.693 4.243 -4.927) 8.642 4.626 ( -5.265 2.830 -9.046) 10.842 5.124 ( -2.063 -0.363 -20.004) 20.114 5.285 ( 2.389 5.608 0.672) 6.132 5.601 ( 5.292 5.851 -12.760) 15.001 5.799 ( 2.036 1.355 -3.281) 4.092 5.912 ( -8.430 -0.230 4.488) 9.553 6.033 ( -3.238 3.538 -6.147) 7.797 6.539 ( -8.849 7.673 -9.198) 14.892 6.677 ( -12.472 5.354 -5.918) 14.807 7.170 ( -18.172 -2.348 -1.672) 18.399 7.736 ( 4.532 7.891 4.638) 10.214 8.013 ( -0.089 5.443 2.653) 6.056 8.406 ( -4.311 2.405 -3.019) 5.786 8.944 ( -3.505 6.093 -7.100) 9.991 9.131 ( -4.213 -3.754 5.546) 7.912 9.342 ( 5.103 0.627 4.710) 6.973 9.675 ( 13.271 3.613 2.240) 13.935 10.057 ( 5.837 2.323 3.894) 7.391 10.456 ( 11.471 2.402 -10.302) 15.604 10.519 ( -1.295 -3.805 9.849) 10.638 10.859 ( 4.172 0.907 -1.733) 4.607 10.964 ( -4.985 0.386 2.104) 5.425 11.507 ( 2.228 -10.709 3.991) 11.644 11.619 ( 1.993 -6.865 2.576) 7.599 11.830 ( 4.609 -9.799 7.688) 13.280 12.169 ( 0.100 -8.525 0.218) 8.528 12.359 ( -0.580 0.798 3.226) 3.374 12.449 ( -6.202 8.961 2.831) 11.260 12.763 ( 1.181 -6.112 8.021) 10.154 13.304 ( 4.226 0.528 0.995) 4.374 13.441 ( 1.051 -1.281 0.614) 1.767 13.610 ( 2.897 -1.456 6.460) 7.227 14.239 ( -7.440 -18.828 0.761) 20.259 14.518 ( 1.949 -23.434 -7.605) 24.714 16.011 ( 4.862 4.716 7.014) 9.751 16.310 ( 0.346 -1.497 10.257) 10.371 16.370 ( 8.617 5.604 11.098) 15.126 16.679 ( 2.910 -3.587 5.394) 7.101 17.521 ( -4.918 16.087 -17.718) 24.432 17.949 ( -2.831 16.646 -6.145) 17.968 18.568 ( -8.462 7.436 1.839) 11.414 19.403 ( -6.330 -8.084 -16.292) 19.258 ======================= Grid point 346 (183/205) ======================= q-point: ( 0.44 0.25 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.631 ( 5.484 10.409 -5.257) 12.886 2.876 ( -22.973 6.185 -3.689) 24.076 3.368 ( 9.197 12.797 3.198) 16.080 3.571 ( 11.133 4.545 -9.727) 15.467 3.698 ( -8.613 -2.955 10.719) 14.065 4.211 ( -10.788 6.669 -13.380) 18.436 4.585 ( 1.474 -2.976 -3.968) 5.174 4.873 ( -4.621 0.535 -16.140) 16.797 5.376 ( 1.426 7.768 6.082) 9.968 5.588 ( 6.740 11.195 -12.412) 18.023 5.623 ( -10.123 10.867 -3.074) 15.166 5.715 ( -7.750 2.742 -5.361) 9.815 6.159 ( -1.031 -6.582 13.501) 15.055 6.325 ( 4.361 7.053 -1.969) 8.523 6.549 ( -0.771 1.956 -5.910) 6.273 6.800 ( -14.993 -5.931 -6.983) 17.571 7.880 ( 8.696 5.106 -0.277) 10.088 8.094 ( -1.703 2.451 1.621) 3.396 8.287 ( -0.060 6.307 1.979) 6.610 8.719 ( -7.782 3.694 -11.869) 14.666 9.184 ( -1.856 -3.833 12.624) 13.323 9.453 ( 4.797 -2.449 -3.864) 6.629 9.953 ( 7.430 2.951 10.034) 12.829 10.162 ( 1.037 1.771 2.505) 3.239 10.495 ( -12.488 -1.948 10.630) 16.515 10.593 ( 14.599 7.377 -13.049) 20.925 10.799 ( -2.258 1.428 0.459) 2.711 10.922 ( 0.864 0.796 -5.952) 6.067 11.645 ( 6.969 -0.054 5.256) 8.729 11.767 ( 5.093 -0.399 6.120) 7.972 11.996 ( 4.578 -11.617 5.812) 13.773 12.098 ( -4.225 -7.064 -2.220) 8.525 12.350 ( -5.753 7.153 0.053) 9.180 12.355 ( -0.680 -1.086 -1.326) 1.844 12.898 ( 4.263 -7.094 9.742) 12.783 13.309 ( -3.741 -2.357 -7.727) 8.903 13.547 ( 6.518 -6.469 11.466) 14.691 13.748 ( 4.317 -4.621 4.658) 7.854 14.123 ( -6.593 -20.585 3.242) 21.857 14.408 ( -2.484 -22.453 -12.348) 25.744 16.200 ( 7.027 1.832 8.268) 11.004 16.388 ( -1.053 -3.992 5.572) 6.935 16.632 ( 5.269 3.629 9.671) 11.596 16.750 ( 0.816 -2.920 1.875) 3.565 17.274 ( -7.210 29.956 -2.416) 30.906 17.728 ( -2.943 24.786 -20.461) 32.275 18.618 ( 4.540 2.250 8.408) 9.817 19.107 ( -7.723 -4.724 -15.516) 17.964 ======================= Grid point 347 (184/205) ======================= q-point: (-0.44 0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.484 ( -17.258 7.016 8.170) 20.343 2.805 ( 7.946 14.729 3.756) 17.152 3.352 ( -11.385 -4.085 7.640) 14.307 3.567 ( -1.157 14.376 -11.966) 18.740 3.921 ( 9.228 5.243 3.335) 11.125 4.000 ( 14.309 -1.154 -8.297) 16.581 4.552 ( -7.768 -1.943 6.809) 10.511 4.670 ( -2.862 1.281 -5.012) 5.912 5.276 ( -16.706 23.095 11.916) 30.894 5.531 ( -4.768 2.553 1.992) 5.763 5.599 ( 3.101 3.989 -5.872) 7.746 5.709 ( 14.802 9.536 -4.728) 18.232 6.144 ( -10.707 -5.396 10.023) 15.627 6.475 ( 6.044 4.368 -8.292) 11.152 6.550 ( 0.867 -6.946 -8.135) 10.732 6.672 ( 16.855 -0.380 5.401) 17.704 7.928 ( -8.472 2.142 -5.185) 10.161 8.052 ( 9.311 2.988 1.636) 9.914 8.468 ( -4.847 6.038 -10.828) 13.312 8.495 ( 9.316 5.953 8.758) 14.104 9.266 ( -4.353 -3.801 12.704) 13.957 9.427 ( 0.630 -4.440 -10.062) 11.016 10.081 ( -4.831 -0.075 8.994) 10.209 10.105 ( -8.320 1.427 -2.829) 8.903 10.300 ( -16.749 5.719 13.606) 22.324 10.749 ( 12.919 3.716 -11.244) 17.526 10.820 ( 3.148 0.751 -0.776) 3.328 10.909 ( 5.814 1.385 -6.676) 8.960 11.751 ( -6.167 0.920 -3.784) 7.294 11.823 ( 5.068 6.990 1.793) 8.818 12.058 ( -0.143 -8.578 0.351) 8.586 12.080 ( 0.781 -12.565 -1.500) 12.678 12.291 ( -0.129 2.645 3.722) 4.568 12.359 ( 3.814 1.026 -1.409) 4.194 13.046 ( -5.609 -7.504 3.686) 10.067 13.166 ( 4.456 -5.060 -2.301) 7.124 13.725 ( -1.767 -7.259 3.286) 8.161 13.789 ( 0.588 -6.592 -4.932) 8.254 14.122 ( -1.014 -19.621 12.120) 23.085 14.255 ( 1.215 -20.783 -8.531) 22.498 16.337 ( -5.551 -0.807 -3.608) 6.669 16.403 ( 6.292 -3.357 4.207) 8.280 16.712 ( -1.677 0.392 2.110) 2.723 16.759 ( 1.583 -0.763 -1.272) 2.169 17.207 ( -12.809 29.077 11.764) 33.881 17.607 ( 16.345 33.134 -15.751) 40.163 18.736 ( -7.954 -2.876 3.862) 9.298 18.919 ( 7.494 1.255 -4.394) 8.778 ======================= Grid point 348 (185/205) ======================= q-point: (-0.33 0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.378 ( -8.073 7.553 14.211) 18.005 2.770 ( -22.984 19.045 12.817) 32.485 3.303 ( -0.074 -9.314 3.502) 9.951 3.578 ( 19.178 17.033 -5.997) 26.341 4.044 ( 2.812 -5.072 -2.396) 6.274 4.307 ( 7.753 5.955 6.171) 11.560 4.478 ( 5.691 3.550 0.721) 6.746 4.716 ( -2.432 0.705 17.560) 17.741 5.152 ( -11.962 23.308 14.283) 29.839 5.440 ( -4.932 3.508 0.471) 6.071 5.696 ( 7.247 1.509 3.831) 8.335 5.885 ( 4.880 0.574 -0.750) 4.970 6.061 ( -3.529 -3.675 5.075) 7.191 6.475 ( -0.895 -6.895 -6.032) 9.205 6.646 ( 19.462 11.224 -1.912) 22.548 7.111 ( 21.453 -2.058 4.302) 21.976 7.760 ( -5.317 4.297 -1.168) 6.936 8.170 ( 1.653 2.026 -7.120) 7.585 8.354 ( 5.026 7.241 -1.487) 8.939 8.774 ( 9.486 4.272 8.312) 13.317 9.253 ( -6.093 -7.703 1.843) 9.992 9.328 ( -2.183 3.330 -1.903) 4.413 9.800 ( -15.197 6.830 -7.432) 18.244 10.034 ( -9.385 -0.633 6.877) 11.652 10.212 ( -8.198 3.074 10.405) 13.599 10.736 ( -0.197 -4.108 -9.015) 9.908 10.859 ( 0.294 3.247 -3.701) 4.932 11.005 ( 8.345 -0.321 -2.893) 8.838 11.606 ( -2.832 -5.725 -5.640) 8.521 11.759 ( -3.902 -3.881 -8.732) 10.321 11.982 ( -4.525 -13.565 -6.592) 15.746 12.138 ( 2.938 -3.618 3.207) 5.657 12.388 ( 3.134 0.298 0.157) 3.152 12.448 ( 6.753 7.358 3.111) 10.460 12.903 ( -3.454 -7.923 -4.405) 9.701 13.292 ( 1.294 -0.767 3.451) 3.765 13.522 ( -8.024 -6.336 -9.237) 13.779 13.748 ( -1.539 -4.065 -5.670) 7.144 14.235 ( 4.321 -14.002 3.092) 14.977 14.324 ( 1.503 -24.941 9.063) 26.579 16.157 ( -6.439 4.833 -6.995) 10.666 16.470 ( 1.717 -4.958 -4.978) 7.233 16.601 ( -8.256 2.450 -9.089) 12.521 16.769 ( -0.095 -2.505 -2.809) 3.765 17.146 ( -4.434 23.214 16.932) 29.073 17.892 ( 18.218 26.371 -2.555) 32.154 18.607 ( 0.144 3.549 -0.590) 3.601 19.132 ( 8.427 -1.844 8.760) 12.295 ======================= Grid point 349 (186/205) ======================= q-point: (-0.22 0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.400 ( -12.531 8.543 18.914) 24.244 2.547 ( -10.401 12.815 17.062) 23.738 3.302 ( -0.479 -3.758 -4.172) 5.635 3.811 ( -19.787 -4.554 5.819) 21.121 4.039 ( 24.825 14.637 -0.619) 28.825 4.510 ( 13.646 5.347 -0.387) 14.661 4.744 ( 12.085 8.656 4.488) 15.528 4.867 ( -4.426 2.531 22.694) 23.259 5.130 ( -7.705 14.925 17.977) 24.602 5.403 ( 0.262 5.189 2.264) 5.667 5.807 ( 1.831 -3.226 -6.885) 7.821 5.983 ( 5.459 3.699 12.722) 14.330 6.143 ( 6.086 -4.372 2.602) 7.932 6.393 ( -5.057 -9.582 1.400) 10.925 7.050 ( 21.285 13.792 1.912) 25.435 7.398 ( 4.921 7.275 1.525) 8.915 7.783 ( 6.969 2.576 2.251) 7.763 8.097 ( 3.384 3.713 -6.596) 8.291 8.474 ( 5.212 2.019 -1.026) 5.683 8.947 ( 1.615 9.400 1.273) 9.623 9.129 ( -8.449 -4.753 -0.032) 9.695 9.281 ( -4.627 3.244 0.830) 5.712 9.550 ( 0.341 7.217 -2.568) 7.668 9.926 ( -7.054 -0.694 3.177) 7.767 10.193 ( -2.065 0.135 3.013) 3.655 10.621 ( -3.087 -9.609 -6.308) 11.902 10.687 ( -14.298 -2.230 -3.394) 14.863 11.135 ( 8.571 0.334 -2.141) 8.840 11.518 ( -2.137 -8.373 -4.284) 9.645 11.662 ( 1.563 -13.815 -4.646) 14.659 11.818 ( -5.501 -11.629 -6.230) 14.294 12.152 ( -0.992 -5.205 -1.466) 5.498 12.393 ( -1.162 4.031 -3.323) 5.352 12.601 ( 7.004 8.005 -2.120) 10.846 12.825 ( -0.610 -6.148 -6.318) 8.837 13.249 ( -1.548 3.226 0.436) 3.605 13.403 ( -3.501 -1.250 -0.208) 3.723 13.637 ( -2.494 -1.647 -7.263) 7.854 14.347 ( 4.748 -15.621 1.595) 16.404 14.385 ( -4.135 -23.434 7.301) 24.891 15.994 ( -4.125 6.892 -5.539) 9.757 16.301 ( -10.663 6.890 -10.712) 16.611 16.418 ( 0.850 -4.219 -8.521) 9.546 16.675 ( -4.762 -4.021 -6.887) 9.288 17.316 ( -1.197 14.075 21.249) 25.516 18.038 ( 3.131 10.686 -4.856) 12.148 18.870 ( 25.347 10.060 1.690) 27.322 19.354 ( 4.133 -4.444 11.389) 12.905 ======================= Grid point 350 (187/205) ======================= q-point: (-0.11 0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.387 ( -6.062 7.989 18.785) 21.294 2.700 ( 1.112 4.590 21.837) 22.342 3.146 ( -8.809 -1.842 -10.597) 13.903 3.516 ( -9.894 -3.044 -3.423) 10.903 4.465 ( 15.720 15.905 4.329) 22.778 4.734 ( 8.839 4.745 1.475) 10.140 4.842 ( -1.423 13.851 3.529) 14.364 5.060 ( -0.877 -0.360 17.847) 17.873 5.251 ( 0.332 5.502 17.524) 18.370 5.482 ( 2.252 7.670 5.081) 9.471 5.792 ( 11.360 -2.093 -11.242) 16.118 6.118 ( -7.290 -2.976 5.424) 9.562 6.309 ( 3.375 -0.457 13.271) 13.701 6.377 ( 3.052 -4.760 1.673) 5.897 7.318 ( 8.132 17.120 -2.099) 19.070 7.494 ( 3.306 13.504 8.089) 16.085 7.845 ( 0.122 6.288 -3.396) 7.147 8.256 ( 9.319 -0.787 3.894) 10.131 8.438 ( -1.165 7.693 -11.341) 13.754 8.864 ( -1.068 10.238 -1.611) 10.419 9.036 ( -3.212 -7.359 2.709) 8.474 9.278 ( -0.944 -5.167 6.670) 8.490 9.658 ( 4.793 3.129 4.212) 7.107 9.858 ( -0.652 2.765 -6.057) 6.690 10.140 ( -2.975 1.160 -6.987) 7.683 10.343 ( -14.933 -4.364 -5.027) 16.350 10.600 ( 4.452 -12.673 3.673) 13.925 11.220 ( 1.095 -2.436 -4.252) 5.021 11.463 ( 0.787 -10.088 -1.598) 10.244 11.606 ( -3.804 -14.170 -3.548) 15.095 11.761 ( 1.274 -8.073 4.083) 9.136 12.122 ( 0.687 -5.222 -4.246) 6.765 12.281 ( -4.353 7.168 -5.187) 9.860 12.554 ( -3.944 3.199 -11.095) 12.202 12.823 ( 4.950 -4.128 -0.611) 6.474 13.240 ( -5.111 -0.445 -5.014) 7.173 13.380 ( 4.117 5.650 4.527) 8.328 13.548 ( -1.916 2.621 -1.573) 3.607 14.348 ( -5.929 -22.950 5.655) 24.369 14.421 ( 2.603 -15.724 -0.574) 15.949 15.902 ( -1.007 6.354 -3.312) 7.235 16.044 ( -7.472 6.034 -6.548) 11.624 16.355 ( 1.832 -5.199 -7.797) 9.549 16.482 ( -8.070 -4.602 -6.114) 11.121 17.496 ( -1.805 11.450 19.485) 22.672 18.008 ( 1.837 6.723 -7.843) 10.493 19.362 ( 26.648 1.982 -4.123) 27.038 19.491 ( -2.213 -5.490 11.300) 12.757 ======================= Grid point 351 (188/205) ======================= q-point: ( 0.00 0.38 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.636 ( 3.766 2.501 7.690) 8.921 2.774 ( 3.591 -5.644 -3.754) 7.671 3.128 ( 0.686 7.583 7.271) 10.529 3.306 ( -0.335 -2.316 -8.084) 8.416 4.801 ( -8.245 4.692 8.079) 12.460 4.875 ( -0.706 0.169 1.464) 1.634 5.130 ( -0.370 8.990 4.121) 9.896 5.216 ( 5.118 11.322 -5.072) 13.421 5.478 ( -0.357 -0.388 12.474) 12.485 5.670 ( -4.240 -6.696 -2.873) 8.430 5.732 ( -11.310 0.559 8.729) 14.297 5.927 ( 19.891 -6.034 -7.882) 22.230 6.587 ( 6.300 8.357 5.699) 11.917 6.622 ( 4.008 8.730 3.728) 10.304 7.789 ( -5.441 11.262 5.702) 13.746 7.840 ( -2.320 9.084 3.548) 10.024 8.030 ( 7.844 15.433 8.644) 19.350 8.325 ( -5.518 12.368 -13.722) 19.280 8.646 ( 11.581 -0.738 7.369) 13.747 8.846 ( -11.425 -1.164 -8.537) 14.309 9.009 ( 0.426 0.369 2.023) 2.100 9.124 ( 5.706 -2.071 -7.841) 9.916 9.528 ( -3.268 -16.344 8.416) 18.672 9.647 ( -4.530 -10.342 -4.969) 12.336 10.096 ( -7.600 5.019 0.804) 9.143 10.201 ( 6.602 0.368 -8.655) 10.891 10.681 ( 9.989 -4.013 6.394) 12.521 10.804 ( -6.339 -11.056 -5.303) 13.804 11.410 ( 1.087 -1.862 4.272) 4.785 11.467 ( 0.325 -0.543 0.209) 0.667 11.684 ( 1.798 -7.401 3.601) 8.425 11.853 ( -1.455 -10.761 -10.847) 15.348 12.423 ( 1.621 9.641 -0.297) 9.781 12.472 ( -6.449 8.324 -4.613) 11.496 12.837 ( 5.184 -4.199 2.701) 7.197 12.926 ( -8.950 -6.840 -6.357) 12.935 13.634 ( -1.277 5.705 2.810) 6.487 13.667 ( 2.362 6.368 -0.420) 6.805 13.974 ( 2.194 -13.217 7.814) 15.510 14.098 ( -1.296 -14.261 -3.927) 14.848 15.957 ( 0.676 2.735 -1.107) 3.027 15.978 ( -3.517 2.619 -3.156) 5.403 16.202 ( -6.255 -4.206 -2.095) 7.823 16.219 ( 2.783 -5.479 -3.604) 7.124 17.864 ( -0.868 9.710 12.133) 15.564 18.050 ( 1.261 2.178 -5.505) 6.053 19.409 ( -5.219 -1.494 4.220) 6.876 19.555 ( 9.988 -6.950 -9.359) 15.351 ======================= Grid point 352 (189/205) ======================= q-point: ( 0.11 0.38 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.795 ( 8.953 -0.517 -0.123) 8.969 2.854 ( 12.748 1.662 -12.543) 17.961 3.255 ( 5.348 3.417 -7.404) 9.752 3.331 ( 12.674 -1.642 6.987) 14.566 4.605 ( -22.391 9.816 8.933) 26.029 4.813 ( -12.384 -0.361 3.775) 12.952 5.077 ( 0.747 2.563 -4.695) 5.401 5.271 ( -0.329 7.818 -1.945) 8.063 5.411 ( -12.652 -8.477 5.963) 16.355 5.569 ( -3.320 -4.010 7.401) 9.048 5.791 ( 10.929 9.676 -10.943) 18.243 6.171 ( 13.316 -7.382 -6.685) 16.628 6.520 ( -4.646 13.792 -11.392) 18.482 6.726 ( 4.837 4.832 -8.966) 11.275 7.593 ( -15.694 13.415 4.658) 21.165 7.826 ( -9.441 4.361 6.533) 12.281 8.037 ( -7.760 14.615 -10.624) 19.664 8.295 ( 3.225 8.195 4.341) 9.819 8.520 ( -7.118 5.164 -5.641) 10.448 8.928 ( 7.453 5.324 9.667) 13.317 9.068 ( 4.003 -5.431 -1.036) 6.826 9.171 ( 7.471 -1.846 -8.240) 11.274 9.509 ( -2.361 -7.707 6.875) 10.594 9.724 ( 5.076 -16.035 4.439) 17.395 10.045 ( 0.352 1.108 7.394) 7.485 10.242 ( 4.595 -5.636 -3.544) 8.090 10.594 ( -3.316 5.245 -6.904) 9.283 10.938 ( 9.242 -11.359 1.454) 14.715 11.368 ( -5.468 2.008 -2.488) 6.335 11.501 ( 2.123 -2.189 -0.278) 3.062 11.710 ( -2.692 -9.357 -8.357) 12.831 11.784 ( 1.807 -10.612 7.623) 13.190 12.323 ( -4.853 6.712 3.554) 9.013 12.522 ( 2.105 5.625 3.889) 7.155 12.723 ( -6.479 -1.147 0.766) 6.624 13.025 ( 7.518 -5.655 6.219) 11.277 13.576 ( -3.748 7.853 0.470) 8.715 13.709 ( 0.445 6.096 -2.361) 6.552 13.994 ( -1.405 -16.217 -3.075) 16.566 14.110 ( 2.794 -13.343 1.553) 13.720 15.922 ( -0.973 2.667 1.607) 3.262 16.022 ( 4.175 1.153 3.402) 5.508 16.132 ( -2.196 -1.888 3.806) 4.783 16.288 ( 5.425 -5.975 2.219) 8.370 17.971 ( 0.914 6.992 8.597) 11.119 18.013 ( 2.899 5.224 -9.110) 10.894 19.284 ( -12.212 2.275 2.436) 12.659 19.557 ( 2.031 -10.277 -10.903) 15.120 ======================= Grid point 353 (190/205) ======================= q-point: ( 0.22 0.38 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.859 ( 3.732 5.781 -8.846) 11.207 3.037 ( 22.420 3.937 -14.256) 26.859 3.316 ( 7.665 5.558 -5.733) 11.069 3.710 ( 20.421 -6.532 2.255) 21.558 4.205 ( -28.585 9.361 5.444) 30.568 4.496 ( -25.154 -2.512 7.182) 26.280 4.999 ( -4.670 4.628 -8.973) 11.124 5.187 ( 0.462 -1.928 -10.316) 10.505 5.359 ( -2.615 -1.171 5.071) 5.824 5.576 ( -2.653 -5.891 7.792) 10.122 5.861 ( 8.508 13.341 -10.658) 19.078 6.160 ( -7.572 1.592 -7.741) 10.945 6.364 ( 3.699 6.815 -14.691) 16.612 6.599 ( 4.237 -1.889 -24.715) 25.146 7.336 ( -19.443 12.215 2.937) 23.149 7.571 ( -21.856 1.761 0.432) 21.931 7.890 ( -2.688 12.206 0.193) 12.500 8.142 ( -4.895 0.863 -3.873) 6.301 8.563 ( 1.092 10.852 -0.109) 10.908 9.058 ( -2.649 -8.486 -3.344) 9.498 9.138 ( 2.947 5.261 -2.202) 6.419 9.250 ( 7.378 8.599 11.686) 16.277 9.598 ( 2.999 1.840 5.256) 6.325 9.793 ( 1.955 -14.998 2.716) 15.367 10.214 ( 5.548 -5.635 3.384) 8.601 10.411 ( 15.540 -10.664 8.871) 20.830 10.587 ( 8.454 12.028 -4.504) 15.376 11.078 ( 4.357 -11.594 2.211) 12.582 11.200 ( -7.132 0.862 -5.157) 8.844 11.479 ( -1.719 -7.728 -6.132) 10.014 11.646 ( 0.827 -1.527 2.659) 3.176 11.894 ( 1.815 -10.343 7.081) 12.665 12.344 ( -0.006 3.106 6.505) 7.208 12.553 ( -2.782 -7.251 5.410) 9.465 12.715 ( -0.533 13.824 6.808) 15.419 13.224 ( 5.260 -5.703 9.217) 12.048 13.520 ( -2.780 11.220 -3.298) 12.020 13.623 ( -2.794 2.054 -4.275) 5.504 13.950 ( -1.810 -17.280 -3.082) 17.646 14.139 ( 0.721 -14.869 -1.086) 14.926 15.964 ( 1.593 2.894 5.100) 6.076 16.134 ( 1.127 -5.174 7.134) 8.885 16.232 ( 6.386 5.118 8.589) 11.863 16.440 ( 5.888 -5.399 6.196) 10.110 17.955 ( 2.417 9.869 -10.748) 14.791 18.086 ( 3.980 4.696 4.449) 7.595 19.031 ( -16.046 7.663 -0.503) 17.789 19.424 ( -3.753 -11.224 -11.426) 16.450 ======================= Grid point 354 (191/205) ======================= q-point: ( 0.33 0.38 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.826 ( 5.081 9.854 -11.761) 16.163 3.230 ( 4.226 -8.009 -9.192) 12.903 3.433 ( 18.879 18.412 -12.771) 29.300 3.741 ( -22.413 10.463 7.701) 25.906 3.862 ( -16.121 -3.260 4.244) 16.986 4.326 ( 8.476 -11.489 -0.097) 14.278 4.732 ( -10.613 7.823 -13.280) 18.713 5.039 ( -2.497 -5.532 -16.837) 17.897 5.390 ( -0.351 3.580 7.852) 8.636 5.632 ( -2.282 -5.768 7.841) 9.998 5.883 ( 1.982 7.866 -3.637) 8.890 5.957 ( -0.998 3.768 -9.542) 10.307 6.192 ( -3.970 10.096 -15.280) 18.739 6.514 ( 8.820 -4.701 -19.223) 21.666 6.942 ( -21.708 12.816 -1.799) 25.273 7.132 ( -24.049 -0.984 -0.948) 24.087 7.904 ( 3.407 8.502 -0.323) 9.165 8.118 ( 0.928 2.730 2.682) 3.938 8.499 ( -4.786 7.386 -3.319) 9.406 8.917 ( -6.611 -7.809 -7.259) 12.545 9.126 ( -1.180 5.797 4.947) 7.712 9.463 ( 3.050 8.910 4.520) 10.446 9.739 ( 5.257 -0.482 7.972) 9.561 9.919 ( 8.371 -14.354 0.925) 16.643 10.376 ( 7.038 0.549 6.325) 9.478 10.641 ( 6.782 2.549 -2.736) 7.744 10.859 ( 11.731 1.126 4.098) 12.477 10.989 ( -8.400 3.223 -1.969) 9.210 11.243 ( 10.328 -11.174 4.084) 15.755 11.439 ( 4.918 -10.708 1.172) 11.842 11.747 ( 3.864 1.025 6.693) 7.796 11.990 ( 1.799 -8.345 4.662) 9.727 12.396 ( -1.082 2.320 3.758) 4.548 12.546 ( -3.440 -4.315 3.914) 6.766 12.780 ( -1.652 13.576 7.012) 15.369 13.375 ( -0.036 3.084 1.161) 3.295 13.414 ( 0.525 -1.406 0.487) 1.578 13.569 ( -1.881 -4.216 -1.939) 5.007 13.846 ( -5.825 -14.145 -0.476) 15.305 14.124 ( 0.155 -15.687 -4.332) 16.275 16.074 ( 3.399 2.661 7.093) 8.303 16.229 ( 0.910 -4.595 7.892) 9.177 16.464 ( 7.456 2.986 9.526) 12.460 16.597 ( 3.743 -4.103 6.240) 8.354 17.888 ( 1.622 17.395 -8.523) 19.438 18.198 ( 4.745 5.862 0.147) 7.543 18.738 ( -12.727 9.772 -2.316) 16.212 19.207 ( -6.736 -10.843 -11.615) 17.258 ======================= Grid point 355 (192/205) ======================= q-point: ( 0.44 0.38 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.828 ( 5.570 8.450 -7.136) 12.383 2.959 ( -19.359 2.159 -1.089) 19.510 3.538 ( -20.145 -0.508 10.348) 22.653 3.590 ( 11.152 -2.521 -10.621) 15.606 3.802 ( 16.242 16.849 1.024) 23.425 4.378 ( -12.293 8.650 -14.896) 21.162 4.479 ( 4.694 -7.460 -1.126) 8.885 4.798 ( -4.105 -6.858 -15.805) 17.711 5.480 ( 0.961 4.130 6.971) 8.159 5.646 ( -2.415 -2.249 3.485) 4.800 5.813 ( -0.614 5.641 -4.919) 7.510 5.976 ( -1.821 15.360 -9.440) 18.121 6.010 ( -0.561 -4.845 7.795) 9.195 6.429 ( 1.832 -3.539 -17.876) 18.314 6.662 ( -5.225 10.319 -0.575) 11.581 6.758 ( -14.051 2.792 -0.598) 14.338 7.993 ( 6.711 5.886 -0.817) 8.964 8.142 ( -1.705 1.762 -1.980) 3.152 8.414 ( -0.744 5.779 3.033) 6.569 8.709 ( -6.252 -4.793 -8.816) 11.823 9.208 ( 0.059 7.689 10.932) 13.365 9.490 ( 1.412 6.117 -5.317) 8.227 9.884 ( -1.010 -11.154 11.161) 15.811 10.044 ( 4.795 -12.665 -2.183) 13.717 10.515 ( -5.819 5.097 13.317) 15.401 10.701 ( 5.554 1.399 -5.644) 8.041 10.853 ( -2.640 3.896 -2.057) 5.136 10.921 ( 2.738 -0.397 -6.164) 6.756 11.590 ( 17.965 -3.239 6.654) 19.430 11.699 ( 12.580 -5.527 9.313) 16.599 11.884 ( 2.886 -0.373 4.818) 5.629 12.000 ( -4.863 -2.206 -0.668) 5.381 12.384 ( -1.707 3.199 0.948) 3.748 12.517 ( -4.037 4.571 3.349) 6.958 12.778 ( -0.127 0.830 1.620) 1.825 13.232 ( -8.452 -6.061 -13.197) 16.803 13.479 ( 3.391 -1.191 7.701) 8.498 13.626 ( 2.801 -9.916 9.550) 14.050 13.776 ( -3.124 -7.416 0.902) 8.098 14.041 ( -1.764 -14.140 -9.021) 16.865 16.218 ( 4.286 0.912 6.700) 8.006 16.309 ( 0.084 -3.463 4.913) 6.011 16.648 ( 3.799 -0.443 5.206) 6.460 16.688 ( 1.020 -2.783 3.179) 4.347 17.864 ( -2.124 25.269 3.969) 25.667 18.190 ( 1.752 17.627 -12.772) 21.838 18.624 ( -0.734 -0.736 4.946) 5.054 18.967 ( -5.062 -9.139 -12.516) 16.303 ======================= Grid point 356 (193/205) ======================= q-point: (-0.44 0.38 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.639 ( -15.664 8.303 9.583) 20.152 2.961 ( 8.404 -1.763 0.703) 8.615 3.345 ( -13.074 6.084 10.144) 17.630 3.737 ( 14.547 -4.634 -7.362) 16.950 3.979 ( -8.804 10.158 -11.466) 17.668 4.160 ( 14.764 12.654 1.947) 19.542 4.482 ( -6.224 -5.683 3.888) 9.282 4.630 ( 0.540 -5.061 -5.870) 7.770 5.562 ( -1.218 3.630 5.751) 6.909 5.568 ( -3.369 1.540 0.083) 3.705 5.823 ( -2.705 16.724 1.650) 17.022 5.880 ( 2.380 5.734 -2.018) 6.528 6.032 ( -9.294 -5.044 8.158) 13.355 6.337 ( 6.335 -10.319 -12.344) 17.292 6.664 ( 4.633 9.476 -0.833) 10.581 6.725 ( 11.200 4.641 2.625) 12.404 8.012 ( -6.473 6.039 -2.746) 9.269 8.119 ( 6.337 3.245 -1.066) 7.199 8.528 ( 1.284 -0.035 -0.845) 1.537 8.564 ( 5.078 -0.022 -0.925) 5.162 9.288 ( -5.166 6.433 9.788) 12.801 9.439 ( 2.098 6.363 -7.310) 9.916 9.915 ( -7.759 -14.597 10.719) 19.702 10.023 ( -4.471 -10.327 -2.470) 11.522 10.436 ( -14.418 7.743 13.179) 21.013 10.727 ( -0.001 -4.521 0.284) 4.530 10.891 ( 10.480 4.017 -7.946) 13.752 10.941 ( 6.583 1.299 -7.094) 9.764 11.723 ( -16.118 -0.977 -5.647) 17.107 11.883 ( -6.091 -3.475 -6.684) 9.688 11.911 ( 6.839 -2.736 2.268) 7.708 11.955 ( 7.929 -1.369 2.862) 8.540 12.415 ( -0.108 9.229 3.741) 9.959 12.468 ( 3.250 8.571 -0.163) 9.168 12.878 ( -4.355 -7.956 2.162) 9.324 13.002 ( 6.558 -10.322 -1.392) 12.308 13.612 ( -2.168 -2.886 3.678) 5.153 13.693 ( 1.777 -2.305 -5.070) 5.846 13.811 ( 1.981 -11.442 12.082) 16.758 13.914 ( 0.522 -12.679 -9.732) 15.992 16.310 ( -2.129 -0.946 -1.412) 2.723 16.340 ( 3.230 -2.403 2.158) 4.568 16.694 ( -1.433 -1.159 0.389) 1.884 16.721 ( 1.175 -2.275 -0.076) 2.561 17.793 ( -14.731 26.142 10.721) 31.864 18.185 ( 13.620 20.616 -13.124) 27.978 18.642 ( -6.910 -5.191 6.363) 10.732 18.888 ( 10.631 -4.754 -7.644) 13.930 ======================= Grid point 357 (194/205) ======================= q-point: (-0.33 0.38 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.564 ( -6.821 10.629 13.398) 18.412 3.049 ( -10.404 -8.872 7.941) 15.811 3.204 ( -10.023 16.605 10.237) 21.931 3.847 ( -3.999 -7.331 2.956) 8.859 3.943 ( 20.402 11.326 -9.832) 25.321 4.425 ( 6.316 -1.003 -5.085) 8.171 4.475 ( 13.705 2.013 6.147) 15.154 4.695 ( -0.513 -2.438 14.193) 14.410 5.523 ( 0.205 7.376 -2.279) 7.723 5.566 ( -9.047 9.710 8.948) 16.007 5.799 ( 0.623 7.433 2.012) 7.726 5.910 ( -2.156 1.388 8.751) 9.119 5.989 ( 1.304 -1.351 -0.101) 1.880 6.298 ( -3.747 -9.332 -1.939) 10.241 6.898 ( 19.214 11.241 2.103) 22.360 7.088 ( 22.498 -0.475 3.818) 22.824 7.889 ( -4.590 8.617 -0.124) 9.764 8.179 ( 1.788 -1.552 -2.507) 3.448 8.506 ( 4.501 6.901 -4.296) 9.292 8.780 ( 9.354 -3.780 5.674) 11.575 9.203 ( -7.457 4.180 0.486) 8.562 9.459 ( 2.839 8.478 0.379) 8.948 9.837 ( -10.781 -11.379 7.575) 17.409 9.874 ( -7.930 -6.290 -1.718) 10.267 10.307 ( -12.849 7.058 9.299) 17.360 10.695 ( -2.316 -3.247 -4.858) 6.285 10.933 ( -1.959 4.339 -5.413) 7.209 11.016 ( 7.949 2.482 -4.516) 9.474 11.360 ( -12.843 -12.060 -6.548) 18.796 11.599 ( -10.684 -11.801 -11.396) 19.578 11.886 ( -3.151 1.993 -6.384) 7.393 12.059 ( 1.988 -4.163 -1.931) 5.001 12.435 ( 2.980 3.949 -0.590) 4.982 12.626 ( 5.279 3.196 -0.580) 6.198 12.809 ( 3.184 4.984 1.797) 6.181 13.256 ( 6.948 -3.595 9.281) 12.138 13.469 ( -5.551 0.634 -5.607) 7.915 13.664 ( -1.232 -5.222 -6.842) 8.695 13.867 ( 2.602 -14.700 -1.682) 15.023 13.998 ( 3.783 -11.432 7.244) 14.052 16.214 ( -3.443 2.201 -6.031) 7.285 16.363 ( 0.594 -5.047 -4.368) 6.701 16.620 ( -4.835 0.475 -5.024) 6.989 16.704 ( -1.382 -3.415 -3.770) 5.271 17.658 ( -10.865 24.120 12.419) 29.225 18.230 ( -1.950 3.382 -3.285) 5.102 18.718 ( 14.146 9.232 0.705) 16.907 19.072 ( 11.223 -4.419 0.404) 12.068 ======================= Grid point 358 (195/205) ======================= q-point: (-0.22 0.38 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.597 ( -7.244 10.343 14.378) 19.136 2.817 ( -16.047 9.618 9.017) 20.768 3.220 ( -1.639 -0.652 4.162) 4.520 3.657 ( -19.364 -10.575 6.410) 22.975 4.337 ( 28.566 13.432 -5.988) 32.129 4.611 ( 13.657 3.272 -0.853) 14.069 4.808 ( 15.431 -1.476 4.880) 16.251 4.850 ( -0.970 -1.280 19.478) 19.544 5.455 ( -11.439 11.419 9.022) 18.511 5.517 ( 2.791 4.860 -1.805) 5.888 5.828 ( -2.201 6.054 -2.126) 6.783 6.037 ( 7.225 -2.025 10.820) 13.168 6.113 ( 6.774 2.652 10.945) 13.142 6.173 ( -10.837 -9.643 4.401) 15.159 7.316 ( 20.668 11.046 4.192) 23.807 7.521 ( 18.110 2.452 4.704) 18.871 7.863 ( 0.867 7.685 2.733) 8.202 8.164 ( 1.389 0.527 -3.664) 3.954 8.563 ( 3.980 7.234 -1.654) 8.421 8.971 ( 5.475 -6.373 4.474) 9.519 9.080 ( -6.852 3.115 1.737) 7.724 9.501 ( -1.764 11.440 -5.710) 12.906 9.656 ( -10.499 -0.175 -1.297) 10.580 9.778 ( 0.453 -6.766 2.201) 7.129 10.190 ( -5.248 0.190 3.991) 6.596 10.549 ( -7.578 -2.884 -5.173) 9.618 10.640 ( -18.383 1.468 -7.799) 20.023 11.130 ( 3.228 -2.756 -0.616) 4.289 11.166 ( -1.638 -16.828 -3.897) 17.351 11.425 ( -0.640 -10.830 -2.067) 11.044 11.754 ( -2.618 3.708 -7.082) 8.412 12.034 ( 0.900 -6.457 -6.302) 9.067 12.458 ( 0.980 2.899 -3.975) 5.016 12.648 ( 3.178 -6.484 -3.960) 8.236 12.879 ( 0.778 14.431 -6.357) 15.788 13.366 ( 2.219 6.747 5.466) 8.962 13.397 ( -3.189 -0.526 -1.810) 3.704 13.578 ( -0.842 -5.473 -1.154) 5.656 13.905 ( 1.087 -15.601 1.151) 15.681 14.098 ( 1.777 -12.767 2.915) 13.216 16.088 ( -2.893 3.715 -6.624) 8.126 16.289 ( -1.765 -5.723 -7.444) 9.554 16.424 ( -7.155 3.515 -9.451) 12.364 16.584 ( -5.500 -4.577 -7.301) 10.223 17.665 ( -5.325 18.009 16.121) 24.750 18.140 ( -4.202 -1.337 -0.258) 4.417 19.057 ( 21.287 7.675 -2.258) 22.741 19.266 ( 7.723 -3.995 2.978) 9.190 ======================= Grid point 359 (196/205) ======================= q-point: (-0.11 0.38 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.566 ( -8.163 8.668 12.802) 17.483 2.754 ( -2.739 0.554 6.994) 7.531 3.162 ( -6.616 3.298 0.555) 7.414 3.418 ( -8.231 -6.305 -0.640) 10.388 4.729 ( 14.584 8.193 -2.055) 16.854 4.813 ( 6.110 3.491 5.181) 8.738 4.966 ( 4.373 1.862 5.298) 7.118 5.151 ( 8.247 4.269 9.117) 13.014 5.383 ( -6.784 7.953 11.819) 15.778 5.622 ( 8.368 2.224 -0.296) 8.664 5.739 ( 2.865 0.710 -7.915) 8.448 5.979 ( -18.662 -9.087 10.712) 23.358 6.330 ( 12.889 1.888 5.816) 14.266 6.407 ( 6.645 4.855 18.670) 20.403 7.649 ( 12.141 13.629 1.561) 18.319 7.778 ( 3.266 12.844 9.628) 16.381 7.949 ( 2.990 4.053 -0.144) 5.039 8.238 ( 9.247 -1.798 4.050) 10.254 8.596 ( 3.256 8.115 -7.067) 11.243 8.984 ( -6.072 3.614 4.488) 8.370 9.086 ( 3.155 -10.229 0.727) 10.730 9.184 ( -11.963 17.648 -13.765) 25.378 9.541 ( -7.766 -14.282 6.806) 17.624 9.861 ( 1.281 -4.378 -10.931) 11.844 10.173 ( 0.059 0.359 -3.193) 3.214 10.250 ( -7.335 -4.055 -4.136) 9.347 10.469 ( 0.267 2.155 4.011) 4.562 10.989 ( -7.589 -18.392 -3.556) 20.211 11.293 ( 6.151 -2.373 3.527) 7.477 11.445 ( -0.198 -5.850 4.183) 7.194 11.670 ( 0.222 0.748 -4.526) 4.593 11.969 ( 0.227 -9.344 -9.152) 13.081 12.413 ( 0.789 6.331 -4.885) 8.035 12.653 ( -0.605 -1.759 -7.138) 7.376 12.766 ( -0.803 6.718 -3.990) 7.854 13.187 ( -9.159 -5.294 -9.144) 13.983 13.556 ( 5.862 9.034 4.990) 11.870 13.601 ( 0.683 3.275 6.194) 7.039 13.913 ( -1.804 -16.315 3.041) 16.694 14.131 ( 0.196 -13.595 -0.031) 13.596 15.990 ( -1.216 3.498 -4.774) 6.043 16.133 ( -6.619 0.990 -6.991) 9.678 16.257 ( -0.564 -2.576 -7.953) 8.379 16.382 ( -7.805 -4.903 -6.727) 11.411 17.757 ( -2.691 12.994 15.077) 20.085 18.084 ( -1.108 -0.197 -1.826) 2.145 19.374 ( 13.968 -0.764 -2.819) 14.270 19.398 ( 5.827 -2.878 0.943) 6.566 ======================= Grid point 360 (197/205) ======================= q-point: ( 0.00 -0.50 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.687 ( 3.549 -2.975 -0.188) 4.635 2.687 ( 3.549 2.975 -0.188) 4.635 3.246 ( 0.254 -3.968 0.471) 4.004 3.246 ( 0.254 3.968 0.471) 4.004 4.851 ( -2.277 -1.801 2.903) 4.106 4.851 ( -2.277 1.801 2.903) 4.106 5.332 ( 0.799 -6.446 4.984) 8.187 5.332 ( 0.799 6.446 4.984) 8.187 5.481 ( -11.223 -5.964 5.327) 13.780 5.481 ( -11.223 5.964 5.327) 13.780 5.811 ( 12.100 -4.714 -5.308) 14.029 5.811 ( 12.100 4.714 -5.308) 14.029 6.705 ( 6.538 -1.577 6.753) 9.531 6.705 ( 6.538 1.577 6.753) 9.531 7.916 ( -5.330 -1.671 4.186) 6.981 7.916 ( -5.330 1.671 4.186) 6.981 8.344 ( 8.342 -11.231 8.002) 16.117 8.344 ( 8.342 11.231 8.002) 16.117 8.714 ( -3.297 -8.722 -12.157) 15.321 8.714 ( -3.297 8.722 -12.157) 15.321 9.167 ( -1.569 -14.656 6.254) 16.012 9.167 ( -1.569 14.656 6.254) 16.012 9.341 ( -2.120 -16.655 -8.451) 18.796 9.341 ( -2.120 16.655 -8.451) 18.796 10.173 ( -2.235 -2.647 -2.465) 4.252 10.173 ( -2.235 2.647 -2.465) 4.252 10.666 ( 3.415 -2.758 1.755) 4.728 10.666 ( 3.415 2.758 1.755) 4.728 11.430 ( 1.392 -3.102 6.247) 7.112 11.430 ( 1.392 3.102 6.247) 7.112 11.666 ( -0.745 -5.962 -8.409) 10.335 11.666 ( -0.745 5.962 -8.409) 10.335 12.573 ( 0.008 -1.816 -3.122) 3.612 12.573 ( 0.008 1.816 -3.122) 3.612 12.800 ( -4.491 -2.997 -0.505) 5.422 12.800 ( -4.491 2.997 -0.505) 5.422 13.730 ( 1.106 -3.521 1.016) 3.828 13.730 ( 1.106 3.521 1.016) 3.828 13.873 ( 0.261 -6.437 1.532) 6.622 13.873 ( 0.261 6.437 1.532) 6.622 16.001 ( -1.335 -0.879 -2.413) 2.894 16.001 ( -1.335 0.879 -2.413) 2.894 16.151 ( -1.899 -0.159 -2.834) 3.415 16.151 ( -1.899 0.159 -2.834) 3.415 18.022 ( -0.383 -4.992 4.331) 6.620 18.022 ( -0.383 4.992 4.331) 6.620 19.435 ( 2.375 -4.030 -3.851) 6.059 19.435 ( 2.375 4.030 -3.851) 6.059 ======================= Grid point 362 (198/205) ======================= q-point: ( 0.11 -0.50 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.826 ( 13.936 -2.827 -6.158) 15.496 2.826 ( 13.936 2.827 -6.158) 15.496 3.306 ( 7.126 -1.691 -0.437) 7.336 3.306 ( 7.126 1.691 -0.437) 7.336 4.757 ( -16.183 -4.956 6.300) 18.060 4.757 ( -16.183 4.956 6.300) 18.060 5.189 ( -7.000 -8.199 -2.244) 11.012 5.189 ( -7.000 8.199 -2.244) 11.012 5.460 ( -4.513 -6.413 6.985) 10.502 5.460 ( -4.513 6.413 6.985) 10.502 5.994 ( 14.360 -9.537 -9.795) 19.827 5.994 ( 14.360 9.537 -9.795) 19.827 6.731 ( -0.721 -5.376 -11.917) 13.093 6.731 ( -0.721 5.376 -11.917) 13.093 7.802 ( -13.630 -6.250 6.631) 16.396 7.802 ( -13.630 6.250 6.631) 16.396 8.275 ( -9.256 -6.987 -8.149) 14.174 8.275 ( -9.256 6.987 -8.149) 14.174 8.764 ( 8.624 -13.143 1.175) 15.764 8.764 ( 8.624 13.143 1.175) 15.764 9.258 ( 2.763 -14.311 7.755) 16.510 9.258 ( 2.763 14.311 7.755) 16.510 9.334 ( 6.332 -16.404 -0.436) 17.589 9.334 ( 6.332 16.404 -0.436) 17.589 10.117 ( -2.547 -5.111 3.042) 6.470 10.117 ( -2.547 5.111 3.042) 6.470 10.742 ( 6.123 -8.112 -4.075) 10.950 10.742 ( 6.123 8.112 -4.075) 10.950 11.451 ( -2.149 -4.697 -3.928) 6.489 11.451 ( -2.149 4.697 -3.928) 6.489 11.622 ( 0.883 -3.305 2.399) 4.178 11.622 ( 0.883 3.305 2.399) 4.178 12.466 ( -6.982 -6.762 2.112) 9.947 12.466 ( -6.982 6.762 2.112) 9.947 12.867 ( 5.005 -9.814 5.507) 12.316 12.867 ( 5.005 9.814 5.507) 12.316 13.727 ( -0.664 -7.997 -1.632) 8.189 13.727 ( -0.664 7.997 -1.632) 8.189 13.882 ( -0.231 -9.061 -0.760) 9.096 13.882 ( -0.231 9.061 -0.760) 9.096 15.981 ( -0.439 -3.190 2.357) 3.991 15.981 ( -0.439 3.190 2.357) 3.991 16.176 ( 3.950 -4.589 3.279) 6.886 16.176 ( 3.950 4.589 3.279) 6.886 18.059 ( 1.585 -1.127 0.873) 2.132 18.059 ( 1.585 1.127 0.873) 2.132 19.375 ( -4.160 -6.882 -4.336) 9.136 19.375 ( -4.160 6.882 -4.336) 9.136 ======================= Grid point 364 (199/205) ======================= q-point: ( 0.22 -0.50 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.990 ( 11.625 -6.121 -9.783) 16.380 2.990 ( 11.625 6.121 -9.783) 16.380 3.517 ( 18.116 -11.389 -4.120) 21.792 3.517 ( 18.116 11.389 -4.120) 21.792 4.386 ( -30.002 -7.653 8.305) 32.057 4.386 ( -30.002 7.653 8.305) 32.057 5.098 ( 0.287 -5.337 -10.809) 12.058 5.098 ( 0.287 5.337 -10.809) 12.058 5.435 ( -5.330 -6.779 8.995) 12.460 5.435 ( -5.330 6.779 8.995) 12.460 6.083 ( 4.855 -7.939 -8.958) 12.916 6.083 ( 4.855 7.939 -8.958) 12.916 6.523 ( 1.010 -6.639 -22.536) 23.515 6.523 ( 1.010 6.639 -22.536) 23.515 7.518 ( -21.957 -5.790 1.489) 22.756 7.518 ( -21.957 5.790 1.489) 22.756 8.105 ( -3.503 -6.580 -2.045) 7.729 8.105 ( -3.503 6.580 -2.045) 7.729 8.813 ( -0.590 -13.037 -4.192) 13.707 8.813 ( -0.590 13.037 -4.192) 13.707 9.326 ( 1.371 -13.745 2.014) 13.959 9.326 ( 1.371 13.745 2.014) 13.959 9.574 ( 7.037 -7.095 11.577) 15.293 9.574 ( 7.037 7.095 11.577) 15.293 10.211 ( 9.653 -5.717 5.649) 12.561 10.211 ( 9.653 5.717 5.649) 12.561 10.831 ( 8.245 -11.563 -2.353) 14.395 10.831 ( 8.245 11.563 -2.353) 14.395 11.310 ( -5.100 -7.779 -7.735) 12.098 11.310 ( -5.100 7.779 -7.735) 12.098 11.709 ( 2.171 -6.880 7.227) 10.212 11.709 ( 2.171 6.880 7.227) 10.212 12.425 ( -2.467 -4.959 5.952) 8.131 12.425 ( -2.467 4.959 5.952) 8.131 13.017 ( 2.899 -14.058 9.071) 16.980 13.017 ( 2.899 14.058 9.071) 16.980 13.654 ( -3.424 -2.687 -7.079) 8.310 13.654 ( -3.424 2.687 -7.079) 8.310 13.862 ( -0.691 -10.958 -0.217) 10.981 13.862 ( -0.691 10.958 -0.217) 10.981 16.035 ( 1.362 -4.182 6.093) 7.514 16.035 ( 1.362 4.182 6.093) 7.514 16.333 ( 6.368 -4.985 7.436) 10.986 16.333 ( 6.368 4.985 7.436) 10.986 18.100 ( 3.593 -3.498 -1.574) 5.255 18.100 ( 3.593 3.498 -1.574) 5.255 19.206 ( -8.758 -9.644 -5.265) 14.051 19.206 ( -8.758 9.644 -5.265) 14.051 ======================= Grid point 366 (200/205) ======================= q-point: ( 0.33 -0.50 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.038 ( 5.599 -10.313 -11.391) 16.354 3.038 ( 5.599 10.313 -11.391) 16.354 3.736 ( -0.427 -9.362 -5.211) 10.723 3.736 ( -0.427 9.362 -5.211) 10.723 4.015 ( -6.490 -16.166 5.663) 18.318 4.015 ( -6.490 16.166 5.663) 18.318 4.902 ( -6.597 -7.890 -14.929) 18.129 4.902 ( -6.597 7.890 -14.929) 18.129 5.488 ( -1.282 -6.462 11.712) 13.437 5.488 ( -1.282 6.462 11.712) 13.437 5.990 ( -2.583 -1.534 -8.950) 9.440 5.990 ( -2.583 1.534 -8.950) 9.440 6.384 ( 5.343 -7.997 -18.846) 21.159 6.384 ( 5.343 7.997 -18.846) 21.159 7.104 ( -21.566 -3.402 -1.060) 21.859 7.104 ( -21.566 3.402 -1.060) 21.859 8.072 ( 0.614 -6.674 -0.294) 6.709 8.072 ( 0.614 6.674 -0.294) 6.709 8.705 ( -5.415 -11.562 -4.664) 13.592 8.705 ( -5.415 11.562 -4.664) 13.592 9.392 ( 1.313 -17.534 6.380) 18.704 9.392 ( 1.313 17.534 6.380) 18.704 9.723 ( 3.166 -6.768 1.878) 7.704 9.723 ( 3.166 6.768 1.878) 7.704 10.503 ( 10.639 -10.187 6.317) 16.028 10.503 ( 10.639 10.187 6.317) 16.028 10.981 ( 2.142 -6.666 1.597) 7.181 10.981 ( 2.142 6.666 1.597) 7.181 11.215 ( 8.550 -9.207 -1.573) 12.663 11.215 ( 8.550 9.207 -1.573) 12.663 11.833 ( 3.227 -6.594 7.104) 10.216 11.833 ( 3.227 6.595 7.104) 10.216 12.454 ( -1.338 -3.577 4.372) 5.805 12.454 ( -1.338 3.577 4.372) 5.805 13.139 ( -1.140 -19.135 8.457) 20.952 13.139 ( -1.140 19.135 8.457) 20.952 13.473 ( -5.385 -3.757 -7.850) 10.234 13.473 ( -5.385 3.757 -7.850) 10.234 13.852 ( -0.393 -10.118 -0.825) 10.159 13.852 ( -0.393 10.118 -0.825) 10.159 16.140 ( 2.317 -3.881 7.326) 8.609 16.140 ( 2.317 3.881 7.326) 8.609 16.521 ( 5.188 -3.108 7.442) 9.589 16.521 ( 5.188 3.108 7.442) 9.589 18.165 ( 5.327 -8.478 -1.245) 10.090 18.165 ( 5.327 8.478 -1.245) 10.090 18.969 ( -10.003 -12.040 -6.921) 17.115 18.969 ( -10.003 12.040 -6.921) 17.115 ======================= Grid point 368 (201/205) ======================= q-point: ( 0.44 -0.50 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.954 ( -5.648 -3.212 -4.418) 7.857 2.954 ( -5.648 3.212 -4.418) 7.857 3.531 ( -6.352 -1.608 -0.724) 6.592 3.531 ( -6.352 1.608 -0.724) 6.592 4.182 ( 10.886 -17.562 -1.024) 20.688 4.182 ( 10.886 17.562 -1.024) 20.688 4.617 ( -7.570 -10.482 -13.246) 18.510 4.617 ( -7.570 10.482 -13.246) 18.510 5.570 ( -1.441 -4.498 6.647) 8.155 5.570 ( -1.441 4.498 6.647) 8.155 5.905 ( -0.139 -4.012 0.328) 4.028 5.905 ( -0.139 4.012 0.328) 4.028 6.261 ( -0.866 -11.015 -14.091) 17.906 6.261 ( -0.866 11.015 -14.091) 17.906 6.805 ( -8.635 -1.474 -1.148) 8.835 6.805 ( -8.635 1.474 -1.148) 8.835 8.112 ( 3.236 -4.834 -0.092) 5.818 8.112 ( 3.236 4.834 -0.092) 5.818 8.560 ( -4.480 -8.406 -3.814) 10.261 8.560 ( -4.480 8.406 -3.814) 10.261 9.483 ( -0.500 -15.579 8.229) 17.626 9.483 ( -0.500 15.579 8.229) 17.626 9.763 ( 1.625 -10.925 -2.008) 11.226 9.763 ( 1.625 10.925 -2.008) 11.226 10.645 ( -1.801 -5.862 6.105) 8.653 10.645 ( -1.801 5.862 6.105) 8.653 10.913 ( 0.221 -1.214 -5.749) 5.880 10.913 ( 0.221 1.214 -5.749) 5.880 11.592 ( 19.140 -3.586 8.664) 21.314 11.592 ( 19.140 3.586 8.664) 21.314 11.935 ( 0.501 -4.084 2.005) 4.577 11.935 ( 0.501 4.084 2.005) 4.577 12.471 ( -0.623 -4.845 6.176) 7.874 12.471 ( -0.623 4.845 6.176) 7.874 13.002 ( -9.974 -15.199 -10.864) 21.178 13.002 ( -9.974 15.199 -10.864) 21.178 13.477 ( 2.638 -2.069 10.315) 10.846 13.477 ( 2.638 2.069 10.315) 10.846 13.813 ( -0.888 -7.704 -4.946) 9.198 13.813 ( -0.888 7.704 -4.946) 9.198 16.250 ( 2.110 -2.243 5.512) 6.314 16.250 ( 2.110 2.243 5.512) 6.314 16.648 ( 2.227 -0.905 3.959) 4.632 16.648 ( 2.227 0.905 3.959) 4.632 18.257 ( 2.309 -11.490 3.321) 12.181 18.257 ( 2.309 11.490 3.321) 12.181 18.739 ( -4.320 -11.943 -9.468) 15.841 18.739 ( -4.320 11.943 -9.468) 15.841 ======================= Grid point 370 (202/205) ======================= q-point: (-0.44 -0.50 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.822 ( -8.632 -9.094 7.660) 14.693 2.822 ( -8.632 9.094 7.660) 14.693 3.542 ( 6.299 -11.048 -1.556) 12.813 3.542 ( 6.299 11.048 -1.556) 12.813 4.236 ( -4.446 -10.534 -3.135) 11.856 4.236 ( -4.446 10.534 -3.135) 11.856 4.471 ( 4.356 -9.119 -2.710) 10.463 4.471 ( 4.356 9.119 -2.710) 10.463 5.589 ( 0.062 -0.218 2.979) 2.988 5.589 ( 0.062 0.218 2.979) 2.988 5.949 ( -3.140 -2.951 5.033) 6.626 5.949 ( -3.140 2.951 5.033) 6.626 6.118 ( 0.281 -11.484 -7.171) 13.542 6.118 ( 0.281 11.484 -7.171) 13.542 6.784 ( 6.690 -0.995 0.756) 6.806 6.784 ( 6.690 0.995 0.756) 6.806 8.131 ( -0.847 -3.475 -2.004) 4.100 8.131 ( -0.847 3.475 -2.004) 4.100 8.528 ( 4.403 -1.579 -0.806) 4.746 8.528 ( 4.403 1.579 -0.806) 4.746 9.504 ( -6.133 -11.225 6.925) 14.545 9.504 ( -6.133 11.225 6.925) 14.545 9.753 ( -0.333 -10.881 -1.741) 11.024 9.753 ( -0.333 10.881 -1.741) 11.024 10.598 ( -8.853 -7.540 7.880) 14.047 10.598 ( -8.853 7.540 7.880) 14.047 10.945 ( 8.698 -1.133 -6.718) 11.049 10.945 ( 8.698 1.133 -6.718) 11.049 11.777 ( -13.973 -5.276 -7.769) 16.836 11.777 ( -13.973 5.276 -7.769) 16.836 11.915 ( 7.475 -1.875 2.767) 8.188 11.915 ( 7.475 1.875 2.767) 8.188 12.590 ( 1.134 -3.258 2.243) 4.115 12.590 ( 1.134 3.258 2.243) 4.115 12.800 ( 3.861 -5.550 0.066) 6.761 12.800 ( 3.861 5.550 0.066) 6.761 13.626 ( 0.033 -4.273 6.164) 7.500 13.626 ( 0.033 4.273 6.164) 7.500 13.735 ( 1.402 -4.603 -5.982) 7.677 13.735 ( 1.402 4.603 -5.982) 7.677 16.308 ( 0.467 -0.741 0.370) 0.951 16.308 ( 0.467 0.741 0.370) 0.951 16.687 ( -0.076 -0.701 0.150) 0.721 16.687 ( -0.076 0.701 0.150) 0.721 18.229 ( -10.836 -14.780 5.882) 19.248 18.229 ( -10.836 14.780 5.882) 19.248 18.718 ( 11.988 -10.958 -7.568) 17.918 18.718 ( 11.988 10.958 -7.568) 17.918 ======================= Grid point 372 (203/205) ======================= q-point: (-0.33 -0.50 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.804 ( -5.135 -12.411 11.085) 17.414 2.804 ( -5.135 12.411 11.085) 17.414 3.570 ( -11.196 -16.380 8.984) 21.780 3.570 ( -11.196 16.380 8.984) 21.780 4.227 ( 18.312 -13.055 -12.871) 25.912 4.227 ( 18.312 13.055 -12.871) 25.912 4.608 ( 3.414 -6.098 11.886) 13.789 4.608 ( 3.414 6.098 11.886) 13.789 5.633 ( -0.750 -2.480 1.983) 3.262 5.633 ( -0.750 2.480 1.983) 3.262 5.875 ( -1.004 -2.308 -0.402) 2.549 5.875 ( -1.004 2.308 -0.402) 2.549 6.117 ( -3.761 -8.805 5.652) 11.118 6.117 ( -3.761 8.805 5.652) 11.118 7.054 ( 19.339 -3.976 3.690) 20.086 7.054 ( 19.339 3.976 3.690) 20.086 8.079 ( -1.452 -8.215 -1.464) 8.470 8.079 ( -1.452 8.215 -1.464) 8.470 8.652 ( 7.388 -7.544 0.531) 10.572 8.652 ( 7.388 7.544 0.531) 10.572 9.420 ( -8.873 -14.642 4.610) 17.730 9.420 ( -8.873 14.642 4.610) 17.730 9.732 ( -0.131 -8.248 0.136) 8.250 9.732 ( -0.131 8.248 0.136) 8.250 10.513 ( -8.073 -11.927 3.667) 14.861 10.513 ( -8.073 11.927 3.667) 14.861 11.025 ( 3.029 -3.482 -3.353) 5.705 11.025 ( 3.029 3.482 -3.353) 5.705 11.346 ( -16.961 -10.312 -11.511) 22.946 11.346 ( -16.961 10.312 -11.511) 22.946 11.965 ( 0.472 -4.759 -4.963) 6.892 11.965 ( 0.472 4.759 -4.963) 6.892 12.543 ( 0.827 -6.130 -4.675) 7.753 12.543 ( 0.827 6.130 -4.675) 7.753 13.078 ( 10.785 -14.085 11.471) 21.125 13.078 ( 10.785 14.085 11.471) 21.125 13.522 ( -4.183 -4.903 -8.757) 10.873 13.522 ( -4.183 4.903 -8.757) 10.873 13.809 ( 3.305 -5.742 2.783) 7.186 13.809 ( 3.305 5.742 2.783) 7.186 16.272 ( -1.428 -3.630 -4.928) 6.285 16.272 ( -1.428 3.630 -4.928) 6.285 16.644 ( -2.796 -2.129 -4.152) 5.440 16.644 ( -2.796 2.129 -4.152) 5.440 18.076 ( -11.243 -15.543 6.793) 20.351 18.076 ( -11.243 15.543 6.793) 20.351 18.933 ( 15.929 -9.377 -3.437) 18.801 18.933 ( 15.929 9.377 -3.437) 18.801 ======================= Grid point 374 (204/205) ======================= q-point: (-0.22 -0.50 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.800 ( -7.708 -8.319 8.618) 14.244 2.800 ( -7.708 8.319 8.618) 14.244 3.393 ( -14.291 -13.953 8.167) 21.578 3.393 ( -14.291 13.953 8.167) 21.578 4.564 ( 26.173 -7.954 -8.933) 28.776 4.564 ( 26.173 7.954 -8.933) 28.776 4.810 ( 3.355 -2.397 15.814) 16.343 4.810 ( 3.355 2.397 15.814) 16.343 5.571 ( -3.320 -1.005 -1.026) 3.617 5.571 ( -3.320 1.005 -1.026) 3.617 5.945 ( -0.954 -6.515 1.320) 6.715 5.945 ( -0.954 6.515 1.320) 6.715 6.121 ( -0.466 -4.343 15.379) 15.987 6.121 ( -0.466 4.343 15.379) 15.987 7.481 ( 20.959 -5.235 4.802) 22.130 7.481 ( 20.959 5.235 4.802) 22.130 8.070 ( 0.419 -9.325 1.278) 9.422 8.070 ( 0.419 9.325 1.278) 9.422 8.765 ( 4.269 -11.566 0.473) 12.338 8.765 ( 4.269 11.566 0.473) 12.338 9.297 ( -9.367 -16.371 4.783) 19.458 9.297 ( -9.367 16.371 4.783) 19.458 9.767 ( 4.851 -3.156 -5.399) 7.915 9.767 ( 4.851 3.156 -5.399) 7.915 10.318 ( -12.355 -13.359 -4.732) 18.802 10.318 ( -12.355 13.359 -4.732) 18.802 10.822 ( -13.639 -12.545 -2.480) 18.696 10.822 ( -13.639 12.545 -2.480) 18.696 11.223 ( 4.058 -7.653 0.339) 8.669 11.223 ( 4.058 7.653 0.339) 8.669 11.886 ( -0.264 -7.709 -9.350) 12.122 11.886 ( -0.264 7.709 -9.350) 12.122 12.530 ( 2.176 -4.487 -4.012) 6.401 12.530 ( 2.176 4.488 -4.012) 6.401 13.213 ( -2.814 -16.565 -7.686) 18.476 13.213 ( -2.814 16.565 -7.686) 18.476 13.473 ( 3.590 -3.520 8.283) 9.690 13.473 ( 3.590 3.520 8.283) 9.690 13.863 ( 1.224 -8.350 -0.044) 8.439 13.863 ( 1.224 8.350 -0.044) 8.439 16.175 ( -2.054 -5.006 -7.052) 8.889 16.175 ( -2.054 5.006 -7.052) 8.889 16.496 ( -6.298 -3.832 -7.989) 10.871 16.496 ( -6.298 3.832 -7.989) 10.871 17.990 ( -6.793 -12.529 8.578) 16.634 17.990 ( -6.793 12.529 8.578) 16.634 19.181 ( 14.136 -4.702 -2.707) 15.141 19.181 ( 14.136 4.702 -2.707) 15.141 ======================= Grid point 376 (205/205) ======================= q-point: (-0.11 -0.50 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 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: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.711 ( -7.927 -4.869 5.109) 10.613 2.711 ( -7.927 4.869 5.109) 10.613 3.274 ( -5.413 -7.049 3.123) 9.420 3.274 ( -5.413 7.049 3.123) 9.420 4.817 ( 4.975 -2.365 1.191) 5.636 4.817 ( 4.975 2.365 1.191) 5.636 5.095 ( 14.595 -7.583 6.357) 17.633 5.095 ( 14.595 7.583 6.357) 17.633 5.559 ( 1.258 -7.336 1.018) 7.512 5.559 ( 1.258 7.336 1.018) 7.512 5.814 ( -11.050 -6.130 3.334) 13.069 5.814 ( -11.050 6.130 3.334) 13.069 6.416 ( 10.225 -3.917 15.942) 19.341 6.416 ( 10.225 3.917 15.942) 19.341 7.842 ( 11.280 -4.982 4.248) 13.042 7.842 ( 11.280 4.982 4.248) 13.042 8.126 ( 3.699 -9.742 5.102) 11.602 8.126 ( 3.699 9.742 5.102) 11.602 8.814 ( 2.194 -13.264 -3.358) 13.857 8.814 ( 2.194 13.264 -3.358) 13.857 9.195 ( -7.588 -15.949 5.961) 18.641 9.195 ( -7.588 15.949 5.961) 18.641 9.606 ( -9.202 -19.265 -17.213) 27.424 9.606 ( -9.202 19.265 -17.213) 27.424 10.188 ( 3.273 -2.118 -3.625) 5.324 10.188 ( 3.273 2.118 -3.625) 5.324 10.648 ( -6.674 -13.448 4.313) 15.620 10.648 ( -6.674 13.448 4.313) 15.620 11.325 ( 2.997 -4.676 5.617) 7.900 11.325 ( 2.997 4.676 5.617) 7.900 11.777 ( -0.559 -8.368 -10.345) 13.318 11.777 ( -0.559 8.368 -10.345) 13.318 12.544 ( 4.236 -6.225 -4.148) 8.597 12.544 ( 4.236 6.225 -4.148) 8.597 13.000 ( -9.076 -12.158 -7.817) 17.068 13.000 ( -9.076 12.158 -7.817) 17.068 13.643 ( 3.796 -3.670 7.337) 9.039 13.643 ( 3.796 3.670 7.337) 9.039 13.866 ( -0.165 -11.292 -0.235) 11.296 13.866 ( -0.165 11.292 -0.235) 11.296 16.071 ( -1.672 -4.505 -6.057) 7.732 16.071 ( -1.672 4.505 -6.057) 7.732 16.290 ( -6.583 -3.895 -7.445) 10.674 16.290 ( -6.583 3.895 -7.445) 10.674 17.989 ( -2.905 -8.718 7.458) 11.835 17.989 ( -2.905 8.718 7.458) 11.835 19.366 ( 9.130 -0.658 -3.283) 9.725 19.366 ( 9.130 0.658 -3.283) 9.725 =================== 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 3/31104 10.0 4422.047 10556.348 7262.050 0.000 107.048 0.000 3/31104 20.0 1043.485 1563.464 1330.843 0.000 231.917 0.000 3/31104 30.0 322.916 432.879 387.274 0.000 83.230 0.000 3/31104 40.0 154.165 188.077 172.498 0.000 36.499 0.000 3/31104 50.0 92.843 105.558 98.687 0.000 19.840 0.000 3/31104 60.0 63.295 68.541 65.193 0.000 12.359 0.000 3/31104 70.0 46.519 48.679 47.027 0.000 8.421 0.000 3/31104 80.0 35.990 36.727 35.971 0.000 6.111 0.000 3/31104 90.0 28.924 28.960 28.699 0.000 4.649 0.000 3/31104 100.0 23.946 23.624 23.642 0.000 3.669 0.000 3/31104 110.0 20.301 19.799 19.973 0.000 2.984 0.000 3/31104 120.0 17.549 16.961 17.221 0.000 2.488 0.000 3/31104 130.0 15.415 14.795 15.098 0.000 2.117 0.000 3/31104 140.0 13.723 13.100 13.421 0.000 1.833 0.000 3/31104 150.0 12.356 11.747 12.070 0.000 1.610 0.000 3/31104 160.0 11.232 10.645 10.962 0.000 1.433 0.000 3/31104 170.0 10.294 9.734 10.040 0.000 1.289 0.000 3/31104 180.0 9.501 8.970 9.261 0.000 1.170 0.000 3/31104 190.0 8.823 8.320 8.597 0.000 1.070 0.000 3/31104 200.0 8.237 7.762 8.023 0.000 0.986 0.000 3/31104 210.0 7.726 7.277 7.524 0.000 0.914 0.000 3/31104 220.0 7.277 6.852 7.085 0.000 0.852 0.000 3/31104 230.0 6.879 6.476 6.696 0.000 0.798 0.000 3/31104 240.0 6.523 6.142 6.350 0.000 0.751 0.000 3/31104 250.0 6.205 5.843 6.039 0.000 0.708 0.000 3/31104 260.0 5.917 5.573 5.758 0.000 0.671 0.000 3/31104 270.0 5.655 5.329 5.504 0.000 0.637 0.000 3/31104 280.0 5.417 5.106 5.272 0.000 0.607 0.000 3/31104 290.0 5.199 4.902 5.060 0.000 0.580 0.000 3/31104 300.0 4.999 4.715 4.865 0.000 0.555 0.000 3/31104 310.0 4.814 4.542 4.685 0.000 0.532 0.000 3/31104 320.0 4.643 4.382 4.519 0.000 0.511 0.000 3/31104 330.0 4.484 4.234 4.364 0.000 0.492 0.000 3/31104 340.0 4.336 4.096 4.220 0.000 0.474 0.000 3/31104 350.0 4.198 3.967 4.086 0.000 0.457 0.000 3/31104 360.0 4.069 3.846 3.961 0.000 0.442 0.000 3/31104 370.0 3.948 3.733 3.843 0.000 0.428 0.000 3/31104 380.0 3.834 3.626 3.732 0.000 0.414 0.000 3/31104 390.0 3.727 3.526 3.628 0.000 0.402 0.000 3/31104 400.0 3.626 3.431 3.529 0.000 0.390 0.000 3/31104 410.0 3.530 3.342 3.437 0.000 0.379 0.000 3/31104 420.0 3.440 3.257 3.348 0.000 0.369 0.000 3/31104 430.0 3.354 3.177 3.265 0.000 0.359 0.000 3/31104 440.0 3.272 3.100 3.186 0.000 0.350 0.000 3/31104 450.0 3.195 3.027 3.110 0.000 0.341 0.000 3/31104 460.0 3.121 2.958 3.038 0.000 0.332 0.000 3/31104 470.0 3.050 2.892 2.970 0.000 0.325 0.000 3/31104 480.0 2.983 2.829 2.905 0.000 0.317 0.000 3/31104 490.0 2.919 2.769 2.842 0.000 0.310 0.000 3/31104 500.0 2.857 2.711 2.782 0.000 0.303 0.000 3/31104 510.0 2.799 2.655 2.725 0.000 0.296 0.000 3/31104 520.0 2.742 2.602 2.670 0.000 0.290 0.000 3/31104 530.0 2.688 2.551 2.618 0.000 0.284 0.000 3/31104 540.0 2.636 2.502 2.567 0.000 0.278 0.000 3/31104 550.0 2.586 2.455 2.518 0.000 0.273 0.000 3/31104 560.0 2.538 2.410 2.472 0.000 0.268 0.000 3/31104 570.0 2.492 2.366 2.427 0.000 0.263 0.000 3/31104 580.0 2.447 2.324 2.383 0.000 0.258 0.000 3/31104 590.0 2.404 2.284 2.341 0.000 0.253 0.000 3/31104 600.0 2.363 2.245 2.301 0.000 0.248 0.000 3/31104 610.0 2.323 2.207 2.262 0.000 0.244 0.000 3/31104 620.0 2.284 2.171 2.225 0.000 0.240 0.000 3/31104 630.0 2.246 2.135 2.188 0.000 0.236 0.000 3/31104 640.0 2.210 2.101 2.153 0.000 0.232 0.000 3/31104 650.0 2.175 2.068 2.119 0.000 0.228 0.000 3/31104 660.0 2.141 2.036 2.086 0.000 0.225 0.000 3/31104 670.0 2.109 2.005 2.054 0.000 0.221 0.000 3/31104 680.0 2.077 1.975 2.023 0.000 0.218 0.000 3/31104 690.0 2.046 1.946 1.993 0.000 0.214 0.000 3/31104 700.0 2.016 1.917 1.964 0.000 0.211 0.000 3/31104 710.0 1.987 1.890 1.936 0.000 0.208 0.000 3/31104 720.0 1.959 1.863 1.908 0.000 0.205 0.000 3/31104 730.0 1.931 1.837 1.881 0.000 0.202 0.000 3/31104 740.0 1.904 1.812 1.855 0.000 0.199 0.000 3/31104 750.0 1.878 1.787 1.830 0.000 0.196 0.000 3/31104 760.0 1.853 1.764 1.806 0.000 0.194 0.000 3/31104 770.0 1.829 1.740 1.782 0.000 0.191 0.000 3/31104 780.0 1.805 1.718 1.758 0.000 0.188 0.000 3/31104 790.0 1.782 1.696 1.736 0.000 0.186 0.000 3/31104 800.0 1.759 1.674 1.714 0.000 0.184 0.000 3/31104 810.0 1.737 1.653 1.692 0.000 0.181 0.000 3/31104 820.0 1.715 1.633 1.671 0.000 0.179 0.000 3/31104 830.0 1.694 1.613 1.651 0.000 0.177 0.000 3/31104 840.0 1.674 1.593 1.631 0.000 0.175 0.000 3/31104 850.0 1.654 1.574 1.611 0.000 0.172 0.000 3/31104 860.0 1.634 1.556 1.592 0.000 0.170 0.000 3/31104 870.0 1.615 1.538 1.574 0.000 0.168 0.000 3/31104 880.0 1.596 1.520 1.556 0.000 0.166 0.000 3/31104 890.0 1.578 1.503 1.538 0.000 0.164 0.000 3/31104 900.0 1.560 1.486 1.521 0.000 0.163 0.000 3/31104 910.0 1.543 1.470 1.504 0.000 0.161 0.000 3/31104 920.0 1.526 1.453 1.487 0.000 0.159 0.000 3/31104 930.0 1.509 1.438 1.471 0.000 0.157 0.000 3/31104 940.0 1.493 1.422 1.455 0.000 0.155 0.000 3/31104 950.0 1.477 1.407 1.440 0.000 0.154 0.000 3/31104 960.0 1.462 1.392 1.424 0.000 0.152 0.000 3/31104 970.0 1.446 1.378 1.410 0.000 0.151 0.000 3/31104 980.0 1.432 1.364 1.395 0.000 0.149 0.000 3/31104 990.0 1.417 1.350 1.381 0.000 0.147 0.000 3/31104 1000.0 1.403 1.336 1.367 0.000 0.146 0.000 3/31104 Thermal conductivity related properties were written into "kappa-m989.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 22:17:13]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|