----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 00:09:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [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 6.093785370136920 0.000000000000000 0.000000000000000 b 0.000000000000000 6.089201600000000 0.000000000000000 c -3.003378387295919 0.000000000000000 5.394569603420902 Atomic positions (fractional): *1 Li 0.71085725006466 0.65335149038786 0.93973199867598 6.941 2 Li 0.28914274993534 0.15335149038786 0.56026800132402 6.941 3 Li 0.28914274993534 0.34664850961214 0.06026800132402 6.941 4 Li 0.71085725006466 0.84664850961214 0.43973199867598 6.941 *5 O 0.54512190745723 0.39036611146652 0.73553280584566 15.999 *6 O 0.00960269542516 0.17003570475876 0.84208373570819 15.999 7 O 0.45487809254277 0.89036611146652 0.76446719415434 15.999 8 O 0.45487809254277 0.60963388853348 0.26446719415434 15.999 9 O 0.99039730457484 0.82996429524124 0.15791626429181 15.999 10 O 0.99039730457484 0.67003570475876 0.65791626429181 15.999 11 O 0.00960269542516 0.32996429524124 0.34208373570819 15.999 12 O 0.54512190745723 0.10963388853348 0.23553280584566 15.999 *13 Ho 0.76530885649174 0.13014135448232 0.02023937306296 164.930 14 Ho 0.76530885649174 0.36985864551768 0.52023937306296 164.930 15 Ho 0.23469114350826 0.86985864551768 0.97976062693704 164.930 16 Ho 0.23469114350826 0.63014135448232 0.47976062693704 164.930 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.093785370136920 0.000000000000000 0.000000000000000 b 0.000000000000000 6.089201600000000 0.000000000000000 c -3.003378387295919 0.000000000000000 5.394569603420902 Atomic positions (fractional): *1 Li 0.71085725006466 0.65335149038786 0.93973199867598 6.941 > 1 2 Li 0.28914274993534 0.15335149038786 0.56026800132402 6.941 > 2 3 Li 0.28914274993534 0.34664850961214 0.06026800132402 6.941 > 3 4 Li 0.71085725006466 0.84664850961214 0.43973199867598 6.941 > 4 *5 O 0.54512190745723 0.39036611146652 0.73553280584566 15.999 > 5 *6 O 0.00960269542516 0.17003570475876 0.84208373570819 15.999 > 6 7 O 0.45487809254277 0.89036611146652 0.76446719415434 15.999 > 7 8 O 0.45487809254277 0.60963388853348 0.26446719415434 15.999 > 8 9 O 0.99039730457484 0.82996429524124 0.15791626429181 15.999 > 9 10 O 0.99039730457484 0.67003570475876 0.65791626429181 15.999 > 10 11 O 0.00960269542516 0.32996429524124 0.34208373570819 15.999 > 11 12 O 0.54512190745723 0.10963388853348 0.23553280584566 15.999 > 12 *13 Ho 0.76530885649174 0.13014135448232 0.02023937306296 164.930 > 13 14 Ho 0.76530885649174 0.36985864551768 0.52023937306296 164.930 > 14 15 Ho 0.23469114350826 0.86985864551768 0.97976062693704 164.930 > 15 16 Ho 0.23469114350826 0.63014135448232 0.47976062693704 164.930 > 16 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.187570740273840 0.000000000000000 0.000000000000000 b 0.000000000000000 12.178403200000000 0.000000000000000 c -6.006756774591838 0.000000000000000 10.789139206841805 Atomic positions (fractional): *1 Li 0.35542862503233 0.32667574519393 0.46986599933799 6.941 > 1 2 Li 0.85542862503233 0.32667574519393 0.46986599933799 6.941 > 1 3 Li 0.35542862503233 0.82667574519393 0.46986599933799 6.941 > 1 4 Li 0.85542862503233 0.82667574519393 0.46986599933799 6.941 > 1 5 Li 0.35542862503233 0.32667574519393 0.96986599933799 6.941 > 1 6 Li 0.85542862503233 0.32667574519393 0.96986599933799 6.941 > 1 7 Li 0.35542862503233 0.82667574519393 0.96986599933799 6.941 > 1 8 Li 0.85542862503233 0.82667574519393 0.96986599933799 6.941 > 1 9 Li 0.14457137496767 0.07667574519393 0.28013400066201 6.941 > 2 10 Li 0.64457137496767 0.07667574519393 0.28013400066201 6.941 > 2 11 Li 0.14457137496767 0.57667574519393 0.28013400066201 6.941 > 2 12 Li 0.64457137496767 0.57667574519393 0.28013400066201 6.941 > 2 13 Li 0.14457137496767 0.07667574519393 0.78013400066201 6.941 > 2 14 Li 0.64457137496767 0.07667574519393 0.78013400066201 6.941 > 2 15 Li 0.14457137496767 0.57667574519393 0.78013400066201 6.941 > 2 16 Li 0.64457137496767 0.57667574519393 0.78013400066201 6.941 > 2 17 Li 0.14457137496767 0.17332425480607 0.03013400066201 6.941 > 3 18 Li 0.64457137496767 0.17332425480607 0.03013400066201 6.941 > 3 19 Li 0.14457137496767 0.67332425480607 0.03013400066201 6.941 > 3 20 Li 0.64457137496767 0.67332425480607 0.03013400066201 6.941 > 3 21 Li 0.14457137496767 0.17332425480607 0.53013400066201 6.941 > 3 22 Li 0.64457137496767 0.17332425480607 0.53013400066201 6.941 > 3 23 Li 0.14457137496767 0.67332425480607 0.53013400066201 6.941 > 3 24 Li 0.64457137496767 0.67332425480607 0.53013400066201 6.941 > 3 25 Li 0.35542862503233 0.42332425480607 0.21986599933799 6.941 > 4 26 Li 0.85542862503233 0.42332425480607 0.21986599933799 6.941 > 4 27 Li 0.35542862503233 0.92332425480607 0.21986599933799 6.941 > 4 28 Li 0.85542862503233 0.92332425480607 0.21986599933799 6.941 > 4 29 Li 0.35542862503233 0.42332425480607 0.71986599933799 6.941 > 4 30 Li 0.85542862503233 0.42332425480607 0.71986599933799 6.941 > 4 31 Li 0.35542862503233 0.92332425480607 0.71986599933799 6.941 > 4 32 Li 0.85542862503233 0.92332425480607 0.71986599933799 6.941 > 4 *33 O 0.27256095372862 0.19518305573326 0.36776640292283 15.999 > 5 34 O 0.77256095372862 0.19518305573326 0.36776640292283 15.999 > 5 35 O 0.27256095372862 0.69518305573326 0.36776640292283 15.999 > 5 36 O 0.77256095372862 0.69518305573326 0.36776640292283 15.999 > 5 37 O 0.27256095372862 0.19518305573326 0.86776640292283 15.999 > 5 38 O 0.77256095372862 0.19518305573326 0.86776640292283 15.999 > 5 39 O 0.27256095372862 0.69518305573326 0.86776640292283 15.999 > 5 40 O 0.77256095372862 0.69518305573326 0.86776640292283 15.999 > 5 *41 O 0.00480134771258 0.08501785237938 0.42104186785409 15.999 > 6 42 O 0.50480134771258 0.08501785237938 0.42104186785409 15.999 > 6 43 O 0.00480134771258 0.58501785237938 0.42104186785409 15.999 > 6 44 O 0.50480134771258 0.58501785237938 0.42104186785409 15.999 > 6 45 O 0.00480134771258 0.08501785237938 0.92104186785410 15.999 > 6 46 O 0.50480134771258 0.08501785237938 0.92104186785410 15.999 > 6 47 O 0.00480134771258 0.58501785237938 0.92104186785410 15.999 > 6 48 O 0.50480134771258 0.58501785237938 0.92104186785410 15.999 > 6 49 O 0.22743904627138 0.44518305573326 0.38223359707717 15.999 > 7 50 O 0.72743904627138 0.44518305573326 0.38223359707717 15.999 > 7 51 O 0.22743904627138 0.94518305573326 0.38223359707717 15.999 > 7 52 O 0.72743904627138 0.94518305573326 0.38223359707717 15.999 > 7 53 O 0.22743904627138 0.44518305573326 0.88223359707717 15.999 > 7 54 O 0.72743904627138 0.44518305573326 0.88223359707717 15.999 > 7 55 O 0.22743904627138 0.94518305573326 0.88223359707717 15.999 > 7 56 O 0.72743904627138 0.94518305573326 0.88223359707717 15.999 > 7 57 O 0.22743904627138 0.30481694426674 0.13223359707717 15.999 > 8 58 O 0.72743904627138 0.30481694426674 0.13223359707717 15.999 > 8 59 O 0.22743904627138 0.80481694426674 0.13223359707717 15.999 > 8 60 O 0.72743904627138 0.80481694426674 0.13223359707717 15.999 > 8 61 O 0.22743904627138 0.30481694426674 0.63223359707717 15.999 > 8 62 O 0.72743904627138 0.30481694426674 0.63223359707717 15.999 > 8 63 O 0.22743904627138 0.80481694426674 0.63223359707717 15.999 > 8 64 O 0.72743904627138 0.80481694426674 0.63223359707717 15.999 > 8 65 O 0.49519865228742 0.41498214762062 0.07895813214590 15.999 > 9 66 O 0.99519865228742 0.41498214762062 0.07895813214590 15.999 > 9 67 O 0.49519865228742 0.91498214762062 0.07895813214590 15.999 > 9 68 O 0.99519865228742 0.91498214762062 0.07895813214590 15.999 > 9 69 O 0.49519865228742 0.41498214762062 0.57895813214590 15.999 > 9 70 O 0.99519865228742 0.41498214762062 0.57895813214590 15.999 > 9 71 O 0.49519865228742 0.91498214762062 0.57895813214590 15.999 > 9 72 O 0.99519865228742 0.91498214762062 0.57895813214590 15.999 > 9 73 O 0.49519865228742 0.33501785237938 0.32895813214591 15.999 > 10 74 O 0.99519865228742 0.33501785237938 0.32895813214591 15.999 > 10 75 O 0.49519865228742 0.83501785237938 0.32895813214591 15.999 > 10 76 O 0.99519865228742 0.83501785237938 0.32895813214591 15.999 > 10 77 O 0.49519865228742 0.33501785237938 0.82895813214590 15.999 > 10 78 O 0.99519865228742 0.33501785237938 0.82895813214590 15.999 > 10 79 O 0.49519865228742 0.83501785237938 0.82895813214590 15.999 > 10 80 O 0.99519865228742 0.83501785237938 0.82895813214590 15.999 > 10 81 O 0.00480134771258 0.16498214762062 0.17104186785410 15.999 > 11 82 O 0.50480134771258 0.16498214762062 0.17104186785410 15.999 > 11 83 O 0.00480134771258 0.66498214762062 0.17104186785410 15.999 > 11 84 O 0.50480134771258 0.66498214762062 0.17104186785410 15.999 > 11 85 O 0.00480134771258 0.16498214762062 0.67104186785410 15.999 > 11 86 O 0.50480134771258 0.16498214762062 0.67104186785410 15.999 > 11 87 O 0.00480134771258 0.66498214762062 0.67104186785410 15.999 > 11 88 O 0.50480134771258 0.66498214762062 0.67104186785410 15.999 > 11 89 O 0.27256095372862 0.05481694426674 0.11776640292283 15.999 > 12 90 O 0.77256095372862 0.05481694426674 0.11776640292283 15.999 > 12 91 O 0.27256095372862 0.55481694426674 0.11776640292283 15.999 > 12 92 O 0.77256095372862 0.55481694426674 0.11776640292283 15.999 > 12 93 O 0.27256095372862 0.05481694426674 0.61776640292283 15.999 > 12 94 O 0.77256095372862 0.05481694426674 0.61776640292283 15.999 > 12 95 O 0.27256095372862 0.55481694426674 0.61776640292283 15.999 > 12 96 O 0.77256095372862 0.55481694426674 0.61776640292283 15.999 > 12 *97 Ho 0.38265442824587 0.06507067724116 0.01011968653148 164.930 > 13 98 Ho 0.88265442824587 0.06507067724116 0.01011968653148 164.930 > 13 99 Ho 0.38265442824587 0.56507067724116 0.01011968653148 164.930 > 13 100 Ho 0.88265442824587 0.56507067724116 0.01011968653148 164.930 > 13 101 Ho 0.38265442824587 0.06507067724116 0.51011968653148 164.930 > 13 102 Ho 0.88265442824587 0.06507067724116 0.51011968653148 164.930 > 13 103 Ho 0.38265442824587 0.56507067724116 0.51011968653148 164.930 > 13 104 Ho 0.88265442824587 0.56507067724116 0.51011968653148 164.930 > 13 105 Ho 0.38265442824587 0.18492932275884 0.26011968653148 164.930 > 14 106 Ho 0.88265442824587 0.18492932275884 0.26011968653148 164.930 > 14 107 Ho 0.38265442824587 0.68492932275884 0.26011968653148 164.930 > 14 108 Ho 0.88265442824587 0.68492932275884 0.26011968653148 164.930 > 14 109 Ho 0.38265442824587 0.18492932275884 0.76011968653148 164.930 > 14 110 Ho 0.88265442824587 0.18492932275884 0.76011968653148 164.930 > 14 111 Ho 0.38265442824587 0.68492932275884 0.76011968653148 164.930 > 14 112 Ho 0.88265442824587 0.68492932275884 0.76011968653148 164.930 > 14 113 Ho 0.11734557175413 0.43492932275884 0.48988031346852 164.930 > 15 114 Ho 0.61734557175413 0.43492932275884 0.48988031346852 164.930 > 15 115 Ho 0.11734557175413 0.93492932275884 0.48988031346852 164.930 > 15 116 Ho 0.61734557175413 0.93492932275884 0.48988031346852 164.930 > 15 117 Ho 0.11734557175413 0.43492932275884 0.98988031346852 164.930 > 15 118 Ho 0.61734557175413 0.43492932275884 0.98988031346852 164.930 > 15 119 Ho 0.11734557175413 0.93492932275884 0.98988031346852 164.930 > 15 120 Ho 0.61734557175413 0.93492932275884 0.98988031346852 164.930 > 15 121 Ho 0.11734557175413 0.31507067724116 0.23988031346852 164.930 > 16 122 Ho 0.61734557175413 0.31507067724116 0.23988031346852 164.930 > 16 123 Ho 0.11734557175413 0.81507067724116 0.23988031346852 164.930 > 16 124 Ho 0.61734557175413 0.81507067724116 0.23988031346852 164.930 > 16 125 Ho 0.11734557175413 0.31507067724116 0.73988031346852 164.930 > 16 126 Ho 0.61734557175413 0.31507067724116 0.73988031346852 164.930 > 16 127 Ho 0.11734557175413 0.81507067724116 0.73988031346852 164.930 > 16 128 Ho 0.61734557175413 0.81507067724116 0.73988031346852 164.930 > 16 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.8154750 0.0000000 -0.0453007 0.0000000 3.7284548 0.0000000 -0.0452991 0.0000000 3.7904488 -------------------------- Born effective charges -------------------------- 1 Li 1.0190121 -0.0130486 0.0333596 -0.0069930 1.0398590 0.0663390 0.0340163 0.0541165 1.0112278 2 Li 1.0190121 0.0130486 0.0333596 0.0069930 1.0398590 -0.0663390 0.0340163 -0.0541165 1.0112278 3 Li 1.0190121 -0.0130486 0.0333596 -0.0069930 1.0398590 0.0663390 0.0340163 0.0541165 1.0112278 4 Li 1.0190121 0.0130486 0.0333596 0.0069930 1.0398590 -0.0663390 0.0340163 -0.0541165 1.0112278 5 O -2.2838715 0.3693610 -0.0778706 0.3787674 -2.2831747 0.7421754 -0.0731051 0.6710092 -2.3575425 6 O -2.3591710 0.4153887 -0.0363198 0.4176690 -2.4017480 0.7603168 -0.0154784 0.8617260 -2.3172633 7 O -2.2838715 -0.3693610 -0.0778706 -0.3787674 -2.2831747 -0.7421754 -0.0731051 -0.6710092 -2.3575425 8 O -2.2838715 0.3693610 -0.0778706 0.3787674 -2.2831747 0.7421754 -0.0731051 0.6710092 -2.3575425 9 O -2.3591710 0.4153887 -0.0363198 0.4176690 -2.4017480 0.7603168 -0.0154784 0.8617260 -2.3172633 10 O -2.3591710 -0.4153887 -0.0363198 -0.4176690 -2.4017480 -0.7603168 -0.0154784 -0.8617260 -2.3172633 11 O -2.3591710 -0.4153887 -0.0363198 -0.4176690 -2.4017480 -0.7603168 -0.0154784 -0.8617260 -2.3172633 12 O -2.2838715 -0.3693610 -0.0778706 -0.3787674 -2.2831747 -0.7421754 -0.0731051 -0.6710092 -2.3575425 13 Ho 3.6240304 -0.0530263 0.0808308 0.0251974 3.6450637 0.1628250 0.0545672 -0.1080773 3.6635779 14 Ho 3.6240304 0.0530263 0.0808308 -0.0251974 3.6450637 -0.1628250 0.0545672 0.1080773 3.6635779 15 Ho 3.6240304 -0.0530263 0.0808308 0.0251974 3.6450637 0.1628250 0.0545672 -0.1080773 3.6635779 16 Ho 3.6240304 0.0530263 0.0808308 -0.0251974 3.6450637 -0.1628250 0.0545672 0.1080773 3.6635779 ---------------------------------------------------------------------------- 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) 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: 3 / 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: 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, 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 |-- (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: 0.928 Solver_block: 200 / 480 - Time: 0.905 Solver_block: 300 / 480 - Time: 0.886 Solver_block: 400 / 480 - Time: 0.889 Solver_block: 480 / 480 - Time: 0.732 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 4.432 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) 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) 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: 3 / 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: 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, 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 |-- (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 2026-01-08 00:09:46]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 00:09:47]------------------------- 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 6.093785370136920 0.000000000000000 0.000000000000000 b 0.000000000000000 6.089201600000000 0.000000000000000 c -3.003378387295919 0.000000000000000 5.394569603420902 Atomic positions (fractional): 1 Li 0.71085725006466 0.65335149038786 0.93973199867598 6.941 2 Li 0.28914274993534 0.15335149038786 0.56026800132402 6.941 3 Li 0.28914274993534 0.34664850961214 0.06026800132402 6.941 4 Li 0.71085725006466 0.84664850961214 0.43973199867598 6.941 5 O 0.54512190745723 0.39036611146652 0.73553280584566 15.999 6 O 0.00960269542516 0.17003570475876 0.84208373570819 15.999 7 O 0.45487809254277 0.89036611146652 0.76446719415434 15.999 8 O 0.45487809254277 0.60963388853348 0.26446719415434 15.999 9 O 0.99039730457484 0.82996429524124 0.15791626429181 15.999 10 O 0.99039730457484 0.67003570475876 0.65791626429181 15.999 11 O 0.00960269542516 0.32996429524124 0.34208373570819 15.999 12 O 0.54512190745723 0.10963388853348 0.23553280584566 15.999 13 Ho 0.76530885649174 0.13014135448232 0.02023937306296 164.930 14 Ho 0.76530885649174 0.36985864551768 0.52023937306296 164.930 15 Ho 0.23469114350826 0.86985864551768 0.97976062693704 164.930 16 Ho 0.23469114350826 0.63014135448232 0.47976062693704 164.930 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.187570740273840 0.000000000000000 0.000000000000000 b 0.000000000000000 12.178403200000000 0.000000000000000 c -6.006756774591838 0.000000000000000 10.789139206841805 Atomic positions (fractional): 1 Li 0.35542862503233 0.32667574519393 0.46986599933799 6.941 > 1 2 Li 0.85542862503233 0.32667574519393 0.46986599933799 6.941 > 1 3 Li 0.35542862503233 0.82667574519393 0.46986599933799 6.941 > 1 4 Li 0.85542862503233 0.82667574519393 0.46986599933799 6.941 > 1 5 Li 0.35542862503233 0.32667574519393 0.96986599933799 6.941 > 1 6 Li 0.85542862503233 0.32667574519393 0.96986599933799 6.941 > 1 7 Li 0.35542862503233 0.82667574519393 0.96986599933799 6.941 > 1 8 Li 0.85542862503233 0.82667574519393 0.96986599933799 6.941 > 1 9 Li 0.14457137496767 0.07667574519393 0.28013400066201 6.941 > 9 10 Li 0.64457137496767 0.07667574519393 0.28013400066201 6.941 > 9 11 Li 0.14457137496767 0.57667574519393 0.28013400066201 6.941 > 9 12 Li 0.64457137496767 0.57667574519393 0.28013400066201 6.941 > 9 13 Li 0.14457137496767 0.07667574519393 0.78013400066201 6.941 > 9 14 Li 0.64457137496767 0.07667574519393 0.78013400066201 6.941 > 9 15 Li 0.14457137496767 0.57667574519393 0.78013400066201 6.941 > 9 16 Li 0.64457137496767 0.57667574519393 0.78013400066201 6.941 > 9 17 Li 0.14457137496767 0.17332425480607 0.03013400066201 6.941 > 17 18 Li 0.64457137496767 0.17332425480607 0.03013400066201 6.941 > 17 19 Li 0.14457137496767 0.67332425480607 0.03013400066201 6.941 > 17 20 Li 0.64457137496767 0.67332425480607 0.03013400066201 6.941 > 17 21 Li 0.14457137496767 0.17332425480607 0.53013400066201 6.941 > 17 22 Li 0.64457137496767 0.17332425480607 0.53013400066201 6.941 > 17 23 Li 0.14457137496767 0.67332425480607 0.53013400066201 6.941 > 17 24 Li 0.64457137496767 0.67332425480607 0.53013400066201 6.941 > 17 25 Li 0.35542862503233 0.42332425480607 0.21986599933799 6.941 > 25 26 Li 0.85542862503233 0.42332425480607 0.21986599933799 6.941 > 25 27 Li 0.35542862503233 0.92332425480607 0.21986599933799 6.941 > 25 28 Li 0.85542862503233 0.92332425480607 0.21986599933799 6.941 > 25 29 Li 0.35542862503233 0.42332425480607 0.71986599933799 6.941 > 25 30 Li 0.85542862503233 0.42332425480607 0.71986599933799 6.941 > 25 31 Li 0.35542862503233 0.92332425480607 0.71986599933799 6.941 > 25 32 Li 0.85542862503233 0.92332425480607 0.71986599933799 6.941 > 25 33 O 0.27256095372862 0.19518305573326 0.36776640292283 15.999 > 33 34 O 0.77256095372862 0.19518305573326 0.36776640292283 15.999 > 33 35 O 0.27256095372862 0.69518305573326 0.36776640292283 15.999 > 33 36 O 0.77256095372862 0.69518305573326 0.36776640292283 15.999 > 33 37 O 0.27256095372862 0.19518305573326 0.86776640292283 15.999 > 33 38 O 0.77256095372862 0.19518305573326 0.86776640292283 15.999 > 33 39 O 0.27256095372862 0.69518305573326 0.86776640292283 15.999 > 33 40 O 0.77256095372862 0.69518305573326 0.86776640292283 15.999 > 33 41 O 0.00480134771258 0.08501785237938 0.42104186785409 15.999 > 41 42 O 0.50480134771258 0.08501785237938 0.42104186785409 15.999 > 41 43 O 0.00480134771258 0.58501785237938 0.42104186785409 15.999 > 41 44 O 0.50480134771258 0.58501785237938 0.42104186785409 15.999 > 41 45 O 0.00480134771258 0.08501785237938 0.92104186785410 15.999 > 41 46 O 0.50480134771258 0.08501785237938 0.92104186785410 15.999 > 41 47 O 0.00480134771258 0.58501785237938 0.92104186785410 15.999 > 41 48 O 0.50480134771258 0.58501785237938 0.92104186785410 15.999 > 41 49 O 0.22743904627138 0.44518305573326 0.38223359707717 15.999 > 49 50 O 0.72743904627138 0.44518305573326 0.38223359707717 15.999 > 49 51 O 0.22743904627138 0.94518305573326 0.38223359707717 15.999 > 49 52 O 0.72743904627138 0.94518305573326 0.38223359707717 15.999 > 49 53 O 0.22743904627138 0.44518305573326 0.88223359707717 15.999 > 49 54 O 0.72743904627138 0.44518305573326 0.88223359707717 15.999 > 49 55 O 0.22743904627138 0.94518305573326 0.88223359707717 15.999 > 49 56 O 0.72743904627138 0.94518305573326 0.88223359707717 15.999 > 49 57 O 0.22743904627138 0.30481694426674 0.13223359707717 15.999 > 57 58 O 0.72743904627138 0.30481694426674 0.13223359707717 15.999 > 57 59 O 0.22743904627138 0.80481694426674 0.13223359707717 15.999 > 57 60 O 0.72743904627138 0.80481694426674 0.13223359707717 15.999 > 57 61 O 0.22743904627138 0.30481694426674 0.63223359707717 15.999 > 57 62 O 0.72743904627138 0.30481694426674 0.63223359707717 15.999 > 57 63 O 0.22743904627138 0.80481694426674 0.63223359707717 15.999 > 57 64 O 0.72743904627138 0.80481694426674 0.63223359707717 15.999 > 57 65 O 0.49519865228742 0.41498214762062 0.07895813214590 15.999 > 65 66 O 0.99519865228742 0.41498214762062 0.07895813214590 15.999 > 65 67 O 0.49519865228742 0.91498214762062 0.07895813214590 15.999 > 65 68 O 0.99519865228742 0.91498214762062 0.07895813214590 15.999 > 65 69 O 0.49519865228742 0.41498214762062 0.57895813214590 15.999 > 65 70 O 0.99519865228742 0.41498214762062 0.57895813214590 15.999 > 65 71 O 0.49519865228742 0.91498214762062 0.57895813214590 15.999 > 65 72 O 0.99519865228742 0.91498214762062 0.57895813214590 15.999 > 65 73 O 0.49519865228742 0.33501785237938 0.32895813214591 15.999 > 73 74 O 0.99519865228742 0.33501785237938 0.32895813214591 15.999 > 73 75 O 0.49519865228742 0.83501785237938 0.32895813214591 15.999 > 73 76 O 0.99519865228742 0.83501785237938 0.32895813214591 15.999 > 73 77 O 0.49519865228742 0.33501785237938 0.82895813214590 15.999 > 73 78 O 0.99519865228742 0.33501785237938 0.82895813214590 15.999 > 73 79 O 0.49519865228742 0.83501785237938 0.82895813214590 15.999 > 73 80 O 0.99519865228742 0.83501785237938 0.82895813214590 15.999 > 73 81 O 0.00480134771258 0.16498214762062 0.17104186785410 15.999 > 81 82 O 0.50480134771258 0.16498214762062 0.17104186785410 15.999 > 81 83 O 0.00480134771258 0.66498214762062 0.17104186785410 15.999 > 81 84 O 0.50480134771258 0.66498214762062 0.17104186785410 15.999 > 81 85 O 0.00480134771258 0.16498214762062 0.67104186785410 15.999 > 81 86 O 0.50480134771258 0.16498214762062 0.67104186785410 15.999 > 81 87 O 0.00480134771258 0.66498214762062 0.67104186785410 15.999 > 81 88 O 0.50480134771258 0.66498214762062 0.67104186785410 15.999 > 81 89 O 0.27256095372862 0.05481694426674 0.11776640292283 15.999 > 89 90 O 0.77256095372862 0.05481694426674 0.11776640292283 15.999 > 89 91 O 0.27256095372862 0.55481694426674 0.11776640292283 15.999 > 89 92 O 0.77256095372862 0.55481694426674 0.11776640292283 15.999 > 89 93 O 0.27256095372862 0.05481694426674 0.61776640292283 15.999 > 89 94 O 0.77256095372862 0.05481694426674 0.61776640292283 15.999 > 89 95 O 0.27256095372862 0.55481694426674 0.61776640292283 15.999 > 89 96 O 0.77256095372862 0.55481694426674 0.61776640292283 15.999 > 89 97 Ho 0.38265442824587 0.06507067724116 0.01011968653148 164.930 > 97 98 Ho 0.88265442824587 0.06507067724116 0.01011968653148 164.930 > 97 99 Ho 0.38265442824587 0.56507067724116 0.01011968653148 164.930 > 97 100 Ho 0.88265442824587 0.56507067724116 0.01011968653148 164.930 > 97 101 Ho 0.38265442824587 0.06507067724116 0.51011968653148 164.930 > 97 102 Ho 0.88265442824587 0.06507067724116 0.51011968653148 164.930 > 97 103 Ho 0.38265442824587 0.56507067724116 0.51011968653148 164.930 > 97 104 Ho 0.88265442824587 0.56507067724116 0.51011968653148 164.930 > 97 105 Ho 0.38265442824587 0.18492932275884 0.26011968653148 164.930 > 105 106 Ho 0.88265442824587 0.18492932275884 0.26011968653148 164.930 > 105 107 Ho 0.38265442824587 0.68492932275884 0.26011968653148 164.930 > 105 108 Ho 0.88265442824587 0.68492932275884 0.26011968653148 164.930 > 105 109 Ho 0.38265442824587 0.18492932275884 0.76011968653148 164.930 > 105 110 Ho 0.88265442824587 0.18492932275884 0.76011968653148 164.930 > 105 111 Ho 0.38265442824587 0.68492932275884 0.76011968653148 164.930 > 105 112 Ho 0.88265442824587 0.68492932275884 0.76011968653148 164.930 > 105 113 Ho 0.11734557175413 0.43492932275884 0.48988031346852 164.930 > 113 114 Ho 0.61734557175413 0.43492932275884 0.48988031346852 164.930 > 113 115 Ho 0.11734557175413 0.93492932275884 0.48988031346852 164.930 > 113 116 Ho 0.61734557175413 0.93492932275884 0.48988031346852 164.930 > 113 117 Ho 0.11734557175413 0.43492932275884 0.98988031346852 164.930 > 113 118 Ho 0.61734557175413 0.43492932275884 0.98988031346852 164.930 > 113 119 Ho 0.11734557175413 0.93492932275884 0.98988031346852 164.930 > 113 120 Ho 0.61734557175413 0.93492932275884 0.98988031346852 164.930 > 113 121 Ho 0.11734557175413 0.31507067724116 0.23988031346852 164.930 > 121 122 Ho 0.61734557175413 0.31507067724116 0.23988031346852 164.930 > 121 123 Ho 0.11734557175413 0.81507067724116 0.23988031346852 164.930 > 121 124 Ho 0.61734557175413 0.81507067724116 0.23988031346852 164.930 > 121 125 Ho 0.11734557175413 0.31507067724116 0.73988031346852 164.930 > 121 126 Ho 0.61734557175413 0.31507067724116 0.73988031346852 164.930 > 121 127 Ho 0.11734557175413 0.81507067724116 0.73988031346852 164.930 > 121 128 Ho 0.61734557175413 0.81507067724116 0.73988031346852 164.930 > 121 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.8154750 0.0000000 -0.0453007 0.0000000 3.7284548 0.0000000 -0.0452991 0.0000000 3.7904488 -------------------------- Born effective charges -------------------------- 1 Li 1.0190121 -0.0130486 0.0333596 -0.0069930 1.0398590 0.0663390 0.0340163 0.0541165 1.0112278 2 Li 1.0190121 0.0130486 0.0333596 0.0069930 1.0398590 -0.0663390 0.0340163 -0.0541165 1.0112278 3 Li 1.0190121 -0.0130486 0.0333596 -0.0069930 1.0398590 0.0663390 0.0340163 0.0541165 1.0112278 4 Li 1.0190121 0.0130486 0.0333596 0.0069930 1.0398590 -0.0663390 0.0340163 -0.0541165 1.0112278 5 O -2.2838715 0.3693610 -0.0778706 0.3787674 -2.2831747 0.7421754 -0.0731051 0.6710092 -2.3575425 6 O -2.3591710 0.4153887 -0.0363198 0.4176690 -2.4017480 0.7603168 -0.0154784 0.8617260 -2.3172633 7 O -2.2838715 -0.3693610 -0.0778706 -0.3787674 -2.2831747 -0.7421754 -0.0731051 -0.6710092 -2.3575425 8 O -2.2838715 0.3693610 -0.0778706 0.3787674 -2.2831747 0.7421754 -0.0731051 0.6710092 -2.3575425 9 O -2.3591710 0.4153887 -0.0363198 0.4176690 -2.4017480 0.7603168 -0.0154784 0.8617260 -2.3172633 10 O -2.3591710 -0.4153887 -0.0363198 -0.4176690 -2.4017480 -0.7603168 -0.0154784 -0.8617260 -2.3172633 11 O -2.3591710 -0.4153887 -0.0363198 -0.4176690 -2.4017480 -0.7603168 -0.0154784 -0.8617260 -2.3172633 12 O -2.2838715 -0.3693610 -0.0778706 -0.3787674 -2.2831747 -0.7421754 -0.0731051 -0.6710092 -2.3575425 13 Ho 3.6240304 -0.0530263 0.0808308 0.0251974 3.6450637 0.1628250 0.0545672 -0.1080773 3.6635779 14 Ho 3.6240304 0.0530263 0.0808308 -0.0251974 3.6450637 -0.1628250 0.0545672 0.1080773 3.6635779 15 Ho 3.6240304 -0.0530263 0.0808308 0.0251974 3.6450637 0.1628250 0.0545672 -0.1080773 3.6635779 16 Ho 3.6240304 0.0530263 0.0808308 -0.0251974 3.6450637 -0.1628250 0.0545672 0.1080773 3.6635779 ---------------------------------------------------------------------------- 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 (zzz) -0.00000003 (zzz) -0.00000003 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000002 (zx) 0.00000002 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 00:10:10]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 00:10:10]------------------------- 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 6.093785370136920 0.000000000000000 0.000000000000000 b 0.000000000000000 6.089201600000000 0.000000000000000 c -3.003378387295919 0.000000000000000 5.394569603420902 Atomic positions (fractional): 1 Li 0.71085725006466 0.65335149038786 0.93973199867598 6.941 2 Li 0.28914274993534 0.15335149038786 0.56026800132402 6.941 3 Li 0.28914274993534 0.34664850961214 0.06026800132402 6.941 4 Li 0.71085725006466 0.84664850961214 0.43973199867598 6.941 5 O 0.54512190745723 0.39036611146652 0.73553280584566 15.999 6 O 0.00960269542516 0.17003570475876 0.84208373570819 15.999 7 O 0.45487809254277 0.89036611146652 0.76446719415434 15.999 8 O 0.45487809254277 0.60963388853348 0.26446719415434 15.999 9 O 0.99039730457484 0.82996429524124 0.15791626429181 15.999 10 O 0.99039730457484 0.67003570475876 0.65791626429181 15.999 11 O 0.00960269542516 0.32996429524124 0.34208373570819 15.999 12 O 0.54512190745723 0.10963388853348 0.23553280584566 15.999 13 Ho 0.76530885649174 0.13014135448232 0.02023937306296 164.930 14 Ho 0.76530885649174 0.36985864551768 0.52023937306296 164.930 15 Ho 0.23469114350826 0.86985864551768 0.97976062693704 164.930 16 Ho 0.23469114350826 0.63014135448232 0.47976062693704 164.930 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.187570740273840 0.000000000000000 0.000000000000000 b 0.000000000000000 12.178403200000000 0.000000000000000 c -6.006756774591838 0.000000000000000 10.789139206841805 Atomic positions (fractional): 1 Li 0.35542862503233 0.32667574519393 0.46986599933799 6.941 > 1 2 Li 0.85542862503233 0.32667574519393 0.46986599933799 6.941 > 1 3 Li 0.35542862503233 0.82667574519393 0.46986599933799 6.941 > 1 4 Li 0.85542862503233 0.82667574519393 0.46986599933799 6.941 > 1 5 Li 0.35542862503233 0.32667574519393 0.96986599933799 6.941 > 1 6 Li 0.85542862503233 0.32667574519393 0.96986599933799 6.941 > 1 7 Li 0.35542862503233 0.82667574519393 0.96986599933799 6.941 > 1 8 Li 0.85542862503233 0.82667574519393 0.96986599933799 6.941 > 1 9 Li 0.14457137496767 0.07667574519393 0.28013400066201 6.941 > 9 10 Li 0.64457137496767 0.07667574519393 0.28013400066201 6.941 > 9 11 Li 0.14457137496767 0.57667574519393 0.28013400066201 6.941 > 9 12 Li 0.64457137496767 0.57667574519393 0.28013400066201 6.941 > 9 13 Li 0.14457137496767 0.07667574519393 0.78013400066201 6.941 > 9 14 Li 0.64457137496767 0.07667574519393 0.78013400066201 6.941 > 9 15 Li 0.14457137496767 0.57667574519393 0.78013400066201 6.941 > 9 16 Li 0.64457137496767 0.57667574519393 0.78013400066201 6.941 > 9 17 Li 0.14457137496767 0.17332425480607 0.03013400066201 6.941 > 17 18 Li 0.64457137496767 0.17332425480607 0.03013400066201 6.941 > 17 19 Li 0.14457137496767 0.67332425480607 0.03013400066201 6.941 > 17 20 Li 0.64457137496767 0.67332425480607 0.03013400066201 6.941 > 17 21 Li 0.14457137496767 0.17332425480607 0.53013400066201 6.941 > 17 22 Li 0.64457137496767 0.17332425480607 0.53013400066201 6.941 > 17 23 Li 0.14457137496767 0.67332425480607 0.53013400066201 6.941 > 17 24 Li 0.64457137496767 0.67332425480607 0.53013400066201 6.941 > 17 25 Li 0.35542862503233 0.42332425480607 0.21986599933799 6.941 > 25 26 Li 0.85542862503233 0.42332425480607 0.21986599933799 6.941 > 25 27 Li 0.35542862503233 0.92332425480607 0.21986599933799 6.941 > 25 28 Li 0.85542862503233 0.92332425480607 0.21986599933799 6.941 > 25 29 Li 0.35542862503233 0.42332425480607 0.71986599933799 6.941 > 25 30 Li 0.85542862503233 0.42332425480607 0.71986599933799 6.941 > 25 31 Li 0.35542862503233 0.92332425480607 0.71986599933799 6.941 > 25 32 Li 0.85542862503233 0.92332425480607 0.71986599933799 6.941 > 25 33 O 0.27256095372862 0.19518305573326 0.36776640292283 15.999 > 33 34 O 0.77256095372862 0.19518305573326 0.36776640292283 15.999 > 33 35 O 0.27256095372862 0.69518305573326 0.36776640292283 15.999 > 33 36 O 0.77256095372862 0.69518305573326 0.36776640292283 15.999 > 33 37 O 0.27256095372862 0.19518305573326 0.86776640292283 15.999 > 33 38 O 0.77256095372862 0.19518305573326 0.86776640292283 15.999 > 33 39 O 0.27256095372862 0.69518305573326 0.86776640292283 15.999 > 33 40 O 0.77256095372862 0.69518305573326 0.86776640292283 15.999 > 33 41 O 0.00480134771258 0.08501785237938 0.42104186785409 15.999 > 41 42 O 0.50480134771258 0.08501785237938 0.42104186785409 15.999 > 41 43 O 0.00480134771258 0.58501785237938 0.42104186785409 15.999 > 41 44 O 0.50480134771258 0.58501785237938 0.42104186785409 15.999 > 41 45 O 0.00480134771258 0.08501785237938 0.92104186785410 15.999 > 41 46 O 0.50480134771258 0.08501785237938 0.92104186785410 15.999 > 41 47 O 0.00480134771258 0.58501785237938 0.92104186785410 15.999 > 41 48 O 0.50480134771258 0.58501785237938 0.92104186785410 15.999 > 41 49 O 0.22743904627138 0.44518305573326 0.38223359707717 15.999 > 49 50 O 0.72743904627138 0.44518305573326 0.38223359707717 15.999 > 49 51 O 0.22743904627138 0.94518305573326 0.38223359707717 15.999 > 49 52 O 0.72743904627138 0.94518305573326 0.38223359707717 15.999 > 49 53 O 0.22743904627138 0.44518305573326 0.88223359707717 15.999 > 49 54 O 0.72743904627138 0.44518305573326 0.88223359707717 15.999 > 49 55 O 0.22743904627138 0.94518305573326 0.88223359707717 15.999 > 49 56 O 0.72743904627138 0.94518305573326 0.88223359707717 15.999 > 49 57 O 0.22743904627138 0.30481694426674 0.13223359707717 15.999 > 57 58 O 0.72743904627138 0.30481694426674 0.13223359707717 15.999 > 57 59 O 0.22743904627138 0.80481694426674 0.13223359707717 15.999 > 57 60 O 0.72743904627138 0.80481694426674 0.13223359707717 15.999 > 57 61 O 0.22743904627138 0.30481694426674 0.63223359707717 15.999 > 57 62 O 0.72743904627138 0.30481694426674 0.63223359707717 15.999 > 57 63 O 0.22743904627138 0.80481694426674 0.63223359707717 15.999 > 57 64 O 0.72743904627138 0.80481694426674 0.63223359707717 15.999 > 57 65 O 0.49519865228742 0.41498214762062 0.07895813214590 15.999 > 65 66 O 0.99519865228742 0.41498214762062 0.07895813214590 15.999 > 65 67 O 0.49519865228742 0.91498214762062 0.07895813214590 15.999 > 65 68 O 0.99519865228742 0.91498214762062 0.07895813214590 15.999 > 65 69 O 0.49519865228742 0.41498214762062 0.57895813214590 15.999 > 65 70 O 0.99519865228742 0.41498214762062 0.57895813214590 15.999 > 65 71 O 0.49519865228742 0.91498214762062 0.57895813214590 15.999 > 65 72 O 0.99519865228742 0.91498214762062 0.57895813214590 15.999 > 65 73 O 0.49519865228742 0.33501785237938 0.32895813214591 15.999 > 73 74 O 0.99519865228742 0.33501785237938 0.32895813214591 15.999 > 73 75 O 0.49519865228742 0.83501785237938 0.32895813214591 15.999 > 73 76 O 0.99519865228742 0.83501785237938 0.32895813214591 15.999 > 73 77 O 0.49519865228742 0.33501785237938 0.82895813214590 15.999 > 73 78 O 0.99519865228742 0.33501785237938 0.82895813214590 15.999 > 73 79 O 0.49519865228742 0.83501785237938 0.82895813214590 15.999 > 73 80 O 0.99519865228742 0.83501785237938 0.82895813214590 15.999 > 73 81 O 0.00480134771258 0.16498214762062 0.17104186785410 15.999 > 81 82 O 0.50480134771258 0.16498214762062 0.17104186785410 15.999 > 81 83 O 0.00480134771258 0.66498214762062 0.17104186785410 15.999 > 81 84 O 0.50480134771258 0.66498214762062 0.17104186785410 15.999 > 81 85 O 0.00480134771258 0.16498214762062 0.67104186785410 15.999 > 81 86 O 0.50480134771258 0.16498214762062 0.67104186785410 15.999 > 81 87 O 0.00480134771258 0.66498214762062 0.67104186785410 15.999 > 81 88 O 0.50480134771258 0.66498214762062 0.67104186785410 15.999 > 81 89 O 0.27256095372862 0.05481694426674 0.11776640292283 15.999 > 89 90 O 0.77256095372862 0.05481694426674 0.11776640292283 15.999 > 89 91 O 0.27256095372862 0.55481694426674 0.11776640292283 15.999 > 89 92 O 0.77256095372862 0.55481694426674 0.11776640292283 15.999 > 89 93 O 0.27256095372862 0.05481694426674 0.61776640292283 15.999 > 89 94 O 0.77256095372862 0.05481694426674 0.61776640292283 15.999 > 89 95 O 0.27256095372862 0.55481694426674 0.61776640292283 15.999 > 89 96 O 0.77256095372862 0.55481694426674 0.61776640292283 15.999 > 89 97 Ho 0.38265442824587 0.06507067724116 0.01011968653148 164.930 > 97 98 Ho 0.88265442824587 0.06507067724116 0.01011968653148 164.930 > 97 99 Ho 0.38265442824587 0.56507067724116 0.01011968653148 164.930 > 97 100 Ho 0.88265442824587 0.56507067724116 0.01011968653148 164.930 > 97 101 Ho 0.38265442824587 0.06507067724116 0.51011968653148 164.930 > 97 102 Ho 0.88265442824587 0.06507067724116 0.51011968653148 164.930 > 97 103 Ho 0.38265442824587 0.56507067724116 0.51011968653148 164.930 > 97 104 Ho 0.88265442824587 0.56507067724116 0.51011968653148 164.930 > 97 105 Ho 0.38265442824587 0.18492932275884 0.26011968653148 164.930 > 105 106 Ho 0.88265442824587 0.18492932275884 0.26011968653148 164.930 > 105 107 Ho 0.38265442824587 0.68492932275884 0.26011968653148 164.930 > 105 108 Ho 0.88265442824587 0.68492932275884 0.26011968653148 164.930 > 105 109 Ho 0.38265442824587 0.18492932275884 0.76011968653148 164.930 > 105 110 Ho 0.88265442824587 0.18492932275884 0.76011968653148 164.930 > 105 111 Ho 0.38265442824587 0.68492932275884 0.76011968653148 164.930 > 105 112 Ho 0.88265442824587 0.68492932275884 0.76011968653148 164.930 > 105 113 Ho 0.11734557175413 0.43492932275884 0.48988031346852 164.930 > 113 114 Ho 0.61734557175413 0.43492932275884 0.48988031346852 164.930 > 113 115 Ho 0.11734557175413 0.93492932275884 0.48988031346852 164.930 > 113 116 Ho 0.61734557175413 0.93492932275884 0.48988031346852 164.930 > 113 117 Ho 0.11734557175413 0.43492932275884 0.98988031346852 164.930 > 113 118 Ho 0.61734557175413 0.43492932275884 0.98988031346852 164.930 > 113 119 Ho 0.11734557175413 0.93492932275884 0.98988031346852 164.930 > 113 120 Ho 0.61734557175413 0.93492932275884 0.98988031346852 164.930 > 113 121 Ho 0.11734557175413 0.31507067724116 0.23988031346852 164.930 > 121 122 Ho 0.61734557175413 0.31507067724116 0.23988031346852 164.930 > 121 123 Ho 0.11734557175413 0.81507067724116 0.23988031346852 164.930 > 121 124 Ho 0.61734557175413 0.81507067724116 0.23988031346852 164.930 > 121 125 Ho 0.11734557175413 0.31507067724116 0.73988031346852 164.930 > 121 126 Ho 0.61734557175413 0.31507067724116 0.73988031346852 164.930 > 121 127 Ho 0.11734557175413 0.81507067724116 0.73988031346852 164.930 > 121 128 Ho 0.61734557175413 0.81507067724116 0.73988031346852 164.930 > 121 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.8154750 0.0000000 -0.0453007 0.0000000 3.7284548 0.0000000 -0.0452991 0.0000000 3.7904488 -------------------------- Born effective charges -------------------------- 1 Li 1.0190121 -0.0130486 0.0333596 -0.0069930 1.0398590 0.0663390 0.0340163 0.0541165 1.0112278 2 Li 1.0190121 0.0130486 0.0333596 0.0069930 1.0398590 -0.0663390 0.0340163 -0.0541165 1.0112278 3 Li 1.0190121 -0.0130486 0.0333596 -0.0069930 1.0398590 0.0663390 0.0340163 0.0541165 1.0112278 4 Li 1.0190121 0.0130486 0.0333596 0.0069930 1.0398590 -0.0663390 0.0340163 -0.0541165 1.0112278 5 O -2.2838715 0.3693610 -0.0778706 0.3787674 -2.2831747 0.7421754 -0.0731051 0.6710092 -2.3575425 6 O -2.3591710 0.4153887 -0.0363198 0.4176690 -2.4017480 0.7603168 -0.0154784 0.8617260 -2.3172633 7 O -2.2838715 -0.3693610 -0.0778706 -0.3787674 -2.2831747 -0.7421754 -0.0731051 -0.6710092 -2.3575425 8 O -2.2838715 0.3693610 -0.0778706 0.3787674 -2.2831747 0.7421754 -0.0731051 0.6710092 -2.3575425 9 O -2.3591710 0.4153887 -0.0363198 0.4176690 -2.4017480 0.7603168 -0.0154784 0.8617260 -2.3172633 10 O -2.3591710 -0.4153887 -0.0363198 -0.4176690 -2.4017480 -0.7603168 -0.0154784 -0.8617260 -2.3172633 11 O -2.3591710 -0.4153887 -0.0363198 -0.4176690 -2.4017480 -0.7603168 -0.0154784 -0.8617260 -2.3172633 12 O -2.2838715 -0.3693610 -0.0778706 -0.3787674 -2.2831747 -0.7421754 -0.0731051 -0.6710092 -2.3575425 13 Ho 3.6240304 -0.0530263 0.0808308 0.0251974 3.6450637 0.1628250 0.0545672 -0.1080773 3.6635779 14 Ho 3.6240304 0.0530263 0.0808308 -0.0251974 3.6450637 -0.1628250 0.0545672 0.1080773 3.6635779 15 Ho 3.6240304 -0.0530263 0.0808308 0.0251974 3.6450637 0.1628250 0.0545672 -0.1080773 3.6635779 16 Ho 3.6240304 0.0530263 0.0808308 -0.0251974 3.6450637 -0.1628250 0.0545672 0.1080773 3.6635779 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000003 (zzz) -0.00000003 (zzz) -0.00000003 (zzz) Max drift of fc2: 0.00000000 (xx) 0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 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 2.667 ( 0.000 0.000 0.000) 0.000 2.696 ( 0.000 0.000 0.000) 0.000 3.288 ( 0.000 0.000 0.000) 0.000 3.410 ( 0.000 0.000 0.000) 0.000 3.530 ( 0.000 0.000 0.000) 0.000 4.249 ( 0.000 0.000 0.000) 0.000 4.461 ( 0.000 0.000 0.000) 0.000 4.524 ( 0.000 0.000 0.000) 0.000 5.040 ( 0.000 0.000 0.000) 0.000 5.563 ( 0.000 0.000 0.000) 0.000 5.950 ( 0.000 0.000 0.000) 0.000 6.287 ( 0.000 0.000 0.000) 0.000 6.366 ( 0.000 0.000 0.000) 0.000 7.058 ( 0.000 0.000 0.000) 0.000 7.427 ( 0.000 0.000 0.000) 0.000 7.911 ( 0.000 0.000 0.000) 0.000 8.150 ( 0.000 0.000 0.000) 0.000 8.448 ( 0.000 0.000 0.000) 0.000 8.812 ( 0.000 0.000 0.000) 0.000 8.909 ( 0.000 0.000 0.000) 0.000 10.088 ( 0.000 0.000 0.000) 0.000 10.201 ( 0.000 0.000 0.000) 0.000 10.711 ( 0.000 0.000 0.000) 0.000 10.927 ( 0.000 0.000 0.000) 0.000 11.303 ( 0.000 0.000 0.000) 0.000 11.372 ( 0.000 0.000 0.000) 0.000 11.422 ( 0.000 0.000 0.000) 0.000 11.922 ( 0.000 0.000 0.000) 0.000 12.238 ( 0.000 0.000 0.000) 0.000 12.481 ( 0.000 0.000 0.000) 0.000 12.828 ( 0.000 0.000 0.000) 0.000 12.891 ( 0.000 0.000 0.000) 0.000 13.308 ( 0.000 0.000 0.000) 0.000 13.346 ( 0.000 0.000 0.000) 0.000 13.820 ( 0.000 0.000 0.000) 0.000 13.936 ( 0.000 0.000 0.000) 0.000 14.253 ( 0.000 0.000 0.000) 0.000 15.161 ( 0.000 0.000 0.000) 0.000 15.669 ( 0.000 0.000 0.000) 0.000 16.190 ( 0.000 0.000 0.000) 0.000 16.348 ( 0.000 0.000 0.000) 0.000 16.584 ( 0.000 0.000 0.000) 0.000 16.685 ( 0.000 0.000 0.000) 0.000 18.992 ( 0.000 0.000 0.000) 0.000 19.222 ( 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| 0.416 ( 17.172 0.000 11.865) 20.873 0.609 ( 25.545 0.000 14.458) 29.353 1.233 ( 44.195 0.000 39.145) 59.038 2.716 ( 1.862 0.000 4.668) 5.026 2.825 ( 13.448 0.000 -0.336) 13.452 3.244 ( -0.775 0.000 -5.217) 5.274 3.523 ( 5.828 0.000 10.113) 11.672 3.572 ( 0.131 0.000 4.648) 4.650 4.186 ( -9.411 0.000 -0.595) 9.430 4.473 ( 3.950 0.000 1.528) 4.236 4.528 ( -0.128 0.000 1.119) 1.126 5.061 ( 1.038 0.000 2.016) 2.267 5.507 ( -2.248 0.000 -6.476) 6.856 6.108 ( 9.222 0.000 -5.653) 10.817 6.249 ( -1.041 0.000 -3.621) 3.768 6.425 ( 5.355 0.000 -0.618) 5.391 7.095 ( 3.711 0.000 0.537) 3.750 7.350 ( -4.226 0.000 -7.625) 8.718 7.873 ( -1.779 0.000 -2.757) 3.281 8.286 ( 6.492 0.000 13.565) 15.038 8.824 ( 3.706 0.000 -4.783) 6.051 8.859 ( 2.281 0.000 -9.077) 9.359 9.471 ( -34.945 0.000 -1.451) 34.975 10.213 ( 41.503 0.000 -57.827) 71.179 10.526 ( -18.920 0.000 4.103) 19.360 10.932 ( 37.574 0.000 -13.561) 39.947 10.951 ( 0.397 0.000 2.988) 3.014 11.281 ( -1.033 0.000 -2.518) 2.722 11.434 ( 0.902 0.000 0.127) 0.911 11.471 ( 4.275 0.000 4.712) 6.362 11.929 ( -0.186 0.000 1.773) 1.783 12.209 ( -4.928 0.000 2.589) 5.567 12.526 ( -24.450 0.000 -9.317) 26.165 12.843 ( -2.717 0.000 -3.848) 4.710 12.910 ( -1.220 0.000 0.611) 1.365 13.076 ( -6.453 0.000 -3.242) 7.221 13.884 ( 5.262 0.000 -14.582) 15.503 13.918 ( -1.310 0.000 -0.958) 1.623 14.655 ( 21.359 0.000 18.481) 28.244 15.186 ( 4.354 0.000 2.096) 4.832 15.308 ( -0.700 0.000 -3.197) 3.273 15.694 ( 2.094 0.000 0.502) 2.154 16.372 ( 1.527 0.000 2.764) 3.158 16.474 ( -7.500 0.000 -6.693) 10.052 16.648 ( -2.598 0.000 -2.326) 3.487 18.562 ( -1.699 0.000 16.395) 16.483 19.177 ( -4.400 0.000 -1.083) 4.531 20.319 ( -41.725 0.000 73.713) 84.703 ======================= 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| 0.882 ( 19.356 0.000 14.764) 24.344 1.221 ( 26.168 0.000 12.763) 29.114 2.366 ( 36.617 0.000 35.306) 50.866 2.763 ( -5.126 0.000 7.154) 8.801 3.120 ( 17.166 0.000 -0.994) 17.195 3.210 ( 5.113 0.000 -5.952) 7.846 3.623 ( -1.749 0.000 8.420) 8.600 3.764 ( 3.777 0.000 13.268) 13.795 3.931 ( -13.294 0.000 0.221) 13.296 4.546 ( -0.137 0.000 3.024) 3.027 4.640 ( 9.590 0.000 4.079) 10.422 5.114 ( 1.864 0.000 2.972) 3.508 5.367 ( -4.491 0.000 -7.829) 9.026 6.193 ( -1.380 0.000 -2.392) 2.762 6.235 ( 4.625 0.000 4.146) 6.212 6.511 ( 5.331 0.000 -2.939) 6.087 7.135 ( -5.752 0.000 -15.227) 16.277 7.201 ( 7.121 0.000 0.289) 7.127 7.816 ( -1.848 0.000 -1.608) 2.450 8.564 ( 2.207 0.000 13.749) 13.925 8.782 ( -3.414 0.000 -3.934) 5.209 8.873 ( -28.079 0.000 -0.326) 28.081 8.894 ( 11.527 0.000 0.777) 11.553 10.192 ( -20.074 0.000 2.640) 20.246 10.435 ( 29.317 0.000 -26.600) 39.586 10.995 ( 0.678 0.000 1.623) 1.759 11.163 ( -15.214 0.000 4.467) 15.856 11.392 ( 23.909 0.000 -10.007) 25.918 11.469 ( 1.025 0.000 4.178) 4.302 11.529 ( -1.985 0.000 5.069) 5.444 11.954 ( -0.929 0.000 5.036) 5.121 12.081 ( -6.164 0.000 -16.124) 17.262 12.103 ( -9.248 0.000 2.704) 9.635 12.774 ( -0.306 0.000 -1.243) 1.280 12.900 ( -0.118 0.000 0.096) 0.152 12.954 ( -6.418 0.000 -2.318) 6.824 13.767 ( -1.118 0.000 -13.434) 13.480 13.872 ( -2.235 0.000 -1.449) 2.664 14.939 ( 2.213 0.000 -0.568) 2.285 15.261 ( -1.866 0.000 -0.992) 2.113 15.518 ( 17.840 0.000 11.104) 21.013 15.740 ( 2.248 0.000 0.173) 2.254 16.221 ( -10.159 0.000 -8.963) 13.548 16.496 ( 4.090 0.000 7.293) 8.361 16.568 ( 0.243 0.000 -0.171) 0.297 18.721 ( 3.681 0.000 9.676) 10.353 19.033 ( -8.864 0.000 -3.645) 9.584 20.302 ( -19.592 0.000 33.277) 38.616 ======================= 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| 1.413 ( 21.908 0.000 14.357) 26.193 1.812 ( 25.806 0.000 9.879) 27.632 2.634 ( -15.587 0.000 8.047) 17.542 3.066 ( 6.688 0.000 8.136) 10.532 3.240 ( -9.471 0.000 -1.279) 9.557 3.460 ( 22.554 0.000 6.384) 23.440 3.719 ( 6.342 0.000 11.248) 12.913 3.741 ( 9.023 0.000 -6.124) 10.905 4.018 ( -1.146 0.000 16.788) 16.827 4.580 ( -0.666 0.000 4.645) 4.693 4.863 ( 9.042 0.000 4.667) 10.175 5.176 ( 1.326 0.000 2.600) 2.919 5.206 ( -4.430 0.000 -6.917) 8.214 6.167 ( 0.212 0.000 -0.087) 0.230 6.341 ( 0.434 0.000 7.525) 7.537 6.547 ( 1.987 0.000 -3.219) 3.783 6.857 ( -5.282 0.000 -18.816) 19.543 7.341 ( 7.798 0.000 -0.573) 7.819 7.774 ( -1.360 0.000 -0.377) 1.411 8.477 ( -16.392 0.000 2.644) 16.604 8.549 ( -5.054 0.000 -3.036) 5.896 8.661 ( -5.101 0.000 -3.997) 6.480 9.322 ( 16.937 0.000 22.280) 27.987 9.897 ( -12.637 0.000 0.848) 12.666 10.717 ( 23.541 0.000 -14.135) 27.459 10.849 ( -20.051 0.000 4.034) 20.453 10.929 ( -4.937 0.000 -10.361) 11.477 11.495 ( 1.406 0.000 -1.794) 2.280 11.622 ( 5.329 0.000 5.672) 7.783 11.628 ( 9.365 0.000 -5.553) 10.888 11.912 ( -10.549 0.000 6.625) 12.456 11.921 ( 1.589 0.000 -7.747) 7.908 12.042 ( 0.540 0.000 3.353) 3.396 12.758 ( -10.368 0.000 -6.267) 12.115 12.833 ( 4.163 0.000 4.444) 6.090 12.908 ( 0.464 0.000 0.724) 0.860 13.602 ( -2.762 0.000 -11.176) 11.512 13.816 ( -2.227 0.000 -1.239) 2.548 14.929 ( -0.095 0.000 -2.223) 2.225 15.228 ( -1.199 0.000 0.260) 1.227 15.773 ( 1.820 0.000 -0.935) 2.047 15.799 ( 6.091 0.000 2.000) 6.411 15.962 ( -8.649 0.000 -6.658) 10.914 16.424 ( -4.196 0.000 -3.244) 5.304 16.942 ( 18.214 0.000 18.866) 26.224 18.781 ( -12.347 0.000 -7.380) 14.384 18.867 ( 3.549 0.000 5.367) 6.434 20.283 ( -10.362 0.000 16.914) 19.835 ======================= 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| 1.931 ( 20.956 0.000 7.787) 22.356 2.351 ( 23.378 0.000 6.258) 24.201 2.369 ( -18.538 0.000 1.978) 18.644 2.885 ( -21.356 0.000 -3.243) 21.601 3.124 ( 0.609 0.000 -0.737) 0.956 3.639 ( 1.333 0.000 0.541) 1.438 3.942 ( 16.628 0.000 -9.829) 19.316 4.074 ( -10.096 0.000 13.910) 17.188 4.173 ( 14.995 0.000 10.990) 18.591 4.599 ( -1.731 0.000 2.669) 3.181 5.030 ( 4.401 0.000 2.259) 4.947 5.079 ( -2.475 0.000 -4.336) 4.993 5.202 ( -0.342 0.000 0.941) 1.001 6.192 ( 1.230 0.000 0.773) 1.453 6.415 ( -1.016 0.000 8.887) 8.945 6.529 ( -0.374 0.000 -1.656) 1.698 6.596 ( -2.891 0.000 -14.568) 14.852 7.448 ( 3.762 0.000 -0.446) 3.788 7.766 ( 0.017 0.000 0.496) 0.496 8.312 ( -4.937 0.000 1.807) 5.257 8.430 ( -3.116 0.000 -2.253) 3.845 8.544 ( -2.883 0.000 -2.518) 3.828 9.658 ( -2.339 0.000 3.997) 4.631 9.965 ( 13.358 0.000 20.260) 24.267 10.534 ( -11.866 0.000 -14.744) 18.926 10.682 ( -7.059 0.000 -4.344) 8.289 10.964 ( 12.493 0.000 -5.450) 13.630 11.441 ( -4.295 0.000 -0.862) 4.381 11.680 ( 1.708 0.000 -1.680) 2.396 11.690 ( 0.770 0.000 -1.897) 2.047 11.850 ( -1.746 0.000 3.031) 3.498 12.070 ( -0.555 0.000 1.406) 1.511 12.071 ( 10.409 0.000 10.437) 14.740 12.459 ( -11.924 0.000 -10.217) 15.702 12.924 ( 0.428 0.000 0.399) 0.585 12.960 ( 3.024 0.000 3.943) 4.969 13.464 ( -1.961 0.000 -5.511) 5.850 13.776 ( -0.958 0.000 -0.473) 1.069 14.911 ( -0.033 0.000 -0.896) 0.896 15.220 ( -0.291 0.000 0.414) 0.506 15.784 ( 2.638 0.000 -6.304) 6.834 15.803 ( -5.392 0.000 3.186) 6.263 15.861 ( 1.100 0.000 -0.058) 1.101 16.340 ( -1.797 0.000 -1.448) 2.307 17.421 ( 12.161 0.000 11.897) 17.012 18.481 ( -9.314 0.000 -6.906) 11.595 18.949 ( 1.372 0.000 1.688) 2.176 20.271 ( -3.347 0.000 5.339) 6.301 ======================= 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| 0.569 ( 0.000 27.156 0.000) 27.156 0.605 ( 0.000 28.765 0.000) 28.765 1.184 ( 0.000 55.154 0.000) 55.154 2.600 ( 0.000 -5.789 0.000) 5.789 2.735 ( 0.000 -0.397 0.000) 0.397 3.360 ( 0.000 -1.866 0.000) 1.866 3.450 ( 0.000 14.763 0.000) 14.763 3.667 ( 0.000 9.992 0.000) 9.992 4.287 ( 0.000 3.607 0.000) 3.607 4.452 ( 0.000 -6.532 0.000) 6.532 4.473 ( 0.000 1.165 0.000) 1.165 5.042 ( 0.000 -4.557 0.000) 4.557 5.603 ( 0.000 3.341 0.000) 3.341 5.935 ( 0.000 -1.454 0.000) 1.454 6.277 ( 0.000 -0.861 0.000) 0.861 6.408 ( 0.000 -0.307 0.000) 0.307 7.031 ( 0.000 -1.163 0.000) 1.163 7.499 ( 0.000 6.389 0.000) 6.389 8.016 ( 0.000 -9.644 0.000) 9.644 8.155 ( 0.000 22.174 0.000) 22.174 8.555 ( 0.000 6.637 0.000) 6.637 8.855 ( 0.000 -5.021 0.000) 5.021 9.758 ( 0.000 -21.931 0.000) 21.931 10.192 ( 0.000 -0.869 0.000) 0.869 10.228 ( 0.000 2.198 0.000) 2.198 10.902 ( 0.000 10.876 0.000) 10.876 10.927 ( 0.000 0.018 0.000) 0.018 11.263 ( 0.000 -3.688 0.000) 3.688 11.387 ( 0.000 -0.186 0.000) 0.186 11.478 ( 0.000 5.214 0.000) 5.214 11.965 ( 0.000 4.620 0.000) 4.620 12.282 ( 0.000 4.316 0.000) 4.316 12.424 ( 0.000 -8.036 0.000) 8.036 12.779 ( 0.000 -6.566 0.000) 6.566 12.840 ( 0.000 -17.404 0.000) 17.404 13.386 ( 0.000 2.410 0.000) 2.410 13.767 ( 0.000 -5.183 0.000) 5.183 14.069 ( 0.000 4.823 0.000) 4.823 14.251 ( 0.000 -0.165 0.000) 0.165 14.422 ( 0.000 0.622 0.000) 0.622 15.841 ( 0.000 16.864 0.000) 16.864 16.178 ( 0.000 -1.068 0.000) 1.068 16.350 ( 0.000 0.173 0.000) 0.173 16.490 ( 0.000 -3.578 0.000) 3.578 16.588 ( 0.000 -0.363 0.000) 0.363 18.860 ( 0.000 -10.310 0.000) 10.310 19.337 ( 0.000 8.492 0.000) 8.492 20.220 ( 0.000 -2.102 0.000) 2.102 ======================= 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| 0.702 ( 4.821 23.682 12.403) 27.165 0.945 ( 19.883 21.549 11.320) 31.429 1.627 ( 31.077 33.923 23.659) 51.733 2.677 ( 4.552 -3.813 4.320) 7.343 2.816 ( 9.821 -1.697 -0.709) 9.992 3.372 ( -0.921 9.478 -4.126) 10.378 3.477 ( 3.001 1.968 8.480) 9.208 3.714 ( 0.009 9.057 7.127) 11.525 4.223 ( -8.975 3.207 -0.335) 9.537 4.477 ( 2.767 -3.531 1.844) 4.850 4.500 ( 3.544 1.564 1.209) 4.057 5.033 ( -0.116 -2.945 1.443) 3.282 5.551 ( -1.977 4.071 -3.910) 5.981 6.038 ( 7.501 -4.064 -1.435) 8.651 6.255 ( -0.994 -0.374 -2.151) 2.399 6.451 ( 5.785 0.891 -2.101) 6.219 7.078 ( 4.408 -0.268 1.578) 4.689 7.426 ( -4.219 6.790 -5.937) 9.958 8.050 ( -4.736 16.074 -2.407) 16.929 8.259 ( 14.436 -6.739 7.986) 17.821 8.722 ( 3.552 -0.342 1.370) 3.823 8.867 ( 1.391 -0.783 1.293) 2.054 9.372 ( -30.221 -9.136 0.830) 31.583 10.089 ( 21.537 -4.418 -30.714) 37.772 10.374 ( -0.725 -9.916 -10.001) 14.102 11.005 ( 5.107 5.097 3.460) 8.002 11.102 ( 14.801 5.727 5.870) 16.921 11.269 ( -2.339 -1.914 0.750) 3.114 11.378 ( 0.403 -4.195 0.709) 4.274 11.508 ( 0.724 3.881 2.418) 4.630 11.977 ( 2.110 4.157 -1.788) 4.992 12.211 ( -5.941 1.702 1.592) 6.382 12.460 ( -17.046 -5.367 -7.123) 19.239 12.565 ( 0.165 -13.193 0.180) 13.195 12.863 ( 0.728 -7.769 6.559) 10.193 13.184 ( -8.732 7.567 -9.023) 14.661 13.763 ( 1.369 -7.047 -7.214) 10.178 14.010 ( 0.742 3.051 -9.750) 10.243 14.409 ( 5.209 -17.139 5.680) 18.792 14.734 ( 16.781 -8.510 17.450) 25.662 15.882 ( 2.937 17.597 0.593) 17.850 15.896 ( -8.174 13.753 -14.591) 21.653 16.372 ( -0.239 0.555 2.516) 2.588 16.464 ( -3.847 -0.733 -3.123) 5.009 16.587 ( -0.948 -3.794 -0.329) 3.925 18.743 ( -1.444 2.906 -3.729) 4.943 19.231 ( -6.666 7.875 -0.262) 10.321 20.275 ( -23.079 -3.492 44.721) 50.446 ======================= 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| 1.005 ( 11.575 13.113 17.217) 24.543 1.442 ( 22.639 17.167 10.404) 30.257 2.526 ( 32.366 14.147 27.969) 45.055 2.757 ( -3.220 -0.960 6.295) 7.135 3.053 ( 14.893 -4.959 -1.770) 15.796 3.336 ( 3.907 10.472 -3.721) 11.781 3.620 ( 0.377 0.277 8.791) 8.804 3.805 ( -0.757 2.980 8.702) 9.229 4.018 ( -9.818 7.912 3.300) 13.034 4.538 ( 1.914 -0.616 3.230) 3.805 4.657 ( 8.219 1.456 4.020) 9.264 5.065 ( 1.289 -2.577 1.860) 3.430 5.470 ( -2.006 8.015 -3.995) 9.177 6.133 ( 3.343 -4.252 -0.896) 5.483 6.223 ( -1.507 -1.352 2.482) 3.203 6.548 ( 6.870 2.179 -2.744) 7.712 7.154 ( 0.241 2.977 -8.940) 9.426 7.291 ( 1.345 7.756 -1.477) 8.009 7.962 ( -2.937 13.726 -1.804) 14.152 8.608 ( 7.313 -8.914 8.870) 14.547 8.683 ( -6.706 0.825 4.422) 8.075 8.814 ( -11.877 3.798 0.031) 12.470 8.969 ( -4.817 0.063 0.962) 4.913 10.112 ( -13.048 -6.529 1.411) 14.659 10.312 ( 23.937 -8.175 -22.707) 33.992 11.082 ( -1.804 3.196 0.558) 3.712 11.128 ( -10.251 -1.397 2.530) 10.651 11.375 ( -0.640 -7.842 6.073) 9.939 11.467 ( 12.970 3.611 -7.457) 15.390 11.548 ( 3.913 2.777 4.651) 6.683 11.989 ( -0.356 -0.602 -0.328) 0.772 12.073 ( -8.628 2.286 -6.336) 10.946 12.120 ( -4.281 3.147 -5.111) 7.373 12.602 ( 0.041 -10.409 1.954) 10.591 12.851 ( -5.193 -6.269 -2.678) 8.570 13.060 ( -0.763 8.148 2.400) 8.528 13.661 ( -2.456 -7.456 -9.678) 12.461 13.920 ( -1.031 2.005 -7.163) 7.510 14.468 ( -0.543 -27.387 0.075) 27.392 15.174 ( 13.809 -18.714 8.461) 24.748 15.671 ( -3.993 16.396 -7.417) 18.434 15.954 ( 3.030 10.968 -0.580) 11.393 16.197 ( -9.464 -1.677 -8.624) 12.913 16.509 ( -3.338 -2.009 -2.064) 4.409 16.623 ( 10.487 9.366 13.025) 19.166 18.773 ( 3.113 0.232 1.284) 3.375 19.091 ( -8.550 7.777 -0.229) 11.561 20.276 ( -16.998 -2.670 28.545) 33.330 ======================= 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| 1.449 ( 17.644 5.052 15.983) 24.337 1.965 ( 23.409 12.374 8.968) 27.955 2.626 ( -15.317 -1.303 6.419) 16.659 3.091 ( 4.186 0.418 0.910) 4.304 3.269 ( -3.017 4.663 5.145) 7.571 3.510 ( 18.919 4.864 5.915) 20.410 3.718 ( 9.015 0.973 0.403) 9.077 3.804 ( 4.624 3.667 3.256) 6.740 4.083 ( -0.579 6.519 15.672) 16.983 4.608 ( 0.651 2.360 4.962) 5.533 4.813 ( 4.092 -3.747 2.221) 5.976 5.121 ( 3.136 0.980 2.137) 3.919 5.409 ( -1.524 12.478 -1.948) 12.721 6.146 ( 0.683 -1.776 -0.938) 2.121 6.262 ( -0.130 -5.202 6.077) 8.001 6.626 ( 3.444 4.468 -1.019) 5.732 6.919 ( -6.345 6.577 -16.953) 19.260 7.429 ( 8.023 8.093 2.099) 11.588 7.897 ( -2.218 11.384 -1.218) 11.662 8.427 ( -12.890 -2.883 0.255) 13.211 8.614 ( -8.616 1.885 4.845) 10.064 8.708 ( -3.345 7.174 -7.226) 10.718 9.248 ( 15.387 -7.407 19.411) 25.854 9.885 ( -10.621 -1.123 1.365) 10.767 10.534 ( 14.682 -11.376 -10.324) 21.250 10.820 ( -19.143 -2.335 3.060) 19.526 11.074 ( 4.156 7.039 -13.601) 15.869 11.442 ( 2.404 -11.276 4.726) 12.460 11.515 ( 1.500 1.155 -2.189) 2.894 11.721 ( 8.124 3.524 -1.242) 8.942 11.909 ( -2.147 1.358 -3.714) 4.499 11.976 ( -2.757 -0.355 2.592) 3.801 12.065 ( -0.107 6.542 0.358) 6.553 12.563 ( -6.414 -12.963 -1.779) 14.572 12.767 ( -0.423 -3.292 0.136) 3.322 13.089 ( 0.090 9.285 3.088) 9.786 13.505 ( -3.207 -7.346 -9.563) 12.478 13.833 ( -1.950 0.577 -4.210) 4.675 14.437 ( -1.161 -31.420 -1.611) 31.482 15.386 ( 5.370 -17.841 0.400) 18.636 15.581 ( -1.089 11.440 -1.432) 11.581 15.952 ( -7.656 -0.756 -6.718) 10.213 15.972 ( 0.765 5.430 -2.051) 5.855 16.403 ( -3.931 -2.050 -3.397) 5.585 17.071 ( 17.511 11.725 19.040) 28.401 18.735 ( -7.529 -3.535 -6.572) 10.601 18.995 ( -0.773 10.450 2.890) 10.869 20.250 ( -10.169 -3.286 15.602) 18.911 ======================= 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| 1.926 ( 19.191 0.602 8.890) 21.159 2.349 ( -18.209 -1.542 0.476) 18.280 2.456 ( 20.793 8.355 6.302) 23.278 2.922 ( -16.068 2.388 -4.379) 16.825 3.203 ( -1.547 7.665 0.480) 7.835 3.674 ( 0.876 3.255 0.648) 3.432 3.941 ( 15.542 0.037 -8.256) 17.599 4.041 ( -3.211 -1.591 11.375) 11.926 4.276 ( 8.954 7.847 10.056) 15.584 4.636 ( -2.111 2.963 2.460) 4.392 4.853 ( 0.387 -6.972 -0.290) 6.988 5.205 ( 2.641 2.556 1.571) 3.997 5.364 ( -1.598 15.285 -1.112) 15.408 6.151 ( 0.172 -2.457 -0.167) 2.469 6.337 ( 1.502 -6.156 5.873) 8.640 6.629 ( -5.146 10.218 -3.439) 11.946 6.678 ( 0.833 4.716 -7.888) 9.228 7.567 ( 4.332 11.069 0.889) 11.920 7.869 ( -0.469 9.162 0.099) 9.175 8.264 ( -4.906 -1.078 0.166) 5.026 8.530 ( -4.275 5.809 3.094) 7.848 8.577 ( -1.734 3.614 -5.890) 7.124 9.629 ( 2.181 -4.399 7.795) 9.212 9.869 ( 7.238 -6.872 11.111) 14.936 10.472 ( -9.990 -5.419 -13.205) 17.422 10.585 ( -3.455 -6.671 0.855) 7.561 11.102 ( 10.322 8.621 -8.596) 15.961 11.439 ( -5.779 -2.513 0.762) 6.348 11.521 ( 0.934 -5.586 0.544) 5.690 11.797 ( 2.421 4.653 -2.394) 5.765 11.975 ( 4.835 -6.119 6.133) 9.922 11.981 ( -0.192 8.583 4.136) 9.530 12.073 ( 1.358 -0.133 -0.003) 1.364 12.357 ( -9.086 -8.612 -6.757) 14.227 12.790 ( 0.687 -5.837 1.118) 5.983 13.133 ( 1.054 8.260 2.749) 8.770 13.372 ( -2.114 -7.075 -5.516) 9.217 13.775 ( -1.000 -0.617 -1.370) 1.805 14.410 ( -0.378 -32.738 -0.744) 32.748 15.427 ( 0.991 -9.655 -1.079) 9.766 15.580 ( 0.201 2.653 0.763) 2.767 15.804 ( -2.779 0.682 -2.871) 4.053 15.962 ( -0.036 3.071 -0.697) 3.150 16.322 ( -1.713 -1.830 -1.512) 2.927 17.534 ( 11.789 9.927 11.836) 19.432 18.473 ( -8.868 -0.861 -7.160) 11.430 19.036 ( 0.998 7.824 1.268) 7.989 20.229 ( -3.439 -4.035 5.026) 7.305 ======================= 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| 1.098 ( 0.000 23.942 0.000) 23.942 1.175 ( 0.000 26.664 0.000) 26.664 2.178 ( 0.000 36.026 0.000) 36.026 2.446 ( 0.000 -8.254 0.000) 8.254 2.733 ( 0.000 3.481 0.000) 3.481 3.361 ( 0.000 1.858 0.000) 1.858 3.817 ( 0.000 18.164 0.000) 18.164 3.879 ( 0.000 9.544 0.000) 9.544 4.292 ( 0.000 -7.428 0.000) 7.428 4.384 ( 0.000 5.370 0.000) 5.370 4.514 ( 0.000 2.942 0.000) 2.942 4.931 ( 0.000 -5.900 0.000) 5.900 5.675 ( 0.000 3.256 0.000) 3.256 5.888 ( 0.000 -3.124 0.000) 3.124 6.257 ( 0.000 -0.870 0.000) 0.870 6.383 ( 0.000 -2.370 0.000) 2.370 7.068 ( 0.000 5.322 0.000) 5.322 7.662 ( 0.000 9.048 0.000) 9.048 7.817 ( 0.000 -9.326 0.000) 9.326 8.616 ( 0.000 -3.731 0.000) 3.731 8.739 ( 0.000 -3.503 0.000) 3.503 8.744 ( 0.000 33.014 0.000) 33.014 9.321 ( 0.000 -18.688 0.000) 18.688 10.168 ( 0.000 -1.473 0.000) 1.473 10.268 ( 0.000 1.619 0.000) 1.619 10.933 ( 0.000 0.582 0.000) 0.582 10.981 ( 0.000 -2.997 0.000) 2.997 11.156 ( 0.000 -6.737 0.000) 6.737 11.393 ( 0.000 0.395 0.000) 0.395 11.621 ( 0.000 7.958 0.000) 7.958 12.081 ( 0.000 -22.963 0.000) 22.963 12.114 ( 0.000 7.837 0.000) 7.837 12.392 ( 0.000 5.212 0.000) 5.212 12.607 ( 0.000 -1.072 0.000) 1.072 12.758 ( 0.000 3.690 0.000) 3.690 13.408 ( 0.000 -0.545 0.000) 0.545 13.613 ( 0.000 -9.546 0.000) 9.546 14.006 ( 0.000 -9.141 0.000) 9.141 14.249 ( 0.000 0.048 0.000) 0.048 14.438 ( 0.000 -0.588 0.000) 0.588 16.153 ( 0.000 -1.158 0.000) 1.158 16.267 ( 0.000 12.849 0.000) 12.849 16.359 ( 0.000 0.860 0.000) 0.860 16.471 ( 0.000 10.960 0.000) 10.960 16.566 ( 0.000 -0.594 0.000) 0.594 18.597 ( 0.000 -15.449 0.000) 15.449 19.526 ( 0.000 9.543 0.000) 9.543 20.155 ( 0.000 -4.215 0.000) 4.215 ======================= 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| 1.225 ( 0.884 25.865 9.139) 27.446 1.376 ( 17.315 20.209 10.865) 28.744 2.341 ( 12.381 26.451 10.857) 31.158 2.562 ( 10.137 -6.356 2.354) 12.194 2.784 ( 5.478 2.379 0.069) 5.972 3.447 ( 4.629 2.203 6.064) 7.941 3.734 ( -4.346 16.149 -3.072) 17.004 3.884 ( -4.576 6.064 6.365) 9.910 4.285 ( -2.353 1.761 -0.630) 3.006 4.415 ( 3.203 0.003 0.385) 3.226 4.565 ( 4.457 4.501 4.277) 7.643 4.959 ( 0.848 -3.730 4.176) 5.664 5.647 ( -0.462 4.819 -1.199) 4.987 5.969 ( 6.557 -2.722 -0.903) 7.156 6.237 ( -1.684 -1.101 -0.974) 2.235 6.433 ( 6.083 -2.755 -1.586) 6.863 7.135 ( 4.770 6.204 4.607) 9.081 7.596 ( -3.897 9.151 -3.536) 10.556 8.015 ( 12.689 -10.856 8.280) 18.639 8.485 ( -5.403 16.369 -4.121) 17.724 8.647 ( -5.576 -6.762 4.710) 9.950 9.008 ( 10.049 16.202 4.688) 19.633 9.140 ( -18.843 -12.028 4.614) 22.826 10.052 ( 1.294 -0.437 -12.538) 12.612 10.233 ( 4.108 -3.775 -18.679) 19.495 11.002 ( 2.962 -3.458 5.024) 6.780 11.110 ( 2.970 -6.462 4.478) 8.404 11.197 ( 1.607 -3.689 8.987) 9.847 11.348 ( -1.280 0.269 -1.214) 1.784 11.612 ( -1.637 5.491 0.482) 5.750 11.981 ( -3.683 -12.702 -5.267) 14.236 12.183 ( 3.111 -0.603 -0.396) 3.194 12.376 ( -5.325 1.018 -4.637) 7.134 12.501 ( -3.771 8.769 4.383) 10.504 12.805 ( -0.353 2.241 3.781) 4.409 13.283 ( -6.042 2.035 -6.989) 9.460 13.588 ( 0.620 -10.052 -6.879) 12.196 13.967 ( 0.039 -10.868 -7.660) 13.296 14.167 ( -4.259 -3.479 -5.420) 7.721 14.581 ( 7.160 -7.531 8.814) 13.626 16.026 ( -5.052 2.678 -8.101) 9.916 16.178 ( -1.674 4.414 -7.111) 8.535 16.400 ( -4.071 -0.539 -5.243) 6.660 16.493 ( -0.539 -0.912 0.275) 1.094 16.621 ( 7.202 19.074 10.587) 22.973 18.609 ( 2.800 -12.943 -1.879) 13.375 19.453 ( -5.397 11.664 -1.752) 12.971 20.186 ( -9.886 -5.270 21.030) 23.828 ======================= 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| 1.372 ( 1.917 20.729 15.867) 26.175 1.813 ( 18.224 17.926 9.776) 27.368 2.655 ( -1.693 -5.337 9.471) 11.002 2.844 ( 17.135 1.213 4.546) 17.769 3.000 ( 20.064 9.480 5.485) 22.859 3.574 ( 4.511 7.950 0.026) 9.141 3.663 ( -3.195 6.954 3.707) 8.503 3.863 ( -3.280 2.698 5.280) 6.776 4.209 ( -5.155 9.180 4.185) 11.329 4.510 ( 5.445 -2.272 1.482) 6.084 4.724 ( 5.007 5.694 6.061) 9.707 5.044 ( 2.385 0.117 6.596) 7.015 5.655 ( 1.985 9.749 -0.574) 9.966 6.063 ( 4.626 -2.039 -0.864) 5.129 6.187 ( -3.128 -1.823 1.067) 3.775 6.549 ( 7.439 -2.700 -1.310) 8.022 7.277 ( 3.252 8.984 -0.431) 9.564 7.491 ( -1.007 11.198 -0.289) 11.247 8.293 ( 0.586 7.068 8.759) 11.271 8.383 ( 0.149 -1.542 -4.218) 4.494 8.615 ( -3.385 -6.804 9.051) 11.818 8.875 ( -11.491 -4.025 7.456) 14.277 9.109 ( -1.987 17.985 -1.817) 18.186 9.979 ( -6.071 -5.334 -0.606) 8.104 10.172 ( 16.404 -5.611 -20.739) 27.031 11.014 ( -13.602 -7.343 8.994) 17.884 11.124 ( 1.714 -2.682 -2.704) 4.176 11.203 ( -1.137 -6.840 -0.169) 6.936 11.504 ( 7.267 -1.196 -2.594) 7.808 11.576 ( 3.305 -1.076 1.262) 3.698 11.889 ( -0.578 -6.901 -2.364) 7.317 12.167 ( -7.434 2.312 1.871) 8.007 12.228 ( 3.537 7.557 -11.263) 14.017 12.513 ( -4.446 5.969 3.844) 8.377 12.762 ( -4.281 -1.761 -1.281) 4.803 13.200 ( -0.874 5.181 4.153) 6.697 13.491 ( -1.979 -8.962 -9.016) 12.865 13.862 ( 0.088 -18.353 -12.191) 22.033 14.009 ( -7.041 -6.271 -4.006) 10.245 14.793 ( 7.316 -17.718 4.611) 19.716 15.872 ( -2.939 4.748 -7.238) 9.142 16.071 ( -3.689 -0.258 -4.808) 6.065 16.205 ( -6.112 2.828 -9.736) 11.838 16.438 ( -2.928 -4.191 -3.211) 6.038 16.956 ( 12.936 21.826 15.789) 29.883 18.654 ( 3.200 -10.660 -2.009) 11.310 19.332 ( -6.453 13.467 0.084) 14.933 20.189 ( -12.245 -5.791 19.414) 23.672 ======================= 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| 1.633 ( 8.590 12.081 16.140) 21.914 2.239 ( 18.378 13.389 8.167) 24.161 2.561 ( -13.857 -5.251 5.379) 15.765 3.040 ( 4.121 -4.755 -3.005) 6.973 3.449 ( 4.277 11.254 5.919) 13.415 3.638 ( 10.697 6.342 3.662) 12.964 3.757 ( 11.362 2.858 -1.828) 11.858 3.858 ( -0.043 1.785 3.719) 4.125 4.258 ( 1.674 8.999 10.675) 14.062 4.614 ( 3.623 -2.643 1.329) 4.677 4.822 ( -1.100 6.031 6.416) 8.874 5.168 ( 2.761 2.144 6.645) 7.509 5.691 ( 1.737 14.713 0.133) 14.816 6.115 ( 2.063 -0.561 -0.830) 2.294 6.178 ( -0.271 -2.607 3.919) 4.715 6.655 ( 4.699 -1.917 0.016) 5.075 7.135 ( -7.169 13.769 -10.552) 18.770 7.649 ( 8.854 12.839 7.375) 17.252 8.176 ( -6.885 11.477 -3.762) 13.903 8.367 ( -6.122 -1.023 6.326) 8.863 8.646 ( -5.079 2.287 6.846) 8.826 8.938 ( -5.660 11.054 -10.513) 16.271 9.028 ( 10.398 -9.726 14.797) 20.534 9.861 ( -5.798 -0.729 1.767) 6.105 10.312 ( 10.848 -10.317 -8.272) 17.104 10.752 ( -18.558 -5.752 -0.456) 19.434 11.110 ( 5.322 -4.801 -8.034) 10.767 11.208 ( 1.418 -9.295 -0.262) 9.406 11.517 ( 3.219 -0.656 -0.643) 3.348 11.748 ( 7.291 -0.482 -0.096) 7.308 11.918 ( 2.633 -1.230 2.374) 3.753 12.040 ( -4.870 7.285 -3.457) 9.420 12.191 ( -0.497 0.510 -3.283) 3.359 12.393 ( -6.648 1.787 -3.284) 7.627 12.707 ( -3.336 -1.929 2.987) 4.876 13.232 ( -1.640 3.662 2.896) 4.948 13.360 ( -2.109 -5.925 -8.265) 10.386 13.762 ( 2.419 -24.677 -9.808) 26.665 13.856 ( -6.839 -5.526 -0.214) 8.795 14.922 ( 3.997 -23.796 0.813) 24.143 15.775 ( -1.175 5.583 -4.379) 7.193 15.930 ( -5.822 -1.279 -4.422) 7.422 16.054 ( -1.700 3.044 -5.706) 6.687 16.340 ( -3.305 -3.926 -3.706) 6.330 17.382 ( 14.963 17.582 16.328) 28.278 18.626 ( -3.266 -7.478 -5.667) 9.935 19.246 ( -2.873 13.096 0.849) 13.434 20.147 ( -9.417 -6.721 12.025) 16.687 ======================= 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| 1.977 ( 13.566 4.169 9.224) 16.927 2.314 ( -15.393 -1.970 -0.114) 15.519 2.630 ( 15.342 7.782 6.525) 18.398 2.950 ( -7.997 0.111 -5.718) 9.831 3.408 ( -3.393 11.135 1.067) 11.689 3.759 ( -0.407 4.389 0.337) 4.421 3.948 ( 11.749 0.679 -3.710) 12.340 4.024 ( 2.370 -0.183 5.686) 6.163 4.444 ( 7.462 7.565 6.319) 12.363 4.648 ( -0.361 -2.407 -0.902) 2.596 4.829 ( -3.516 4.727 4.214) 7.243 5.245 ( 0.446 0.805 2.687) 2.840 5.710 ( 0.411 17.767 -0.163) 17.772 6.132 ( 0.358 1.067 0.025) 1.126 6.235 ( 1.459 -2.892 2.800) 4.281 6.717 ( 1.975 -0.560 -0.030) 2.053 6.920 ( -4.790 16.686 -5.792) 18.300 7.865 ( 6.526 16.582 4.413) 18.358 8.049 ( -4.321 5.459 -0.924) 7.023 8.336 ( -2.048 7.856 2.731) 8.566 8.614 ( -2.822 3.013 3.755) 5.581 8.709 ( -4.581 9.809 -9.471) 14.384 9.403 ( 9.477 -15.917 11.994) 22.068 9.815 ( -1.183 1.403 1.531) 2.390 10.307 ( -3.918 -10.531 -9.254) 14.557 10.451 ( -6.605 -7.019 -0.299) 9.643 11.168 ( 6.828 -3.429 -6.674) 10.145 11.262 ( 1.306 -12.020 4.395) 12.865 11.552 ( -0.046 6.031 -0.754) 6.078 11.854 ( 4.017 -1.179 2.546) 4.900 11.928 ( -2.375 5.220 -0.188) 5.738 11.999 ( 2.119 -2.934 -0.801) 3.707 12.122 ( -3.720 -5.862 -2.582) 7.408 12.277 ( -2.228 8.158 -1.494) 8.587 12.680 ( -1.758 -5.289 1.293) 5.722 13.218 ( -1.265 -1.755 2.207) 3.091 13.257 ( -0.885 -3.775 -5.959) 7.109 13.744 ( 3.994 -7.931 -8.299) 12.155 13.772 ( -4.990 -18.842 6.133) 20.433 14.968 ( 1.079 -26.068 -0.199) 26.091 15.739 ( 0.023 5.533 -1.139) 5.649 15.817 ( -2.358 0.523 -2.044) 3.164 15.999 ( -0.518 1.201 -1.652) 2.107 16.264 ( -1.492 -3.723 -1.666) 4.343 17.778 ( 10.436 12.779 10.523) 19.569 18.441 ( -6.934 -2.355 -6.758) 9.965 19.235 ( 0.037 10.839 0.513) 10.851 20.106 ( -3.575 -7.805 4.039) 9.487 ======================= 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| 1.544 ( 0.000 19.530 0.000) 19.530 1.694 ( 0.000 23.559 0.000) 23.559 2.198 ( 0.000 -12.598 0.000) 12.598 2.405 ( 0.000 -8.412 0.000) 8.412 3.139 ( 0.000 25.695 0.000) 25.695 3.424 ( 0.000 3.647 0.000) 3.647 3.989 ( 0.000 -2.537 0.000) 2.537 4.009 ( 0.000 2.080 0.000) 2.080 4.318 ( 0.000 10.881 0.000) 10.881 4.485 ( 0.000 3.742 0.000) 3.742 4.594 ( 0.000 4.685 0.000) 4.685 4.810 ( 0.000 -5.717 0.000) 5.717 5.727 ( 0.000 1.805 0.000) 1.805 5.817 ( 0.000 -3.420 0.000) 3.420 6.247 ( 0.000 -0.013 0.000) 0.013 6.319 ( 0.000 -3.344 0.000) 3.344 7.236 ( 0.000 10.116 0.000) 10.116 7.634 ( 0.000 -8.765 0.000) 8.765 7.867 ( 0.000 11.139 0.000) 11.139 8.411 ( 0.000 -13.279 0.000) 13.279 8.726 ( 0.000 0.452 0.000) 0.452 8.942 ( 0.000 -11.696 0.000) 11.696 9.532 ( 0.000 35.750 0.000) 35.750 10.135 ( 0.000 -1.539 0.000) 1.539 10.286 ( 0.000 0.611 0.000) 0.611 10.889 ( 0.000 -3.267 0.000) 3.267 10.932 ( 0.000 -2.980 0.000) 2.980 10.959 ( 0.000 -13.626 0.000) 13.626 11.385 ( 0.000 -1.063 0.000) 1.063 11.550 ( 0.000 -17.614 0.000) 17.614 11.849 ( 0.000 7.237 0.000) 7.237 12.137 ( 0.000 -4.405 0.000) 4.405 12.590 ( 0.000 13.944 0.000) 13.944 12.770 ( 0.000 12.701 0.000) 12.701 12.861 ( 0.000 4.354 0.000) 4.354 13.332 ( 0.000 -10.137 0.000) 10.137 13.433 ( 0.000 -3.170 0.000) 3.170 13.763 ( 0.000 -13.395 0.000) 13.395 14.260 ( 0.000 1.314 0.000) 1.314 14.387 ( 0.000 -3.791 0.000) 3.791 16.142 ( 0.000 0.333 0.000) 0.333 16.249 ( 0.000 -4.292 0.000) 4.292 16.388 ( 0.000 1.982 0.000) 1.982 16.502 ( 0.000 -2.986 0.000) 2.986 17.060 ( 0.000 32.344 0.000) 32.344 18.216 ( 0.000 -21.956 0.000) 21.956 19.720 ( 0.000 9.252 0.000) 9.252 20.047 ( 0.000 -6.267 0.000) 6.267 ======================= 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| 1.732 ( -0.597 22.566 7.836) 23.895 1.765 ( 15.980 17.912 7.945) 25.285 2.338 ( 9.398 -10.913 6.420) 15.768 2.463 ( 4.298 -10.103 4.103) 11.721 3.135 ( 2.111 21.130 0.022) 21.235 3.497 ( 3.211 1.486 4.641) 5.836 3.919 ( -4.557 1.392 2.477) 5.370 4.008 ( -0.445 6.155 -4.652) 7.728 4.333 ( 3.400 4.450 -2.730) 6.230 4.461 ( -2.962 2.084 -0.087) 3.623 4.679 ( 4.722 6.286 8.337) 11.460 4.887 ( 2.737 -3.485 8.456) 9.547 5.747 ( 3.593 5.094 0.910) 6.299 5.920 ( 7.990 -2.389 0.002) 8.340 6.223 ( -1.944 0.025 -1.243) 2.308 6.347 ( 3.864 -5.094 -1.150) 6.496 7.319 ( 4.915 10.915 7.162) 13.950 7.729 ( 3.728 -3.012 4.097) 6.305 7.874 ( 2.169 3.885 3.510) 5.667 8.380 ( -3.888 -13.564 1.511) 14.191 8.724 ( -2.887 4.083 5.333) 7.310 8.924 ( -7.193 -8.508 6.243) 12.771 9.540 ( 3.979 31.836 -3.217) 32.245 10.044 ( -4.211 -0.490 -6.825) 8.034 10.199 ( -0.494 0.354 -13.768) 13.782 10.867 ( -4.252 -11.222 2.324) 12.223 11.007 ( 4.088 -4.050 2.645) 6.333 11.030 ( 3.650 -10.614 3.201) 11.672 11.354 ( -0.003 0.233 -0.137) 0.270 11.527 ( -1.083 -13.637 -4.619) 14.439 11.839 ( -1.976 6.358 3.191) 7.383 12.130 ( -2.454 -5.072 3.716) 6.749 12.573 ( 1.457 14.107 -8.334) 16.449 12.733 ( -3.730 11.112 5.812) 13.083 12.921 ( -0.130 7.958 2.427) 8.321 13.270 ( -4.193 -3.745 -3.519) 6.632 13.367 ( 0.866 -9.711 -9.065) 13.313 13.654 ( -5.213 -16.476 -11.367) 20.684 14.185 ( -3.768 3.134 -5.811) 7.602 14.422 ( 1.302 -7.679 2.362) 8.138 16.062 ( -4.067 1.598 -5.663) 7.153 16.166 ( -3.929 -2.786 -5.235) 7.114 16.384 ( -1.242 -0.220 -3.335) 3.566 16.443 ( -3.022 -2.595 -4.075) 5.698 17.181 ( 7.955 29.935 7.391) 31.843 18.261 ( 4.361 -20.576 0.598) 21.042 19.684 ( -3.861 10.665 0.417) 11.350 20.057 ( -5.301 -7.278 10.273) 13.661 ======================= 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| 1.802 ( -3.161 20.296 13.151) 24.390 2.158 ( 15.735 15.300 8.290) 23.460 2.482 ( -4.003 -11.043 9.240) 14.945 2.696 ( 14.381 -10.189 2.944) 17.869 3.302 ( 15.444 13.032 2.603) 20.374 3.598 ( 5.109 -2.377 2.493) 6.161 3.878 ( -4.380 8.755 -1.736) 9.942 3.943 ( -1.741 5.548 1.645) 6.043 4.346 ( -1.095 3.825 0.698) 4.039 4.457 ( 4.774 -2.684 -0.641) 5.514 4.873 ( 3.263 7.720 11.572) 14.289 5.044 ( 2.286 -0.583 12.029) 12.258 5.868 ( 7.009 10.598 1.840) 12.839 6.048 ( 6.200 0.058 -0.937) 6.270 6.164 ( -2.709 0.253 -0.253) 2.733 6.435 ( 5.744 -8.124 0.590) 9.967 7.508 ( 3.557 12.986 6.878) 15.120 7.736 ( 0.207 12.173 2.243) 12.379 8.093 ( 5.831 -11.818 11.665) 17.600 8.344 ( -0.222 -13.351 6.110) 14.684 8.690 ( -7.000 9.659 1.433) 12.014 8.817 ( -8.850 -1.187 6.650) 11.134 9.571 ( -1.266 26.374 -3.019) 26.576 9.918 ( -2.541 -0.519 -3.661) 4.486 10.072 ( 6.081 -3.752 -15.723) 17.270 10.754 ( -11.127 -19.385 1.954) 22.437 11.028 ( -3.036 -5.363 -1.741) 6.404 11.088 ( 3.876 -5.333 -5.219) 8.408 11.426 ( 2.951 -3.548 -2.271) 5.144 11.504 ( 7.941 -4.061 2.100) 9.163 11.867 ( 0.812 5.029 4.310) 6.673 12.123 ( -3.814 -3.950 5.064) 7.470 12.475 ( -0.890 13.632 -11.026) 17.555 12.718 ( -5.562 9.527 -1.408) 11.122 12.784 ( -7.898 3.688 -4.281) 9.712 13.262 ( 0.143 0.548 6.849) 6.873 13.313 ( 1.758 -7.155 -5.808) 9.382 13.377 ( -7.720 -23.142 -15.679) 29.000 14.036 ( -4.538 4.628 -7.630) 10.011 14.455 ( 1.161 -14.971 -0.698) 15.032 15.933 ( -3.083 2.140 -5.655) 6.787 16.030 ( -4.815 -2.614 -5.137) 7.511 16.253 ( -4.128 1.716 -8.654) 9.740 16.353 ( -2.799 -3.775 -4.395) 6.434 17.451 ( 10.878 25.023 10.120) 29.102 18.362 ( 5.289 -17.535 0.146) 18.316 19.601 ( -5.754 12.529 1.188) 13.839 20.041 ( -8.582 -8.566 11.135) 16.463 ======================= 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| 1.907 ( 0.191 13.885 13.856) 19.617 2.402 ( -8.747 -8.344 7.547) 14.251 2.509 ( 11.232 10.992 5.548) 16.666 2.912 ( 6.876 -7.571 -0.913) 10.268 3.666 ( 13.165 8.159 2.708) 15.723 3.729 ( 3.312 3.004 0.545) 4.504 3.818 ( 9.787 2.209 -1.527) 10.149 3.898 ( -5.150 2.065 0.864) 5.616 4.408 ( 5.062 5.405 4.167) 8.497 4.553 ( 5.181 -2.797 -0.848) 5.949 4.983 ( -4.401 7.906 11.597) 14.709 5.178 ( -1.422 -1.369 10.890) 11.067 5.998 ( 4.909 14.336 0.819) 15.176 6.135 ( 4.270 2.230 -0.007) 4.817 6.158 ( 1.244 0.689 2.271) 2.680 6.550 ( 4.848 -8.250 2.157) 9.809 7.453 ( -6.977 16.662 -3.278) 18.359 7.936 ( 9.067 13.938 10.638) 19.740 8.119 ( -6.491 -10.104 4.817) 12.939 8.547 ( -5.883 11.139 2.237) 12.794 8.643 ( 13.220 -13.001 15.321) 24.052 8.725 ( -6.558 -2.668 0.997) 7.150 9.381 ( -9.115 25.180 -11.521) 29.152 9.876 ( -0.832 2.565 0.990) 2.873 10.112 ( 7.098 -9.005 -6.644) 13.252 10.489 ( -14.552 -20.675 -6.527) 26.111 10.976 ( 0.001 -4.532 -0.034) 4.532 11.056 ( 0.823 -6.890 -4.697) 8.379 11.529 ( 9.270 2.498 -0.579) 9.618 11.707 ( 10.194 -3.625 -0.086) 10.819 11.932 ( 1.404 3.141 2.823) 4.451 12.065 ( -7.031 -2.021 2.480) 7.725 12.317 ( -4.618 11.207 -9.844) 15.615 12.500 ( -4.592 4.864 -8.431) 10.762 12.684 ( -7.050 -1.839 1.821) 7.510 13.071 ( -6.253 -21.798 -11.724) 25.528 13.285 ( 0.100 0.795 -0.765) 1.108 13.410 ( 3.064 -3.141 6.976) 8.241 13.882 ( -4.057 4.759 -6.531) 9.043 14.452 ( 0.477 -21.352 -2.383) 21.490 15.843 ( -1.387 1.953 -3.924) 4.598 15.903 ( -3.947 -1.304 -3.479) 5.420 16.108 ( -2.696 2.450 -6.704) 7.630 16.251 ( -2.929 -4.491 -4.490) 6.993 17.759 ( 11.075 18.528 10.141) 23.849 18.421 ( 1.634 -12.434 -2.314) 12.753 19.513 ( -4.581 12.698 0.811) 13.523 19.978 ( -8.067 -9.541 7.348) 14.495 ======================= 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| 2.079 ( 5.850 5.384 7.586) 10.989 2.263 ( -9.634 -3.084 1.542) 10.233 2.764 ( 9.139 5.420 4.710) 11.623 2.926 ( -1.996 -2.335 -4.068) 5.097 3.623 ( -3.299 9.231 0.176) 9.804 3.820 ( -2.282 0.679 -0.245) 2.394 3.971 ( 9.019 1.638 -0.209) 9.169 4.024 ( 6.688 -0.074 1.088) 6.777 4.559 ( 6.094 3.439 2.180) 7.329 4.607 ( 2.181 -1.031 -2.010) 3.140 4.959 ( -6.868 6.900 6.358) 11.628 5.216 ( -2.124 -3.855 4.564) 6.341 6.060 ( 1.604 14.700 0.008) 14.787 6.201 ( 1.636 6.126 1.171) 6.448 6.221 ( 2.193 0.745 1.285) 2.649 6.637 ( 2.296 -7.292 1.112) 7.726 7.304 ( -4.136 20.145 -2.481) 20.714 8.003 ( -3.226 -7.511 0.891) 8.223 8.234 ( 6.254 15.090 8.383) 18.360 8.475 ( -3.915 5.057 -1.886) 6.667 8.651 ( -1.027 0.792 3.758) 3.975 8.995 ( 4.173 0.835 2.107) 4.748 9.134 ( -1.367 7.552 -1.121) 7.757 9.883 ( -0.010 4.937 0.846) 5.009 10.048 ( -5.346 -15.378 -10.022) 19.118 10.251 ( -3.163 -12.373 0.093) 12.771 11.022 ( 2.614 -8.418 0.960) 8.867 11.047 ( 0.619 -6.654 -0.646) 6.714 11.670 ( 5.326 3.956 -1.860) 6.890 11.832 ( 3.393 -3.051 -0.098) 4.564 11.951 ( -0.256 0.491 -0.215) 0.594 11.973 ( -2.423 -0.580 0.406) 2.524 12.145 ( -4.444 9.017 -4.481) 11.006 12.431 ( 0.812 4.938 -0.245) 5.010 12.564 ( -5.104 -5.934 -1.236) 7.924 12.927 ( -1.506 -20.619 -3.343) 20.943 13.284 ( 0.073 5.910 0.036) 5.911 13.506 ( 1.349 -4.143 3.000) 5.290 13.776 ( -1.930 4.783 -2.526) 5.743 14.436 ( 0.083 -24.659 -1.197) 24.688 15.804 ( 0.147 1.569 -1.493) 2.171 15.825 ( -1.940 0.217 -1.154) 2.268 16.028 ( -0.895 1.887 -2.368) 3.158 16.175 ( -1.296 -4.680 -1.941) 5.230 18.029 ( 7.389 11.320 6.742) 15.106 18.368 ( -2.822 -4.985 -3.934) 6.949 19.464 ( -1.367 11.273 0.264) 11.359 19.918 ( -3.442 -10.294 2.502) 11.139 ======================= 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| 1.906 ( 0.000 -15.857 0.000) 15.857 1.906 ( 0.000 15.857 0.000) 15.857 2.124 ( 0.000 -17.918 0.000) 17.918 2.124 ( 0.000 17.918 0.000) 17.918 3.452 ( 0.000 -3.895 0.000) 3.895 3.452 ( 0.000 3.895 0.000) 3.895 3.975 ( 0.000 -3.007 0.000) 3.007 3.975 ( 0.000 3.007 0.000) 3.007 4.494 ( 0.000 -4.006 0.000) 4.006 4.494 ( 0.000 4.006 0.000) 4.006 4.697 ( 0.000 -5.302 0.000) 5.302 4.697 ( 0.000 5.302 0.000) 5.302 5.761 ( 0.000 -1.948 0.000) 1.948 5.761 ( 0.000 1.948 0.000) 1.948 6.264 ( 0.000 -1.782 0.000) 1.782 6.264 ( 0.000 1.782 0.000) 1.782 7.446 ( 0.000 -9.781 0.000) 9.781 7.446 ( 0.000 9.781 0.000) 9.781 8.125 ( 0.000 -13.800 0.000) 13.800 8.125 ( 0.000 13.800 0.000) 13.800 8.770 ( 0.000 -4.734 0.000) 4.734 8.770 ( 0.000 4.734 0.000) 4.734 10.075 ( 0.000 -8.714 0.000) 8.714 10.075 ( 0.000 8.714 0.000) 8.714 10.473 ( 0.000 -24.673 0.000) 24.673 10.473 ( 0.000 24.673 0.000) 24.673 10.886 ( 0.000 -2.372 0.000) 2.372 10.886 ( 0.000 2.372 0.000) 2.372 11.374 ( 0.000 -1.258 0.000) 1.258 11.374 ( 0.000 1.258 0.000) 1.258 12.012 ( 0.000 -7.362 0.000) 7.362 12.012 ( 0.000 7.362 0.000) 7.362 12.838 ( 0.000 -7.781 0.000) 7.781 12.838 ( 0.000 7.781 0.000) 7.781 13.055 ( 0.000 -14.559 0.000) 14.559 13.055 ( 0.000 14.559 0.000) 14.559 13.509 ( 0.000 -9.592 0.000) 9.592 13.509 ( 0.000 9.592 0.000) 9.592 14.308 ( 0.000 -3.344 0.000) 3.344 14.308 ( 0.000 3.344 0.000) 3.344 16.173 ( 0.000 -2.760 0.000) 2.760 16.173 ( 0.000 2.760 0.000) 2.760 16.439 ( 0.000 -2.925 0.000) 2.925 16.439 ( 0.000 2.925 0.000) 2.925 17.695 ( 0.000 -28.616 0.000) 28.616 17.695 ( 0.000 28.616 0.000) 28.616 19.899 ( 0.000 -8.051 0.000) 8.051 19.899 ( 0.000 8.051 0.000) 8.051 ======================= 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| 2.078 ( 11.547 -13.500 6.162) 18.803 2.078 ( 11.547 13.500 6.162) 18.803 2.168 ( 2.248 -17.426 6.381) 18.693 2.168 ( 2.248 17.426 6.381) 18.693 3.434 ( -2.054 -8.395 2.677) 9.048 3.434 ( -2.054 8.395 2.677) 9.048 3.997 ( 4.018 -5.164 -3.784) 7.559 3.997 ( 4.018 5.164 -3.784) 7.559 4.442 ( -3.514 -4.154 -1.806) 5.733 4.442 ( -3.514 4.154 -1.806) 5.733 4.802 ( 4.355 -5.143 10.313) 12.320 4.802 ( 4.355 5.143 10.313) 12.320 5.851 ( 7.887 -4.529 1.675) 9.248 5.851 ( 7.887 4.529 1.675) 9.248 6.254 ( -0.048 -3.250 -1.602) 3.624 6.254 ( -0.048 3.250 -1.602) 3.624 7.548 ( 6.165 -10.823 8.279) 14.956 7.548 ( 6.165 10.823 8.279) 14.956 8.093 ( -3.686 -13.443 1.045) 13.978 8.093 ( -3.686 13.443 1.045) 13.978 8.795 ( -1.574 -4.231 6.470) 7.890 8.795 ( -1.574 4.231 6.470) 7.890 10.008 ( -0.337 -6.417 -9.808) 11.726 10.008 ( -0.337 6.417 -9.808) 11.726 10.411 ( -6.323 -25.567 -0.525) 26.342 10.411 ( -6.323 25.567 -0.525) 26.342 10.948 ( 4.845 -1.771 0.601) 5.193 10.948 ( 4.845 1.771 0.601) 5.193 11.372 ( 0.659 -2.470 -0.882) 2.704 11.372 ( 0.659 2.470 -0.882) 2.704 11.998 ( -2.769 -7.579 3.859) 8.944 11.998 ( -2.769 7.579 3.859) 8.944 12.820 ( -1.250 -6.314 -2.877) 7.051 12.820 ( -1.250 6.314 -2.877) 7.051 13.093 ( 1.347 -9.540 4.274) 10.540 13.093 ( 1.347 9.540 4.274) 10.540 13.367 ( -6.069 -9.392 -14.560) 18.359 13.367 ( -6.069 9.392 -14.560) 18.359 14.279 ( -1.965 -5.937 -2.418) 6.705 14.279 ( -1.965 5.937 -2.418) 6.705 16.106 ( -3.815 -2.706 -4.719) 6.644 16.106 ( -3.815 2.706 -4.719) 6.644 16.398 ( -2.206 -1.572 -3.946) 4.786 16.398 ( -2.206 1.572 -3.946) 4.786 17.772 ( 5.970 -26.804 3.330) 27.662 17.772 ( 5.970 26.804 3.330) 27.662 19.888 ( -3.792 -9.157 4.259) 10.787 19.888 ( -3.792 9.157 4.259) 10.787 ======================= 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| 2.181 ( -4.901 -16.036 10.454) 19.760 2.181 ( -4.901 16.036 10.454) 19.760 2.462 ( 15.094 -12.283 6.200) 20.424 2.462 ( 15.094 12.283 6.200) 20.424 3.501 ( 8.259 -6.948 1.705) 10.926 3.501 ( 8.259 6.948 1.705) 10.926 3.996 ( -2.025 -2.252 -2.577) 3.977 3.996 ( -2.025 2.252 -2.577) 3.977 4.401 ( 2.065 -2.622 -0.517) 3.377 4.401 ( 2.065 2.622 -0.517) 3.377 5.000 ( 2.051 -4.138 14.103) 14.840 5.000 ( 2.051 4.138 14.103) 14.840 6.027 ( 8.639 -3.469 0.525) 9.324 6.027 ( 8.639 3.469 0.525) 9.324 6.247 ( 0.894 -8.429 0.701) 8.505 6.247 ( 0.894 8.429 0.701) 8.505 7.782 ( 4.656 -12.199 10.777) 16.931 7.782 ( 4.656 12.199 10.777) 16.931 8.056 ( -0.090 -12.782 4.864) 13.676 8.056 ( -0.090 12.782 4.864) 13.676 8.797 ( -5.837 -1.863 5.215) 8.046 8.797 ( -5.837 1.863 5.215) 8.046 9.933 ( 3.125 -0.200 -7.712) 8.323 9.933 ( 3.125 0.200 -7.712) 8.323 10.236 ( -9.580 -26.851 -5.242) 28.987 10.236 ( -9.580 26.851 -5.242) 28.987 10.993 ( 0.644 -2.366 -3.420) 4.209 10.993 ( 0.644 2.366 -3.420) 4.209 11.431 ( 7.010 -2.830 0.955) 7.620 11.431 ( 7.010 2.830 0.955) 7.620 12.009 ( -1.866 -7.112 5.880) 9.414 12.009 ( -1.866 7.112 5.880) 9.414 12.724 ( -4.451 -8.610 -5.580) 11.184 12.724 ( -4.451 8.610 -5.580) 11.184 12.977 ( -9.935 -14.915 -16.316) 24.236 12.977 ( -9.935 14.915 -16.316) 24.236 13.249 ( 2.760 -1.262 4.454) 5.390 13.249 ( 2.760 1.262 4.454) 5.390 14.190 ( -3.001 -10.440 -5.516) 12.183 14.190 ( -3.001 10.440 -5.516) 12.183 15.978 ( -3.904 -2.368 -5.109) 6.852 15.978 ( -3.904 2.368 -5.109) 6.852 16.291 ( -3.292 -2.260 -6.459) 7.593 16.291 ( -3.292 2.260 -6.459) 7.593 17.946 ( 7.959 -22.632 4.284) 24.370 17.946 ( 7.959 22.632 4.284) 24.370 19.841 ( -6.476 -10.775 4.978) 13.520 19.841 ( -6.476 10.775 4.978) 13.520 ======================= 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| 2.181 ( -6.088 -12.373 10.555) 17.365 2.181 ( -6.088 12.373 10.555) 17.365 2.732 ( 9.441 -9.961 2.318) 13.919 2.732 ( 9.441 9.961 2.318) 13.919 3.749 ( 14.319 -1.490 1.450) 14.469 3.749 ( 14.319 1.490 1.450) 14.469 3.889 ( -4.851 -3.450 -2.073) 6.303 3.889 ( -4.851 3.450 -2.073) 6.303 4.493 ( 6.655 -3.295 0.041) 7.426 4.493 ( 6.655 3.295 0.041) 7.426 5.114 ( -5.200 -4.740 13.142) 14.907 5.114 ( -5.200 4.740 13.142) 14.907 6.145 ( 5.302 -1.289 -1.143) 5.575 6.145 ( 5.302 1.289 -1.143) 5.575 6.328 ( 4.163 -12.750 4.212) 14.058 6.328 ( 4.163 12.750 4.212) 14.058 7.799 ( -6.419 -16.446 2.907) 17.892 7.799 ( -6.419 16.446 2.907) 17.892 8.294 ( 10.954 -17.163 12.811) 24.056 8.294 ( 10.954 17.163 12.811) 24.056 8.702 ( -6.323 -3.645 1.805) 7.518 8.702 ( -6.323 3.645 1.805) 7.518 9.915 ( -4.126 -18.056 -11.644) 21.878 9.915 ( -4.126 18.056 -11.644) 21.878 10.001 ( -3.469 -16.507 -1.514) 16.935 10.001 ( -3.469 16.507 -1.514) 16.935 10.953 ( -0.587 -2.287 -1.506) 2.800 10.953 ( -0.587 2.287 -1.506) 2.800 11.613 ( 11.138 -4.983 -1.197) 12.261 11.613 ( 11.138 4.983 -1.197) 12.261 12.016 ( -3.076 -3.575 2.715) 5.442 12.016 ( -3.076 3.575 2.715) 5.442 12.532 ( -8.893 -7.693 -6.896) 13.631 12.532 ( -8.893 7.693 -6.896) 13.631 12.693 ( -3.846 -11.340 -9.902) 15.538 12.693 ( -3.846 11.340 -9.902) 15.538 13.353 ( 1.604 -3.897 6.153) 7.457 13.353 ( 1.604 3.897 6.153) 7.457 14.076 ( -2.590 -14.415 -5.833) 15.765 14.076 ( -2.590 14.415 -5.833) 15.765 15.876 ( -2.392 -1.385 -3.450) 4.420 15.876 ( -2.392 1.385 -3.450) 4.420 16.167 ( -2.886 -3.501 -5.795) 7.360 16.167 ( -2.886 3.501 -5.795) 7.360 18.122 ( 6.532 -16.465 3.284) 18.015 18.122 ( 6.532 16.465 3.284) 18.015 19.762 ( -6.358 -11.445 3.181) 13.474 19.762 ( -6.358 11.445 3.181) 13.474 ======================= 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| 2.184 ( -2.213 -4.593 4.632) 6.888 2.184 ( -2.213 4.593 4.632) 6.888 2.860 ( 3.363 -3.970 0.220) 5.208 2.860 ( 3.363 3.970 0.220) 5.208 3.773 ( -2.973 -5.083 -0.246) 5.894 3.773 ( -2.973 5.083 -0.246) 5.894 4.008 ( 8.042 -1.575 0.078) 8.195 4.008 ( 8.042 1.575 0.078) 8.195 4.595 ( 4.039 -0.631 -0.910) 4.188 4.595 ( 4.039 0.631 -0.910) 4.188 5.101 ( -5.350 -6.728 6.221) 10.611 5.101 ( -5.350 6.728 6.221) 10.611 6.215 ( 2.463 -2.310 0.059) 3.378 6.215 ( 2.463 2.310 0.059) 3.378 6.426 ( 2.160 -12.695 1.921) 13.020 6.426 ( 2.160 12.695 1.921) 13.020 7.715 ( -3.437 -18.696 0.587) 19.019 7.715 ( -3.437 18.696 0.587) 19.019 8.474 ( -0.246 -6.966 0.913) 7.029 8.474 ( -0.246 6.966 0.913) 7.029 8.759 ( 5.347 -11.190 9.055) 15.356 8.759 ( 5.347 11.190 9.055) 15.356 9.621 ( -7.424 -25.471 -10.799) 28.645 9.621 ( -7.424 25.471 -10.799) 28.645 10.022 ( 0.692 -8.786 1.059) 8.876 10.022 ( 0.692 8.786 1.059) 8.876 10.954 ( 0.649 -1.501 0.319) 1.666 10.954 ( 0.649 1.501 0.319) 1.666 11.742 ( 3.865 -4.224 -2.592) 6.285 11.742 ( 3.865 4.224 -2.592) 6.285 11.978 ( -0.455 -0.510 -0.181) 0.707 11.978 ( -0.455 0.510 -0.181) 0.707 12.359 ( -4.667 -10.351 -0.968) 11.395 12.359 ( -4.667 10.351 -0.968) 11.395 12.598 ( -0.490 -10.016 -2.873) 10.431 12.598 ( -0.490 10.016 -2.873) 10.431 13.417 ( 0.384 -5.584 2.576) 6.162 13.417 ( 0.384 5.584 2.576) 6.162 13.998 ( -1.002 -16.959 -2.469) 17.167 13.998 ( -1.002 16.959 -2.469) 17.167 15.823 ( -0.787 -0.439 -1.206) 1.505 15.823 ( -0.787 0.439 -1.206) 1.505 16.086 ( -1.150 -3.742 -2.319) 4.550 16.086 ( -1.150 3.742 -2.319) 4.550 18.232 ( 2.573 -8.292 1.220) 8.767 18.232 ( 2.573 8.292 1.220) 8.767 19.695 ( -2.712 -11.194 0.997) 11.561 19.695 ( -2.712 11.194 0.997) 11.561 ======================= 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| 0.585 ( 1.026 0.000 28.010) 28.029 0.611 ( 1.019 0.000 29.092) 29.110 1.139 ( 12.065 0.000 53.270) 54.619 2.687 ( 0.032 0.000 -0.834) 0.834 2.778 ( -2.037 0.000 9.766) 9.977 3.338 ( -1.387 0.000 5.182) 5.365 3.502 ( 6.630 0.000 8.392) 10.695 3.737 ( -3.627 0.000 -5.925) 6.947 4.211 ( 2.848 0.000 -4.364) 5.211 4.434 ( 2.005 0.000 -1.138) 2.305 4.621 ( -5.567 0.000 8.622) 10.263 5.087 ( -0.424 0.000 3.503) 3.528 5.548 ( -6.082 0.000 -2.112) 6.438 6.103 ( -12.204 0.000 0.931) 12.240 6.184 ( -0.196 0.000 -6.569) 6.571 6.450 ( -4.016 0.000 5.022) 6.430 7.041 ( 1.425 0.000 -1.731) 2.242 7.477 ( -10.280 0.000 3.761) 10.946 7.891 ( -5.651 0.000 -1.142) 5.765 8.226 ( 11.666 0.000 7.035) 13.623 8.490 ( 4.920 0.000 3.560) 6.073 8.790 ( -3.823 0.000 -1.646) 4.163 10.028 ( -11.703 0.000 -4.937) 12.702 10.197 ( 5.083 0.000 0.542) 5.112 10.490 ( 14.222 0.000 -17.693) 22.701 10.633 ( -81.187 0.000 2.421) 81.223 10.976 ( 1.307 0.000 4.114) 4.316 11.320 ( -3.001 0.000 0.244) 3.011 11.449 ( 2.468 0.000 4.526) 5.155 11.496 ( -4.804 0.000 4.030) 6.270 11.938 ( 0.541 0.000 1.456) 1.553 12.259 ( 1.943 0.000 2.020) 2.803 12.608 ( 0.998 0.000 -15.865) 15.897 12.888 ( -3.671 0.000 -6.969) 7.876 12.977 ( -7.929 0.000 -4.346) 9.042 13.128 ( -2.933 0.000 -5.321) 6.076 13.814 ( -13.320 0.000 -2.839) 13.619 13.902 ( 0.487 0.000 -3.231) 3.267 14.617 ( 9.429 0.000 27.112) 28.705 15.165 ( -0.269 0.000 0.597) 0.655 15.371 ( -7.682 0.000 -1.039) 7.752 15.679 ( -0.407 0.000 0.931) 1.016 16.379 ( 1.161 0.000 3.433) 3.624 16.524 ( -4.749 0.000 -5.469) 7.243 16.665 ( -1.651 0.000 -1.932) 2.541 18.447 ( 25.101 0.000 -1.363) 25.138 19.246 ( -2.369 0.000 2.313) 3.311 20.042 ( 103.480 0.000 -2.004) 103.500 ======================= 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| 0.931 ( 3.369 0.000 29.824) 30.014 1.012 ( 14.872 0.000 21.985) 26.543 2.108 ( 33.734 0.000 41.518) 53.496 2.800 ( 13.115 0.000 -2.399) 13.333 2.863 ( 0.576 0.000 7.861) 7.882 3.290 ( -9.897 0.000 10.290) 14.277 3.697 ( 0.940 0.000 1.935) 2.151 3.779 ( 9.650 0.000 13.601) 16.676 4.122 ( -7.555 0.000 -5.190) 9.166 4.525 ( 7.153 0.000 3.796) 8.098 4.621 ( -3.387 0.000 7.584) 8.306 5.114 ( 0.462 0.000 2.220) 2.268 5.382 ( -6.212 0.000 -5.971) 8.617 6.117 ( 1.247 0.000 -7.488) 7.591 6.149 ( 6.263 0.000 7.615) 9.860 6.455 ( -0.074 0.000 2.052) 2.053 7.083 ( 5.093 0.000 -1.526) 5.317 7.237 ( -14.903 0.000 -3.884) 15.401 7.815 ( -1.621 0.000 0.032) 1.622 8.632 ( 17.633 0.000 18.427) 25.504 8.700 ( -2.388 0.000 -5.529) 6.023 8.773 ( 8.437 0.000 2.159) 8.709 9.494 ( -32.190 0.000 3.464) 32.376 9.902 ( -2.741 0.000 1.787) 3.272 10.421 ( -3.824 0.000 -12.759) 13.319 10.787 ( 29.617 0.000 -7.336) 30.512 11.005 ( -1.904 0.000 -0.237) 1.919 11.317 ( -0.217 0.000 5.883) 5.887 11.518 ( -0.826 0.000 5.177) 5.242 11.556 ( 3.936 0.000 2.794) 4.827 11.982 ( 1.649 0.000 3.564) 3.927 12.212 ( -21.057 0.000 -17.147) 27.155 12.275 ( -4.350 0.000 3.620) 5.659 12.729 ( -0.375 0.000 -6.361) 6.372 12.896 ( 0.192 0.000 -1.412) 1.425 13.037 ( -4.797 0.000 -1.344) 4.982 13.660 ( -2.145 0.000 -8.376) 8.647 13.869 ( -0.230 0.000 -3.874) 3.880 14.943 ( 0.398 0.000 6.747) 6.758 15.304 ( -2.553 0.000 0.651) 2.634 15.341 ( 14.942 0.000 13.233) 19.960 15.702 ( 1.588 0.000 0.154) 1.595 16.315 ( -9.339 0.000 -7.863) 12.208 16.496 ( 5.585 0.000 10.384) 11.791 16.584 ( -3.765 0.000 -3.725) 5.296 18.627 ( 8.181 0.000 -3.203) 8.786 19.167 ( -7.840 0.000 0.002) 7.840 20.710 ( 5.449 0.000 -7.341) 9.142 ======================= 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| 1.342 ( 9.484 0.000 26.423) 28.074 1.520 ( 19.373 0.000 15.340) 24.711 2.905 ( -3.530 0.000 3.065) 4.675 3.059 ( 17.493 0.000 -5.285) 18.274 3.084 ( 31.456 0.000 24.907) 40.123 3.222 ( -10.075 0.000 16.758) 19.554 3.737 ( 1.646 0.000 1.635) 2.320 3.804 ( -14.025 0.000 -5.074) 14.914 4.137 ( 6.338 0.000 14.954) 16.242 4.647 ( -1.582 0.000 6.089) 6.291 4.734 ( 9.708 0.000 4.658) 10.768 5.152 ( 2.212 0.000 -0.105) 2.215 5.214 ( -5.064 0.000 -6.607) 8.324 6.079 ( 3.033 0.000 -7.763) 8.335 6.345 ( 5.957 0.000 6.969) 9.168 6.473 ( 1.433 0.000 -1.596) 2.145 6.899 ( -14.916 0.000 -7.348) 16.628 7.193 ( 7.866 0.000 -0.407) 7.877 7.799 ( -1.451 0.000 1.711) 2.243 8.578 ( -3.891 0.000 -6.765) 7.804 8.746 ( -11.816 0.000 2.462) 12.070 9.043 ( -24.653 0.000 12.475) 27.629 9.210 ( 20.955 0.000 23.906) 31.790 10.104 ( 24.064 0.000 -9.530) 25.882 10.161 ( -12.709 0.000 -4.917) 13.627 10.874 ( -5.076 0.000 -14.488) 15.352 11.153 ( 22.193 0.000 -13.130) 25.786 11.295 ( -17.105 0.000 6.520) 18.306 11.544 ( -0.631 0.000 1.803) 1.910 11.604 ( 1.164 0.000 1.646) 2.017 11.832 ( -1.275 0.000 -3.889) 4.092 12.065 ( 1.590 0.000 5.819) 6.032 12.176 ( -9.703 0.000 3.842) 10.436 12.747 ( 5.808 0.000 -2.204) 6.212 12.879 ( -8.905 0.000 -5.227) 10.326 12.924 ( 1.317 0.000 2.656) 2.964 13.530 ( -1.943 0.000 -8.925) 9.134 13.820 ( -0.789 0.000 -3.591) 3.676 14.934 ( -1.930 0.000 0.219) 1.942 15.272 ( -2.114 0.000 1.568) 2.632 15.694 ( 9.435 0.000 5.616) 10.980 15.718 ( 1.165 0.000 -2.949) 3.171 16.075 ( -8.977 0.000 -4.076) 9.859 16.466 ( -4.387 0.000 -3.974) 5.920 16.841 ( 14.706 0.000 19.885) 24.732 18.731 ( 8.427 0.000 -6.630) 10.723 18.954 ( -13.182 0.000 -4.071) 13.796 20.610 ( -9.053 0.000 0.697) 9.080 ======================= 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| 1.772 ( 11.184 0.000 18.998) 22.046 2.015 ( 20.892 0.000 9.399) 22.909 2.741 ( -16.835 0.000 0.721) 16.850 3.163 ( -3.491 0.000 4.443) 5.650 3.168 ( -6.908 0.000 -6.119) 9.229 3.579 ( 5.052 0.000 -9.167) 10.467 3.677 ( 1.343 0.000 11.795) 11.871 3.943 ( 20.275 0.000 8.499) 21.984 4.336 ( -2.172 0.000 13.677) 13.849 4.665 ( -2.203 0.000 2.339) 3.213 4.932 ( 7.799 0.000 1.532) 7.948 5.082 ( -3.009 0.000 -3.191) 4.386 5.176 ( 1.868 0.000 -3.238) 3.738 6.073 ( 5.381 0.000 -8.464) 10.030 6.468 ( 1.743 0.000 -4.792) 5.099 6.487 ( 2.800 0.000 1.398) 3.130 6.587 ( -10.868 0.000 -1.636) 10.990 7.352 ( 7.835 0.000 2.479) 8.217 7.797 ( -1.552 0.000 3.134) 3.497 8.440 ( -3.111 0.000 -6.274) 7.003 8.513 ( -13.907 0.000 3.065) 14.241 8.821 ( -16.711 0.000 15.754) 22.966 9.796 ( 7.746 0.000 17.946) 19.547 9.951 ( -0.870 0.000 6.941) 6.995 10.485 ( 26.625 0.000 -8.824) 28.049 10.527 ( -9.473 0.000 -23.483) 25.322 10.951 ( -20.311 0.000 4.165) 20.733 11.354 ( 14.563 0.000 -12.520) 19.205 11.527 ( -0.086 0.000 -3.078) 3.079 11.655 ( 2.254 0.000 0.560) 2.323 11.988 ( 9.990 0.000 9.789) 13.987 12.041 ( -9.305 0.000 5.177) 10.648 12.123 ( -1.764 0.000 4.282) 4.631 12.569 ( -12.428 0.000 -11.667) 17.046 12.886 ( 6.590 0.000 -0.757) 6.633 12.975 ( -0.677 0.000 5.484) 5.526 13.431 ( -0.591 0.000 -4.243) 4.284 13.775 ( -0.525 0.000 -2.548) 2.601 14.913 ( -0.619 0.000 0.640) 0.890 15.257 ( -1.902 0.000 2.247) 2.944 15.683 ( 1.127 0.000 -6.497) 6.593 15.826 ( 3.162 0.000 0.961) 3.305 15.938 ( -5.643 0.000 3.241) 6.507 16.363 ( -2.816 0.000 -2.457) 3.737 17.328 ( 14.187 0.000 17.021) 22.158 18.629 ( -14.609 0.000 -6.697) 16.071 18.790 ( 8.115 0.000 -11.747) 14.277 20.438 ( -9.283 0.000 -1.042) 9.342 ======================= 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| 2.104 ( 10.267 0.000 7.636) 12.795 2.333 ( -25.430 0.000 -3.246) 25.637 2.456 ( 17.648 0.000 3.710) 18.034 2.792 ( -19.577 0.000 -5.739) 20.400 3.158 ( -0.810 0.000 1.400) 1.618 3.695 ( 14.537 0.000 -13.743) 20.005 3.735 ( -4.265 0.000 9.871) 10.753 4.201 ( 2.095 0.000 -7.796) 8.073 4.314 ( -12.559 0.000 8.913) 15.401 4.581 ( -4.430 0.000 -4.675) 6.441 5.026 ( 2.086 0.000 -2.689) 3.403 5.076 ( 1.727 0.000 3.729) 4.110 5.152 ( 1.338 0.000 -5.599) 5.757 6.083 ( 5.448 0.000 -10.585) 11.905 6.359 ( -3.640 0.000 -5.114) 6.277 6.464 ( 4.182 0.000 -4.979) 6.503 6.662 ( 4.390 0.000 11.305) 12.127 7.490 ( 2.122 0.000 4.211) 4.716 7.790 ( -2.085 0.000 1.442) 2.535 8.346 ( -7.874 0.000 3.900) 8.787 8.376 ( 2.123 0.000 -2.816) 3.526 8.751 ( -10.404 0.000 19.489) 22.092 9.719 ( -9.632 0.000 0.971) 9.681 9.961 ( -9.349 0.000 -20.531) 22.560 10.504 ( 10.021 0.000 15.189) 18.197 10.723 ( -6.585 0.000 5.928) 8.860 10.862 ( 20.837 0.000 -3.937) 21.206 11.405 ( 0.303 0.000 -3.233) 3.247 11.540 ( 9.509 0.000 -9.913) 13.737 11.719 ( 1.724 0.000 4.963) 5.254 11.938 ( -8.131 0.000 4.696) 9.390 12.092 ( -3.363 0.000 0.602) 3.416 12.141 ( -8.661 0.000 -10.075) 13.286 12.358 ( 8.124 0.000 6.312) 10.288 12.916 ( 0.886 0.000 -7.603) 7.654 13.002 ( -3.198 0.000 6.391) 7.147 13.466 ( 3.966 0.000 5.286) 6.609 13.756 ( 0.681 0.000 -1.181) 1.364 14.925 ( 0.218 0.000 2.319) 2.329 15.241 ( -1.889 0.000 1.539) 2.436 15.677 ( 4.532 0.000 -3.567) 5.768 15.867 ( 0.816 0.000 0.638) 1.036 15.908 ( -3.526 0.000 6.488) 7.384 16.329 ( 0.477 0.000 0.473) 0.672 17.510 ( -6.585 0.000 -4.296) 7.862 18.443 ( 0.783 0.000 3.989) 4.065 18.782 ( 7.074 0.000 -17.346) 18.733 20.253 ( -6.820 0.000 -6.699) 9.559 ======================= 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| 1.784 ( -27.482 0.000 -6.426) 28.223 2.207 ( -26.174 0.000 -7.451) 27.214 2.333 ( 10.247 0.000 1.457) 10.350 2.925 ( 20.518 0.000 0.682) 20.529 3.127 ( -3.529 0.000 -3.383) 4.889 3.702 ( -8.567 0.000 4.782) 9.811 3.754 ( 8.267 0.000 -16.581) 18.527 3.859 ( -21.611 0.000 -14.947) 26.276 4.089 ( -18.055 0.000 4.026) 18.498 4.506 ( 1.790 0.000 -5.132) 5.435 4.938 ( -5.014 0.000 -6.491) 8.202 5.138 ( 1.503 0.000 -4.234) 4.493 5.174 ( 4.877 0.000 3.381) 5.934 6.059 ( 5.174 0.000 -11.241) 12.374 6.279 ( -1.523 0.000 -3.864) 4.153 6.528 ( 5.994 0.000 -2.064) 6.340 6.932 ( 9.504 0.000 15.239) 17.960 7.483 ( -5.948 0.000 1.805) 6.216 7.763 ( -0.762 0.000 -0.457) 0.888 8.317 ( 0.025 0.000 5.266) 5.266 8.454 ( 6.396 0.000 -0.790) 6.444 8.818 ( -5.584 0.000 20.518) 21.264 9.366 ( -13.273 0.000 -20.131) 24.113 9.804 ( -0.549 0.000 3.621) 3.662 10.582 ( 3.114 0.000 -2.331) 3.890 10.933 ( 6.430 0.000 9.496) 11.468 11.084 ( -0.095 0.000 6.526) 6.527 11.443 ( 8.674 0.000 -0.901) 8.721 11.593 ( 5.009 0.000 -8.455) 9.827 11.683 ( -8.646 0.000 -6.919) 11.073 11.849 ( -4.238 0.000 3.117) 5.261 11.999 ( 2.923 0.000 8.597) 9.080 12.036 ( -2.088 0.000 -1.983) 2.880 12.623 ( 10.401 0.000 4.167) 11.204 12.818 ( -1.099 0.000 -7.255) 7.338 12.984 ( -5.187 0.000 5.399) 7.487 13.642 ( 5.400 0.000 10.625) 11.919 13.779 ( 2.264 0.000 0.308) 2.285 14.964 ( 0.152 0.000 4.318) 4.321 15.231 ( -0.644 0.000 1.602) 1.726 15.748 ( 4.196 0.000 -1.635) 4.503 15.866 ( -2.146 0.000 0.235) 2.159 15.957 ( 1.219 0.000 9.433) 9.512 16.385 ( 3.398 0.000 2.836) 4.426 17.100 ( -19.779 0.000 -17.684) 26.531 18.658 ( 10.452 0.000 9.045) 13.822 18.688 ( 5.436 0.000 -24.096) 24.702 20.049 ( -3.697 0.000 -14.992) 15.441 ======================= 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| 1.256 ( -25.674 0.000 0.625) 25.682 1.627 ( -28.404 0.000 -7.539) 29.388 2.507 ( 4.707 0.000 -3.723) 6.001 2.766 ( -25.172 0.000 -15.929) 29.789 3.237 ( 9.414 0.000 -1.142) 9.483 3.409 ( -8.588 0.000 -6.078) 10.522 3.560 ( -7.979 0.000 -0.657) 8.006 3.663 ( 0.519 0.000 -16.454) 16.463 3.823 ( -8.837 0.000 1.114) 8.907 4.517 ( 1.752 0.000 -0.077) 1.754 4.757 ( -7.630 0.000 -5.511) 9.412 5.102 ( -0.611 0.000 -3.733) 3.782 5.332 ( 7.556 0.000 5.202) 9.173 6.078 ( 7.822 0.000 -8.260) 11.375 6.206 ( -0.925 0.000 -5.951) 6.023 6.606 ( 1.600 0.000 2.399) 2.884 7.251 ( 5.891 0.000 17.020) 18.011 7.342 ( -8.983 0.000 -1.011) 9.039 7.764 ( 2.279 0.000 -1.922) 2.981 8.458 ( -1.395 0.000 -13.309) 13.381 8.476 ( 11.691 0.000 5.772) 13.038 8.933 ( -3.316 0.000 16.896) 17.218 9.045 ( -6.471 0.000 -2.704) 7.013 9.888 ( 6.912 0.000 -0.293) 6.919 10.715 ( 17.730 0.000 -8.212) 19.540 11.008 ( -0.714 0.000 -1.485) 1.648 11.091 ( -10.546 0.000 21.009) 23.507 11.472 ( -4.238 0.000 -4.415) 6.120 11.489 ( -3.382 0.000 -5.478) 6.438 11.697 ( 11.516 0.000 -0.752) 11.540 11.834 ( -4.488 0.000 4.463) 6.329 11.999 ( 1.550 0.000 -0.712) 1.705 12.206 ( 2.132 0.000 15.148) 15.297 12.720 ( 4.113 0.000 -4.488) 6.088 12.866 ( 6.191 0.000 3.752) 7.239 12.938 ( -4.076 0.000 3.315) 5.254 13.838 ( 2.748 0.000 1.839) 3.307 13.854 ( 4.453 0.000 12.691) 13.450 15.009 ( -1.266 0.000 5.697) 5.836 15.261 ( 1.119 0.000 3.968) 4.123 15.723 ( -13.321 0.000 -5.857) 14.552 15.764 ( -0.487 0.000 -0.961) 1.078 16.151 ( 7.893 0.000 10.181) 12.883 16.479 ( 1.933 0.000 0.692) 2.053 16.615 ( -10.904 0.000 -10.586) 15.197 18.476 ( 3.763 0.000 -35.733) 35.930 18.920 ( 9.136 0.000 6.127) 11.001 19.797 ( -1.854 0.000 -26.008) 26.074 ======================= 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| 0.886 ( -23.218 0.000 13.449) 26.832 1.043 ( -28.752 0.000 -3.255) 28.936 1.765 ( -45.437 0.000 -19.103) 49.289 2.710 ( 3.201 0.000 2.206) 3.887 3.120 ( -16.192 0.000 -0.660) 16.206 3.294 ( -2.479 0.000 -0.723) 2.582 3.487 ( -2.256 0.000 -11.302) 11.525 3.488 ( 3.347 0.000 -2.557) 4.212 3.925 ( 14.996 0.000 -1.978) 15.126 4.557 ( -0.190 0.000 4.852) 4.856 4.565 ( -7.766 0.000 -3.457) 8.501 5.061 ( -0.505 0.000 -1.567) 1.646 5.530 ( 5.553 0.000 7.801) 9.576 6.136 ( 1.241 0.000 -6.509) 6.626 6.156 ( 7.667 0.000 -5.553) 9.467 6.613 ( -6.217 0.000 6.577) 9.050 7.171 ( -6.805 0.000 -2.529) 7.259 7.463 ( -0.519 0.000 14.777) 14.786 7.808 ( 4.480 0.000 -1.797) 4.827 8.219 ( -4.103 0.000 -15.643) 16.172 8.832 ( 15.708 0.000 6.179) 16.879 8.976 ( -6.025 0.000 4.583) 7.570 9.033 ( 5.570 0.000 4.544) 7.189 10.050 ( 17.280 0.000 -10.399) 20.167 10.923 ( 2.658 0.000 -2.967) 3.983 11.082 ( 20.312 0.000 -5.757) 21.112 11.129 ( -16.572 0.000 17.718) 24.260 11.331 ( -1.394 0.000 -1.954) 2.400 11.416 ( -0.113 0.000 -4.829) 4.830 11.835 ( 2.498 0.000 3.303) 4.141 11.925 ( 0.489 0.000 38.728) 38.731 12.074 ( 5.075 0.000 0.439) 5.094 12.358 ( 3.294 0.000 9.283) 9.850 12.800 ( 5.300 0.000 0.383) 5.314 12.922 ( -0.999 0.000 4.101) 4.221 13.007 ( 5.056 0.000 3.887) 6.377 13.907 ( 1.600 0.000 3.873) 4.191 14.056 ( 3.093 0.000 13.692) 14.037 14.947 ( -16.676 0.000 -0.189) 16.677 15.301 ( -14.886 0.000 -7.776) 16.795 15.371 ( 3.173 0.000 12.934) 13.318 15.729 ( -2.065 0.000 -0.611) 2.154 16.375 ( -2.174 0.000 -3.012) 3.715 16.401 ( 8.306 0.000 7.688) 11.318 16.619 ( 3.252 0.000 2.443) 4.067 18.016 ( -1.482 0.000 -69.585) 69.601 19.108 ( 5.962 0.000 3.857) 7.101 19.422 ( -6.117 0.000 -34.016) 34.562 ======================= 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| 0.574 ( -27.102 0.000 6.648) 27.906 0.578 ( -23.836 0.000 12.570) 26.947 0.927 ( -35.045 0.000 26.903) 44.181 2.744 ( -3.063 0.000 6.904) 7.553 2.821 ( -13.141 0.000 -0.620) 13.156 3.284 ( 1.078 0.000 1.091) 1.534 3.399 ( 0.667 0.000 -1.401) 1.552 3.647 ( 13.802 0.000 -0.294) 13.805 4.145 ( 10.350 0.000 -4.560) 11.310 4.439 ( -2.018 0.000 -1.919) 2.784 4.604 ( -2.224 0.000 8.479) 8.766 5.060 ( 0.045 0.000 1.902) 1.903 5.624 ( -3.016 0.000 4.255) 5.215 6.185 ( 9.678 0.000 -4.506) 10.676 6.215 ( 4.103 0.000 -5.349) 6.741 6.522 ( -10.026 0.000 7.046) 12.255 7.066 ( -2.156 0.000 -2.092) 3.005 7.538 ( -4.789 0.000 9.858) 10.960 7.877 ( 3.586 0.000 0.316) 3.600 8.087 ( 2.761 0.000 -5.640) 6.280 8.806 ( -11.855 0.000 -10.752) 16.005 8.886 ( -6.421 0.000 1.319) 6.555 9.497 ( 33.555 0.000 2.407) 33.642 10.297 ( 23.093 0.000 -15.854) 28.011 10.720 ( -28.717 0.000 -4.422) 29.055 10.930 ( 0.565 0.000 1.192) 1.319 11.347 ( 8.830 0.000 -0.418) 8.840 11.371 ( -0.188 0.000 -3.514) 3.519 11.380 ( 0.162 0.000 3.038) 3.042 11.895 ( 2.624 0.000 -1.449) 2.998 12.157 ( 4.740 0.000 -3.352) 5.806 12.495 ( -2.368 0.000 -3.503) 4.228 12.562 ( 13.016 0.000 -3.400) 13.453 12.880 ( 4.021 0.000 -0.668) 4.076 13.128 ( 4.917 0.000 1.019) 5.021 13.232 ( 18.843 0.000 22.814) 29.589 13.977 ( -1.712 0.000 3.973) 4.326 14.251 ( 2.649 0.000 5.099) 5.746 14.361 ( -33.623 0.000 6.117) 34.175 15.183 ( -1.909 0.000 0.930) 2.123 15.666 ( -0.609 0.000 -1.598) 1.710 16.066 ( 50.702 0.000 88.411) 101.918 16.351 ( -0.000 0.000 0.539) 0.539 16.531 ( -58.077 0.000 -106.846) 121.610 16.564 ( 3.016 0.000 1.504) 3.370 16.677 ( 1.124 0.000 0.458) 1.214 19.013 ( -6.284 0.000 -8.241) 10.364 19.218 ( 2.190 0.000 3.047) 3.752 ======================= 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| 0.817 ( 2.866 19.580 18.494) 27.085 0.871 ( 6.536 19.411 21.300) 29.550 1.594 ( 3.907 37.026 33.948) 50.385 2.633 ( -0.120 -4.798 1.832) 5.137 2.781 ( -1.296 -0.602 6.236) 6.398 3.453 ( -2.812 10.752 3.901) 11.778 3.506 ( 3.696 -0.786 8.615) 9.408 3.733 ( 4.497 4.956 0.380) 6.703 4.247 ( 3.033 3.362 -4.554) 6.422 4.461 ( 2.159 2.567 0.482) 3.388 4.546 ( -5.233 -6.575 8.463) 11.927 5.067 ( -0.345 -2.047 3.053) 3.692 5.589 ( -4.432 3.268 -1.896) 5.824 5.983 ( -2.457 -7.267 0.622) 7.697 6.205 ( -1.025 1.552 -2.679) 3.261 6.483 ( -5.457 1.149 4.883) 7.412 7.038 ( 1.701 0.880 0.443) 1.965 7.547 ( -9.029 6.231 3.875) 11.635 8.082 ( 6.334 -0.450 2.846) 6.958 8.127 ( -5.074 11.322 1.675) 12.519 8.599 ( 12.049 7.396 3.433) 14.549 8.895 ( -2.703 3.458 0.270) 4.398 9.731 ( 4.734 -22.276 -4.434) 23.201 10.084 ( -36.949 -9.293 -2.639) 38.191 10.240 ( -10.298 -9.044 2.930) 14.015 10.716 ( 17.001 12.696 -14.142) 25.500 11.148 ( -6.078 -0.201 7.616) 9.746 11.302 ( -0.162 -1.917 1.298) 2.320 11.400 ( 0.372 -2.778 1.617) 3.236 11.537 ( 0.581 4.742 4.943) 6.874 11.966 ( -1.643 2.992 0.302) 3.427 12.295 ( -1.611 2.733 0.661) 3.241 12.460 ( 4.996 -9.014 0.051) 10.306 12.642 ( -3.555 -13.057 -12.467) 18.400 12.887 ( 3.376 -6.645 6.548) 9.921 13.236 ( -8.023 5.314 -11.310) 14.850 13.721 ( -5.644 -6.566 -4.290) 9.663 13.969 ( -7.245 3.330 -6.469) 10.267 14.437 ( 3.168 -15.207 15.790) 22.150 14.705 ( 6.928 -7.395 15.876) 18.834 15.845 ( 0.727 16.123 -0.618) 16.151 15.925 ( -10.477 12.474 -13.067) 20.883 16.403 ( 1.188 3.025 5.458) 6.352 16.496 ( -3.049 -2.757 -3.414) 5.343 16.598 ( -0.294 -3.758 0.110) 3.772 18.667 ( 1.564 4.487 -11.282) 12.242 19.297 ( -1.689 6.478 -0.402) 6.707 20.125 ( 60.951 3.610 -5.180) 61.277 ======================= 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| 1.110 ( 5.498 15.978 23.254) 28.745 1.253 ( 11.581 18.815 18.463) 28.792 2.278 ( 27.707 15.954 33.796) 46.523 2.751 ( 11.059 -4.164 0.288) 11.820 2.858 ( 1.744 -1.210 6.045) 6.407 3.400 ( -8.130 9.945 7.520) 14.885 3.675 ( 3.643 -0.614 6.621) 7.582 3.860 ( 5.285 5.912 7.294) 10.775 4.171 ( -5.805 4.317 -4.073) 8.302 4.565 ( 6.428 3.467 4.825) 8.753 4.567 ( -0.923 -4.421 6.829) 8.187 5.088 ( -0.822 -0.733 3.519) 3.687 5.465 ( -3.639 6.208 -4.891) 8.701 6.023 ( 4.363 -5.648 -2.617) 7.602 6.208 ( 2.848 2.427 2.109) 4.296 6.468 ( -0.401 0.688 2.159) 2.301 7.097 ( 3.052 3.295 0.401) 4.509 7.358 ( -11.071 9.604 -1.610) 14.745 7.986 ( -3.488 15.972 -1.688) 16.435 8.466 ( 16.738 -10.689 12.727) 23.588 8.825 ( -1.696 7.000 -5.899) 9.310 8.888 ( 3.447 8.002 11.632) 14.533 9.420 ( -26.431 -6.792 3.721) 27.542 9.743 ( 4.017 -10.049 -3.650) 11.421 10.231 ( 2.502 -12.606 -8.588) 15.457 10.952 ( 17.774 10.361 -9.106) 22.499 11.100 ( -1.868 3.053 -3.876) 5.276 11.334 ( -0.102 2.048 4.636) 5.070 11.463 ( 2.255 -4.300 5.469) 7.313 11.592 ( -0.626 2.305 4.357) 4.969 11.943 ( -0.381 -2.931 -1.670) 3.395 12.225 ( -14.841 -5.533 -6.953) 17.298 12.242 ( -8.000 2.734 -4.483) 9.570 12.586 ( 3.720 -4.917 1.942) 6.464 12.917 ( -5.348 -7.818 -3.217) 10.004 13.072 ( 0.875 8.603 -0.120) 8.648 13.591 ( -2.528 -6.100 -8.495) 10.760 13.856 ( -0.406 -1.492 -6.551) 6.731 14.538 ( -3.320 -24.624 5.979) 25.556 15.032 ( 11.798 -15.456 10.560) 22.126 15.680 ( -4.627 14.096 -6.164) 16.065 15.897 ( 2.656 11.979 0.045) 12.270 16.286 ( -9.075 -2.202 -7.464) 11.954 16.544 ( -3.066 -3.539 -3.414) 5.795 16.598 ( 7.336 10.198 14.154) 18.925 18.668 ( 5.566 0.727 -4.596) 7.255 19.215 ( -6.767 5.676 -0.871) 8.875 20.609 ( 5.840 -8.538 -2.503) 10.643 ======================= 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| 1.465 ( 6.266 11.423 24.947) 28.144 1.683 ( 17.926 13.974 12.490) 25.935 2.882 ( -2.866 -2.283 3.188) 4.856 2.998 ( 12.649 -3.995 -2.908) 13.580 3.134 ( 28.305 3.470 26.597) 38.995 3.336 ( -5.213 9.652 6.034) 12.520 3.712 ( -3.930 -0.499 0.100) 3.963 3.877 ( -7.005 4.367 -1.093) 8.326 4.193 ( 5.098 4.912 12.284) 14.178 4.631 ( 1.266 -2.253 4.350) 5.060 4.753 ( 6.624 2.813 5.594) 9.115 5.110 ( -0.024 1.822 2.459) 3.060 5.381 ( -0.171 10.367 -4.957) 11.492 6.044 ( 4.077 -2.890 -6.934) 8.547 6.305 ( 1.323 -3.167 5.553) 6.528 6.510 ( 4.519 2.340 -1.320) 5.258 6.977 ( -12.433 8.052 -5.838) 15.922 7.315 ( 6.262 10.694 1.582) 12.493 7.931 ( -2.422 12.560 0.777) 12.815 8.657 ( -8.261 2.984 -1.567) 8.922 8.718 ( -5.015 1.268 -0.648) 5.213 9.017 ( -19.478 -1.778 14.593) 24.403 9.170 ( 11.644 -4.548 17.668) 21.643 10.008 ( 24.968 -6.835 -7.092) 26.840 10.102 ( -7.209 -6.043 -3.896) 10.181 10.904 ( -5.625 1.613 -16.411) 17.423 11.159 ( 5.976 -1.270 -6.033) 8.586 11.336 ( -4.106 4.996 -0.396) 6.479 11.505 ( -2.750 -5.385 4.436) 7.499 11.620 ( 2.354 1.677 2.396) 3.754 11.851 ( -0.939 2.349 -6.008) 6.518 12.009 ( -0.529 -6.880 2.035) 7.194 12.180 ( -4.344 3.194 4.251) 6.866 12.650 ( -1.639 -8.789 1.963) 9.153 12.762 ( -3.033 -2.683 -5.513) 6.840 13.118 ( 0.802 10.046 2.464) 10.374 13.452 ( -2.476 -6.583 -8.842) 11.299 13.790 ( 0.253 -3.456 -6.300) 7.190 14.500 ( -4.509 -28.190 3.116) 28.718 15.272 ( 7.494 -17.955 1.258) 19.497 15.597 ( -1.507 9.891 -0.260) 10.008 15.920 ( 0.854 7.052 -3.315) 7.839 16.053 ( -8.154 -1.951 -3.866) 9.233 16.438 ( -3.917 -2.728 -3.991) 6.222 16.983 ( 14.317 12.754 20.276) 27.907 18.715 ( 3.728 -2.819 -6.455) 7.970 19.039 ( -8.407 8.584 -4.411) 12.799 20.551 ( -7.984 -5.637 0.949) 9.819 ======================= 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| 1.825 ( 7.954 5.574 19.123) 21.448 2.135 ( 20.031 10.235 7.291) 23.646 2.721 ( -17.352 -1.853 1.543) 17.519 3.046 ( -4.134 -4.539 -3.678) 7.157 3.354 ( -3.252 10.534 2.061) 11.215 3.593 ( 4.966 1.339 -7.896) 9.423 3.701 ( 3.385 2.019 11.015) 11.699 3.932 ( 16.138 -0.744 4.786) 16.849 4.372 ( -0.840 2.834 11.229) 11.611 4.670 ( 0.001 -1.294 -0.843) 1.545 4.879 ( 0.497 0.774 6.065) 6.134 5.149 ( 2.853 5.531 -0.110) 6.225 5.345 ( 0.817 13.000 -4.225) 13.694 6.048 ( 4.859 -1.891 -8.156) 9.680 6.348 ( 0.049 -6.351 0.784) 6.400 6.564 ( 2.365 2.873 -5.666) 6.779 6.717 ( -7.820 11.447 -0.268) 13.866 7.479 ( 7.600 11.755 3.297) 14.381 7.911 ( -2.077 10.624 3.077) 11.254 8.441 ( -11.440 1.209 -0.421) 11.511 8.571 ( -6.335 4.060 -3.722) 8.394 8.832 ( -15.299 1.058 15.204) 21.595 9.655 ( 13.066 -12.989 16.428) 24.684 9.935 ( -6.767 -0.815 3.120) 7.495 10.390 ( 12.417 -6.108 -3.936) 14.387 10.575 ( 1.088 -0.072 -20.942) 20.970 10.980 ( -13.779 3.157 2.742) 14.400 11.381 ( 10.473 1.197 -9.394) 14.120 11.520 ( -0.362 -1.998 0.599) 2.117 11.660 ( 2.797 2.168 -3.613) 5.057 11.933 ( 7.082 -4.563 7.012) 10.961 12.042 ( 0.024 -2.882 3.210) 4.314 12.144 ( -5.564 5.119 4.887) 9.002 12.464 ( -10.791 -9.171 -7.973) 16.252 12.775 ( 2.770 -4.044 -0.134) 4.904 13.155 ( 0.179 9.491 2.979) 9.949 13.344 ( -1.082 -6.961 -4.449) 8.332 13.742 ( 0.847 -3.834 -4.616) 6.060 14.464 ( -3.239 -29.409 4.069) 29.865 15.363 ( 4.062 -13.170 -1.722) 13.890 15.589 ( -0.617 5.905 0.713) 5.980 15.842 ( -3.204 0.926 -2.434) 4.129 15.971 ( -1.328 1.416 1.194) 2.280 16.341 ( -2.547 -2.142 -2.417) 4.113 17.449 ( 13.302 10.555 16.378) 23.592 18.581 ( -9.647 -3.424 -7.842) 12.896 18.915 ( 3.346 10.244 -9.879) 14.620 20.390 ( -8.938 -4.740 -1.287) 10.199 ======================= 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| 2.119 ( 8.514 1.595 8.713) 12.287 2.310 ( -25.697 -1.490 -3.088) 25.924 2.529 ( 15.053 6.314 0.954) 16.352 2.813 ( -11.674 1.561 -5.551) 13.021 3.274 ( -4.717 9.988 3.325) 11.536 3.712 ( 14.186 1.660 -13.067) 19.359 3.752 ( -4.100 1.537 8.149) 9.251 4.173 ( 1.514 -2.172 -1.877) 3.246 4.365 ( -7.760 4.093 1.909) 8.978 4.597 ( -2.904 0.581 -5.824) 6.534 4.901 ( -3.281 -2.852 3.573) 5.627 5.181 ( 2.064 3.629 -3.916) 5.724 5.328 ( 1.540 14.917 -2.156) 15.151 6.051 ( 5.157 -2.136 -9.131) 10.702 6.297 ( -2.429 -5.136 -6.399) 8.557 6.534 ( 4.434 5.781 -3.685) 8.164 6.744 ( 2.859 7.256 8.507) 11.541 7.606 ( 1.315 10.965 2.547) 11.334 7.901 ( -2.291 10.055 2.289) 10.563 8.288 ( -5.647 -1.546 2.702) 6.448 8.472 ( -0.129 5.348 -2.029) 5.721 8.771 ( -9.479 1.659 17.366) 19.854 9.692 ( -10.251 -4.962 -4.514) 12.250 9.888 ( -5.812 -4.753 -8.125) 11.063 10.387 ( 9.571 -6.916 6.257) 13.364 10.651 ( -4.874 -6.615 6.599) 10.539 11.017 ( 17.958 9.601 -0.366) 20.367 11.419 ( -1.335 0.669 -2.268) 2.716 11.509 ( 3.030 -3.278 -3.999) 5.993 11.709 ( 6.036 1.510 -2.329) 6.644 12.001 ( -5.540 -6.125 -4.661) 9.483 12.058 ( -7.279 7.439 3.105) 10.861 12.113 ( -0.791 -2.153 0.578) 2.365 12.284 ( 3.983 -6.371 3.177) 8.158 12.790 ( -0.049 -6.596 -2.430) 7.030 13.150 ( -2.469 7.296 0.483) 7.718 13.371 ( 3.662 -6.695 4.574) 8.897 13.739 ( 2.470 -2.658 -1.387) 3.884 14.464 ( -2.250 -29.579 5.479) 30.166 15.414 ( 2.824 -12.558 -0.317) 12.876 15.576 ( -0.444 7.329 -0.454) 7.357 15.818 ( -0.123 -0.452 3.548) 3.578 15.977 ( -0.139 2.115 2.312) 3.137 16.312 ( 0.572 -1.722 0.656) 1.930 17.618 ( -6.691 9.560 -4.784) 12.612 18.431 ( 1.941 -0.896 3.952) 4.493 18.886 ( 6.152 9.151 -15.290) 18.851 20.208 ( -6.502 -4.348 -6.695) 10.296 ======================= 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| 1.766 ( -27.388 -0.249 -6.073) 28.055 2.260 ( -10.869 4.417 -8.179) 14.302 2.375 ( -0.444 2.916 1.046) 3.130 2.961 ( 17.568 2.992 -0.271) 17.823 3.229 ( -4.045 9.290 -0.191) 10.134 3.715 ( -6.831 1.306 3.234) 7.670 3.751 ( 2.008 0.423 -14.237) 14.384 3.943 ( -13.772 6.233 -12.777) 19.793 4.114 ( -17.783 3.214 1.089) 18.104 4.533 ( 2.295 2.323 -6.031) 6.858 4.854 ( -2.787 -4.923 -1.542) 5.864 5.140 ( -1.513 1.788 -3.886) 4.537 5.358 ( 3.700 12.895 -1.982) 13.561 6.052 ( 5.526 -0.500 -9.907) 11.356 6.202 ( -1.069 -5.500 -4.659) 7.287 6.589 ( 5.242 3.742 -4.406) 7.803 6.980 ( 8.764 4.965 14.742) 17.855 7.553 ( -6.922 6.706 -1.215) 9.714 7.885 ( -0.415 11.062 0.378) 11.076 8.290 ( 1.571 -2.065 4.363) 5.076 8.522 ( 4.189 5.551 0.940) 7.017 8.825 ( -4.635 1.453 17.062) 17.740 9.307 ( -13.044 -6.205 -17.895) 22.998 9.816 ( -1.376 1.091 4.364) 4.704 10.529 ( 4.507 -4.614 -2.970) 7.101 10.747 ( 2.999 -10.058 11.078) 15.260 11.295 ( -0.219 11.807 6.341) 13.404 11.367 ( 5.550 -8.918 -6.060) 12.127 11.519 ( 0.018 -1.671 -0.364) 1.710 11.751 ( 0.279 2.686 -6.897) 7.407 11.870 ( 1.716 -2.116 1.002) 2.902 11.968 ( -3.726 3.401 1.902) 5.392 12.112 ( 0.018 5.348 4.118) 6.750 12.470 ( 7.050 -11.968 3.181) 14.249 12.749 ( -0.005 -5.015 -2.791) 5.739 13.100 ( -3.561 7.222 0.562) 8.072 13.515 ( 5.004 -8.307 6.556) 11.706 13.813 ( 4.270 0.313 3.700) 5.659 14.488 ( -1.729 -29.370 6.047) 30.036 15.438 ( -0.794 -19.207 -1.059) 19.253 15.587 ( 0.944 14.282 3.104) 14.646 15.901 ( 4.055 0.096 5.094) 6.512 16.016 ( 0.492 3.488 5.164) 6.251 16.370 ( 3.285 -1.552 3.065) 4.753 17.214 ( -18.994 10.605 -17.696) 28.042 18.652 ( 9.740 -0.813 9.047) 13.318 18.812 ( 5.981 10.978 -20.850) 24.311 20.016 ( -2.920 -3.211 -14.565) 15.198 ======================= 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| 1.244 ( -23.919 2.095 -2.046) 24.097 1.781 ( -23.658 12.201 -8.269) 27.874 2.535 ( 8.638 0.458 -1.257) 8.741 2.922 ( -26.601 14.564 -12.222) 32.697 3.200 ( 5.169 -2.621 -2.237) 6.212 3.453 ( -8.484 3.690 -3.980) 10.072 3.598 ( -4.867 3.515 -4.023) 7.227 3.737 ( -1.922 5.942 -12.444) 13.923 3.857 ( -4.918 4.171 -1.216) 6.562 4.529 ( 0.889 1.174 -1.216) 1.909 4.751 ( -5.831 -0.422 -3.774) 6.958 5.078 ( -1.724 -1.276 -1.839) 2.826 5.430 ( 5.516 8.164 0.351) 9.859 6.075 ( 7.406 -0.163 -7.755) 10.724 6.145 ( -0.405 -4.572 -4.896) 6.712 6.635 ( 1.802 1.296 -0.024) 2.219 7.280 ( 4.383 2.834 14.705) 15.604 7.378 ( -7.681 4.085 -2.053) 8.939 7.900 ( 2.860 12.163 -1.869) 12.633 8.428 ( 7.017 -3.385 0.578) 7.812 8.538 ( 2.953 4.835 -8.045) 9.840 8.881 ( -7.194 -2.733 12.843) 14.972 9.037 ( -4.314 -1.261 0.583) 4.532 9.877 ( 5.166 -0.909 0.486) 5.268 10.652 ( 16.112 -7.056 -7.692) 19.198 10.837 ( -4.899 -6.962 12.625) 15.227 11.244 ( -6.552 3.989 3.094) 8.271 11.333 ( -2.148 -6.367 -3.353) 7.510 11.541 ( -0.898 2.825 -0.709) 3.048 11.740 ( 0.402 1.127 0.579) 1.329 11.897 ( 0.940 4.745 -1.144) 4.971 11.978 ( 2.310 -0.799 2.445) 3.458 12.238 ( 2.124 3.618 13.165) 13.817 12.557 ( 2.868 -12.194 -1.665) 12.637 12.789 ( 4.155 -5.502 2.279) 7.262 13.034 ( -2.198 5.875 -1.702) 6.500 13.672 ( 4.979 -8.445 5.986) 11.487 13.955 ( 4.011 2.798 8.481) 9.790 14.513 ( -2.095 -27.913 4.892) 28.415 15.317 ( -9.346 -22.172 -6.241) 24.857 15.691 ( 3.540 18.686 9.296) 21.169 15.999 ( 0.365 7.422 2.247) 7.763 16.144 ( 6.012 0.578 9.550) 11.299 16.471 ( 3.568 -1.496 2.886) 4.827 16.706 ( -14.937 10.288 -15.416) 23.804 18.664 ( 4.783 14.314 -24.755) 28.993 18.905 ( 9.341 -0.513 2.902) 9.795 19.795 ( 0.133 -0.243 -24.697) 24.699 ======================= 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| 0.885 ( -17.946 7.716 6.762) 20.672 1.281 ( -23.828 16.396 -4.441) 29.263 2.098 ( -37.054 26.977 -11.003) 47.136 2.699 ( 1.467 -0.944 1.354) 2.209 3.065 ( -13.914 -5.350 -0.302) 14.911 3.397 ( 1.323 9.446 -1.894) 9.724 3.459 ( -4.105 1.239 -2.568) 4.998 3.601 ( 1.335 6.833 -9.225) 11.558 3.970 ( 14.430 4.358 -3.131) 15.395 4.537 ( -1.719 -1.452 3.494) 4.156 4.586 ( -7.232 1.881 -2.606) 7.914 5.039 ( -1.128 -2.222 -0.486) 2.539 5.556 ( 4.556 2.606 4.365) 6.827 6.083 ( -0.223 -3.543 -5.358) 6.428 6.157 ( 7.756 -0.234 -4.844) 9.148 6.632 ( -5.431 0.593 5.295) 7.608 7.164 ( -7.712 0.058 -3.563) 8.495 7.509 ( 0.576 4.332 13.640) 14.323 7.957 ( 5.578 12.485 -1.346) 13.740 8.268 ( -4.261 3.022 -15.891) 16.728 8.817 ( 19.118 -1.821 3.103) 19.454 8.893 ( -6.802 -6.850 12.075) 15.460 8.986 ( -2.165 -2.453 0.451) 3.303 10.023 ( 14.275 -2.325 -6.621) 15.907 10.894 ( -3.789 -7.484 17.659) 19.551 10.939 ( 19.998 -8.311 -10.237) 23.954 11.140 ( -10.133 -1.866 7.146) 12.539 11.274 ( -3.185 -1.918 -3.394) 5.034 11.442 ( -3.301 2.546 -3.457) 5.416 11.712 ( -13.055 -12.619 19.266) 26.473 11.952 ( 6.666 7.745 -4.369) 11.114 12.081 ( 4.913 0.606 3.467) 6.043 12.386 ( 1.769 1.416 10.674) 10.912 12.592 ( -0.248 -12.932 2.716) 13.216 12.799 ( -1.842 -8.433 -7.900) 11.701 13.101 ( 8.421 6.478 6.350) 12.378 13.813 ( 3.360 -6.499 6.507) 9.791 14.110 ( 2.176 2.181 9.690) 10.168 14.486 ( -5.027 -23.784 1.580) 24.361 14.944 ( -20.695 -15.286 -12.229) 28.487 15.914 ( 7.137 17.979 16.227) 25.248 15.958 ( -5.249 17.618 -0.158) 18.384 16.335 ( 3.306 -1.586 1.753) 4.064 16.436 ( 0.518 2.141 -0.255) 2.218 16.571 ( 1.549 -3.373 0.872) 3.813 18.518 ( 14.123 31.840 -32.616) 47.719 19.037 ( 4.920 -4.048 -5.480) 8.404 19.513 ( 0.285 7.141 -29.829) 30.673 ======================= 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| 0.726 ( -10.320 17.993 12.444) 24.189 0.831 ( -20.332 20.327 3.587) 28.974 1.523 ( -22.664 41.901 14.286) 49.734 2.681 ( -6.212 -4.543 4.901) 9.124 2.828 ( -9.149 -1.336 0.543) 9.261 3.402 ( 0.915 2.444 1.826) 3.185 3.441 ( 1.036 11.136 0.255) 11.187 3.631 ( 7.580 2.752 -2.409) 8.416 4.177 ( 10.544 2.947 -4.777) 11.946 4.458 ( -2.436 1.317 -1.131) 2.992 4.554 ( -4.022 -3.896 7.625) 9.460 5.037 ( 0.271 -2.503 1.835) 3.115 5.633 ( -1.378 0.907 3.622) 3.980 6.043 ( 0.429 -7.531 -3.838) 8.464 6.229 ( 3.216 0.297 -2.805) 4.278 6.556 ( -8.413 1.071 6.450) 10.655 7.041 ( -2.332 -0.989 -1.527) 2.958 7.595 ( -3.952 5.126 9.445) 11.450 8.065 ( -0.404 -4.640 -5.829) 7.461 8.095 ( 5.244 19.121 -0.019) 19.827 8.697 ( -13.905 -1.909 -5.352) 15.021 8.924 ( -3.953 -1.592 6.203) 7.526 9.360 ( 29.092 -12.587 -0.845) 31.710 10.232 ( 13.009 -4.643 -5.544) 14.884 10.826 ( -14.109 6.569 -9.565) 18.268 10.854 ( -15.892 -12.437 -5.280) 20.859 11.161 ( 0.558 -15.263 5.685) 16.297 11.289 ( -0.208 -11.183 10.331) 15.226 11.423 ( -3.556 -2.352 3.988) 5.838 11.583 ( -19.765 -23.239 10.549) 32.280 11.988 ( 0.190 7.320 -1.113) 7.407 12.227 ( 5.848 1.420 4.833) 7.718 12.445 ( -3.386 -7.122 -4.485) 9.072 12.631 ( 7.736 -9.111 2.464) 12.204 12.752 ( 3.492 -6.237 0.981) 7.215 13.335 ( 7.110 3.983 1.417) 8.272 13.880 ( -5.491 -7.862 2.156) 9.829 14.200 ( 2.571 -2.738 2.532) 4.529 14.332 ( -19.129 -6.211 0.145) 20.112 14.519 ( -6.228 -3.299 7.211) 10.083 15.866 ( -3.135 18.326 -0.530) 18.600 16.198 ( 0.631 0.373 4.928) 4.982 16.350 ( 0.715 -0.049 1.392) 1.566 16.488 ( 0.457 -3.714 0.070) 3.742 16.576 ( 1.121 -0.031 0.030) 1.121 18.814 ( 64.973 72.985 -36.244) 104.221 18.886 ( -5.764 -9.031 -8.901) 13.928 19.334 ( 0.184 8.740 -3.863) 9.557 ======================= 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| 1.250 ( 6.460 21.041 12.202) 25.166 1.316 ( 3.515 22.821 12.590) 26.300 2.357 ( 2.301 27.759 15.410) 31.833 2.507 ( -1.807 -5.200 5.677) 7.907 2.764 ( -1.160 2.587 3.695) 4.658 3.481 ( 1.651 0.422 9.527) 9.679 3.746 ( 0.125 12.884 -2.643) 13.152 3.913 ( 6.040 11.325 0.215) 12.836 4.337 ( 1.641 4.563 -4.551) 6.650 4.385 ( -5.105 -7.451 7.784) 11.923 4.543 ( 3.381 5.343 4.196) 7.588 5.014 ( 0.558 -2.995 6.880) 7.525 5.654 ( -1.811 2.633 -2.385) 3.987 5.851 ( 2.790 -5.499 -3.711) 7.197 6.240 ( -1.894 1.816 1.150) 2.865 6.474 ( -6.081 -2.010 6.430) 9.075 7.119 ( 2.897 7.308 4.461) 9.039 7.703 ( -6.841 8.089 3.413) 11.130 7.909 ( 7.118 -7.959 8.514) 13.656 8.579 ( -8.586 14.426 -3.101) 17.072 8.783 ( 17.799 11.862 2.885) 21.583 8.834 ( -6.534 -1.481 7.435) 10.008 9.297 ( 7.139 -18.059 -2.367) 19.563 10.033 ( -19.231 3.897 -14.592) 24.453 10.160 ( -9.385 -2.077 -0.748) 9.641 10.869 ( 14.042 1.591 -8.643) 16.565 11.047 ( 2.632 -7.186 2.066) 7.926 11.192 ( 7.208 -7.248 4.351) 11.109 11.374 ( -2.250 -0.726 -1.476) 2.787 11.667 ( -0.950 6.090 3.669) 7.173 11.990 ( -3.774 -13.945 -7.097) 16.095 12.123 ( 1.147 -1.974 -0.345) 2.310 12.451 ( -1.887 0.748 2.525) 3.239 12.563 ( 2.012 9.097 0.353) 9.323 12.835 ( 1.406 1.913 4.789) 5.345 13.294 ( -5.552 0.484 -9.043) 10.623 13.553 ( -4.096 -9.808 -5.321) 11.887 13.964 ( -8.566 -7.044 -6.111) 12.662 14.187 ( -1.021 -6.267 0.277) 6.356 14.579 ( 3.242 -6.629 7.852) 10.775 16.047 ( -6.166 2.483 -7.937) 10.353 16.143 ( -3.032 8.013 -6.357) 10.668 16.413 ( -1.549 -3.731 -2.595) 4.801 16.517 ( -1.969 -1.727 -0.557) 2.677 16.635 ( 4.391 19.046 12.439) 23.168 18.562 ( -0.338 -11.810 -2.697) 12.119 19.480 ( -0.949 10.069 -3.286) 10.634 20.130 ( 26.726 -2.729 -2.651) 26.996 ======================= 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| 1.507 ( 5.323 21.125 16.004) 27.032 1.646 ( 13.020 18.230 14.443) 26.654 2.635 ( 11.745 -4.945 2.584) 13.003 2.680 ( 11.145 14.192 19.184) 26.337 2.820 ( 2.743 1.845 4.877) 5.892 3.603 ( -1.828 5.023 6.202) 8.188 3.729 ( -0.064 8.673 3.670) 9.418 3.971 ( -1.472 3.836 2.627) 4.877 4.261 ( -1.838 3.041 -1.599) 3.897 4.450 ( 3.076 -3.966 3.366) 6.043 4.705 ( 6.116 9.107 9.165) 14.295 5.105 ( 0.505 1.717 8.799) 8.979 5.595 ( 0.788 6.204 -4.053) 7.453 5.922 ( 6.679 -3.661 -3.568) 8.411 6.235 ( -1.020 0.423 2.818) 3.027 6.459 ( -0.218 -1.863 2.916) 3.467 7.248 ( 4.227 11.109 5.846) 13.246 7.580 ( -8.219 11.381 1.059) 14.078 8.252 ( 14.787 -9.336 14.505) 22.720 8.408 ( -6.448 21.428 -2.659) 22.534 8.793 ( -5.836 -7.242 6.184) 11.169 9.127 ( 7.951 11.872 7.141) 15.974 9.244 ( -13.309 -9.236 4.913) 16.929 9.652 ( 2.544 2.553 -17.620) 17.985 10.014 ( -0.693 -7.883 -8.236) 11.422 11.059 ( -1.655 -4.514 -1.606) 5.068 11.080 ( 11.605 0.238 -6.709) 13.407 11.289 ( -1.214 -8.102 1.421) 8.314 11.408 ( 6.244 -1.394 5.357) 8.344 11.620 ( -6.478 -2.290 0.242) 6.875 11.854 ( -1.848 -5.780 -5.891) 8.458 12.110 ( -1.151 0.968 -4.330) 4.584 12.320 ( -7.659 3.120 -1.307) 8.373 12.629 ( -3.394 7.803 4.575) 9.661 12.810 ( -3.467 -0.737 -2.454) 4.311 13.207 ( 2.825 3.756 0.523) 4.729 13.432 ( -2.363 -8.749 -7.949) 12.055 13.760 ( -3.762 -11.083 -11.316) 16.280 14.117 ( -6.367 -12.769 0.603) 14.281 14.721 ( 5.242 -14.653 4.161) 16.109 15.865 ( -4.352 5.266 -6.630) 9.520 16.060 ( -0.943 3.347 -4.463) 5.657 16.247 ( -8.089 -1.172 -8.261) 11.621 16.453 ( -2.564 -4.945 -3.538) 6.599 16.925 ( 9.403 20.940 17.505) 28.867 18.574 ( 3.202 -9.745 -1.823) 10.418 19.403 ( -4.066 11.618 -3.115) 12.697 20.405 ( 4.660 -10.791 1.169) 11.812 ======================= 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| 1.766 ( 2.147 16.747 20.509) 26.564 2.011 ( 14.575 16.503 9.170) 23.851 2.809 ( -3.077 -4.947 4.947) 7.643 2.896 ( 9.707 -6.033 -0.109) 11.429 3.228 ( 22.459 5.636 14.464) 27.301 3.548 ( -1.656 8.317 -1.698) 8.649 3.733 ( -5.509 3.295 2.808) 7.007 3.949 ( -3.843 2.620 1.932) 5.037 4.298 ( 3.777 4.418 5.515) 8.013 4.543 ( 4.011 -4.858 1.075) 6.391 4.910 ( 3.492 11.665 11.804) 16.959 5.205 ( 1.128 5.883 7.565) 9.650 5.608 ( 4.278 11.741 -3.680) 13.026 5.990 ( 5.982 -1.739 -5.841) 8.539 6.236 ( -2.685 -3.191 4.047) 5.811 6.526 ( 5.417 -1.337 -1.003) 5.669 7.231 ( -9.686 16.153 -2.113) 18.953 7.581 ( 6.213 14.417 6.305) 16.917 8.278 ( -6.015 19.284 -0.399) 20.204 8.578 ( -3.206 -5.854 13.219) 14.809 8.793 ( 2.637 -4.272 1.778) 5.326 9.024 ( -12.399 -4.682 6.873) 14.930 9.084 ( -7.898 9.468 3.952) 12.947 9.876 ( 25.610 -5.683 -5.982) 26.906 9.953 ( -0.187 -7.409 -3.368) 8.141 10.873 ( -8.542 -6.062 -16.985) 19.956 11.106 ( -1.227 -3.517 -1.951) 4.205 11.330 ( -6.752 -10.736 9.084) 15.600 11.429 ( 0.360 1.392 -2.009) 2.471 11.618 ( 5.518 -2.031 1.295) 6.021 11.847 ( 5.769 -1.797 -3.443) 6.954 12.002 ( -2.364 8.621 -5.910) 10.716 12.256 ( -2.737 1.454 4.290) 5.292 12.482 ( -8.178 -4.231 -5.225) 10.587 12.771 ( -1.766 2.268 -0.185) 2.881 13.279 ( 0.549 3.790 1.415) 4.083 13.311 ( -2.178 -5.341 -6.546) 8.724 13.614 ( 0.829 -15.952 -10.091) 18.894 14.011 ( -6.790 -14.350 3.957) 16.361 14.841 ( 5.170 -21.839 0.288) 22.445 15.761 ( -1.694 5.289 -3.224) 6.421 16.002 ( -4.354 -2.294 -2.213) 5.396 16.025 ( -3.845 3.200 -7.122) 8.703 16.359 ( -3.095 -4.745 -4.154) 7.024 17.310 ( 12.352 17.996 18.063) 28.332 18.596 ( 1.133 -8.579 -3.986) 9.528 19.276 ( -4.625 13.410 -5.213) 15.113 20.386 ( -6.047 -10.221 0.656) 11.894 ======================= 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| 1.993 ( 1.418 10.138 17.649) 20.403 2.373 ( 17.011 11.776 4.334) 21.139 2.666 ( -17.250 -3.604 4.163) 18.108 2.960 ( -0.949 -4.111 -4.357) 6.065 3.562 ( 5.145 8.126 -0.700) 9.643 3.639 ( -0.999 3.823 -1.600) 4.263 3.743 ( 11.717 1.823 5.272) 12.978 3.920 ( 5.188 -0.377 1.026) 5.302 4.425 ( 1.991 2.086 5.122) 5.878 4.595 ( 2.333 -4.231 -2.812) 5.590 5.027 ( -5.243 11.125 12.207) 17.328 5.281 ( 0.697 6.706 2.880) 7.331 5.647 ( 3.672 15.765 -3.756) 16.617 6.022 ( 5.272 -0.222 -7.877) 9.481 6.232 ( -0.622 -4.406 0.894) 4.539 6.593 ( 4.700 -0.563 -5.056) 6.926 7.020 ( -8.445 17.621 -1.051) 19.568 7.795 ( 7.700 17.887 6.427) 20.507 8.187 ( -6.201 13.936 4.223) 15.827 8.475 ( -11.488 0.470 2.992) 11.880 8.683 ( -4.714 8.660 -9.280) 13.540 8.858 ( -12.704 1.248 10.728) 16.675 9.333 ( 12.511 -16.522 12.547) 24.227 9.914 ( -3.416 -1.393 2.210) 4.300 10.236 ( 9.827 -8.818 1.745) 13.318 10.500 ( -5.297 -7.093 -18.257) 20.290 11.043 ( -3.219 1.200 0.939) 3.562 11.290 ( -0.653 -9.678 3.711) 10.386 11.500 ( 4.124 0.554 -0.404) 4.181 11.725 ( 7.587 2.189 -4.726) 9.203 11.887 ( 2.571 1.110 -4.902) 5.646 11.983 ( 1.365 0.072 3.387) 3.653 12.222 ( -7.262 -7.330 1.517) 10.429 12.313 ( -3.093 3.949 -2.708) 5.701 12.714 ( -2.052 -3.321 -3.227) 5.065 13.224 ( -1.755 -3.744 -3.818) 5.628 13.261 ( -0.887 -2.248 0.805) 2.547 13.588 ( 3.645 -9.351 -5.479) 11.434 13.961 ( -5.894 -15.058 8.219) 18.139 14.915 ( 3.677 -25.225 -1.231) 25.521 15.732 ( 0.013 4.732 0.047) 4.732 15.861 ( -4.339 0.732 -1.787) 4.749 15.987 ( 0.151 0.534 -1.185) 1.309 16.275 ( -1.912 -4.171 -2.326) 5.144 17.705 ( 11.264 13.391 14.162) 22.512 18.498 ( -5.750 -4.830 -6.350) 9.834 19.164 ( 0.521 13.334 -8.370) 15.752 20.244 ( -7.877 -9.381 -2.102) 12.428 ======================= 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| 2.171 ( 3.224 3.258 9.157) 10.240 2.291 ( -23.570 -0.272 -1.775) 23.638 2.672 ( 8.800 6.630 -3.249) 11.487 2.845 ( -1.364 1.480 -3.027) 3.635 3.499 ( -7.264 10.451 5.492) 13.862 3.764 ( 12.904 3.351 -10.784) 17.147 3.794 ( -2.365 2.578 3.035) 4.631 4.119 ( 3.947 -3.150 1.053) 5.159 4.449 ( -0.637 3.534 -3.444) 4.976 4.575 ( 1.306 -2.190 -6.097) 6.608 4.947 ( -12.200 6.118 5.575) 14.743 5.272 ( -2.924 4.460 -0.593) 5.366 5.663 ( 2.697 17.141 -4.325) 17.883 6.029 ( 5.258 0.375 -8.936) 10.375 6.204 ( -0.745 -2.912 -5.404) 6.184 6.615 ( 5.077 0.768 -7.186) 8.832 6.967 ( 0.240 14.678 6.555) 16.077 7.912 ( -0.846 17.780 -0.912) 17.824 8.116 ( -6.253 6.905 6.713) 11.482 8.313 ( -4.401 4.362 -4.635) 7.738 8.591 ( 0.669 7.128 0.843) 7.209 8.819 ( -5.214 3.977 14.049) 15.504 9.444 ( -6.749 -16.726 -9.223) 20.257 9.873 ( -4.470 2.098 4.455) 6.650 10.259 ( 6.967 -6.814 3.338) 10.301 10.474 ( -3.000 -10.059 5.707) 11.948 11.110 ( 9.202 -1.811 -1.166) 9.451 11.330 ( -0.256 -10.052 3.223) 10.560 11.519 ( 0.891 5.756 -2.471) 6.327 11.789 ( 8.371 5.198 -8.651) 13.112 11.885 ( -3.698 -2.736 -2.573) 5.271 12.038 ( 3.280 -3.096 2.881) 5.352 12.120 ( -2.677 -7.073 2.717) 8.036 12.283 ( -1.322 10.034 2.022) 10.321 12.650 ( -0.649 -7.538 -3.810) 8.471 13.192 ( 0.282 -3.429 0.227) 3.448 13.295 ( 1.220 -2.308 4.623) 5.309 13.617 ( 4.785 -8.488 -3.266) 10.276 13.944 ( -5.930 -16.323 9.602) 19.844 14.955 ( 1.963 -25.946 -1.007) 26.040 15.751 ( 0.628 5.377 2.213) 5.849 15.824 ( -0.286 0.677 2.707) 2.805 16.001 ( 1.253 0.815 1.816) 2.352 16.258 ( 0.817 -3.566 1.074) 3.813 17.852 ( -6.069 12.205 -4.532) 14.364 18.409 ( 3.027 -1.427 4.670) 5.746 19.115 ( 4.663 12.335 -11.884) 17.752 20.076 ( -5.368 -8.432 -6.664) 12.014 ======================= 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| 1.812 ( -23.025 4.734 -5.941) 24.246 2.316 ( 7.139 -0.856 0.628) 7.217 2.466 ( -14.053 7.222 -8.140) 17.774 3.012 ( 10.442 0.991 0.084) 10.489 3.455 ( -3.125 11.170 3.579) 12.138 3.759 ( -1.819 2.817 -1.844) 3.826 3.786 ( -1.982 3.325 -10.061) 10.779 4.023 ( -10.154 1.179 -2.065) 10.428 4.257 ( -12.333 9.540 -8.236) 17.634 4.572 ( 4.363 0.829 -7.005) 8.294 4.808 ( -4.638 1.088 1.073) 4.884 5.180 ( -4.457 1.282 -3.394) 5.747 5.654 ( 2.044 15.499 -5.883) 16.704 6.049 ( 5.792 0.347 -7.177) 9.229 6.115 ( -0.512 -1.829 -7.340) 7.581 6.614 ( 3.718 -1.957 -8.302) 9.305 7.147 ( 7.219 11.050 11.868) 17.750 7.746 ( -9.394 11.617 -6.968) 16.485 8.156 ( 0.982 11.304 7.075) 13.372 8.230 ( 1.732 -2.057 -5.359) 5.996 8.632 ( -2.671 4.048 4.796) 6.820 8.950 ( 3.308 12.723 12.134) 17.890 9.097 ( -12.182 -14.061 -13.292) 22.865 9.849 ( -3.376 2.272 5.018) 6.461 10.401 ( 2.014 -8.088 -3.522) 9.048 10.569 ( 6.146 -7.924 13.420) 16.753 11.155 ( -0.988 -9.909 -4.937) 11.114 11.384 ( -1.584 -8.276 11.428) 14.198 11.547 ( 0.602 7.791 -1.260) 7.916 11.777 ( 1.000 1.394 -4.356) 4.681 11.863 ( 5.538 1.989 -4.458) 7.382 12.047 ( -5.057 0.894 2.961) 5.928 12.195 ( 5.260 -3.505 3.439) 7.196 12.325 ( 3.200 7.216 2.741) 8.356 12.625 ( 1.877 -6.761 -2.515) 7.454 13.204 ( -0.870 1.757 0.060) 1.961 13.381 ( 3.145 -4.062 4.429) 6.783 13.717 ( 6.904 -14.804 2.749) 16.564 13.955 ( -3.810 -14.777 10.968) 18.792 14.956 ( -0.898 -24.857 -1.638) 24.927 15.804 ( 1.327 5.667 5.122) 7.753 15.895 ( 3.331 -0.469 5.261) 6.244 16.075 ( 2.704 2.567 5.847) 6.935 16.320 ( 2.995 -3.276 3.540) 5.678 17.506 ( -16.072 16.955 -14.536) 27.515 18.607 ( 6.477 -4.116 8.199) 11.229 19.081 ( 6.818 13.990 -14.720) 21.422 19.920 ( -0.678 -6.035 -13.140) 14.475 ======================= 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| 1.395 ( -14.820 11.971 -5.226) 19.755 2.066 ( -18.314 14.865 -7.687) 24.808 2.480 ( 8.501 -5.918 -1.828) 10.518 3.071 ( -6.095 -5.266 0.186) 8.057 3.320 ( -19.665 16.003 -7.371) 26.404 3.565 ( 0.555 7.149 -3.195) 7.850 3.702 ( -3.683 6.705 -4.384) 8.817 3.812 ( -7.976 1.542 -3.297) 8.767 4.040 ( 1.709 12.129 -9.004) 15.203 4.556 ( -0.571 0.992 -2.368) 2.631 4.759 ( -3.029 1.834 -1.134) 3.718 5.057 ( -4.489 -1.369 -3.449) 5.824 5.633 ( 2.249 11.310 -5.221) 12.658 6.066 ( 2.538 -1.678 -5.788) 6.539 6.082 ( 4.245 0.274 -4.694) 6.335 6.606 ( 2.172 -4.657 -3.845) 6.418 7.371 ( 0.271 6.014 7.218) 9.399 7.520 ( -4.497 9.480 -2.229) 10.727 8.170 ( 2.915 8.005 -9.266) 12.587 8.353 ( 6.717 -0.027 7.994) 10.442 8.544 ( -3.587 -4.869 -6.097) 8.587 8.834 ( -8.760 -4.583 2.298) 10.150 9.123 ( 1.871 14.207 6.368) 15.681 9.864 ( 1.724 -0.029 2.166) 2.768 10.426 ( 6.158 -13.092 -3.817) 14.963 10.770 ( 2.413 -2.453 9.877) 10.459 11.120 ( 1.470 -7.059 -0.143) 7.212 11.370 ( -11.118 1.459 3.394) 11.716 11.548 ( 2.712 -3.332 3.611) 5.612 11.732 ( -8.172 -1.209 -1.952) 8.488 11.888 ( 1.592 -2.396 -0.188) 2.883 12.030 ( 3.086 0.148 -1.426) 3.403 12.350 ( 4.441 3.487 9.026) 10.646 12.397 ( 3.437 4.671 -3.084) 6.569 12.693 ( 4.922 -2.762 2.956) 6.371 13.141 ( -1.237 4.279 -4.808) 6.554 13.511 ( 4.868 -7.336 6.039) 10.676 13.911 ( 6.910 -19.308 8.607) 22.240 14.024 ( -0.853 -6.718 9.980) 12.061 14.868 ( -5.628 -20.821 -4.664) 22.067 15.903 ( 2.342 4.050 7.447) 8.795 16.039 ( 5.386 -1.369 6.570) 8.606 16.219 ( 4.241 4.154 9.617) 11.302 16.417 ( 3.110 -3.427 3.514) 5.811 17.061 ( -15.488 23.102 -14.115) 31.189 18.721 ( -0.821 -7.972 3.333) 8.679 19.100 ( 12.264 16.313 -14.631) 25.111 19.781 ( 4.185 -1.326 -20.653) 21.114 ======================= 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| 1.196 ( -4.624 20.023 0.212) 20.551 1.649 ( -20.251 18.699 -4.853) 27.988 2.489 ( -7.872 0.341 -4.354) 9.003 2.809 ( -17.072 11.651 1.741) 20.742 2.934 ( -11.237 -0.225 -2.240) 11.460 3.502 ( -6.777 3.142 -3.418) 8.215 3.662 ( 5.180 13.971 0.818) 14.922 3.738 ( 2.887 6.401 -6.448) 9.533 4.106 ( 11.368 8.572 -5.880) 15.404 4.515 ( -4.080 -0.530 2.685) 4.913 4.640 ( -6.910 3.318 -2.558) 8.081 4.972 ( -2.632 -4.107 -0.333) 4.889 5.636 ( 2.052 5.207 -2.027) 5.953 6.025 ( -1.258 -1.911 -4.817) 5.333 6.156 ( 6.929 0.413 -2.185) 7.277 6.595 ( -3.811 -4.595 3.535) 6.938 7.209 ( -8.459 4.893 -4.797) 10.886 7.629 ( 2.089 7.035 9.901) 12.325 8.071 ( -3.040 -5.497 -9.991) 11.802 8.406 ( 3.334 10.681 -6.016) 12.704 8.660 ( 5.324 -10.339 11.309) 16.222 8.784 ( 3.719 -4.434 2.168) 6.179 9.113 ( -5.652 16.439 -0.999) 17.412 9.974 ( 9.556 -1.846 -1.089) 9.793 10.550 ( 6.772 -17.703 3.031) 19.195 10.901 ( 1.856 -1.637 9.600) 9.914 11.098 ( -9.724 -0.768 -4.220) 10.628 11.234 ( -0.025 -3.554 1.673) 3.928 11.455 ( -15.287 -2.503 -4.085) 16.020 11.602 ( -0.880 1.670 1.000) 2.137 11.952 ( 3.965 -11.714 3.068) 12.742 12.094 ( 6.020 -0.793 -4.205) 7.386 12.387 ( 2.036 3.334 -5.883) 7.062 12.507 ( -1.478 6.545 14.170) 15.678 12.742 ( 0.792 2.826 -5.268) 6.030 13.199 ( 8.400 2.686 4.129) 9.737 13.657 ( 2.729 -8.701 7.676) 11.920 14.058 ( -0.946 -15.951 6.215) 17.145 14.147 ( 5.143 -1.784 7.251) 9.067 14.660 ( -9.737 -12.435 -7.185) 17.351 16.034 ( 3.267 1.902 7.705) 8.582 16.202 ( 4.191 -1.033 7.214) 8.407 16.391 ( 3.608 1.786 6.735) 7.846 16.487 ( 1.342 -2.508 2.081) 3.524 16.688 ( -11.640 26.190 -9.082) 30.065 18.695 ( -3.733 -10.728 2.325) 11.595 19.225 ( 18.168 17.658 -14.493) 29.188 19.656 ( 7.962 5.763 -24.950) 26.816 ======================= 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| 1.185 ( -1.310 24.289 4.663) 24.767 1.275 ( -14.598 21.418 2.636) 26.054 2.291 ( -8.068 22.810 6.283) 24.997 2.590 ( -12.138 -2.915 4.938) 13.424 2.794 ( -4.898 3.737 1.282) 6.293 3.418 ( -2.180 1.813 3.093) 4.195 3.744 ( 5.107 7.016 -5.929) 10.510 3.786 ( 5.960 17.309 0.926) 18.329 4.258 ( 9.660 4.895 -4.527) 11.738 4.456 ( -7.032 -2.193 5.772) 9.359 4.521 ( -3.449 2.238 -0.008) 4.111 4.957 ( -0.530 -5.005 3.422) 6.086 5.659 ( 1.108 1.455 0.291) 1.852 5.927 ( -2.962 -4.410 -6.223) 8.182 6.242 ( 1.988 1.155 0.774) 2.426 6.537 ( -8.041 -2.910 7.342) 11.271 7.079 ( -1.895 5.229 -0.477) 5.582 7.726 ( -1.589 6.978 8.151) 10.847 7.893 ( -6.492 -9.727 -3.890) 12.324 8.498 ( 11.197 12.863 -1.376) 17.109 8.712 ( -5.773 -6.090 7.238) 11.081 8.939 ( -9.310 14.337 -0.856) 17.116 9.066 ( 18.504 -11.557 -2.439) 21.952 10.152 ( 7.625 -2.580 0.690) 8.079 10.545 ( -18.130 -10.132 0.356) 20.772 10.892 ( -0.840 -3.164 -9.526) 10.072 10.998 ( 1.706 -3.800 -9.693) 10.551 11.062 ( -5.940 -5.802 10.559) 13.433 11.381 ( 2.259 -1.056 0.810) 2.622 11.616 ( 1.685 7.223 2.030) 7.689 12.048 ( 3.032 -19.903 0.344) 20.135 12.119 ( 1.242 0.255 -4.667) 4.836 12.393 ( 2.510 9.071 0.142) 9.413 12.561 ( -1.365 3.362 2.896) 4.642 12.744 ( 2.626 3.922 2.192) 5.204 13.371 ( 4.718 -0.656 -0.709) 4.816 13.695 ( -5.952 -9.687 1.488) 11.467 14.085 ( -1.929 -10.418 5.935) 12.144 14.224 ( -1.630 -1.745 -4.471) 5.069 14.482 ( -2.452 -3.028 3.583) 5.294 16.137 ( 1.036 1.085 0.706) 1.658 16.325 ( -1.338 1.594 3.606) 4.164 16.353 ( -3.071 2.917 -4.841) 6.432 16.508 ( -1.665 16.129 4.863) 16.929 16.561 ( 0.754 1.793 0.822) 2.112 18.634 ( -4.209 -14.828 -0.736) 15.432 19.481 ( 8.392 9.654 1.042) 12.834 19.644 ( 29.019 15.866 -25.329) 41.658 ======================= 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| 1.650 ( 5.344 17.574 8.711) 20.329 1.770 ( 3.975 20.243 7.002) 21.785 2.293 ( 0.481 -10.132 7.571) 12.658 2.491 ( 1.881 -9.058 7.496) 11.907 3.166 ( -2.209 24.253 3.485) 24.601 3.510 ( 1.714 1.794 7.322) 7.731 3.893 ( 4.568 2.707 -3.773) 6.514 4.080 ( -5.663 -1.320 1.285) 5.956 4.320 ( -4.768 6.062 1.686) 7.894 4.443 ( 3.379 3.904 -3.436) 6.201 4.676 ( 5.045 7.288 8.292) 12.138 4.940 ( 2.797 -4.438 10.284) 11.545 5.691 ( 0.937 1.129 -3.565) 3.856 5.762 ( 5.681 -3.168 -4.445) 7.878 6.281 ( -4.112 2.258 4.243) 6.325 6.411 ( -6.381 -3.701 7.166) 10.284 7.317 ( 4.158 11.050 7.374) 13.920 7.712 ( 4.487 -7.448 6.865) 11.079 7.932 ( -2.597 10.464 6.028) 12.352 8.506 ( -3.735 -14.086 8.651) 16.947 8.728 ( 7.272 0.636 0.446) 7.314 8.944 ( 8.471 -11.072 0.447) 13.948 9.472 ( -3.342 33.345 -5.901) 34.027 10.121 ( -10.720 -2.001 -1.733) 11.042 10.162 ( -11.011 7.753 -10.419) 17.027 10.819 ( 10.515 -4.586 -2.607) 11.764 10.892 ( 10.337 -7.739 -5.282) 13.951 11.012 ( 0.066 -13.412 1.703) 13.520 11.355 ( -1.130 -1.208 -1.877) 2.502 11.476 ( 0.210 -16.755 -5.908) 17.768 11.896 ( 0.903 7.513 3.669) 8.410 12.146 ( 2.238 -2.064 -0.028) 3.044 12.570 ( -6.140 11.338 -1.970) 13.044 12.808 ( 2.731 12.009 4.800) 13.217 12.925 ( 2.308 4.803 3.756) 6.519 13.271 ( -3.557 -2.621 -7.465) 8.674 13.336 ( -5.911 -9.400 -5.713) 12.487 13.692 ( -9.623 -15.806 -6.477) 19.606 14.182 ( -2.152 3.087 -5.389) 6.573 14.428 ( 0.677 -7.730 1.672) 7.937 16.083 ( -4.002 1.662 -4.860) 6.511 16.186 ( -4.213 -1.778 -4.906) 6.707 16.367 ( -0.679 -0.178 -3.222) 3.298 16.456 ( -3.052 -3.213 -4.112) 6.045 17.175 ( 2.901 29.186 10.447) 31.135 18.233 ( 0.090 -19.938 1.824) 20.021 19.687 ( 1.838 9.865 -2.986) 10.470 20.033 ( 12.905 -6.349 -1.736) 14.486 ======================= 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| 1.930 ( 6.581 19.089 10.687) 22.846 1.985 ( 12.800 14.787 11.291) 22.582 2.480 ( 11.120 -8.390 6.317) 15.295 2.615 ( 1.442 -9.946 8.580) 13.215 3.169 ( 0.942 18.990 4.325) 19.499 3.621 ( -0.690 -2.128 5.438) 5.880 3.908 ( -0.278 4.891 -1.401) 5.095 3.993 ( -3.046 -1.068 2.142) 3.874 4.299 ( 1.665 3.499 0.156) 3.879 4.442 ( -0.506 0.595 -0.774) 1.100 4.909 ( 7.438 9.846 13.127) 18.016 5.127 ( 3.838 -0.280 12.974) 13.532 5.723 ( 6.821 6.222 -2.982) 9.702 5.874 ( 8.826 -1.483 -3.681) 9.677 6.243 ( -4.577 0.864 3.840) 6.037 6.389 ( -1.469 -4.702 4.153) 6.443 7.520 ( 6.545 14.322 11.653) 19.590 7.809 ( -3.878 9.924 3.732) 11.290 8.077 ( 10.021 -6.525 14.722) 18.966 8.496 ( -6.770 -13.654 8.884) 17.640 8.813 ( -2.393 8.512 2.755) 9.261 9.055 ( -3.839 -7.542 6.032) 10.392 9.448 ( 11.535 19.049 -5.594) 22.961 9.809 ( -7.313 8.780 -15.419) 19.192 9.915 ( -5.452 1.214 -11.515) 12.798 10.883 ( -7.050 -17.769 -7.037) 20.370 11.019 ( 6.030 -5.494 -0.226) 8.161 11.044 ( 5.087 -10.113 2.773) 11.655 11.368 ( 2.906 -1.839 0.771) 3.524 11.435 ( 1.431 -7.670 -2.155) 8.094 11.920 ( -1.872 8.580 3.677) 9.521 12.169 ( 1.624 0.120 -2.081) 2.642 12.432 ( -5.522 9.858 -3.268) 11.762 12.788 ( -9.296 7.065 -7.935) 14.117 12.878 ( -5.527 2.699 -1.669) 6.373 13.174 ( 5.641 -5.606 -2.996) 8.498 13.305 ( -0.050 -3.397 -1.074) 3.563 13.412 ( -8.993 -16.906 -7.074) 20.413 14.051 ( -4.927 3.206 -6.154) 8.510 14.432 ( -0.036 -13.320 -1.613) 13.417 15.943 ( -4.329 3.052 -5.373) 7.545 16.061 ( -3.996 -2.103 -4.563) 6.419 16.245 ( -4.896 0.889 -8.483) 9.834 16.354 ( -2.664 -4.431 -4.983) 7.180 17.402 ( 7.621 24.250 13.149) 28.619 18.293 ( 3.398 -17.158 2.269) 17.638 19.658 ( -1.780 12.817 -3.028) 13.290 20.173 ( 2.455 -11.850 0.565) 12.115 ======================= 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| 2.114 ( -0.806 16.520 15.698) 22.803 2.323 ( 12.341 13.406 6.986) 19.514 2.670 ( -4.858 -8.818 8.100) 12.922 2.754 ( 10.692 -7.691 2.223) 13.357 3.358 ( 15.407 6.798 2.690) 17.053 3.590 ( 1.230 -2.656 -3.221) 4.352 3.864 ( -5.143 7.032 1.210) 8.795 3.986 ( -2.536 0.842 1.410) 3.022 4.361 ( 3.804 2.132 2.068) 4.826 4.465 ( 3.059 -2.811 1.177) 4.318 5.162 ( 2.654 11.099 15.286) 19.076 5.309 ( 1.514 3.467 11.637) 12.237 5.845 ( 8.796 10.170 -3.260) 13.836 5.977 ( 7.524 0.122 -5.529) 9.338 6.196 ( -3.776 0.299 3.358) 5.062 6.447 ( 4.437 -6.246 0.461) 7.675 7.606 ( -9.102 19.580 2.396) 21.724 7.887 ( 8.843 14.898 10.987) 20.515 8.370 ( -7.865 -11.135 14.269) 19.735 8.541 ( 11.690 -14.789 11.480) 22.071 8.694 ( -8.644 13.577 -0.782) 16.114 8.953 ( -11.795 -2.080 5.577) 13.212 9.450 ( -11.540 23.343 -9.859) 27.844 9.782 ( 19.457 -3.133 -7.169) 20.971 9.828 ( 6.847 -4.159 -5.806) 9.894 10.588 ( -10.900 -22.274 -15.690) 29.344 11.027 ( -2.464 -3.012 0.803) 3.974 11.135 ( -4.016 -7.278 8.469) 11.867 11.406 ( 3.779 -0.643 0.430) 3.857 11.547 ( 7.441 -4.698 1.803) 8.983 11.929 ( 1.096 8.085 -0.271) 8.164 12.157 ( 0.289 0.643 -4.351) 4.408 12.295 ( -7.750 9.085 -2.995) 12.312 12.499 ( -5.689 3.962 -10.220) 12.350 12.755 ( -4.572 -5.988 -6.441) 9.912 13.057 ( -5.768 -22.333 -12.111) 26.052 13.288 ( 0.962 4.535 3.070) 5.560 13.443 ( 2.288 0.225 7.709) 8.045 13.909 ( -4.567 1.747 -3.516) 6.022 14.408 ( 0.669 -19.709 -3.406) 20.013 15.838 ( -2.226 2.841 -3.357) 4.929 15.947 ( -4.292 -2.721 -2.844) 5.823 16.086 ( -2.893 2.883 -6.896) 8.014 16.254 ( -2.600 -5.227 -4.857) 7.594 17.691 ( 9.182 18.573 12.634) 24.267 18.369 ( 2.688 -13.349 0.360) 13.622 19.565 ( -3.807 14.435 -4.695) 15.649 20.144 ( -4.651 -13.057 -0.935) 13.893 ======================= 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| 2.213 ( -5.192 10.729 14.891) 19.074 2.565 ( -12.708 -4.316 5.773) 14.610 2.594 ( 9.832 7.558 4.283) 13.119 2.869 ( 2.784 -4.958 -3.007) 6.432 3.656 ( 16.269 2.922 -7.068) 17.977 3.734 ( 7.508 1.626 2.389) 8.045 3.786 ( 3.014 3.859 -0.199) 4.900 3.912 ( -4.140 -0.745 0.361) 4.222 4.458 ( 3.634 1.329 1.223) 4.058 4.527 ( 3.003 -2.420 -1.639) 4.190 5.249 ( -9.446 9.287 12.523) 18.229 5.392 ( -4.194 3.162 8.258) 9.786 5.950 ( 6.709 11.781 -4.502) 14.285 6.040 ( 7.256 1.713 -8.095) 11.005 6.195 ( 1.227 2.019 0.093) 2.365 6.526 ( 5.404 -6.083 -3.698) 8.938 7.423 ( -9.274 21.196 -0.500) 23.142 8.137 ( 0.170 7.608 7.932) 10.992 8.288 ( -5.065 -0.413 10.003) 11.220 8.540 ( -6.278 7.960 -2.603) 10.467 8.794 ( -8.441 -3.380 4.812) 10.287 8.926 ( 9.008 -3.312 7.831) 12.387 9.161 ( -5.911 13.386 -4.779) 15.393 9.877 ( 3.336 -2.739 -2.679) 5.080 10.052 ( 4.157 -8.164 3.029) 9.649 10.260 ( -3.622 -16.147 -11.429) 20.111 11.005 ( -1.011 -2.858 1.770) 3.511 11.111 ( -4.991 -6.616 6.907) 10.789 11.523 ( 7.401 1.981 0.466) 7.676 11.705 ( 8.703 -4.348 0.348) 9.735 11.919 ( 0.875 3.141 -6.619) 7.379 12.065 ( -6.515 -5.239 -2.744) 8.799 12.126 ( -1.870 11.227 -5.604) 12.686 12.429 ( 0.563 5.537 1.119) 5.677 12.595 ( -3.908 -8.288 -8.554) 12.536 12.917 ( -1.314 -20.039 -2.509) 20.238 13.317 ( -0.980 8.035 2.919) 8.605 13.528 ( 0.258 0.025 3.374) 3.384 13.826 ( -3.634 0.080 1.702) 4.014 14.400 ( 1.727 -23.865 -2.270) 24.035 15.794 ( -0.356 2.062 -0.741) 2.219 15.861 ( -2.886 -0.825 -0.503) 3.043 16.012 ( -0.136 2.181 -2.490) 3.313 16.177 ( -1.290 -5.104 -2.298) 5.744 17.972 ( 8.112 12.221 9.890) 17.691 18.375 ( -1.191 -7.231 -1.976) 7.590 19.448 ( -1.864 14.129 -6.892) 15.830 20.015 ( -6.221 -12.647 -3.510) 14.524 ======================= 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| 2.237 ( -4.386 2.872 7.575) 9.213 2.292 ( -18.700 -0.001 1.109) 18.732 2.780 ( 3.513 4.012 -4.627) 7.060 2.866 ( 4.356 0.198 0.021) 4.360 3.676 ( -5.773 6.944 4.186) 9.953 3.822 ( -0.415 1.136 -0.128) 1.216 3.862 ( 10.866 4.202 -8.203) 14.248 4.042 ( 8.180 -4.278 -0.895) 9.275 4.499 ( 2.852 1.475 -4.844) 5.811 4.538 ( 3.146 -1.156 -5.334) 6.299 5.095 ( -15.931 7.533 5.755) 18.538 5.318 ( -9.886 -0.879 4.036) 10.715 5.996 ( 4.315 13.547 -6.197) 15.510 6.071 ( 6.124 3.521 -10.362) 12.541 6.200 ( 1.366 2.887 -5.557) 6.410 6.556 ( 3.938 -6.322 -7.862) 10.830 7.325 ( -1.701 19.477 2.994) 19.779 8.059 ( -6.399 -10.417 2.373) 12.454 8.302 ( -8.246 17.152 -5.000) 19.678 8.443 ( 0.626 8.223 0.904) 8.296 8.690 ( -5.694 0.073 3.505) 6.687 9.036 ( 0.312 3.339 3.367) 4.752 9.126 ( -1.281 1.452 -2.025) 2.802 9.919 ( 1.571 -0.145 3.980) 4.281 10.056 ( 1.643 -11.723 7.749) 14.148 10.259 ( -1.203 -10.520 3.225) 11.069 11.013 ( 0.597 -4.784 -0.600) 4.858 11.117 ( -1.701 -8.710 5.156) 10.264 11.651 ( 6.575 5.484 -0.328) 8.569 11.836 ( 1.693 -3.474 -0.060) 3.865 11.887 ( 5.607 3.971 -6.355) 9.359 11.985 ( -0.058 -3.855 -0.825) 3.943 12.084 ( 0.992 6.927 1.501) 7.156 12.451 ( -1.016 1.302 -1.100) 1.984 12.493 ( 1.242 -2.901 -1.463) 3.479 12.932 ( 1.526 -18.162 4.349) 18.738 13.320 ( -1.461 5.884 2.340) 6.498 13.521 ( -2.429 -2.294 -1.348) 3.603 13.811 ( -1.321 1.402 5.203) 5.548 14.425 ( 2.039 -24.535 0.105) 24.620 15.807 ( 1.158 1.272 1.696) 2.416 15.838 ( -0.765 0.232 2.478) 2.604 16.027 ( 1.903 1.935 2.231) 3.513 16.172 ( 1.131 -4.517 1.641) 4.937 18.088 ( -3.755 10.236 -2.037) 11.091 18.363 ( 2.299 -3.343 4.258) 5.882 19.372 ( 2.504 12.589 -8.953) 15.650 19.871 ( -3.237 -11.181 -6.716) 13.439 ======================= 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| 1.944 ( -15.384 7.617 -4.808) 17.827 2.243 ( 1.179 -5.562 -0.007) 5.686 2.647 ( -8.416 9.607 -5.993) 14.108 2.976 ( 2.360 -4.549 0.725) 5.176 3.654 ( 0.256 8.130 1.893) 8.351 3.806 ( 0.280 1.206 -3.479) 3.693 3.880 ( -2.100 4.722 -5.918) 7.857 4.014 ( -8.164 -1.770 -1.588) 8.503 4.432 ( -3.372 6.726 -7.553) 10.661 4.570 ( 4.489 -0.844 -5.708) 7.311 4.886 ( -6.946 5.933 -0.137) 9.136 5.157 ( -8.111 -3.932 -1.557) 9.147 5.972 ( 1.833 14.585 -9.353) 17.423 6.079 ( 4.727 2.831 -6.601) 8.599 6.131 ( 0.124 2.525 -8.798) 9.154 6.508 ( 1.655 -8.135 -10.321) 13.245 7.412 ( 4.720 14.339 5.908) 16.211 8.008 ( -6.903 1.901 -4.343) 8.374 8.036 ( -2.959 0.649 -6.670) 7.326 8.461 ( 1.422 12.167 -0.249) 12.252 8.684 ( -6.255 0.305 -0.553) 6.287 8.760 ( -8.891 -17.092 -4.729) 19.839 9.343 ( 8.269 23.934 11.403) 27.772 9.915 ( -4.555 4.372 4.361) 7.673 10.205 ( -0.631 -10.721 -2.863) 11.114 10.342 ( 8.052 -15.865 14.376) 22.874 11.003 ( -0.884 -3.945 1.023) 4.170 11.163 ( -0.486 -10.431 8.886) 13.712 11.698 ( -5.706 6.171 -0.509) 8.420 11.829 ( 1.107 2.464 -0.486) 2.744 11.912 ( 3.646 2.457 -4.042) 5.972 11.960 ( -3.604 -4.164 -0.795) 5.564 12.242 ( 10.487 5.732 4.648) 12.823 12.486 ( 5.928 -5.704 -0.080) 8.227 12.528 ( 2.776 8.637 1.754) 9.240 13.075 ( 5.848 -17.288 11.068) 21.344 13.321 ( -1.083 -1.349 2.684) 3.193 13.412 ( -4.557 -4.754 -5.405) 8.519 13.895 ( 2.794 3.724 7.841) 9.119 14.465 ( 1.243 -22.117 1.207) 22.185 15.862 ( 1.569 1.169 3.857) 4.325 15.886 ( 2.081 -0.376 4.881) 5.320 16.122 ( 3.423 2.100 6.513) 7.652 16.244 ( 2.914 -3.898 4.356) 6.531 17.872 ( -11.233 17.914 -7.643) 22.483 18.468 ( 0.990 -9.602 5.137) 10.935 19.356 ( 6.470 12.410 -10.373) 17.420 19.773 ( 2.364 -8.147 -10.925) 13.831 ======================= 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| 1.691 ( -5.261 15.854 -5.947) 17.731 2.282 ( 2.877 -9.006 -3.518) 10.088 2.390 ( -11.532 12.395 -5.109) 17.684 2.908 ( -9.821 -9.952 -0.935) 14.013 3.566 ( -15.491 7.533 -6.811) 18.523 3.701 ( -1.657 3.062 -2.282) 4.163 3.821 ( -3.127 4.717 -1.684) 5.905 3.881 ( 3.078 5.722 -0.962) 6.568 4.284 ( -1.757 10.933 -6.869) 13.031 4.552 ( -2.299 -1.696 -0.811) 2.970 4.825 ( -1.063 3.945 -3.290) 5.245 5.003 ( -5.027 -3.958 -5.368) 8.352 5.886 ( -0.655 12.990 -9.702) 16.227 6.066 ( 1.589 1.431 -5.648) 6.040 6.106 ( 3.468 1.746 -3.543) 5.256 6.448 ( 2.074 -10.297 -6.403) 12.302 7.530 ( -0.642 9.592 1.151) 9.682 7.753 ( -5.007 12.752 -4.811) 14.520 8.051 ( 1.096 -12.002 -4.918) 13.017 8.336 ( -6.778 -11.656 -9.255) 16.354 8.572 ( 3.936 10.052 2.797) 11.152 8.753 ( -3.758 -2.108 4.995) 6.597 9.553 ( 4.762 25.101 4.751) 25.987 9.893 ( -0.849 3.527 2.947) 4.674 10.165 ( 1.943 -11.645 -3.817) 12.408 10.600 ( 6.889 -15.923 8.205) 19.192 11.041 ( 0.812 -0.583 6.661) 6.736 11.270 ( -2.374 -10.158 11.814) 15.761 11.525 ( -8.398 3.447 -1.146) 9.150 11.695 ( -12.694 -2.579 -1.491) 13.039 11.860 ( -3.401 0.473 -3.678) 5.032 11.990 ( 5.444 -2.327 -3.891) 7.085 12.471 ( 8.338 7.337 2.774) 11.448 12.550 ( 8.112 5.161 -6.641) 11.685 12.738 ( 7.928 8.151 12.675) 17.028 13.206 ( -1.684 2.250 -5.134) 5.853 13.369 ( 1.306 -7.424 4.788) 8.931 13.411 ( 7.098 -22.346 15.148) 27.914 14.040 ( 3.868 3.909 7.279) 9.123 14.478 ( -0.711 -16.882 -0.271) 16.899 15.946 ( 2.278 1.204 5.749) 6.300 16.003 ( 4.253 -1.768 6.202) 7.725 16.269 ( 3.941 1.284 8.137) 9.132 16.346 ( 2.917 -3.179 4.357) 6.131 17.576 ( -12.325 25.562 -7.034) 29.237 18.469 ( -4.784 -16.114 2.344) 16.972 19.402 ( 10.268 12.508 -10.577) 19.333 19.730 ( 7.151 -3.964 -15.218) 17.276 ======================= 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| 1.630 ( 2.089 21.142 -2.528) 21.395 2.025 ( -18.251 17.529 -3.846) 25.596 2.338 ( 1.215 -11.821 -3.372) 12.352 2.652 ( -14.719 -12.786 -0.958) 19.521 3.257 ( -10.883 13.731 -1.331) 17.571 3.530 ( -6.319 -1.401 -3.149) 7.198 3.896 ( -1.039 10.358 -0.081) 10.410 3.936 ( 9.410 10.508 0.048) 14.105 4.281 ( 7.447 7.360 -5.701) 11.922 4.493 ( -4.950 -2.480 2.865) 6.234 4.716 ( -6.292 3.859 -3.742) 8.276 4.882 ( -3.305 -4.379 -2.654) 6.095 5.768 ( -1.903 7.508 -7.437) 10.738 5.993 ( -3.071 -1.878 -6.871) 7.757 6.186 ( 5.540 2.834 1.721) 6.456 6.454 ( -0.714 -8.477 3.100) 9.054 7.365 ( -7.744 9.989 -5.888) 13.944 7.767 ( -0.757 2.648 1.487) 3.130 7.905 ( -4.454 -4.863 -4.223) 7.830 8.320 ( 4.758 -13.658 1.929) 14.591 8.659 ( -1.146 4.285 0.766) 4.501 8.722 ( 3.393 -1.395 -1.518) 3.971 9.611 ( -0.773 29.491 0.963) 29.517 9.970 ( 7.095 2.300 1.143) 7.546 10.230 ( 8.282 -13.020 -2.028) 15.563 10.779 ( 4.129 -13.775 7.817) 16.368 11.096 ( -9.666 -0.753 0.817) 9.730 11.141 ( -8.096 -3.097 1.290) 8.763 11.410 ( -10.739 -1.367 -4.094) 11.574 11.540 ( 2.369 -10.433 4.038) 11.435 11.789 ( 0.118 3.028 -2.761) 4.099 12.027 ( 3.666 -4.794 -3.210) 6.836 12.566 ( 7.225 10.765 -6.443) 14.478 12.685 ( 2.885 8.244 7.649) 11.610 12.886 ( -0.114 10.102 -2.312) 10.363 13.204 ( 4.833 -2.274 2.093) 5.737 13.473 ( 1.716 -8.083 9.590) 12.659 13.702 ( 5.110 -16.727 14.018) 22.414 14.166 ( 3.714 2.656 3.529) 5.771 14.431 ( -2.342 -9.808 -2.568) 10.406 16.058 ( 3.084 1.111 6.030) 6.863 16.148 ( 4.275 -3.025 5.805) 7.818 16.392 ( 1.455 -0.355 3.101) 3.444 16.433 ( 2.696 -2.323 3.972) 5.333 17.302 ( -11.171 30.496 -3.612) 32.678 18.370 ( -6.964 -19.870 0.960) 21.077 19.514 ( 12.275 10.584 -7.850) 18.009 19.722 ( 10.275 0.405 -17.133) 19.982 ======================= 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| 1.671 ( 2.167 21.526 2.231) 21.750 1.684 ( -13.638 18.934 0.455) 23.339 2.299 ( -5.206 -9.503 3.743) 11.464 2.452 ( -5.316 -11.795 2.337) 13.147 3.157 ( -2.117 18.973 2.649) 19.273 3.463 ( -0.744 1.080 1.157) 1.749 3.872 ( 0.188 7.717 -1.377) 7.842 4.081 ( 4.438 8.366 0.999) 9.522 4.372 ( 4.786 5.364 -2.349) 7.563 4.425 ( -3.942 -0.291 0.565) 3.993 4.600 ( -2.619 5.049 0.981) 5.772 4.844 ( -0.895 -5.845 4.181) 7.242 5.693 ( 0.610 2.150 -3.879) 4.477 5.841 ( -4.290 -4.153 -7.765) 9.795 6.281 ( 0.068 2.726 4.689) 5.425 6.451 ( -5.908 -4.901 7.940) 11.044 7.244 ( -1.174 10.115 0.020) 10.182 7.672 ( -3.624 -9.852 -0.749) 10.524 7.911 ( -0.993 9.506 5.540) 11.047 8.440 ( 2.782 -14.443 5.914) 15.853 8.633 ( 2.150 1.855 -1.389) 3.161 8.813 ( 8.016 -8.761 -4.044) 12.545 9.573 ( -3.637 35.594 -0.204) 35.780 10.136 ( 6.650 1.318 2.117) 7.102 10.355 ( 0.689 -9.321 1.969) 9.551 10.818 ( -3.031 -0.471 -11.650) 12.047 10.882 ( -2.335 -12.823 -5.561) 14.171 10.974 ( -4.259 -4.513 3.231) 6.996 11.352 ( 2.573 -1.363 -1.076) 3.104 11.553 ( -2.160 -16.408 -2.510) 16.738 11.821 ( 3.317 6.878 1.737) 7.831 12.085 ( 4.324 -4.076 -0.448) 5.959 12.634 ( 2.718 12.355 -0.439) 12.658 12.748 ( -2.510 12.896 3.144) 13.509 12.849 ( 2.198 4.718 -0.176) 5.208 13.291 ( 3.084 -8.087 -1.673) 8.815 13.526 ( -5.940 -4.526 2.760) 7.961 13.824 ( -3.026 -13.670 4.987) 14.863 14.228 ( 1.767 1.649 -2.704) 3.627 14.392 ( 0.254 -5.224 1.015) 5.328 16.140 ( 0.549 0.520 0.953) 1.216 16.251 ( 1.184 -4.478 2.040) 5.062 16.389 ( -1.054 1.815 -1.622) 2.652 16.498 ( 0.775 -2.964 0.632) 3.128 17.131 ( -5.878 32.100 2.830) 32.756 18.265 ( -4.781 -21.338 0.739) 21.879 19.651 ( 6.073 7.239 -2.628) 9.808 19.803 ( 17.145 1.784 -12.431) 21.253 ======================= 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| 1.951 ( 4.781 -9.521 4.401) 11.527 1.951 ( 4.781 9.521 4.401) 11.527 2.244 ( 0.980 -11.945 9.767) 15.461 2.244 ( 0.980 11.945 9.767) 15.461 3.489 ( 2.021 -6.549 3.395) 7.649 3.489 ( 2.021 6.549 3.395) 7.649 3.964 ( -4.824 -6.005 -0.312) 7.709 3.964 ( -4.824 6.005 -0.312) 7.709 4.456 ( -0.069 -3.506 -2.390) 4.244 4.456 ( -0.069 3.506 -2.390) 4.244 4.825 ( 4.923 -6.757 10.514) 13.433 4.825 ( 4.923 6.757 10.514) 13.433 5.715 ( 4.820 -1.549 -3.891) 6.385 5.715 ( 4.820 1.549 -3.891) 6.385 6.337 ( -6.017 -3.246 6.465) 9.409 6.337 ( -6.017 3.246 6.465) 9.409 7.535 ( 5.048 -9.676 8.153) 13.622 7.535 ( 5.048 9.676 8.153) 13.622 8.196 ( -2.730 -14.771 6.492) 16.364 8.196 ( -2.730 14.771 6.492) 16.364 8.778 ( 7.728 -4.789 1.162) 9.166 8.778 ( 7.728 4.789 1.162) 9.166 10.001 ( -10.649 -12.991 -7.474) 18.386 10.001 ( -10.649 12.991 -7.474) 18.386 10.473 ( -0.704 -25.089 -0.266) 25.101 10.473 ( -0.704 25.089 -0.266) 25.101 10.818 ( 8.251 -2.836 -5.829) 10.493 10.818 ( 8.251 2.836 -5.829) 10.493 11.337 ( 0.855 -0.381 -2.471) 2.642 11.337 ( 0.855 0.381 -2.471) 2.642 12.050 ( 1.636 -6.622 2.858) 7.396 12.050 ( 1.636 6.622 2.858) 7.396 12.823 ( -3.493 -10.578 -2.503) 11.418 12.823 ( -3.493 10.578 -2.503) 11.418 13.089 ( 4.358 -11.026 3.451) 12.348 13.089 ( 4.358 11.026 3.451) 12.348 13.396 ( -11.368 -11.407 -9.538) 18.717 13.396 ( -11.368 11.407 -9.538) 18.717 14.280 ( -1.024 -6.274 -2.903) 6.989 14.280 ( -1.024 6.274 -2.903) 6.989 16.129 ( -3.486 -2.854 -3.745) 5.858 16.129 ( -3.486 2.854 -3.745) 5.858 16.396 ( -2.290 -2.475 -4.371) 5.520 16.396 ( -2.290 2.475 -4.371) 5.520 17.754 ( 1.047 -26.320 5.703) 26.951 17.754 ( 1.047 26.320 5.703) 26.951 19.878 ( 6.022 -8.585 -2.203) 10.715 19.878 ( 6.022 8.585 -2.203) 10.715 ======================= 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| 2.201 ( 13.481 -3.797 6.273) 15.346 2.201 ( 13.481 3.797 6.273) 15.346 2.385 ( 2.485 -7.905 11.323) 14.031 2.385 ( 2.485 7.905 11.323) 14.031 3.486 ( -4.144 -11.346 2.039) 12.250 3.486 ( -4.144 11.346 2.039) 12.250 3.958 ( 2.828 -2.042 0.516) 3.526 3.958 ( 2.828 2.042 0.516) 3.526 4.403 ( -2.262 -4.530 -1.088) 5.179 4.403 ( -2.262 4.530 -1.088) 5.179 5.072 ( 6.930 -5.391 14.446) 16.905 5.072 ( 6.930 5.391 14.446) 16.905 5.829 ( 10.125 -3.574 -3.082) 11.171 5.829 ( 10.125 3.574 -3.082) 11.171 6.291 ( -4.595 -4.029 4.685) 7.700 6.291 ( -4.595 4.029 4.685) 7.700 7.787 ( 9.175 -10.529 13.939) 19.731 7.787 ( 9.175 10.529 13.939) 19.731 8.181 ( -5.955 -14.649 6.901) 17.254 8.181 ( -5.955 14.649 6.901) 17.254 8.931 ( 1.736 -4.865 6.465) 8.275 8.931 ( 1.736 4.865 6.465) 8.275 9.749 ( -0.744 -8.740 -14.588) 17.022 9.749 ( -0.744 8.740 -14.588) 17.022 10.327 ( -8.832 -29.585 -8.458) 32.013 10.327 ( -8.832 29.585 -8.458) 32.013 10.960 ( 6.042 -0.895 2.072) 6.449 10.960 ( 6.042 0.895 2.072) 6.449 11.358 ( 2.940 -1.277 -0.010) 3.206 11.358 ( 2.940 1.277 -0.010) 3.206 12.092 ( -0.553 -6.879 3.657) 7.810 12.092 ( -0.553 6.879 3.657) 7.810 12.694 ( -3.649 -13.885 -8.372) 16.619 12.694 ( -3.649 13.885 -8.372) 16.619 13.009 ( -12.336 -11.872 -15.514) 23.104 13.009 ( -12.336 11.872 -15.514) 23.104 13.261 ( 3.952 -3.763 8.176) 9.830 13.261 ( 3.952 3.763 8.176) 9.830 14.190 ( -3.453 -9.791 -5.929) 11.956 14.190 ( -3.453 9.791 -5.929) 11.956 16.005 ( -4.548 -3.038 -4.643) 7.174 16.005 ( -4.548 3.038 -4.643) 7.174 16.281 ( -3.317 -2.624 -6.960) 8.144 16.281 ( -3.317 2.624 -6.960) 8.144 17.885 ( 5.093 -22.177 7.239) 23.878 17.885 ( 5.093 22.177 7.239) 23.878 19.921 ( 0.275 -12.612 -1.415) 12.694 19.921 ( 0.275 12.612 -1.415) 12.694 ======================= 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| 2.420 ( -1.394 -12.067 11.466) 16.704 2.420 ( -1.394 12.067 11.466) 16.704 2.581 ( 9.162 -8.551 4.759) 13.405 2.581 ( 9.162 8.551 4.759) 13.405 3.494 ( 7.518 -6.105 -2.088) 9.907 3.494 ( 7.518 6.105 -2.088) 9.907 3.967 ( -3.226 -2.953 -0.338) 4.386 3.967 ( -3.226 2.953 -0.338) 4.386 4.410 ( 2.819 -2.724 1.774) 4.303 4.410 ( 2.819 2.724 1.774) 4.303 5.316 ( 1.762 -3.417 15.003) 15.488 5.316 ( 1.762 3.417 15.003) 15.488 5.968 ( 8.818 -1.994 -5.062) 10.361 5.968 ( 8.818 1.994 -5.062) 10.361 6.289 ( 0.708 -7.981 2.650) 8.439 6.289 ( 0.708 7.981 2.650) 8.439 7.997 ( -6.284 -15.846 7.930) 18.801 7.997 ( -6.284 15.846 7.930) 18.801 8.243 ( 8.345 -11.764 13.287) 19.611 8.243 ( 8.345 11.764 13.287) 19.611 8.890 ( -10.099 -5.255 3.384) 11.876 8.890 ( -10.099 5.255 3.384) 11.876 9.751 ( 10.742 -0.897 -9.540) 14.395 9.751 ( 10.742 0.897 -9.540) 14.395 10.037 ( -8.866 -28.345 -11.895) 31.993 10.037 ( -8.866 28.345 -11.895) 31.993 11.026 ( -2.776 -3.039 5.428) 6.812 11.026 ( -2.776 3.039 5.428) 6.812 11.448 ( 6.294 -4.217 0.980) 7.639 11.448 ( 6.294 4.217 0.980) 7.639 12.090 ( -2.514 -6.023 -0.427) 6.541 12.090 ( -2.514 6.023 -0.427) 6.541 12.536 ( -3.784 -11.105 -9.736) 15.246 12.536 ( -3.784 11.105 -9.736) 15.246 12.677 ( -6.477 -12.247 -10.345) 17.290 12.677 ( -6.477 12.247 -10.345) 17.290 13.407 ( 1.819 -4.588 8.296) 9.653 13.407 ( 1.819 4.588 8.296) 9.653 14.062 ( -2.921 -12.996 -6.156) 14.674 14.062 ( -2.921 12.996 -6.156) 14.674 15.892 ( -3.157 -2.619 -3.066) 5.121 15.892 ( -3.157 2.619 -3.066) 5.121 16.156 ( -2.642 -4.101 -6.013) 7.743 16.156 ( -2.642 4.101 -6.013) 7.743 18.057 ( 5.703 -16.802 6.179) 18.788 18.057 ( 5.703 16.802 6.179) 18.788 19.861 ( -3.941 -14.283 -3.054) 15.129 19.861 ( -3.941 14.283 -3.054) 15.129 ======================= 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| 2.416 ( -10.980 -8.775 11.585) 18.215 2.416 ( -10.980 8.775 11.585) 18.215 2.752 ( 7.203 -6.566 -0.377) 9.754 2.752 ( 7.203 6.566 -0.377) 9.754 3.712 ( 17.984 -2.421 -5.097) 18.849 3.712 ( 17.984 2.421 -5.097) 18.849 3.872 ( -6.011 -3.381 0.704) 6.932 3.872 ( -6.011 3.381 0.704) 6.932 4.488 ( 3.562 -1.596 -0.369) 3.920 4.488 ( 3.562 1.596 -0.369) 3.920 5.386 ( -9.384 -3.757 11.548) 15.347 5.386 ( -9.384 3.757 11.548) 15.347 6.061 ( 8.338 -0.913 -6.659) 10.710 6.061 ( 8.338 0.913 -6.659) 10.710 6.350 ( 4.128 -10.362 -1.719) 11.286 6.350 ( 4.128 10.362 -1.719) 11.286 7.864 ( -9.883 -20.762 1.527) 23.045 7.864 ( -9.883 20.762 1.527) 23.045 8.537 ( 2.240 -12.205 11.318) 16.795 8.537 ( 2.240 12.205 11.318) 16.795 8.777 ( -1.663 -6.545 3.683) 7.692 8.777 ( -1.663 6.545 3.683) 7.692 9.630 ( -6.480 -23.093 -12.449) 27.023 9.630 ( -6.480 23.093 -12.449) 27.023 10.002 ( 5.686 -5.073 1.419) 7.751 10.002 ( 5.686 5.073 1.419) 7.751 11.007 ( -4.054 -3.154 5.018) 7.181 11.007 ( -4.054 3.154 5.018) 7.181 11.595 ( 8.570 -5.106 0.351) 9.982 11.595 ( 8.570 5.106 0.351) 9.982 11.990 ( -3.126 -3.137 -5.259) 6.875 11.990 ( -3.126 3.137 -5.259) 6.875 12.375 ( -2.782 -12.001 -8.615) 15.033 12.375 ( -2.782 12.001 -8.615) 15.033 12.591 ( -0.116 -10.896 1.216) 10.964 12.591 ( -0.116 10.896 1.216) 10.964 13.477 ( -1.630 -5.653 4.815) 7.603 13.477 ( -1.630 5.653 4.815) 7.603 13.983 ( -0.499 -15.309 -2.634) 15.542 13.983 ( -0.499 15.309 -2.634) 15.542 15.832 ( -1.327 -1.750 -0.694) 2.304 15.832 ( -1.327 1.750 -0.694) 2.304 16.078 ( -0.788 -4.233 -2.417) 4.937 16.078 ( -0.788 4.233 -2.417) 4.937 18.199 ( 3.765 -9.878 4.029) 11.314 18.199 ( 3.765 9.878 4.029) 11.314 19.738 ( -4.168 -14.021 -5.227) 15.533 19.738 ( -4.168 14.021 -5.227) 15.533 ======================= 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| 2.280 ( -12.150 -1.258 4.553) 13.036 2.280 ( -12.150 1.258 4.553) 13.036 2.844 ( 3.813 -2.229 -1.596) 4.696 2.844 ( 3.813 2.229 -1.596) 4.696 3.791 ( -3.621 -4.030 1.734) 5.688 3.791 ( -3.621 4.030 1.734) 5.688 3.952 ( 11.677 -4.375 -5.584) 13.662 3.952 ( 11.677 4.375 -5.584) 13.662 4.521 ( 3.535 -0.786 -4.932) 6.119 4.521 ( 3.535 0.786 -4.932) 6.119 5.239 ( -14.764 -6.063 5.778) 16.974 5.239 ( -14.764 6.063 5.778) 16.974 6.122 ( 6.346 -1.070 -8.661) 10.790 6.122 ( 6.346 1.070 -8.661) 10.790 6.369 ( 2.289 -11.173 -6.963) 13.363 6.369 ( 2.289 11.173 -6.963) 13.363 7.734 ( -4.167 -19.277 -0.017) 19.722 7.734 ( -4.167 19.277 -0.017) 19.722 8.549 ( -5.795 -5.822 6.677) 10.586 8.549 ( -5.795 5.822 6.677) 10.586 8.756 ( -4.461 -13.306 -9.163) 16.760 8.756 ( -4.461 13.306 -9.163) 16.760 9.587 ( 6.718 -24.468 7.318) 26.407 9.587 ( 6.718 24.468 7.318) 26.407 10.070 ( -1.795 -7.105 4.139) 8.416 10.070 ( -1.795 7.105 4.139) 8.416 10.993 ( -2.017 -3.030 3.083) 4.769 10.993 ( -2.017 3.030 3.083) 4.769 11.747 ( 5.723 -4.618 2.611) 7.803 11.747 ( 5.723 4.618 2.611) 7.803 11.942 ( 2.753 -1.439 -3.695) 4.827 11.942 ( 2.753 1.439 -3.695) 4.827 12.278 ( 0.777 -10.256 -4.887) 11.388 12.278 ( 0.777 10.256 -4.887) 11.388 12.631 ( 0.164 -10.237 5.395) 11.573 12.631 ( 0.164 10.237 5.395) 11.573 13.448 ( -3.859 -5.185 -0.131) 6.465 13.448 ( -3.859 5.185 -0.131) 6.465 13.995 ( 1.895 -16.123 2.147) 16.375 13.995 ( 1.895 16.123 2.147) 16.375 15.829 ( 0.287 -0.901 1.813) 2.045 15.829 ( 0.287 0.901 1.813) 2.045 16.085 ( 1.553 -3.688 2.223) 4.578 16.085 ( 1.553 3.688 2.223) 4.578 18.262 ( -0.390 -6.647 1.615) 6.852 18.262 ( -0.390 6.647 1.615) 6.852 19.628 ( -0.370 -12.281 -7.274) 14.278 19.628 ( -0.370 12.281 -7.274) 14.278 ======================= 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| 2.104 ( -6.912 -7.600 -2.611) 10.600 2.104 ( -6.912 7.600 -2.611) 10.600 2.838 ( -3.414 -8.493 -1.672) 9.305 2.838 ( -3.414 8.493 -1.672) 9.305 3.782 ( 1.542 -3.897 -0.497) 4.221 3.782 ( 1.542 3.897 -0.497) 4.221 3.960 ( -4.699 -3.235 -4.259) 7.119 3.960 ( -4.699 3.235 -4.259) 7.119 4.531 ( 2.689 -3.154 -5.801) 7.130 4.531 ( 2.689 3.154 -5.801) 7.130 5.031 ( -9.031 -7.508 -0.726) 11.767 5.031 ( -9.031 7.508 -0.726) 11.767 6.122 ( 3.937 -0.856 -8.530) 9.433 6.122 ( 3.937 0.856 -8.530) 9.433 6.293 ( -0.508 -12.253 -10.147) 15.917 6.293 ( -0.508 12.253 -10.147) 15.917 7.723 ( 2.149 -15.552 0.476) 15.707 7.723 ( 2.149 15.552 0.476) 15.707 8.366 ( -11.480 -17.946 -12.479) 24.690 8.366 ( -11.480 17.946 -12.479) 24.690 8.657 ( -0.544 -5.025 4.881) 7.026 8.657 ( -0.544 5.025 4.881) 7.026 9.861 ( 10.055 -24.257 7.436) 27.291 9.861 ( 10.055 24.257 7.436) 27.291 10.047 ( -4.457 -8.755 5.909) 11.464 10.047 ( -4.457 8.755 5.909) 11.464 11.008 ( -0.739 -4.187 5.857) 7.238 11.008 ( -0.739 4.187 5.857) 7.238 11.801 ( -4.143 -4.044 1.380) 5.952 11.801 ( -4.143 4.044 1.380) 5.952 11.947 ( 0.703 -0.595 -3.183) 3.314 11.947 ( 0.703 0.595 -3.183) 3.314 12.363 ( 10.999 -5.987 0.222) 12.525 12.363 ( 10.999 5.987 0.222) 12.525 12.729 ( 3.414 -12.752 10.366) 16.784 12.729 ( 3.414 12.752 10.366) 16.784 13.353 ( -3.742 -2.828 -3.644) 5.940 13.353 ( -3.742 2.828 -3.644) 5.940 14.082 ( 3.159 -14.425 5.008) 15.593 14.082 ( 3.159 14.425 5.008) 15.593 15.877 ( 1.709 -0.514 4.055) 4.431 15.877 ( 1.709 0.514 4.055) 4.431 16.171 ( 3.178 -2.934 5.606) 7.081 16.171 ( 3.178 2.934 5.606) 7.081 18.214 ( -5.336 -14.887 -0.420) 15.820 18.214 ( -5.336 14.887 -0.420) 15.820 19.586 ( 4.967 -10.105 -9.363) 14.644 19.586 ( 4.967 10.105 -9.363) 14.644 ======================= 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| 2.014 ( 1.465 -15.012 -4.907) 15.861 2.014 ( 1.465 15.012 -4.907) 15.861 2.671 ( -12.203 -12.934 -2.924) 18.020 2.671 ( -12.203 12.934 -2.924) 18.020 3.675 ( -11.473 -3.700 -5.078) 13.081 3.675 ( -11.473 3.700 -5.078) 13.081 3.921 ( 6.213 -2.496 -0.193) 6.699 3.921 ( 6.213 2.496 -0.193) 6.699 4.470 ( -4.018 -6.658 -2.014) 8.033 4.470 ( -4.018 6.658 -2.014) 8.033 4.910 ( -2.206 -4.501 -5.611) 7.523 4.910 ( -2.206 4.501 -5.611) 7.523 6.079 ( -1.103 -2.046 -9.204) 9.493 6.079 ( -1.103 2.046 -9.204) 9.493 6.210 ( 2.951 -11.281 -4.629) 12.546 6.210 ( 2.951 11.281 -4.629) 12.546 7.764 ( -0.276 -12.720 -2.209) 12.914 7.764 ( -0.276 12.720 -2.209) 12.914 8.056 ( -6.536 -14.191 -8.181) 17.636 8.056 ( -6.536 14.191 -8.181) 17.636 8.712 ( 0.300 -3.430 3.046) 4.597 8.712 ( 0.300 3.430 3.046) 4.597 9.955 ( 1.844 -9.680 -2.734) 10.226 9.955 ( 1.844 9.680 -2.734) 10.226 10.152 ( 4.870 -24.454 8.430) 26.320 10.152 ( 4.870 24.454 8.430) 26.320 11.093 ( -0.163 -5.802 10.701) 12.174 11.093 ( -0.163 5.802 10.701) 12.174 11.621 ( -13.905 -4.612 -0.609) 14.662 11.621 ( -13.905 4.612 -0.609) 14.662 11.919 ( 1.411 -4.315 -5.552) 7.172 11.919 ( 1.411 4.315 -5.552) 7.172 12.583 ( 11.984 -2.511 -2.041) 12.413 12.583 ( 11.984 2.511 -2.041) 12.413 12.989 ( 7.574 -16.205 16.255) 24.170 12.989 ( 7.574 16.205 16.255) 24.170 13.267 ( -1.402 -4.163 -0.748) 4.456 13.267 ( -1.402 4.163 -0.748) 4.456 14.190 ( 2.935 -10.858 4.283) 12.035 14.190 ( 2.935 10.858 4.283) 12.035 15.971 ( 3.021 -1.389 5.656) 6.561 15.971 ( 3.021 1.389 5.656) 6.561 16.295 ( 3.353 -1.692 6.063) 7.132 16.295 ( 3.353 1.692 6.063) 7.132 18.072 ( -8.700 -22.184 -1.355) 23.867 18.072 ( -8.700 22.184 -1.355) 23.867 19.610 ( 8.717 -7.858 -11.104) 16.157 19.610 ( 8.717 7.858 -11.104) 16.157 ======================= 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| 2.033 ( 3.629 -17.623 -3.203) 18.275 2.033 ( 3.629 17.623 -3.203) 18.275 2.362 ( -16.702 -15.313 -2.628) 22.811 2.362 ( -16.702 15.313 -2.628) 22.811 3.449 ( -6.696 -6.212 -2.396) 9.442 3.449 ( -6.696 6.212 -2.396) 9.442 4.047 ( 5.010 -1.319 0.881) 5.255 4.047 ( 5.010 1.319 0.881) 5.255 4.404 ( -0.769 -5.435 -0.278) 5.496 4.404 ( -0.769 5.435 -0.278) 5.496 4.796 ( -4.303 -4.014 -4.492) 7.403 4.796 ( -4.303 4.014 -4.492) 7.403 5.917 ( -4.573 -5.945 -9.566) 12.155 5.917 ( -4.573 5.945 -9.566) 12.155 6.285 ( 3.295 -6.967 3.978) 8.673 6.285 ( 3.295 6.967 3.978) 8.673 7.598 ( -7.769 -11.941 -6.920) 15.838 7.598 ( -7.769 11.941 -6.920) 15.838 8.047 ( 3.413 -12.000 3.576) 12.978 8.047 ( 3.413 12.000 3.576) 12.978 8.705 ( -0.751 -1.074 -2.559) 2.875 8.705 ( -0.751 1.074 -2.559) 2.875 10.014 ( 7.060 -7.956 -0.762) 10.664 10.014 ( 7.060 7.956 -0.762) 10.664 10.301 ( 4.823 -28.905 3.448) 29.507 10.301 ( 4.823 28.905 3.448) 29.507 11.102 ( -11.054 -1.858 3.657) 11.790 11.102 ( -11.054 1.858 3.657) 11.790 11.408 ( -4.496 -1.979 -0.968) 5.006 11.408 ( -4.496 1.979 -0.968) 5.006 11.908 ( 2.897 -6.538 -2.847) 7.698 11.908 ( 2.897 6.538 -2.847) 7.698 12.743 ( 8.113 -4.167 -2.247) 9.393 12.743 ( 8.113 4.167 -2.247) 9.393 13.095 ( -1.849 -8.675 -1.041) 8.930 13.095 ( -1.849 8.675 -1.041) 8.930 13.434 ( 5.645 -6.908 16.354) 18.629 13.434 ( 5.645 6.908 16.354) 18.629 14.261 ( 1.943 -6.591 0.901) 6.930 14.261 ( 1.943 6.591 0.901) 6.930 16.092 ( 3.458 -2.283 5.511) 6.896 16.092 ( 3.458 2.283 5.511) 6.896 16.398 ( 2.123 -1.000 3.515) 4.226 16.398 ( 2.123 1.000 3.515) 4.226 17.892 ( -9.134 -26.407 -0.752) 27.952 17.892 ( -9.134 26.407 -0.752) 27.952 19.673 ( 10.249 -5.067 -10.469) 15.502 19.673 ( 10.249 5.067 -10.469) 15.502 ======================= 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| 1.979 ( -7.262 -6.100 -1.540) 9.608 1.979 ( -7.262 6.100 -1.540) 9.608 2.170 ( -2.592 -10.238 5.124) 11.738 2.170 ( -2.592 10.238 5.124) 11.738 3.407 ( 2.370 -6.751 0.642) 7.184 3.407 ( 2.370 6.751 0.642) 7.184 4.067 ( -4.597 -8.241 1.806) 9.608 4.067 ( -4.597 8.241 1.806) 9.608 4.435 ( 4.136 -0.520 -2.173) 4.701 4.435 ( 4.136 0.520 -2.173) 4.701 4.719 ( -1.466 -6.238 2.971) 7.063 4.719 ( -1.466 6.238 2.971) 7.063 5.756 ( -2.727 -3.903 -7.067) 8.521 5.756 ( -2.727 3.903 -7.067) 8.521 6.354 ( -2.794 -4.309 7.346) 8.963 6.354 ( -2.794 4.309 7.346) 8.963 7.463 ( -1.845 -10.600 -0.246) 10.762 7.463 ( -1.845 10.600 -0.246) 10.762 8.146 ( 1.305 -13.289 5.756) 14.541 8.146 ( 1.305 13.289 5.756) 14.541 8.685 ( 3.301 -3.900 -3.338) 6.103 8.685 ( 3.301 3.900 -3.338) 6.103 10.138 ( 1.087 -9.673 2.857) 10.145 10.138 ( 1.087 9.673 2.857) 10.145 10.399 ( 5.534 -27.176 -1.278) 27.763 10.399 ( 5.534 27.176 -1.278) 27.763 10.872 ( -6.668 -4.573 -7.034) 10.717 10.872 ( -6.668 4.573 -7.034) 10.717 11.367 ( -1.126 -3.563 -1.687) 4.100 11.367 ( -1.126 3.563 -1.687) 4.100 11.972 ( 4.138 -6.724 1.302) 8.002 11.972 ( 4.138 6.724 1.302) 8.002 12.836 ( 2.901 -5.802 0.448) 6.502 12.836 ( 2.901 5.802 0.448) 6.502 13.048 ( -0.811 -14.103 -1.333) 14.189 13.048 ( -0.811 14.103 -1.333) 14.189 13.576 ( -3.739 -8.903 4.479) 10.645 13.576 ( -3.739 8.903 4.479) 10.645 14.290 ( 1.484 -4.265 -1.030) 4.632 14.290 ( 1.484 4.265 -1.030) 4.632 16.173 ( 0.640 -2.792 1.222) 3.115 16.173 ( 0.640 2.792 1.222) 3.115 16.437 ( 0.192 -2.817 -0.093) 2.825 16.437 ( 0.192 2.817 -0.093) 2.825 17.756 ( -5.454 -28.058 1.840) 28.643 17.756 ( -5.454 28.058 1.840) 28.643 19.771 ( 9.683 -4.129 -6.352) 12.294 19.771 ( 9.683 4.129 -6.352) 12.294 ======================= 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| 1.146 ( -0.339 0.000 26.241) 26.243 1.185 ( 3.735 0.000 26.200) 26.465 2.146 ( 8.756 0.000 42.957) 43.841 2.659 ( -1.176 0.000 -2.077) 2.387 2.989 ( -2.134 0.000 7.965) 8.246 3.522 ( 1.217 0.000 12.636) 12.694 3.619 ( 3.212 0.000 -2.754) 4.231 3.723 ( 10.783 0.000 12.273) 16.337 4.062 ( 4.899 0.000 -9.384) 10.586 4.451 ( 4.746 0.000 2.419) 5.327 4.831 ( -7.279 0.000 10.254) 12.575 5.134 ( -0.115 0.000 -0.018) 0.116 5.460 ( -7.858 0.000 -5.570) 9.632 6.052 ( -0.878 0.000 -5.958) 6.023 6.199 ( 2.331 0.000 8.668) 8.976 6.551 ( -6.785 0.000 4.695) 8.250 6.991 ( 2.071 0.000 -2.724) 3.422 7.507 ( -16.410 0.000 -2.486) 16.597 7.918 ( -4.179 0.000 4.669) 6.266 8.391 ( 17.965 0.000 6.498) 19.105 8.597 ( 8.589 0.000 7.086) 11.134 8.798 ( -3.954 0.000 4.769) 6.195 9.903 ( -3.958 0.000 -6.905) 7.959 10.084 ( 15.843 0.000 -20.379) 25.813 10.174 ( -2.485 0.000 -3.192) 4.045 10.722 ( -43.575 0.000 6.478) 44.054 11.004 ( 0.488 0.000 -7.338) 7.354 11.296 ( 8.985 0.000 0.311) 8.990 11.493 ( 4.720 0.000 0.936) 4.812 11.601 ( -1.897 0.000 5.547) 5.863 11.980 ( 1.695 0.000 2.588) 3.093 12.318 ( 3.578 0.000 3.536) 5.031 12.335 ( -10.441 0.000 -8.112) 13.222 12.676 ( -2.242 0.000 -10.932) 11.160 12.865 ( -0.892 0.000 -5.796) 5.864 13.107 ( -4.047 0.000 -0.092) 4.048 13.721 ( -10.944 0.000 -5.472) 12.236 13.808 ( 0.832 0.000 -5.594) 5.655 15.066 ( -4.321 0.000 8.905) 9.898 15.256 ( 9.483 0.000 12.973) 16.069 15.338 ( -1.435 0.000 -2.147) 2.583 15.702 ( -1.136 0.000 1.115) 1.592 16.388 ( -6.923 0.000 -6.871) 9.753 16.508 ( 3.351 0.000 6.720) 7.509 16.628 ( -2.522 0.000 1.972) 3.202 18.385 ( 13.754 0.000 -5.147) 14.686 19.316 ( -5.759 0.000 4.441) 7.273 19.977 ( 51.941 0.000 -4.316) 52.120 ======================= 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| 1.461 ( 7.674 0.000 21.032) 22.388 1.534 ( 4.392 0.000 27.762) 28.108 2.717 ( 11.045 0.000 -5.768) 12.460 2.748 ( 16.002 0.000 14.305) 21.464 3.085 ( 4.167 0.000 17.104) 17.605 3.590 ( -6.735 0.000 8.802) 11.083 3.691 ( 2.703 0.000 8.962) 9.360 3.925 ( -4.243 0.000 -6.219) 7.529 4.113 ( 10.733 0.000 10.917) 15.309 4.614 ( 8.565 0.000 3.899) 9.411 4.788 ( -6.234 0.000 6.069) 8.700 5.113 ( 0.100 0.000 -3.190) 3.192 5.278 ( -7.264 0.000 -2.318) 7.625 5.969 ( -0.517 0.000 -6.655) 6.676 6.364 ( 3.002 0.000 12.642) 12.993 6.492 ( -3.838 0.000 1.487) 4.116 7.050 ( 6.678 0.000 -0.848) 6.732 7.153 ( -17.288 0.000 -5.006) 17.998 7.899 ( -4.484 0.000 7.435) 8.682 8.544 ( -0.195 0.000 -7.343) 7.345 8.863 ( 7.434 0.000 6.004) 9.556 9.089 ( 18.515 0.000 23.216) 29.695 9.539 ( -19.130 0.000 -0.207) 19.131 9.983 ( -15.191 0.000 4.319) 15.793 10.092 ( 6.768 0.000 -17.702) 18.951 10.629 ( 16.718 0.000 -6.117) 17.802 10.824 ( -5.869 0.000 -18.045) 18.975 11.477 ( 4.050 0.000 7.309) 8.356 11.589 ( 4.039 0.000 2.457) 4.728 11.598 ( -2.939 0.000 2.028) 3.571 11.970 ( -17.563 0.000 -5.580) 18.428 12.081 ( 3.710 0.000 5.901) 6.971 12.339 ( -4.538 0.000 2.089) 4.996 12.603 ( 4.273 0.000 -5.684) 7.111 12.888 ( 4.963 0.000 1.346) 5.143 12.980 ( -7.981 0.000 -4.728) 9.276 13.524 ( -5.628 0.000 -4.646) 7.297 13.769 ( 0.971 0.000 -5.375) 5.462 15.006 ( -4.751 0.000 1.506) 4.984 15.312 ( -0.612 0.000 0.074) 0.617 15.588 ( 9.967 0.000 8.520) 13.113 15.687 ( -0.961 0.000 -2.033) 2.249 16.190 ( -7.661 0.000 -3.429) 8.393 16.490 ( -3.003 0.000 -4.917) 5.762 16.835 ( 9.353 0.000 21.479) 23.427 18.478 ( 8.138 0.000 -11.222) 13.862 19.174 ( -12.800 0.000 0.656) 12.817 20.476 ( 16.666 0.000 -13.012) 21.144 ======================= 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| 1.826 ( 12.399 0.000 13.948) 18.663 1.890 ( 3.788 0.000 25.792) 26.068 2.870 ( -0.228 0.000 -5.301) 5.306 2.897 ( 15.962 0.000 -10.380) 19.041 3.351 ( -7.675 0.000 9.701) 12.370 3.650 ( 15.123 0.000 -0.534) 15.132 3.667 ( -13.355 0.000 -7.953) 15.544 3.868 ( -0.837 0.000 24.570) 24.584 4.425 ( 7.300 0.000 12.534) 14.505 4.726 ( -3.726 0.000 -1.074) 3.878 4.797 ( 8.108 0.000 0.508) 8.124 5.078 ( 2.029 0.000 -7.793) 8.052 5.162 ( -5.964 0.000 4.046) 7.206 5.901 ( 1.746 0.000 -8.932) 9.101 6.425 ( -2.706 0.000 -3.271) 4.245 6.513 ( -0.413 0.000 8.666) 8.676 6.813 ( -14.234 0.000 -1.495) 14.312 7.220 ( 9.951 0.000 3.880) 10.680 7.898 ( -3.982 0.000 6.765) 7.850 8.423 ( -3.189 0.000 -7.724) 8.356 8.843 ( -14.493 0.000 6.216) 15.770 9.304 ( -13.515 0.000 10.280) 16.981 9.709 ( 20.650 0.000 22.183) 30.307 9.999 ( 13.623 0.000 0.882) 13.651 10.009 ( 0.676 0.000 -10.127) 10.150 10.458 ( -10.042 0.000 -21.530) 23.757 10.858 ( 19.208 0.000 -14.554) 24.100 11.393 ( -21.142 0.000 3.230) 21.388 11.545 ( -2.938 0.000 -1.467) 3.284 11.621 ( 2.326 0.000 1.491) 2.763 11.919 ( 8.338 0.000 8.579) 11.964 12.173 ( -1.469 0.000 3.698) 3.979 12.256 ( -5.592 0.000 4.390) 7.109 12.630 ( -2.688 0.000 -9.349) 9.728 12.764 ( -1.607 0.000 -5.575) 5.802 13.012 ( 3.556 0.000 5.583) 6.620 13.419 ( -2.021 0.000 -1.770) 2.686 13.738 ( 0.864 0.000 -3.807) 3.903 14.954 ( -2.537 0.000 1.850) 3.140 15.313 ( -0.813 0.000 2.306) 2.445 15.615 ( -1.472 0.000 -6.256) 6.427 15.769 ( 4.870 0.000 2.322) 5.395 16.071 ( -5.164 0.000 3.138) 6.043 16.386 ( -2.946 0.000 -3.528) 4.596 17.276 ( 12.596 0.000 20.595) 24.142 18.478 ( 7.978 0.000 -17.484) 19.218 18.871 ( -17.796 0.000 -3.767) 18.190 20.477 ( -0.244 0.000 -11.405) 11.407 ======================= 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| 2.143 ( -0.643 0.000 15.765) 15.778 2.187 ( 15.342 0.000 7.185) 16.941 2.703 ( -13.392 0.000 -3.158) 13.759 2.973 ( -0.495 0.000 -12.934) 12.943 3.206 ( -7.623 0.000 -0.719) 7.656 3.386 ( -2.276 0.000 -8.991) 9.275 3.884 ( 9.452 0.000 2.758) 9.846 4.076 ( -1.540 0.000 10.478) 10.591 4.560 ( -4.644 0.000 6.571) 8.047 4.616 ( -4.519 0.000 -6.199) 7.671 4.918 ( 6.246 0.000 -2.023) 6.566 5.025 ( 3.179 0.000 -11.457) 11.890 5.140 ( -3.629 0.000 6.899) 7.795 5.853 ( 4.418 0.000 -11.954) 12.744 6.338 ( 0.246 0.000 -7.868) 7.872 6.452 ( -8.274 0.000 1.749) 8.457 6.720 ( -1.040 0.000 7.374) 7.447 7.456 ( 7.938 0.000 7.178) 10.702 7.870 ( -4.611 0.000 2.406) 5.201 8.309 ( -0.327 0.000 -6.208) 6.216 8.629 ( -14.203 0.000 8.137) 16.369 9.213 ( -13.083 0.000 19.844) 23.769 9.843 ( -7.775 0.000 -25.516) 26.674 9.950 ( -5.486 0.000 3.952) 6.761 10.376 ( 24.524 0.000 -0.247) 24.526 10.430 ( 15.109 0.000 15.649) 21.752 11.038 ( -19.433 0.000 4.303) 19.903 11.047 ( 18.975 0.000 -15.850) 24.724 11.469 ( -2.728 0.000 -2.851) 3.946 11.723 ( 4.485 0.000 6.351) 7.775 12.109 ( -5.546 0.000 1.473) 5.738 12.151 ( 2.176 0.000 0.088) 2.178 12.215 ( -6.645 0.000 4.373) 7.955 12.335 ( -5.973 0.000 -5.472) 8.101 12.783 ( 4.086 0.000 -8.389) 9.331 13.112 ( 0.026 0.000 7.327) 7.327 13.443 ( 3.675 0.000 4.663) 5.937 13.727 ( 0.979 0.000 -1.526) 1.813 14.955 ( -0.338 0.000 3.396) 3.413 15.310 ( -2.835 0.000 2.627) 3.865 15.564 ( 3.188 0.000 -4.482) 5.500 15.846 ( 2.323 0.000 1.041) 2.546 16.044 ( -3.736 0.000 6.545) 7.536 16.331 ( -0.511 0.000 -0.446) 0.678 17.571 ( -0.024 0.000 4.849) 4.849 18.412 ( 7.867 0.000 -24.227) 25.472 18.547 ( -10.226 0.000 -0.156) 10.227 20.293 ( -6.222 0.000 -11.776) 13.319 ======================= 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| 2.096 ( -13.605 0.000 -5.698) 14.750 2.446 ( -12.672 0.000 11.985) 17.442 2.489 ( 2.535 0.000 -1.360) 2.877 2.657 ( -5.736 0.000 -6.734) 8.845 3.102 ( -0.924 0.000 -5.912) 5.984 3.400 ( 11.089 0.000 -14.046) 17.896 3.950 ( -11.332 0.000 -10.007) 15.118 4.046 ( -5.370 0.000 13.566) 14.590 4.406 ( -13.523 0.000 -1.102) 13.568 4.449 ( -3.914 0.000 -6.214) 7.344 4.898 ( -0.221 0.000 -10.961) 10.963 5.040 ( 4.712 0.000 -2.537) 5.352 5.136 ( -0.086 0.000 0.819) 0.823 5.804 ( 5.275 0.000 -15.161) 16.052 6.320 ( 8.022 0.000 -8.681) 11.820 6.352 ( -6.984 0.000 3.137) 7.656 6.860 ( 8.714 0.000 7.717) 11.640 7.576 ( -1.468 0.000 2.738) 3.107 7.787 ( -3.603 0.000 -2.558) 4.418 8.318 ( 5.743 0.000 -3.011) 6.485 8.532 ( -8.761 0.000 14.159) 16.651 9.217 ( -10.945 0.000 22.517) 25.036 9.385 ( -11.641 0.000 -21.634) 24.567 9.930 ( -4.165 0.000 8.498) 9.464 10.665 ( -8.036 0.000 2.194) 8.330 10.832 ( 23.760 0.000 1.554) 23.811 10.916 ( 3.436 0.000 8.649) 9.306 11.238 ( 17.458 0.000 -12.344) 21.381 11.400 ( -1.141 0.000 -3.122) 3.324 11.791 ( -10.935 0.000 -7.015) 12.992 11.992 ( 6.323 0.000 6.694) 9.208 12.026 ( -5.965 0.000 3.027) 6.689 12.100 ( -7.772 0.000 1.061) 7.844 12.475 ( 8.099 0.000 1.027) 8.164 12.737 ( 1.790 0.000 -6.221) 6.473 13.152 ( -4.186 0.000 7.484) 8.575 13.629 ( 7.483 0.000 9.842) 12.364 13.750 ( 1.810 0.000 1.427) 2.305 15.006 ( 0.855 0.000 5.548) 5.614 15.278 ( -2.283 0.000 1.893) 2.966 15.635 ( 6.214 0.000 -0.721) 6.256 15.885 ( 0.650 0.000 0.989) 1.184 16.065 ( -2.063 0.000 8.482) 8.729 16.361 ( 2.374 0.000 2.499) 3.447 17.290 ( -19.910 0.000 -15.280) 25.098 18.263 ( 6.606 0.000 -31.947) 32.623 18.595 ( 6.506 0.000 8.974) 11.085 20.028 ( -8.217 0.000 -14.149) 16.362 ======================= 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| 1.694 ( -20.503 0.000 -1.805) 20.582 2.052 ( -25.513 0.000 -7.459) 26.581 2.464 ( -0.324 0.000 10.293) 10.298 2.919 ( 19.506 0.000 -1.085) 19.537 2.989 ( -8.103 0.000 -7.611) 11.117 3.421 ( 6.942 0.000 -14.928) 16.464 3.501 ( -20.096 0.000 -13.121) 24.001 3.863 ( -18.080 0.000 2.005) 18.190 4.096 ( -16.853 0.000 -3.318) 17.176 4.479 ( 4.474 0.000 4.833) 6.586 4.769 ( -1.691 0.000 -9.943) 10.086 5.066 ( 0.740 0.000 -2.359) 2.473 5.211 ( 7.923 0.000 0.796) 7.963 5.774 ( 9.615 0.000 -15.259) 18.036 6.225 ( -6.910 0.000 -2.430) 7.324 6.450 ( 12.861 0.000 -4.891) 13.760 7.172 ( 14.666 0.000 8.436) 16.919 7.483 ( -7.609 0.000 -2.193) 7.919 7.715 ( -0.077 0.000 -4.136) 4.137 8.333 ( 0.423 0.000 -11.861) 11.868 8.584 ( -4.691 0.000 19.601) 20.154 9.093 ( -3.680 0.000 -4.381) 5.722 9.235 ( -9.881 0.000 16.847) 19.531 9.952 ( -5.035 0.000 9.740) 10.964 10.492 ( -3.633 0.000 -6.757) 7.672 11.001 ( -0.158 0.000 -1.711) 1.719 11.232 ( 13.495 0.000 6.306) 14.896 11.377 ( 6.296 0.000 -9.885) 11.720 11.409 ( 9.861 0.000 -3.738) 10.546 11.523 ( -6.720 0.000 -6.037) 9.034 11.983 ( -2.678 0.000 -0.658) 2.758 12.000 ( -3.297 0.000 9.091) 9.670 12.266 ( 6.740 0.000 11.686) 13.491 12.546 ( 7.138 0.000 -7.609) 10.433 12.806 ( 5.323 0.000 4.635) 7.058 13.110 ( -7.522 0.000 5.898) 9.559 13.827 ( 2.624 0.000 5.680) 6.257 13.877 ( 6.845 0.000 11.810) 13.651 15.090 ( 0.456 0.000 7.856) 7.869 15.291 ( 0.758 0.000 4.475) 4.538 15.726 ( 3.531 0.000 -0.611) 3.583 15.859 ( -5.509 0.000 -1.315) 5.664 16.161 ( 2.690 0.000 9.972) 10.329 16.449 ( 3.318 0.000 2.973) 4.455 16.738 ( -17.986 0.000 -16.505) 24.411 17.979 ( 2.671 0.000 -42.645) 42.729 18.830 ( 8.539 0.000 7.536) 11.389 19.710 ( -9.268 0.000 -16.792) 19.180 ======================= 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| 1.388 ( -17.729 0.000 8.366) 19.604 1.525 ( -25.965 0.000 -1.853) 26.031 2.441 ( -38.066 0.000 0.038) 38.066 2.630 ( 6.187 0.000 3.025) 6.887 3.208 ( 9.673 0.000 -1.654) 9.813 3.237 ( 1.203 0.000 -7.705) 7.798 3.365 ( 2.634 0.000 -11.486) 11.784 3.582 ( -12.512 0.000 0.867) 12.542 3.795 ( -8.268 0.000 -3.622) 9.026 4.612 ( 2.109 0.000 8.907) 9.153 4.635 ( -4.174 0.000 -6.298) 7.556 5.044 ( 0.185 0.000 -1.931) 1.940 5.426 ( 12.063 0.000 4.111) 12.744 5.856 ( 14.092 0.000 -12.499) 18.837 6.073 ( -4.025 0.000 -7.414) 8.436 6.647 ( 9.040 0.000 1.834) 9.224 7.292 ( -9.294 0.000 -3.668) 9.991 7.505 ( 11.252 0.000 7.902) 13.749 7.709 ( 3.447 0.000 -2.408) 4.205 8.127 ( -3.825 0.000 -15.930) 16.383 8.758 ( 2.096 0.000 20.231) 20.340 9.089 ( -0.990 0.000 3.967) 4.088 9.171 ( -10.074 0.000 5.182) 11.329 9.873 ( -7.035 0.000 -1.579) 7.211 10.530 ( 17.507 0.000 -9.041) 19.703 10.946 ( -0.840 0.000 -3.254) 3.360 11.299 ( -1.121 0.000 -8.048) 8.125 11.408 ( -2.488 0.000 -2.512) 3.536 11.426 ( -3.590 0.000 5.670) 6.711 11.593 ( 14.839 0.000 -5.710) 15.900 11.973 ( 3.922 0.000 0.043) 3.922 12.193 ( 7.036 0.000 18.963) 20.226 12.397 ( 2.555 0.000 2.308) 3.443 12.661 ( 8.090 0.000 -2.092) 8.356 12.975 ( 5.434 0.000 8.046) 9.709 13.035 ( -5.062 0.000 5.270) 7.307 13.953 ( 1.917 0.000 10.274) 10.452 14.102 ( 5.013 0.000 10.655) 11.775 15.162 ( -2.870 0.000 8.964) 9.412 15.430 ( 6.046 0.000 13.654) 14.933 15.555 ( -20.728 0.000 -9.890) 22.967 15.746 ( -0.098 0.000 -0.398) 0.410 16.347 ( 6.396 0.000 8.208) 10.405 16.389 ( -3.663 0.000 -4.439) 5.755 16.581 ( 3.459 0.000 1.906) 3.950 17.437 ( -8.228 0.000 -57.970) 58.551 19.041 ( 7.025 0.000 5.902) 9.176 19.358 ( -10.304 0.000 -16.397) 19.366 ======================= 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| 1.111 ( -22.940 0.000 7.745) 24.213 1.118 ( -21.790 0.000 10.437) 24.160 1.828 ( -34.047 0.000 23.969) 41.638 2.814 ( 5.796 0.000 6.006) 8.347 3.094 ( -14.927 0.000 -2.030) 15.065 3.257 ( 4.184 0.000 -0.228) 4.190 3.347 ( 3.072 0.000 -1.691) 3.507 3.468 ( -0.189 0.000 0.721) 0.745 3.837 ( 13.827 0.000 -6.378) 15.227 4.493 ( -5.299 0.000 -3.437) 6.316 4.736 ( -0.128 0.000 11.410) 11.411 5.056 ( 1.884 0.000 0.631) 1.987 5.683 ( 6.232 0.000 7.121) 9.463 5.949 ( 3.543 0.000 -11.261) 11.805 5.994 ( 12.297 0.000 -9.457) 15.513 6.759 ( -3.504 0.000 7.230) 8.035 7.104 ( -5.929 0.000 -3.742) 7.011 7.688 ( 1.683 0.000 5.862) 6.099 7.810 ( 5.452 0.000 3.706) 6.593 7.967 ( 1.650 0.000 -8.585) 8.742 8.955 ( -13.344 0.000 -5.303) 14.359 9.038 ( -7.660 0.000 1.336) 7.775 9.092 ( 15.491 0.000 13.496) 20.546 9.807 ( 9.612 0.000 -12.230) 15.555 10.850 ( 24.435 0.000 -9.869) 26.353 10.938 ( 3.029 0.000 -1.701) 3.474 11.056 ( -15.582 0.000 -9.375) 18.185 11.365 ( -0.398 0.000 -0.240) 0.465 11.417 ( -0.223 0.000 2.642) 2.651 11.772 ( 8.755 0.000 -1.862) 8.950 12.058 ( 3.743 0.000 -0.536) 3.781 12.463 ( 3.351 0.000 -0.530) 3.393 12.469 ( 2.408 0.000 2.389) 3.392 12.747 ( 6.165 0.000 -5.813) 8.473 13.121 ( 7.702 0.000 4.321) 8.831 13.124 ( 1.616 0.000 6.599) 6.794 14.060 ( -2.254 0.000 4.341) 4.891 14.250 ( 1.516 0.000 2.380) 2.822 14.967 ( -25.291 0.000 4.752) 25.734 15.248 ( -3.506 0.000 1.933) 4.004 15.655 ( -0.604 0.000 -2.985) 3.045 16.047 ( 29.355 0.000 46.702) 55.162 16.359 ( 0.273 0.000 1.444) 1.470 16.466 ( -28.995 0.000 -56.540) 63.541 16.515 ( 4.106 0.000 2.260) 4.687 16.652 ( 2.274 0.000 0.660) 2.368 19.049 ( -7.380 0.000 -9.043) 11.672 19.205 ( 4.351 0.000 5.803) 7.253 ======================= 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| 0.929 ( -8.582 0.000 23.966) 25.456 0.987 ( -11.597 0.000 23.911) 26.575 1.737 ( -14.360 0.000 43.108) 45.437 2.806 ( -12.835 0.000 -0.680) 12.853 2.935 ( -0.404 0.000 8.493) 8.503 3.367 ( 3.871 0.000 7.133) 8.116 3.459 ( 6.846 0.000 6.589) 9.502 3.550 ( 7.945 0.000 -3.546) 8.700 4.004 ( 11.407 0.000 -8.802) 14.408 4.408 ( -0.913 0.000 -0.833) 1.236 4.823 ( -3.686 0.000 11.747) 12.312 5.108 ( 1.795 0.000 1.715) 2.483 5.650 ( -7.177 0.000 -3.341) 7.917 6.068 ( 10.246 0.000 -1.649) 10.378 6.081 ( 5.680 0.000 -7.048) 9.052 6.667 ( -11.635 0.000 6.539) 13.347 7.015 ( -1.303 0.000 -2.631) 2.936 7.719 ( -7.074 0.000 6.529) 9.626 7.911 ( 2.194 0.000 2.050) 3.003 8.051 ( 11.529 0.000 1.893) 11.684 8.619 ( -13.168 0.000 -4.751) 13.999 8.894 ( -7.504 0.000 0.179) 7.506 9.572 ( 25.293 0.000 4.031) 25.613 9.942 ( 19.544 0.000 -17.647) 26.332 10.592 ( -24.956 0.000 -6.356) 25.753 10.986 ( 2.236 0.000 2.237) 3.163 11.139 ( 18.136 0.000 -13.550) 22.639 11.400 ( 3.106 0.000 2.108) 3.754 11.439 ( -5.331 0.000 1.761) 5.615 11.784 ( -14.054 0.000 -10.561) 17.580 12.018 ( -11.330 0.000 -3.792) 11.948 12.249 ( -5.595 0.000 -3.593) 6.650 12.489 ( -1.388 0.000 -2.661) 3.002 12.778 ( 4.394 0.000 -9.085) 10.092 13.054 ( -8.704 0.000 -13.523) 16.082 13.157 ( -2.417 0.000 2.177) 3.252 13.887 ( -5.698 0.000 -6.468) 8.620 14.055 ( -15.121 0.000 -10.352) 18.325 14.854 ( -3.333 0.000 25.151) 25.371 15.207 ( -3.502 0.000 1.226) 3.711 15.465 ( -8.037 0.000 -10.947) 13.580 15.759 ( -8.542 0.000 -2.027) 8.780 16.403 ( 1.016 0.000 4.943) 5.047 16.530 ( -1.491 0.000 -3.996) 4.265 16.667 ( -0.424 0.000 -1.079) 1.159 17.619 ( 68.153 0.000 38.178) 78.118 19.056 ( 19.490 0.000 6.878) 20.668 19.309 ( 0.221 0.000 5.918) 5.922 ======================= 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| 1.231 ( 3.244 10.303 20.760) 23.402 1.354 ( 5.701 12.140 24.098) 27.579 2.327 ( 3.986 15.946 31.103) 35.179 2.658 ( -1.523 0.416 2.879) 3.284 2.953 ( -1.195 -3.268 7.438) 8.212 3.594 ( 1.948 6.666 9.840) 12.044 3.627 ( 2.573 0.925 1.373) 3.059 3.791 ( 9.303 6.160 9.935) 14.940 4.104 ( 5.596 3.955 -8.498) 10.917 4.508 ( 5.098 5.278 3.451) 8.109 4.745 ( -7.522 -7.327 8.989) 13.822 5.141 ( 0.091 0.889 3.250) 3.370 5.499 ( -5.777 2.902 -6.527) 9.187 5.941 ( 2.271 -8.036 -3.083) 8.901 6.256 ( -0.575 3.917 7.465) 8.449 6.587 ( -7.768 2.440 5.196) 9.659 7.039 ( 3.019 5.192 -0.406) 6.020 7.592 ( -13.916 7.304 -1.280) 15.769 8.071 ( -2.886 13.659 1.111) 14.005 8.320 ( 11.712 -4.979 12.335) 17.723 8.648 ( 11.651 5.823 0.047) 13.025 8.910 ( -1.249 7.242 4.374) 8.552 9.590 ( 11.053 -18.864 -7.752) 23.197 10.043 ( -24.861 -7.999 -4.066) 26.431 10.346 ( -24.021 -9.949 0.010) 26.000 10.427 ( 20.395 5.660 -6.231) 22.064 11.105 ( 0.887 -1.153 -11.291) 11.384 11.340 ( 2.846 2.982 2.944) 5.065 11.445 ( 1.592 -5.010 3.014) 6.059 11.644 ( -0.027 4.546 5.014) 6.768 11.961 ( -1.873 -2.795 -1.333) 3.619 12.254 ( -1.436 -1.777 -3.690) 4.340 12.394 ( -9.723 -7.287 -7.665) 14.366 12.518 ( 6.236 2.733 3.436) 7.627 12.980 ( -5.572 -7.064 -3.950) 9.826 13.040 ( 1.551 6.965 -1.443) 7.280 13.605 ( -5.481 -8.317 -6.506) 11.897 13.832 ( -5.911 0.004 -7.152) 9.279 14.699 ( -5.474 -23.558 8.522) 25.643 14.969 ( 6.755 -14.414 9.163) 18.367 15.704 ( -4.730 14.620 -5.760) 16.410 15.866 ( 0.391 10.534 -0.332) 10.546 16.360 ( -6.772 -2.317 -6.521) 9.683 16.539 ( -0.601 -1.363 -3.192) 3.522 16.660 ( 3.331 8.148 15.459) 17.789 18.486 ( 7.563 5.950 -7.682) 12.313 19.330 ( -4.323 2.170 3.276) 5.842 20.020 ( 43.638 2.830 -5.603) 44.087 ======================= 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| 1.550 ( 9.005 8.976 19.126) 22.966 1.698 ( 4.632 13.188 23.244) 27.123 2.655 ( 12.849 -2.465 -2.490) 13.318 2.849 ( 9.505 5.589 7.052) 13.088 3.064 ( 6.091 -1.344 17.617) 18.688 3.616 ( -6.916 2.521 5.505) 9.192 3.739 ( 1.254 4.326 10.383) 11.318 3.961 ( -2.688 2.842 -3.652) 5.352 4.166 ( 9.064 4.634 8.194) 13.068 4.654 ( 3.066 -1.196 2.553) 4.165 4.725 ( 0.426 0.632 6.902) 6.944 5.158 ( -0.922 4.140 1.673) 4.559 5.356 ( -3.531 6.351 -3.950) 8.271 5.922 ( 0.976 -3.989 -5.463) 6.835 6.370 ( 1.137 0.439 11.601) 11.665 6.511 ( -4.665 1.352 1.867) 5.204 7.106 ( 0.850 7.037 0.710) 7.124 7.304 ( -9.990 12.377 -4.234) 16.460 8.026 ( -4.522 12.229 5.402) 14.113 8.621 ( 2.251 5.674 -6.564) 8.963 8.779 ( 10.009 -5.442 10.397) 15.424 9.169 ( 11.652 5.973 16.073) 20.731 9.469 ( -15.481 -6.405 0.235) 16.755 9.761 ( -3.116 -14.507 -0.140) 14.838 10.053 ( -4.069 -7.891 -5.477) 10.432 10.709 ( 19.536 8.230 -12.809) 24.768 10.893 ( -7.938 3.479 -16.015) 18.209 11.449 ( 0.503 -2.698 5.333) 5.998 11.557 ( 5.889 -1.541 4.610) 7.636 11.653 ( -2.281 2.484 1.137) 3.559 11.885 ( -6.302 -7.337 -3.648) 10.337 12.092 ( -8.798 -1.850 -1.614) 9.134 12.251 ( -0.402 -3.071 2.241) 3.823 12.638 ( 3.473 4.746 1.792) 6.148 12.805 ( -6.925 -8.273 -5.402) 12.065 13.099 ( 2.914 9.234 0.865) 9.721 13.445 ( -4.871 -6.959 -5.100) 9.908 13.713 ( -0.182 -5.414 -7.151) 8.971 14.646 ( -6.458 -24.521 4.765) 25.801 15.154 ( 6.803 -18.230 1.512) 19.516 15.627 ( -1.546 8.758 0.567) 8.911 15.873 ( 0.925 7.915 -2.462) 8.340 16.161 ( -7.748 -2.473 -3.693) 8.932 16.455 ( -2.848 -3.322 -4.916) 6.581 16.981 ( 9.845 13.096 21.784) 27.257 18.519 ( 6.328 2.449 -10.416) 12.431 19.204 ( -11.212 3.415 -0.058) 11.721 20.437 ( 14.494 -3.995 -11.595) 18.986 ======================= 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| 1.917 ( 12.274 7.638 13.409) 19.718 1.993 ( 2.397 9.906 21.989) 24.236 2.827 ( 7.449 -2.251 -7.515) 10.818 2.924 ( 6.358 0.580 -5.681) 8.546 3.404 ( -6.257 4.793 6.589) 10.273 3.541 ( 7.793 -5.588 -0.078) 9.589 3.783 ( -5.285 5.525 -2.808) 8.144 3.878 ( -2.152 1.781 17.745) 17.964 4.435 ( 6.216 0.161 9.953) 11.736 4.645 ( -0.616 -5.936 -3.140) 6.744 4.885 ( 6.325 8.896 4.965) 11.991 5.140 ( -0.418 5.648 -3.109) 6.461 5.294 ( -1.654 10.828 0.462) 10.963 5.880 ( 2.225 -1.726 -8.279) 8.745 6.399 ( -4.996 -2.681 0.480) 5.690 6.520 ( 0.419 0.682 4.539) 4.609 6.909 ( -12.930 9.508 -1.245) 16.098 7.361 ( 9.119 12.947 3.678) 16.257 8.010 ( -3.880 10.721 5.796) 12.790 8.493 ( -3.691 6.337 -8.975) 11.590 8.841 ( -15.071 -0.300 7.104) 16.664 9.274 ( -10.568 -3.123 8.584) 13.968 9.551 ( 11.853 -12.324 17.077) 24.166 9.935 ( 12.828 -3.803 -7.090) 15.142 10.025 ( 11.724 -2.928 4.044) 12.743 10.501 ( -12.915 3.674 -18.436) 22.807 10.906 ( 17.253 3.695 -15.036) 23.182 11.395 ( -15.356 1.015 3.205) 15.720 11.553 ( -4.659 0.157 -0.531) 4.692 11.627 ( 0.022 -0.656 -0.011) 0.656 11.868 ( 7.887 -4.269 5.461) 10.500 12.074 ( 0.338 -7.619 4.226) 8.719 12.272 ( -2.378 1.581 4.005) 4.919 12.573 ( -10.133 -7.411 -9.237) 15.586 12.700 ( 2.653 -0.496 -0.756) 2.803 13.166 ( 2.517 9.671 2.539) 10.311 13.338 ( -2.493 -6.507 -2.169) 7.297 13.665 ( 1.645 -7.276 -5.152) 9.066 14.592 ( -4.815 -24.573 5.628) 25.665 15.255 ( 5.345 -16.038 -2.086) 17.033 15.620 ( -1.494 6.795 1.387) 7.094 15.844 ( -0.226 3.918 -2.581) 4.697 16.045 ( -4.142 -2.280 2.263) 5.242 16.359 ( -2.514 -2.642 -3.395) 4.983 17.405 ( 11.624 11.191 19.426) 25.253 18.497 ( 4.944 0.752 -15.040) 15.849 18.935 ( -14.340 6.583 -4.905) 16.524 20.428 ( -0.606 -4.856 -10.949) 11.993 ======================= 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| 2.189 ( -1.280 4.354 14.180) 14.888 2.262 ( 13.559 6.711 5.866) 16.226 2.704 ( -12.438 0.262 -2.528) 12.695 2.930 ( -6.438 -2.867 -7.696) 10.436 3.261 ( 4.067 3.899 -10.042) 11.514 3.484 ( -6.332 8.577 -2.874) 11.042 3.905 ( 11.291 1.347 0.067) 11.372 4.025 ( -2.219 -4.199 12.619) 13.483 4.523 ( -3.921 -2.698 2.333) 5.300 4.581 ( -1.661 -3.338 -5.557) 6.692 5.005 ( 0.510 8.732 2.586) 9.121 5.079 ( 1.272 5.654 -8.014) 9.890 5.286 ( -0.874 11.869 1.084) 11.951 5.837 ( 4.068 -1.187 -11.413) 12.174 6.294 ( -3.055 -3.687 -5.554) 7.334 6.486 ( -4.324 2.072 -0.182) 4.798 6.797 ( -1.807 7.740 5.306) 9.557 7.572 ( 6.714 11.040 5.320) 13.974 7.981 ( -4.197 10.256 1.830) 11.231 8.361 ( -1.565 5.083 -4.857) 7.203 8.615 ( -13.488 -1.699 6.138) 14.916 9.195 ( -12.249 -1.745 17.867) 21.733 9.737 ( -4.926 -10.741 -15.555) 19.534 9.940 ( 1.407 -1.262 1.700) 2.542 10.256 ( 5.451 -2.521 1.769) 6.261 10.532 ( 23.275 0.720 10.839) 25.685 11.010 ( -2.464 -0.182 -3.326) 4.143 11.151 ( 2.879 7.826 -8.367) 11.813 11.480 ( -2.456 0.686 -3.459) 4.297 11.674 ( 2.461 -4.584 4.662) 6.986 12.059 ( -1.682 -7.660 -1.156) 7.927 12.092 ( 1.773 -3.166 2.092) 4.188 12.216 ( -4.495 1.483 2.210) 5.224 12.316 ( -7.034 -1.723 -1.537) 7.403 12.723 ( 2.388 -3.848 -4.867) 6.648 13.211 ( -0.969 5.523 3.159) 6.436 13.347 ( 3.040 -6.120 3.395) 7.631 13.674 ( 3.041 -5.919 -0.954) 6.722 14.585 ( -3.346 -24.088 7.109) 25.337 15.328 ( 5.022 -15.679 -1.666) 16.548 15.594 ( -1.453 10.955 0.509) 11.063 15.846 ( 0.741 0.251 1.815) 1.977 16.030 ( -1.824 -1.264 4.747) 5.240 16.313 ( -0.213 -1.825 -0.126) 1.841 17.676 ( -0.491 9.252 3.672) 9.967 18.407 ( 3.390 -0.303 -11.808) 12.289 18.663 ( -5.178 10.303 -9.769) 15.113 20.245 ( -6.141 -4.762 -11.621) 13.980 ======================= 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| 2.128 ( -14.270 3.055 -5.064) 15.448 2.416 ( -15.750 -1.650 10.857) 19.200 2.503 ( -0.434 1.365 -3.460) 3.744 2.701 ( 2.429 3.903 -4.710) 6.582 3.234 ( 1.108 10.491 -7.720) 13.073 3.448 ( 8.048 4.797 -10.595) 14.143 3.959 ( -10.918 -0.443 -1.898) 11.090 4.054 ( -2.359 1.512 5.003) 5.735 4.390 ( -9.439 -0.735 -1.596) 9.601 4.450 ( -3.851 -0.821 -6.799) 7.856 4.898 ( -5.464 1.945 -5.489) 7.985 5.091 ( 2.356 4.930 -2.634) 6.066 5.266 ( 1.172 10.672 -4.071) 11.482 5.798 ( 5.983 -0.368 -14.222) 15.434 6.201 ( -0.927 -6.604 -4.176) 7.868 6.436 ( 0.764 2.962 -4.338) 5.308 6.918 ( 8.251 5.795 7.338) 12.470 7.635 ( -2.964 6.006 -0.580) 6.723 7.899 ( -2.940 9.690 -3.654) 10.766 8.369 ( 2.585 3.355 2.844) 5.102 8.527 ( -5.191 1.312 9.091) 10.551 9.188 ( -10.528 -2.581 20.124) 22.858 9.347 ( -11.225 -4.256 -18.105) 21.723 9.960 ( -4.133 2.496 8.798) 10.036 10.494 ( 5.222 -9.665 4.654) 11.931 10.832 ( -4.863 -4.137 8.895) 10.949 11.020 ( 17.661 6.849 -0.792) 18.959 11.287 ( 16.677 4.283 -12.207) 21.107 11.392 ( -3.307 0.292 -2.823) 4.358 11.762 ( -6.294 -1.821 -2.327) 6.954 11.850 ( 1.551 -8.902 0.461) 9.047 12.127 ( -3.148 1.345 1.935) 3.932 12.152 ( -4.801 8.035 5.206) 10.710 12.366 ( 6.052 -9.142 0.909) 11.002 12.701 ( 1.283 -3.567 -3.365) 5.069 13.210 ( -3.931 4.025 4.346) 7.110 13.470 ( 5.506 -9.575 4.215) 11.822 13.772 ( 5.285 -1.945 5.561) 7.914 14.604 ( -2.858 -24.537 7.397) 25.786 15.394 ( 3.391 -19.261 -1.996) 19.659 15.609 ( 0.963 16.113 4.196) 16.679 15.899 ( 2.002 0.610 3.778) 4.319 16.071 ( -0.027 0.233 6.779) 6.783 16.349 ( 2.400 -1.218 2.870) 3.934 17.387 ( -18.972 9.302 -15.814) 26.392 18.398 ( 8.470 11.309 -25.563) 29.207 18.614 ( 4.760 2.134 6.339) 8.210 19.986 ( -7.756 -4.070 -13.892) 16.423 ======================= 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| 1.707 ( -23.676 1.373 0.748) 23.728 2.089 ( -19.603 5.073 -7.803) 21.700 2.470 ( -0.028 -0.685 7.566) 7.597 2.931 ( 16.840 1.692 -2.318) 17.082 3.157 ( -5.089 13.848 -5.853) 15.872 3.437 ( 1.018 2.897 -13.473) 13.819 3.638 ( -12.129 10.807 -10.218) 19.192 3.832 ( -17.781 -2.225 -0.492) 17.927 4.107 ( -16.607 0.910 -3.131) 16.924 4.480 ( 4.882 0.031 2.887) 5.672 4.776 ( -2.127 0.998 -5.856) 6.310 5.080 ( -0.685 1.473 -1.731) 2.374 5.291 ( 6.626 7.114 -3.771) 10.427 5.785 ( 9.518 1.262 -14.319) 17.240 6.141 ( -3.641 -6.494 -2.317) 7.797 6.464 ( 10.377 -0.256 -7.308) 12.695 7.211 ( 13.612 3.825 7.813) 16.154 7.498 ( -7.922 2.306 -4.084) 9.206 7.829 ( 0.872 9.541 -5.316) 10.956 8.419 ( 0.248 7.096 -9.735) 12.049 8.526 ( -5.488 -4.215 14.799) 16.337 9.098 ( -3.009 -0.458 -0.810) 3.149 9.206 ( -10.061 -1.982 17.571) 20.344 9.971 ( -6.098 1.628 9.992) 11.818 10.437 ( -3.244 -4.868 -5.960) 8.351 10.943 ( 1.886 -4.057 6.310) 7.735 11.223 ( 7.336 -7.700 -6.685) 12.562 11.343 ( 1.481 6.140 0.180) 6.319 11.447 ( 9.767 3.424 -6.040) 11.983 11.612 ( 1.204 4.701 -5.273) 7.167 11.933 ( -0.499 -4.871 0.460) 4.918 12.065 ( -4.649 5.616 9.337) 11.846 12.279 ( 5.798 1.421 10.016) 11.660 12.436 ( 6.065 -9.501 -5.841) 12.696 12.749 ( 3.705 -4.654 3.938) 7.134 13.140 ( -7.368 2.138 2.628) 8.110 13.627 ( 6.125 -10.956 5.781) 13.819 13.959 ( 5.810 0.983 9.636) 11.295 14.623 ( -3.024 -25.415 6.381) 26.378 15.367 ( -3.103 -23.226 -5.807) 24.141 15.726 ( 3.966 19.336 10.082) 22.164 15.996 ( 3.279 4.417 4.977) 7.418 16.171 ( 2.322 1.539 8.837) 9.266 16.440 ( 3.439 -1.073 3.504) 5.026 16.842 ( -18.817 11.019 -17.887) 28.204 18.195 ( 5.621 18.740 -37.305) 42.124 18.823 ( 7.396 -1.067 7.412) 10.525 19.687 ( -8.064 -2.279 -16.258) 18.291 ======================= 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| 1.361 ( -20.772 -0.129 10.798) 23.412 1.661 ( -20.565 12.078 -2.340) 23.964 2.587 ( -1.669 0.121 6.199) 6.421 2.724 ( -24.650 18.652 -5.721) 31.437 3.153 ( 7.109 -2.279 -2.216) 7.787 3.335 ( 1.013 6.651 -4.504) 8.096 3.475 ( -0.674 9.020 -9.454) 13.084 3.577 ( -6.782 0.742 -1.697) 7.030 3.817 ( -7.374 2.063 -3.455) 8.401 4.585 ( 1.373 -1.267 4.240) 4.633 4.674 ( -4.150 2.635 -1.559) 5.158 5.047 ( -0.675 0.005 -1.326) 1.488 5.437 ( 10.634 1.354 0.535) 10.733 5.872 ( 13.671 1.680 -10.821) 17.516 6.030 ( -2.819 -3.489 -6.805) 8.150 6.632 ( 10.013 -2.191 0.069) 10.250 7.281 ( -9.064 -0.129 -4.606) 10.168 7.532 ( 10.639 2.647 6.943) 12.977 7.838 ( 4.924 10.161 -2.496) 11.564 8.195 ( -5.262 5.766 -15.442) 17.303 8.680 ( 3.234 -5.742 15.912) 17.223 9.080 ( -4.610 -0.245 1.744) 4.935 9.179 ( -9.378 -0.202 12.695) 15.785 9.896 ( -6.691 2.040 0.914) 7.055 10.450 ( 14.826 -7.585 -9.907) 19.377 10.966 ( -1.074 2.063 -0.905) 2.495 11.231 ( 1.781 -5.153 -1.840) 5.754 11.414 ( 0.235 -0.956 6.924) 6.993 11.441 ( -4.789 3.900 -7.468) 9.691 11.692 ( 10.903 6.274 -4.975) 13.527 11.935 ( 2.250 -3.481 1.105) 4.290 12.158 ( 0.330 -3.029 14.621) 14.935 12.405 ( 3.184 -1.988 0.061) 3.754 12.551 ( 7.268 -6.748 0.892) 9.958 12.855 ( -2.324 -9.072 6.041) 11.144 13.062 ( -0.208 2.179 4.065) 4.616 13.811 ( 5.408 -9.013 9.597) 14.233 14.143 ( 3.646 0.898 7.683) 8.552 14.610 ( -4.735 -26.859 4.441) 27.632 15.141 ( -12.548 -22.234 -9.988) 27.414 15.955 ( 6.625 14.997 14.947) 22.186 16.066 ( -3.175 21.877 5.067) 22.680 16.305 ( 2.426 -0.523 3.703) 4.458 16.442 ( -3.795 4.385 -4.359) 7.255 16.548 ( 1.861 -2.463 0.735) 3.174 17.861 ( 5.528 34.238 -46.406) 57.934 18.988 ( 3.040 -5.176 3.851) 7.132 19.387 ( -6.066 2.471 -14.102) 15.549 ======================= 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| 1.150 ( -16.933 5.103 15.377) 23.435 1.284 ( -22.499 14.694 5.213) 27.374 2.155 ( -27.063 26.265 16.155) 41.027 2.787 ( 4.740 -2.267 5.192) 7.386 3.049 ( -13.804 -4.618 -0.918) 14.585 3.360 ( 5.026 9.620 0.911) 10.892 3.434 ( 1.067 7.432 -0.925) 7.565 3.485 ( -0.154 2.498 -0.784) 2.622 3.868 ( 13.697 3.012 -6.602) 15.501 4.515 ( -4.899 2.005 -2.965) 6.067 4.707 ( -1.460 -2.282 10.589) 10.930 5.046 ( 0.913 -1.119 0.964) 1.736 5.644 ( 7.507 -3.230 3.792) 9.009 5.908 ( 0.600 -2.581 -11.379) 11.684 6.042 ( 12.789 3.368 -5.373) 14.275 6.757 ( -1.740 -0.940 6.485) 6.780 7.091 ( -6.040 -0.175 -3.099) 6.791 7.723 ( 3.223 2.401 5.940) 7.172 7.963 ( 5.981 6.034 1.371) 8.606 8.000 ( 0.603 9.578 -8.068) 12.538 8.881 ( -9.593 -2.429 -2.707) 10.260 8.978 ( 10.753 -7.976 6.429) 14.852 9.114 ( -9.249 2.206 6.821) 11.701 9.869 ( 9.254 4.326 -7.252) 12.527 10.711 ( 22.856 -12.203 -10.956) 28.131 10.899 ( -3.426 -2.165 -4.892) 6.352 11.133 ( -15.734 4.298 -7.892) 18.119 11.316 ( 3.149 -1.683 3.572) 5.050 11.476 ( 0.529 3.041 4.016) 5.066 11.817 ( 6.687 0.692 -5.889) 8.937 11.999 ( 0.251 -6.617 2.689) 7.147 12.304 ( -1.329 -15.161 11.661) 19.173 12.428 ( -0.270 -7.471 -4.164) 8.558 12.594 ( 0.733 -7.684 -9.661) 12.366 12.844 ( -4.813 -10.821 16.386) 20.218 13.199 ( 7.288 3.909 -0.124) 8.271 13.976 ( -1.351 -7.186 4.806) 8.750 14.175 ( -1.470 -6.003 -3.868) 7.291 14.582 ( -3.634 -22.061 10.079) 24.525 14.800 ( -15.031 -11.797 0.698) 19.120 15.944 ( -6.396 20.766 -1.391) 21.773 16.254 ( 1.621 4.785 8.998) 10.319 16.353 ( 1.916 -0.457 3.854) 4.329 16.472 ( 1.317 -2.902 0.345) 3.205 16.554 ( 0.455 0.482 -1.464) 1.607 17.661 ( 26.609 67.060 -28.963) 77.743 18.945 ( -5.338 -7.973 -2.512) 9.919 19.291 ( 2.666 6.031 -0.187) 6.596 ======================= 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| 1.044 ( -8.740 10.738 18.457) 23.073 1.127 ( -7.855 13.613 20.595) 25.907 2.064 ( -12.246 26.815 33.145) 44.358 2.778 ( -12.539 -2.730 1.867) 12.967 2.897 ( -0.205 -3.501 6.227) 7.147 3.470 ( 3.251 8.565 3.593) 9.841 3.516 ( 4.859 3.021 7.551) 9.474 3.570 ( 8.157 5.502 0.115) 9.840 4.034 ( 11.588 2.850 -8.659) 14.744 4.444 ( -0.344 3.383 0.013) 3.400 4.763 ( -4.991 -5.228 11.044) 13.199 5.092 ( 1.510 -1.326 2.886) 3.516 5.663 ( -5.513 0.892 -2.838) 6.264 5.897 ( 7.369 -9.338 -6.605) 13.606 6.194 ( 5.477 4.881 0.162) 7.338 6.696 ( -10.284 1.842 6.871) 12.505 7.020 ( -0.320 1.354 -0.818) 1.614 7.763 ( -6.357 3.942 5.485) 9.276 7.978 ( 6.561 -1.390 -0.458) 6.722 8.156 ( 6.656 15.907 3.585) 17.612 8.595 ( -10.992 0.758 -2.498) 11.298 8.989 ( -6.753 5.596 0.178) 8.772 9.331 ( 19.994 -16.714 -1.704) 26.116 10.082 ( 21.049 6.970 -7.856) 23.524 10.594 ( -22.721 -2.056 -9.580) 24.743 10.793 ( -16.728 -14.406 -0.609) 22.085 11.006 ( 19.522 -10.486 -12.278) 25.334 11.393 ( 1.286 -0.676 1.718) 2.250 11.525 ( -6.797 2.684 2.424) 7.700 11.621 ( -15.047 -11.760 -1.567) 19.162 11.993 ( -1.217 0.971 0.808) 1.754 12.297 ( -0.674 4.502 -0.776) 4.618 12.402 ( 2.229 -11.265 0.760) 11.509 12.542 ( 0.677 -9.847 -6.299) 11.709 12.940 ( -0.708 -7.518 9.654) 12.256 13.196 ( -1.302 4.642 -11.850) 12.793 13.778 ( -7.276 -7.454 -8.080) 13.183 14.076 ( -8.894 0.384 -8.005) 11.972 14.644 ( -4.642 -21.824 17.739) 28.505 14.773 ( 1.797 -8.500 11.906) 14.738 15.847 ( -2.666 18.986 -2.404) 19.322 15.996 ( -11.899 9.399 -12.652) 19.749 16.447 ( 1.388 5.296 7.444) 9.241 16.499 ( -0.589 -3.343 -2.190) 4.040 16.598 ( 0.835 -3.545 0.868) 3.744 18.273 ( 35.257 36.779 -7.230) 51.458 19.074 ( 28.095 4.755 10.092) 30.229 19.366 ( 3.945 5.117 3.628) 7.410 ======================= 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| 1.518 ( 7.648 15.993 13.022) 21.996 1.636 ( 5.657 15.134 17.464) 23.791 2.517 ( 0.283 -1.704 0.225) 1.741 2.778 ( 1.525 2.049 11.891) 12.162 2.939 ( -4.678 12.694 16.958) 21.693 3.650 ( 3.444 1.329 5.723) 6.810 3.756 ( 2.574 7.391 3.984) 8.782 3.953 ( 3.964 8.778 5.324) 11.005 4.218 ( 6.071 6.865 -5.624) 10.753 4.549 ( -7.263 -7.151 6.693) 12.193 4.685 ( 5.374 7.925 8.358) 12.710 5.165 ( 2.492 0.928 6.500) 7.023 5.549 ( -1.522 1.722 -7.366) 7.716 5.790 ( 4.592 -5.841 -0.697) 7.463 6.336 ( -3.034 3.779 7.756) 9.146 6.612 ( -9.074 -0.394 6.752) 11.318 7.220 ( 5.320 12.146 4.617) 14.041 7.759 ( -8.201 8.130 0.768) 11.573 8.134 ( 13.047 -5.483 11.984) 18.545 8.532 ( -8.824 20.343 -0.117) 22.174 8.812 ( 14.094 11.677 -2.270) 18.443 8.959 ( 0.040 -5.107 4.618) 6.885 9.241 ( 11.459 -14.287 -1.084) 18.347 9.862 ( -26.104 -3.886 -2.358) 26.497 10.142 ( -18.033 -5.674 -0.494) 18.911 10.629 ( 21.380 6.697 -13.286) 26.047 10.990 ( 10.918 -8.331 -7.322) 15.563 11.278 ( 1.165 -9.192 3.538) 9.918 11.375 ( -0.555 -0.680 1.962) 2.149 11.700 ( -4.196 -9.328 -3.949) 10.965 11.843 ( 0.019 -1.650 -3.430) 3.806 12.117 ( 0.184 -3.695 0.229) 3.707 12.392 ( -5.108 4.777 -5.015) 8.606 12.705 ( 4.759 11.896 8.655) 15.462 12.867 ( -7.779 -1.474 -3.348) 8.596 13.158 ( 2.208 3.027 -1.445) 4.016 13.409 ( -4.422 -10.406 -8.314) 14.035 13.784 ( -10.272 -5.912 -9.976) 15.492 14.251 ( -5.555 -17.672 4.444) 19.050 14.686 ( 2.621 -13.291 2.317) 13.743 15.894 ( -6.091 5.368 -6.219) 10.227 16.031 ( -1.346 5.009 -4.718) 7.011 16.302 ( -6.038 -3.096 -6.586) 9.456 16.454 ( -2.344 -5.299 -4.882) 7.577 16.979 ( 5.836 20.880 19.361) 29.067 18.503 ( 1.753 -5.190 -3.401) 6.447 19.430 ( -1.315 7.390 -1.121) 7.589 20.041 ( 28.565 -1.388 -5.912) 29.204 ======================= 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| 1.803 ( 9.656 14.687 12.345) 21.479 1.980 ( 8.837 12.933 17.496) 23.483 2.613 ( 11.850 -2.096 -3.960) 12.669 2.877 ( 1.374 -4.261 1.551) 4.738 3.122 ( 5.352 8.224 17.930) 20.440 3.681 ( -6.199 2.874 2.205) 7.180 3.845 ( -0.606 5.351 8.729) 10.257 4.018 ( -1.953 2.224 -0.487) 3.000 4.272 ( 4.061 4.936 4.620) 7.887 4.522 ( -0.842 -6.327 2.689) 6.926 4.910 ( 8.365 12.465 9.093) 17.551 5.256 ( 1.784 4.572 2.659) 5.582 5.510 ( 2.054 8.494 -1.336) 8.840 5.842 ( 3.365 -3.006 -3.359) 5.625 6.373 ( -3.798 -0.170 9.661) 10.382 6.527 ( -5.049 -0.232 3.535) 6.168 7.355 ( 0.442 16.741 3.975) 17.212 7.590 ( -5.373 14.334 -0.821) 15.330 8.377 ( -3.427 20.061 0.813) 20.368 8.597 ( 13.648 -5.927 16.404) 22.147 8.787 ( -1.848 2.825 -6.593) 7.407 9.280 ( 2.742 -9.270 1.915) 9.855 9.314 ( -2.439 4.922 7.114) 8.988 9.503 ( -0.814 -7.544 1.650) 7.766 9.850 ( -5.793 -10.166 -5.921) 13.113 10.828 ( 8.362 -1.334 -14.638) 16.911 10.947 ( -0.703 3.914 -10.356) 11.094 11.353 ( 2.192 -8.346 4.597) 9.777 11.481 ( 7.748 -7.117 0.374) 10.527 11.579 ( -0.971 -8.215 -2.774) 8.725 11.810 ( -4.824 3.133 1.680) 5.993 12.052 ( -6.035 0.796 -1.138) 6.193 12.303 ( -0.074 5.192 -0.481) 5.214 12.605 ( -11.504 -6.960 -4.842) 14.291 12.793 ( -1.534 6.469 -0.229) 6.652 13.257 ( 3.383 3.455 3.112) 5.750 13.277 ( -1.022 -7.579 -7.100) 10.436 13.550 ( -4.205 -9.556 -7.720) 12.985 14.178 ( -6.409 -18.213 5.007) 19.946 14.753 ( 3.999 -19.707 -0.793) 20.125 15.771 ( -2.613 5.085 -2.369) 6.189 15.978 ( -0.129 2.767 -3.988) 4.856 16.103 ( -7.788 -2.688 -4.693) 9.481 16.361 ( -2.263 -5.535 -5.039) 7.819 17.314 ( 8.749 18.164 19.675) 28.171 18.508 ( 2.850 -4.437 -5.312) 7.485 19.334 ( -6.689 9.227 -3.153) 11.825 20.308 ( 9.932 -8.571 -9.056) 15.941 ======================= 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| 2.110 ( 10.773 10.858 9.847) 18.192 2.247 ( 1.754 13.202 16.156) 20.938 2.790 ( 7.849 -1.523 -6.047) 10.025 2.898 ( 3.843 -3.195 -1.579) 5.242 3.432 ( 6.687 -4.492 0.997) 8.117 3.510 ( -2.894 4.087 1.970) 5.382 3.868 ( -7.474 3.427 6.327) 10.375 3.948 ( -2.630 3.666 3.616) 5.782 4.427 ( 4.116 -0.459 5.626) 6.986 4.535 ( 1.157 -4.059 -2.066) 4.699 5.142 ( 7.175 14.542 6.937) 17.637 5.280 ( 0.139 7.683 -1.463) 7.822 5.556 ( 1.723 13.750 1.135) 13.904 5.849 ( 3.284 -0.910 -7.124) 7.897 6.329 ( -7.533 -3.519 3.413) 8.987 6.522 ( -0.279 -1.021 1.586) 1.907 7.194 ( -11.790 17.574 -1.872) 21.245 7.706 ( 9.022 19.513 5.543) 22.201 8.316 ( -4.479 18.115 2.862) 18.879 8.644 ( -2.492 6.113 -9.440) 11.519 8.822 ( -18.385 -1.074 6.366) 19.485 9.115 ( 6.472 -13.052 4.082) 15.130 9.354 ( -8.668 -4.399 17.164) 19.725 9.821 ( 11.881 -7.124 -10.125) 17.159 9.910 ( 22.025 -7.038 8.408) 24.604 10.530 ( -14.568 -3.415 -13.001) 19.822 10.971 ( 9.382 2.420 -10.801) 14.509 11.436 ( -0.774 1.591 2.260) 2.870 11.488 ( -4.538 -9.507 4.386) 11.412 11.585 ( -2.326 1.277 -5.056) 5.710 11.778 ( 5.801 -3.587 0.998) 6.893 12.012 ( -0.060 2.534 4.377) 5.058 12.303 ( -1.674 -0.942 -6.648) 6.919 12.378 ( -7.332 -7.076 2.068) 10.397 12.712 ( -3.549 -1.287 -4.319) 5.737 13.240 ( 1.885 -4.666 -1.628) 5.289 13.246 ( -2.924 -3.697 -2.150) 5.180 13.507 ( 1.957 -2.236 -0.978) 3.128 14.145 ( -4.755 -16.828 8.215) 19.320 14.818 ( 4.776 -23.863 -2.148) 24.431 15.740 ( -0.349 4.029 0.985) 4.162 15.912 ( -2.877 2.812 -3.401) 5.267 15.990 ( -1.968 -2.808 0.790) 3.519 16.281 ( -1.603 -4.800 -3.083) 5.926 17.674 ( 9.479 13.922 16.523) 23.594 18.474 ( 0.560 -3.241 -8.376) 8.998 19.137 ( -8.123 12.447 -7.472) 16.636 20.275 ( -1.351 -9.950 -10.004) 14.175 ======================= 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| 2.314 ( -2.383 7.541 10.516) 13.158 2.425 ( 8.030 8.159 3.309) 11.916 2.721 ( -9.632 1.351 0.377) 9.734 2.874 ( -9.023 -2.795 -3.105) 9.943 3.344 ( 11.186 4.176 -14.129) 18.499 3.674 ( -3.518 8.313 -0.057) 9.027 3.866 ( 12.621 -5.502 -1.879) 13.896 3.977 ( -4.678 -0.041 11.838) 12.729 4.476 ( -1.841 -1.496 -0.510) 2.426 4.512 ( -0.261 -2.631 -4.444) 5.171 5.212 ( -7.042 9.061 -0.942) 11.514 5.266 ( 2.067 12.762 -0.397) 12.935 5.570 ( 0.445 14.879 -2.637) 15.117 5.820 ( 3.878 -0.154 -10.825) 11.500 6.208 ( -5.327 -4.107 -3.404) 7.539 6.501 ( -0.872 -1.046 -2.766) 3.084 7.036 ( -3.994 15.136 1.622) 15.738 7.885 ( 3.911 18.509 1.333) 18.964 8.242 ( -4.534 13.146 -2.864) 14.198 8.488 ( -14.516 -0.352 -0.413) 14.526 8.583 ( 0.300 6.627 3.276) 7.399 9.147 ( -9.539 -2.688 14.691) 17.721 9.445 ( -2.420 -16.030 -4.236) 16.756 9.899 ( 7.855 -2.711 -1.355) 8.420 10.254 ( -5.343 -0.411 1.704) 5.623 10.431 ( 19.094 -9.147 11.854) 24.264 11.018 ( 2.922 -0.031 -4.210) 5.125 11.313 ( -3.016 4.671 -1.938) 5.888 11.491 ( -0.784 0.842 -3.970) 4.133 11.562 ( 5.123 -3.438 -2.982) 6.852 11.909 ( 2.143 -6.449 1.747) 7.017 12.003 ( -1.868 -4.229 -3.614) 5.868 12.188 ( -0.729 -3.525 2.098) 4.166 12.360 ( -3.063 5.581 3.805) 7.417 12.617 ( -1.304 -7.409 -4.105) 8.571 13.201 ( -0.403 -2.540 0.840) 2.706 13.304 ( 2.916 -4.663 3.743) 6.652 13.536 ( 2.219 -2.750 0.012) 3.534 14.148 ( -5.195 -16.714 9.330) 19.834 14.881 ( 4.267 -25.084 -2.016) 25.525 15.765 ( 0.707 4.406 2.985) 5.369 15.868 ( -0.942 2.039 2.339) 3.243 16.000 ( 0.884 -1.326 2.593) 3.044 16.255 ( 0.475 -3.717 0.549) 3.787 17.901 ( -0.595 11.632 2.598) 11.934 18.398 ( 1.654 -0.734 -2.383) 2.992 18.929 ( -2.437 14.722 -13.115) 19.867 20.097 ( -5.662 -9.597 -11.213) 15.809 ======================= 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| 2.214 ( -18.004 4.920 -2.439) 18.822 2.401 ( -12.802 -0.055 10.589) 16.613 2.552 ( -5.331 3.684 -7.129) 9.634 2.797 ( 8.323 4.811 -2.277) 9.880 3.437 ( 10.626 8.464 -13.972) 19.488 3.592 ( -0.810 8.298 -2.497) 8.703 3.909 ( -7.749 -3.776 2.426) 8.955 4.087 ( 3.060 -0.143 -0.259) 3.074 4.394 ( -5.357 1.157 -1.310) 5.635 4.420 ( -0.928 -1.194 -7.792) 7.938 4.999 ( -13.086 7.194 -1.368) 14.995 5.231 ( -3.484 7.863 -2.356) 8.917 5.525 ( 1.749 13.836 -8.995) 16.596 5.800 ( 7.549 0.844 -12.447) 14.581 6.079 ( -2.860 -4.706 -5.878) 8.055 6.445 ( 1.112 -2.225 -8.909) 9.250 7.097 ( 6.418 11.324 5.112) 13.984 7.819 ( -6.415 11.491 -6.861) 14.841 8.112 ( -1.659 7.475 -10.369) 12.890 8.349 ( -5.780 -1.850 11.142) 12.687 8.704 ( 1.977 13.776 5.723) 15.048 9.124 ( -7.001 -4.456 3.730) 9.099 9.206 ( -10.273 -6.990 2.661) 12.708 10.010 ( -2.141 1.830 7.815) 8.307 10.334 ( 4.335 -6.491 4.951) 9.243 10.703 ( -2.880 -8.362 13.498) 16.138 11.056 ( 6.252 -2.683 -3.690) 7.740 11.355 ( 9.148 0.019 -5.910) 10.891 11.468 ( 4.040 6.254 -0.672) 7.476 11.663 ( 8.137 -4.038 -0.212) 9.086 11.768 ( -5.341 0.289 -7.535) 9.240 12.096 ( 6.535 -6.781 1.551) 9.545 12.195 ( -4.299 -2.079 3.598) 5.979 12.353 ( -1.391 9.822 4.861) 11.047 12.584 ( 0.332 -7.596 -0.559) 7.623 13.238 ( 0.907 -1.860 2.788) 3.472 13.362 ( 0.306 -1.108 0.824) 1.414 13.643 ( 6.740 -10.048 6.740) 13.850 14.145 ( -5.127 -17.802 9.395) 20.772 14.921 ( 2.193 -24.805 -2.648) 25.042 15.828 ( 1.775 4.540 5.011) 6.991 15.918 ( 1.296 1.455 6.363) 6.655 16.079 ( 3.302 1.065 5.795) 6.754 16.307 ( 2.527 -2.909 3.544) 5.235 17.654 ( -15.506 15.932 -12.751) 25.629 18.549 ( 9.444 0.551 4.572) 10.507 18.779 ( 2.610 14.999 -17.566) 23.245 19.862 ( -6.119 -7.979 -13.224) 16.613 ======================= 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| 1.769 ( -24.834 4.983 2.181) 25.423 2.272 ( -11.499 11.879 -5.811) 17.524 2.412 ( -1.239 -4.879 4.582) 6.807 2.980 ( 11.468 2.259 -2.407) 11.934 3.437 ( 1.236 11.320 -8.819) 14.403 3.539 ( -1.144 6.366 -7.804) 10.136 3.745 ( -8.062 -0.983 -3.281) 8.760 3.920 ( -12.275 9.010 -5.322) 16.130 4.143 ( -14.998 4.182 -4.926) 16.331 4.484 ( 6.016 0.449 0.758) 6.080 4.820 ( -4.848 3.256 -0.475) 5.859 5.121 ( -5.268 2.021 -2.052) 6.004 5.478 ( 4.574 10.721 -10.348) 15.586 5.830 ( 9.161 3.111 -12.037) 15.443 6.012 ( 0.140 -5.189 -3.541) 6.283 6.406 ( 8.068 -5.365 -11.223) 14.826 7.320 ( 10.553 6.502 4.406) 13.155 7.599 ( -8.373 7.695 -6.571) 13.134 8.014 ( 2.544 4.857 -9.920) 11.334 8.431 ( -0.193 -0.415 12.855) 12.863 8.567 ( -9.734 1.550 -10.852) 14.660 9.099 ( -3.386 0.418 11.873) 12.353 9.196 ( -5.361 4.755 12.380) 14.305 10.008 ( -7.331 1.828 9.892) 12.447 10.310 ( -4.725 -7.178 -4.484) 9.693 10.844 ( 4.199 -6.987 11.505) 14.100 11.086 ( 2.104 -3.639 -1.301) 4.401 11.468 ( 6.525 1.023 -3.993) 7.718 11.516 ( -0.630 4.717 -2.912) 5.579 11.698 ( 5.305 4.484 -2.732) 7.464 11.816 ( 4.720 -4.340 0.876) 6.471 12.108 ( -6.036 -6.948 1.421) 9.313 12.272 ( 8.926 1.229 5.699) 10.661 12.361 ( -1.490 4.221 0.658) 4.524 12.653 ( 4.451 -3.110 5.593) 7.795 13.180 ( -6.670 1.819 -2.188) 7.251 13.445 ( 7.103 -6.590 3.267) 10.225 13.880 ( 7.831 -11.436 11.244) 17.847 14.158 ( -3.481 -16.145 7.706) 18.225 14.885 ( -1.981 -22.615 -5.582) 23.378 15.930 ( 2.864 3.000 6.650) 7.837 16.038 ( 3.269 -0.093 8.650) 9.247 16.234 ( 4.927 3.370 9.073) 10.860 16.400 ( 2.984 -2.752 3.938) 5.655 17.214 ( -16.434 23.993 -12.955) 31.836 18.634 ( 9.402 21.861 -27.597) 36.440 18.761 ( 3.782 -5.662 6.645) 9.514 19.619 ( -4.284 -4.279 -14.888) 16.072 ======================= 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| 1.445 ( -15.963 8.518 8.968) 20.194 1.969 ( -16.834 16.832 -0.769) 23.818 2.495 ( 3.455 -7.684 3.094) 8.975 3.073 ( -3.315 -5.024 0.615) 6.051 3.152 ( -17.564 17.083 -7.943) 25.757 3.509 ( 4.186 8.508 -3.338) 10.052 3.606 ( -1.728 5.478 -4.488) 7.289 3.713 ( -6.280 9.247 -3.771) 11.797 3.906 ( -1.443 8.731 -4.575) 9.962 4.574 ( 1.244 0.108 3.396) 3.618 4.737 ( -5.100 3.469 -0.497) 6.188 5.027 ( -3.292 -2.179 -0.091) 3.949 5.497 ( 7.272 4.794 -7.173) 11.284 5.924 ( 11.993 2.832 -6.801) 14.075 5.962 ( 0.275 -2.225 -7.488) 7.817 6.533 ( 11.723 -7.490 -2.542) 14.142 7.317 ( -8.376 3.957 -5.685) 10.869 7.610 ( 8.944 4.899 3.381) 10.744 7.989 ( 2.353 1.571 -5.502) 6.187 8.308 ( -2.531 3.081 -11.625) 12.290 8.596 ( 2.575 -0.593 12.904) 13.172 9.103 ( -12.265 -3.666 16.962) 21.250 9.200 ( -3.841 10.915 2.284) 11.795 9.938 ( -7.061 1.558 3.986) 8.256 10.250 ( 8.064 -10.645 -8.518) 15.840 10.986 ( 0.972 -2.972 2.804) 4.200 11.166 ( 4.899 0.108 4.255) 6.490 11.388 ( -8.253 -0.401 3.693) 9.050 11.533 ( -0.295 3.364 -6.438) 7.270 11.724 ( -2.889 -4.222 1.018) 5.216 11.890 ( 5.930 -1.814 -0.385) 6.214 12.015 ( -4.509 -8.566 0.080) 9.680 12.323 ( -0.363 -2.001 -1.990) 2.846 12.528 ( 9.454 2.466 5.119) 11.030 12.747 ( -2.133 0.869 2.473) 3.380 13.113 ( 3.379 2.563 2.352) 4.850 13.643 ( 7.509 -7.590 8.220) 13.474 14.123 ( 6.206 -6.295 8.887) 12.535 14.144 ( -3.654 -15.550 2.070) 16.107 14.738 ( -6.206 -17.086 -7.201) 19.552 16.059 ( 2.952 1.220 7.522) 8.172 16.193 ( 4.160 -2.523 7.040) 8.558 16.399 ( 2.916 1.204 5.775) 6.580 16.481 ( 2.155 -2.971 2.809) 4.622 16.846 ( -12.921 31.338 -4.789) 34.234 18.560 ( 16.160 29.999 -28.498) 44.421 18.824 ( -2.121 -10.698 0.580) 10.922 19.438 ( 0.474 1.966 -11.587) 11.762 ======================= 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| 1.352 ( -7.736 14.183 12.461) 20.403 1.642 ( -19.921 18.705 4.110) 27.633 2.522 ( -5.563 -0.241 7.273) 9.160 2.891 ( -6.931 4.455 -1.410) 8.359 2.912 ( -12.835 5.378 7.288) 15.709 3.487 ( -4.032 1.989 1.698) 4.806 3.630 ( 6.592 10.646 -3.842) 13.098 3.673 ( 3.117 14.722 2.270) 15.219 3.970 ( 11.839 7.213 -6.968) 15.516 4.569 ( -3.516 2.898 -0.383) 4.572 4.667 ( -5.046 -1.063 7.283) 8.924 5.003 ( -0.667 -3.171 2.597) 4.152 5.585 ( 7.223 -1.759 -2.712) 7.913 5.854 ( -1.155 -2.792 -11.049) 11.455 6.124 ( 12.085 4.732 -0.469) 12.987 6.694 ( 2.141 -5.336 5.665) 8.071 7.135 ( -5.564 4.873 -2.001) 7.662 7.767 ( 5.781 0.876 0.952) 5.924 7.938 ( -3.711 -2.863 -2.122) 5.145 8.300 ( 8.540 10.365 -2.101) 13.593 8.776 ( 6.812 -6.128 4.147) 10.057 8.998 ( -12.406 3.110 7.578) 14.866 9.123 ( -7.643 7.506 5.755) 12.161 9.928 ( 7.329 1.056 -3.296) 8.105 10.421 ( 17.899 -14.422 -6.820) 23.977 10.866 ( -9.940 -0.542 -10.905) 14.766 11.163 ( -17.442 -1.527 -3.841) 17.925 11.304 ( 3.830 -0.673 3.742) 5.396 11.477 ( -11.522 -11.822 9.848) 19.223 11.615 ( -2.451 -0.291 0.779) 2.588 11.976 ( 2.561 -18.621 -2.703) 18.989 12.008 ( 5.396 2.743 -2.103) 6.408 12.324 ( 2.829 2.999 0.492) 4.152 12.601 ( 0.394 5.531 -6.570) 8.597 12.787 ( -0.037 2.032 12.350) 12.517 13.248 ( 6.475 0.442 -1.662) 6.700 13.798 ( -2.893 -9.382 2.172) 10.055 14.079 ( 2.837 -3.498 -1.977) 4.918 14.275 ( -1.024 -11.879 5.637) 13.189 14.576 ( -4.609 -9.847 -0.079) 10.873 16.143 ( -0.698 0.854 0.909) 1.429 16.314 ( 3.988 -2.421 3.655) 5.926 16.398 ( -4.431 -1.202 -4.113) 6.164 16.537 ( 1.579 -1.842 0.925) 2.596 16.672 ( -7.400 29.380 7.325) 31.170 18.664 ( 9.873 11.462 -22.523) 27.132 18.794 ( 16.356 12.125 0.150) 20.361 19.411 ( 4.081 5.141 -3.927) 7.649 ======================= 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| 1.347 ( -4.698 17.790 10.748) 21.309 1.475 ( -5.778 18.476 14.178) 23.995 2.535 ( -5.793 7.362 13.261) 16.236 2.708 ( -7.765 -5.198 4.455) 10.351 2.893 ( -4.884 12.609 10.955) 17.402 3.524 ( 2.613 0.841 5.916) 6.522 3.678 ( 3.253 9.009 -0.085) 9.579 3.812 ( 6.071 15.082 3.940) 16.728 4.120 ( 11.666 5.664 -7.760) 15.113 4.540 ( 0.831 5.785 2.320) 6.288 4.642 ( -7.979 -5.762 9.816) 13.901 5.058 ( 1.895 -2.175 5.586) 6.287 5.668 ( -1.065 -0.899 -0.701) 1.560 5.722 ( 3.946 -6.956 -10.702) 13.360 6.293 ( 3.099 4.939 3.969) 7.054 6.701 ( -8.094 -1.762 8.102) 11.587 7.108 ( 2.015 7.410 2.564) 8.096 7.851 ( -3.828 -1.143 0.746) 4.064 7.886 ( 4.724 -0.138 5.368) 7.152 8.508 ( 13.018 8.745 2.993) 15.966 8.739 ( -9.905 13.017 -3.430) 16.712 9.027 ( 7.330 -10.257 4.344) 13.335 9.037 ( -4.912 2.460 1.666) 5.741 10.129 ( 14.269 -1.601 -1.749) 14.464 10.416 ( -23.604 -5.706 -7.112) 25.303 10.694 ( -0.420 -4.685 -8.677) 9.870 10.782 ( 4.259 -7.191 -10.868) 13.710 11.296 ( -9.095 -9.829 7.307) 15.256 11.384 ( 0.007 -2.548 0.036) 2.548 11.699 ( 2.443 6.261 4.546) 8.114 11.931 ( -0.156 -19.368 -9.399) 21.529 12.082 ( 3.383 -2.195 -0.489) 4.062 12.475 ( 8.558 10.631 7.185) 15.423 12.520 ( -3.653 4.278 -3.414) 6.581 12.894 ( -0.478 1.985 8.315) 8.562 13.248 ( -0.048 0.208 -10.076) 10.078 13.606 ( -8.318 -9.048 -8.106) 14.723 14.071 ( -7.386 -1.493 -8.845) 11.619 14.252 ( -2.660 -16.332 8.922) 18.799 14.605 ( 1.810 -8.523 5.271) 10.183 16.067 ( -3.747 2.492 -5.565) 7.156 16.174 ( -8.495 7.335 -8.423) 14.033 16.400 ( 0.619 -5.014 -1.322) 5.222 16.534 ( -1.451 -3.148 -2.398) 4.215 16.730 ( 1.115 23.026 15.228) 27.629 18.544 ( -1.305 -5.200 -6.688) 8.571 19.339 ( 27.928 14.996 -4.307) 31.990 19.501 ( 15.565 7.578 0.572) 17.321 ======================= 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| 1.834 ( 8.963 14.002 8.200) 18.538 1.949 ( 4.288 13.798 9.557) 17.324 2.425 ( 0.662 -5.138 3.567) 6.289 2.647 ( 3.049 -9.666 5.813) 11.684 3.330 ( -5.688 17.797 12.657) 22.568 3.666 ( 2.774 -0.405 7.076) 7.612 3.871 ( 2.136 4.411 1.674) 5.179 4.074 ( -1.852 0.373 -0.501) 1.954 4.359 ( 0.374 5.802 -0.167) 5.816 4.438 ( -4.922 -1.281 5.411) 7.426 4.878 ( 9.127 9.479 9.353) 16.144 5.148 ( 5.911 -2.964 7.298) 9.848 5.586 ( 4.074 2.399 -4.394) 6.455 5.705 ( 5.948 -2.998 0.159) 6.663 6.414 ( -5.995 3.957 8.173) 10.881 6.574 ( -9.246 -3.018 8.204) 12.724 7.500 ( 8.312 13.820 9.254) 18.594 7.867 ( 4.813 -0.753 6.802) 8.366 8.091 ( 2.695 5.250 8.673) 10.491 8.707 ( 0.950 -16.546 7.879) 18.350 8.759 ( 5.261 4.526 3.092) 7.597 8.988 ( 9.827 -9.244 5.293) 14.493 9.288 ( -6.881 28.188 -11.440) 31.189 9.937 ( -18.398 5.465 -9.544) 21.435 10.065 ( -17.575 1.014 -3.949) 18.041 10.692 ( 19.332 0.472 -9.414) 21.508 10.813 ( 17.449 -8.137 -3.758) 19.616 10.989 ( -5.370 -22.334 -2.861) 23.148 11.347 ( 0.741 -2.408 0.815) 2.648 11.377 ( 1.389 -9.134 -1.570) 9.371 11.961 ( 1.491 7.520 1.812) 7.878 12.114 ( 1.118 0.680 -2.705) 3.005 12.509 ( -5.766 7.283 -4.091) 10.150 12.897 ( -6.608 1.379 -2.508) 7.202 12.946 ( -0.727 9.295 -0.595) 9.342 13.106 ( -3.939 -6.170 -3.563) 8.141 13.265 ( 1.991 -1.875 -1.572) 3.154 13.541 ( -12.531 -15.608 -6.495) 21.043 14.081 ( -3.901 0.324 -3.968) 5.574 14.418 ( -0.685 -12.615 -2.667) 12.912 15.975 ( -4.957 3.315 -5.022) 7.796 16.081 ( -3.819 0.030 -4.940) 6.244 16.250 ( -4.196 -1.266 -7.128) 8.368 16.347 ( -3.165 -4.812 -6.339) 8.565 17.450 ( 3.525 23.694 15.299) 28.423 18.289 ( 0.231 -14.896 3.283) 15.256 19.610 ( 2.741 9.570 -4.156) 10.788 19.961 ( 16.554 -6.132 -5.367) 18.451 ======================= 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| 2.113 ( 10.535 14.497 5.832) 18.846 2.207 ( 12.583 9.065 10.835) 18.918 2.557 ( 10.972 -3.266 0.259) 11.451 2.731 ( 2.085 -9.043 1.564) 9.411 3.334 ( -5.337 11.222 10.714) 16.407 3.686 ( -7.777 -3.074 2.726) 8.795 3.938 ( 0.450 3.380 3.820) 5.121 4.032 ( -2.079 -1.100 0.702) 2.454 4.351 ( -0.314 3.313 4.795) 5.837 4.453 ( 0.589 -0.967 1.815) 2.139 5.162 ( 10.710 10.825 8.934) 17.655 5.327 ( 7.016 2.099 3.339) 8.048 5.682 ( 6.554 7.303 1.829) 9.982 5.806 ( 5.211 -0.860 -1.674) 5.540 6.376 ( -7.901 0.956 8.446) 11.604 6.493 ( -6.425 -2.944 5.793) 9.138 7.754 ( 3.603 20.765 9.121) 22.964 7.871 ( -1.869 13.020 2.495) 13.388 8.403 ( 14.555 -9.021 14.832) 22.654 8.688 ( -8.498 -13.719 6.851) 17.532 8.836 ( -5.596 17.385 0.946) 18.288 9.101 ( 0.306 -3.560 -4.657) 5.870 9.346 ( 19.913 0.344 -1.216) 19.953 9.593 ( -5.424 5.519 -5.156) 9.298 9.691 ( -15.357 2.516 -7.176) 17.136 10.619 ( -8.787 -19.651 -15.099) 26.294 11.000 ( 6.227 0.411 -2.679) 6.792 11.120 ( 13.616 -8.673 1.990) 16.265 11.377 ( 1.403 -2.106 1.564) 2.974 11.458 ( 5.475 -4.699 3.133) 7.866 11.929 ( -4.473 7.361 -3.875) 9.445 12.096 ( 0.822 1.663 -2.251) 2.917 12.413 ( -1.316 5.561 -1.739) 5.973 12.558 ( -16.897 3.164 -9.521) 19.651 12.805 ( -7.146 -7.276 -3.642) 10.829 13.028 ( -4.883 -15.854 -10.847) 19.820 13.313 ( 1.336 4.982 4.913) 7.123 13.461 ( 3.006 0.170 4.790) 5.658 13.966 ( -4.335 -2.606 -1.493) 5.274 14.364 ( -0.435 -17.765 -4.641) 18.366 15.855 ( -3.249 3.539 -2.960) 5.643 15.985 ( -2.630 -2.059 -2.793) 4.353 16.082 ( -4.841 1.171 -6.700) 8.348 16.241 ( -1.927 -5.779 -5.535) 8.231 17.694 ( 6.038 18.339 14.692) 24.262 18.339 ( 1.724 -11.579 1.667) 11.825 19.564 ( -2.290 12.556 -5.783) 14.012 20.094 ( 5.357 -11.936 -7.502) 15.081 ======================= 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| 2.346 ( 9.343 11.684 4.238) 15.549 2.492 ( 3.382 10.266 11.591) 15.849 2.739 ( 3.976 -4.585 -1.806) 6.332 2.800 ( 7.504 -5.740 1.046) 9.505 3.388 ( 3.450 0.813 -0.094) 3.546 3.532 ( -3.733 -1.964 -0.424) 4.239 3.936 ( -5.470 2.859 4.500) 7.639 3.990 ( -2.958 0.426 0.712) 3.072 4.430 ( 2.458 0.910 3.535) 4.401 4.484 ( 1.196 -1.319 0.154) 1.787 5.401 ( 8.080 9.203 -0.008) 12.247 5.447 ( 1.863 7.789 4.973) 9.427 5.807 ( 4.216 9.008 1.121) 10.009 5.852 ( 3.816 1.310 -5.176) 6.563 6.282 ( -8.860 -0.088 4.218) 9.814 6.466 ( -1.943 -4.451 1.997) 5.251 7.600 ( -11.754 21.370 -3.020) 24.575 8.116 ( 9.848 18.689 9.349) 23.101 8.510 ( -9.850 -14.192 -3.851) 17.699 8.701 ( -8.931 14.289 3.645) 17.240 8.843 ( 10.537 -10.624 16.728) 22.444 8.937 ( -6.089 6.723 -8.380) 12.349 9.340 ( -15.616 4.080 3.473) 16.509 9.674 ( 13.500 -6.413 -7.363) 16.661 9.789 ( 21.308 -3.165 4.621) 22.032 10.296 ( -9.667 -18.683 -9.722) 23.174 11.029 ( 0.844 3.808 -1.947) 4.359 11.289 ( 0.091 -8.492 4.598) 9.657 11.445 ( 3.352 0.413 3.443) 4.824 11.585 ( 4.761 -3.748 1.845) 6.334 11.793 ( -0.870 5.683 -9.493) 11.098 12.058 ( -1.342 -3.245 -7.743) 8.502 12.219 ( -9.916 2.977 -3.071) 10.799 12.423 ( 1.473 6.323 3.350) 7.305 12.602 ( -8.103 -8.516 -7.399) 13.890 12.920 ( 0.133 -17.358 0.068) 17.359 13.356 ( -0.407 9.633 2.112) 9.871 13.553 ( 0.992 2.700 2.642) 3.905 13.918 ( -2.627 -5.435 3.996) 7.239 14.334 ( 2.055 -22.152 -3.368) 22.500 15.802 ( -0.969 2.524 -0.067) 2.704 15.916 ( -3.306 -2.808 -0.009) 4.337 15.984 ( -0.082 2.977 -2.868) 4.135 16.171 ( -0.801 -5.580 -2.746) 6.270 17.950 ( 6.576 12.671 12.036) 18.673 18.366 ( 0.561 -7.116 -0.963) 7.202 19.421 ( -4.685 14.769 -8.698) 17.769 20.029 ( -2.136 -13.657 -9.304) 16.663 ======================= 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| 2.482 ( -4.854 8.282 8.229) 12.644 2.570 ( -0.081 5.712 0.565) 5.741 2.742 ( -5.576 -0.079 5.282) 7.681 2.809 ( -5.392 -3.466 -0.993) 6.486 3.437 ( 15.384 5.087 -13.221) 20.913 3.697 ( 16.866 -6.414 -4.521) 18.602 3.841 ( -7.003 4.040 1.573) 8.236 3.961 ( -4.210 -1.774 6.058) 7.588 4.465 ( -0.637 0.236 -0.634) 0.929 4.482 ( -0.275 -0.531 -2.658) 2.724 5.388 ( -6.326 7.870 -2.093) 10.312 5.492 ( -3.817 6.886 1.795) 8.076 5.838 ( 4.601 4.944 -8.680) 10.998 5.853 ( 1.860 8.053 -5.760) 10.074 6.158 ( -5.009 0.656 -3.330) 6.050 6.434 ( -0.590 -5.632 -4.477) 7.219 7.396 ( -5.918 19.443 -2.366) 20.461 8.166 ( -6.538 -7.784 -7.177) 12.444 8.363 ( -2.893 12.760 -5.968) 14.381 8.545 ( -9.531 12.052 4.658) 16.056 8.861 ( -1.450 9.949 8.835) 13.385 9.061 ( -0.326 -11.677 0.714) 11.703 9.194 ( -6.290 2.248 7.311) 9.904 9.811 ( 10.026 -7.220 -1.234) 12.416 10.163 ( -0.332 -7.591 3.011) 8.173 10.218 ( 13.235 -10.348 11.204) 20.194 11.018 ( -0.606 1.521 -0.604) 1.745 11.252 ( -7.234 -7.079 6.305) 11.925 11.540 ( 3.825 3.880 -0.774) 5.503 11.634 ( 7.694 6.410 -11.687) 15.390 11.785 ( 4.555 -4.988 1.510) 6.921 11.919 ( -0.468 -4.664 -10.626) 11.614 12.160 ( -1.876 1.562 7.067) 7.477 12.427 ( -2.616 -8.777 -5.381) 10.622 12.504 ( 1.317 7.233 5.256) 9.037 12.979 ( 0.837 -14.790 7.986) 16.829 13.355 ( -0.757 8.496 0.079) 8.530 13.551 ( -1.824 1.116 -0.571) 2.213 13.918 ( -3.237 -5.432 5.851) 8.615 14.369 ( 3.597 -23.392 -0.630) 23.675 15.812 ( 0.638 1.530 2.384) 2.904 15.887 ( -1.405 -1.021 3.141) 3.589 16.006 ( 2.746 2.301 1.923) 4.066 16.167 ( 1.218 -4.643 1.354) 4.988 18.122 ( 0.337 9.457 3.107) 9.960 18.366 ( 1.604 -2.663 2.133) 3.770 19.244 ( -2.238 15.692 -12.251) 20.033 19.859 ( -4.598 -13.294 -10.892) 17.791 ======================= 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| 2.310 ( -22.069 3.971 1.232) 22.458 2.397 ( -13.622 -0.620 7.507) 15.566 2.662 ( -1.025 6.927 -5.611) 8.973 2.863 ( 7.588 0.593 -0.679) 7.642 3.596 ( 13.651 7.327 -14.433) 21.174 3.742 ( -3.165 6.085 -0.526) 6.879 3.826 ( -1.026 -4.083 -3.184) 5.278 4.014 ( 5.142 -6.317 -0.048) 8.145 4.421 ( -1.636 1.109 -4.720) 5.117 4.425 ( -0.354 1.328 -1.526) 2.054 5.159 ( -15.967 7.780 -0.117) 17.762 5.349 ( -10.782 1.951 -1.117) 11.014 5.792 ( 2.587 10.094 -12.630) 16.374 5.851 ( 7.781 4.953 -10.243) 13.784 6.034 ( -1.447 1.018 -9.034) 9.206 6.347 ( 0.464 -7.142 -11.844) 13.839 7.365 ( 3.278 14.421 0.154) 14.790 7.990 ( -1.886 -11.686 -8.197) 14.398 8.106 ( -10.517 13.244 -12.239) 20.876 8.516 ( -3.561 12.551 6.562) 14.603 8.806 ( -11.544 -9.141 -10.663) 18.181 8.973 ( -5.924 -4.817 17.813) 19.381 9.324 ( 5.659 17.981 10.660) 21.656 10.015 ( 6.473 -3.148 3.829) 8.153 10.189 ( -2.714 -6.435 6.851) 9.783 10.480 ( -0.707 -13.160 15.341) 20.224 11.011 ( 0.840 0.280 1.070) 1.389 11.238 ( -0.316 -8.404 5.639) 10.125 11.611 ( 9.749 7.142 -5.143) 13.134 11.713 ( 9.997 5.770 -7.157) 13.582 11.779 ( -0.464 0.059 -7.153) 7.169 11.946 ( 5.958 -6.185 -1.164) 8.667 12.210 ( -1.362 2.352 7.576) 8.049 12.418 ( 1.402 -7.760 2.122) 8.166 12.562 ( 0.130 10.337 6.150) 12.029 13.114 ( 2.979 -13.237 12.433) 18.403 13.340 ( 0.129 0.708 -0.747) 1.037 13.466 ( -5.486 -4.602 -3.436) 7.943 13.946 ( -0.014 -1.463 6.942) 7.094 14.432 ( 3.006 -21.721 0.220) 21.929 15.869 ( 1.829 1.172 4.180) 4.711 15.925 ( 0.386 -0.889 5.855) 5.934 16.117 ( 4.500 2.206 6.203) 7.974 16.237 ( 2.844 -3.643 4.360) 6.354 17.997 ( -9.566 16.419 -5.429) 19.763 18.487 ( 3.843 -6.214 6.349) 9.680 19.108 ( 3.238 15.785 -16.161) 22.822 19.664 ( -3.069 -11.111 -12.697) 17.149 ======================= 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| 1.910 ( -19.912 8.390 1.800) 21.683 2.276 ( -5.284 -7.977 3.269) 10.112 2.544 ( -7.319 13.709 -3.340) 15.895 2.971 ( 3.137 -4.209 -0.702) 5.296 3.609 ( 2.212 5.779 -8.905) 10.844 3.663 ( -3.171 5.872 -6.854) 9.567 3.755 ( 1.662 1.598 -7.725) 8.061 3.958 ( -7.345 -3.545 -4.070) 9.115 4.316 ( -5.775 9.402 -2.880) 11.404 4.492 ( 5.654 -0.152 0.549) 5.682 4.907 ( -9.534 5.279 1.043) 10.948 5.128 ( -10.876 -2.201 -1.571) 11.208 5.712 ( 3.809 11.499 -14.479) 18.878 5.900 ( 7.582 2.750 -10.274) 13.061 5.961 ( 3.770 0.792 -6.850) 7.859 6.254 ( 5.524 -9.157 -13.491) 17.216 7.475 ( 6.916 8.786 -0.473) 11.191 7.809 ( -8.671 11.788 -9.326) 17.353 7.941 ( 3.652 -9.131 -6.430) 11.750 8.375 ( -8.933 -10.341 -10.942) 17.506 8.649 ( -3.799 11.013 9.991) 15.347 9.025 ( -9.852 -5.837 18.970) 22.158 9.504 ( 5.023 20.425 3.562) 21.333 10.060 ( -6.818 4.219 8.864) 11.952 10.145 ( -5.960 -9.119 -1.531) 11.001 10.605 ( 2.470 -16.007 10.098) 19.086 11.086 ( 2.803 2.589 6.680) 7.693 11.341 ( 4.304 -9.447 5.947) 11.964 11.638 ( -3.550 6.076 -4.250) 8.220 11.794 ( 3.284 3.690 -4.965) 7.004 11.823 ( 8.216 3.469 -1.446) 9.035 11.935 ( -5.093 -6.828 -1.943) 8.737 12.332 ( 8.916 2.519 4.681) 10.381 12.386 ( -2.485 -1.935 -3.821) 4.952 12.734 ( 6.766 10.899 12.059) 17.607 13.216 ( -3.919 1.859 -3.266) 5.429 13.343 ( 3.565 -3.915 0.523) 5.321 13.469 ( 4.636 -23.259 15.468) 28.315 14.042 ( 2.806 1.379 5.080) 5.965 14.465 ( 1.049 -17.888 -1.686) 17.998 15.961 ( 2.627 1.010 5.697) 6.355 16.016 ( 2.134 -1.506 7.274) 7.728 16.275 ( 4.470 0.931 7.509) 8.788 16.339 ( 2.890 -2.816 4.560) 6.089 17.739 ( -11.904 25.514 -4.637) 28.533 18.569 ( -1.666 -13.224 4.619) 14.106 19.039 ( 9.446 17.041 -19.654) 27.675 19.508 ( 1.238 -6.774 -13.830) 15.449 ======================= 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| 1.688 ( -7.908 14.263 5.299) 17.148 2.276 ( 0.248 -8.038 3.079) 8.611 2.327 ( -13.267 12.213 -0.590) 18.042 2.899 ( -10.938 -10.835 0.768) 15.415 3.426 ( -9.587 9.454 -5.889) 14.696 3.624 ( -1.140 0.889 -4.573) 4.796 3.707 ( 4.716 6.098 -8.748) 11.660 3.852 ( 4.672 3.503 -3.278) 6.696 4.192 ( -4.369 16.045 -0.420) 16.635 4.568 ( 0.420 -1.648 2.984) 3.435 4.806 ( -5.216 3.059 0.329) 6.056 4.958 ( -6.140 -4.268 0.526) 7.496 5.637 ( 3.601 8.486 -13.176) 16.080 5.902 ( 1.849 -2.640 -10.368) 10.857 6.021 ( 10.937 5.149 -3.866) 12.691 6.344 ( 12.600 -10.192 -3.080) 16.496 7.446 ( -6.605 8.553 -6.153) 12.435 7.721 ( 4.504 4.473 -3.869) 7.433 7.924 ( -0.806 -4.542 -2.494) 5.244 8.217 ( 3.422 -10.066 -4.741) 11.641 8.703 ( -2.894 8.170 9.716) 13.020 8.983 ( -14.532 -6.361 16.705) 23.037 9.582 ( 3.289 21.984 -1.769) 22.299 9.958 ( -6.916 0.182 0.269) 6.924 10.075 ( 0.666 -3.702 0.479) 3.792 10.765 ( 5.599 -18.229 5.635) 19.885 11.213 ( 1.637 3.110 5.972) 6.930 11.411 ( -12.586 -1.233 2.175) 12.832 11.518 ( 1.675 -1.810 1.137) 2.715 11.637 ( -14.349 -2.278 -3.836) 15.027 11.787 ( -4.331 -2.155 -3.343) 5.880 11.934 ( 4.083 -4.302 -1.415) 6.097 12.368 ( 6.311 6.623 -3.919) 9.952 12.581 ( 11.640 1.061 3.333) 12.154 12.884 ( 0.297 10.794 -0.371) 10.804 13.157 ( 2.242 1.326 0.551) 2.662 13.494 ( 6.641 -6.264 9.521) 13.191 13.751 ( 5.710 -17.218 15.106) 23.607 14.122 ( 2.998 1.803 -0.302) 3.512 14.434 ( -1.067 -12.661 -3.873) 13.283 16.072 ( 2.564 0.657 6.275) 6.810 16.139 ( 3.344 -2.462 6.143) 7.414 16.396 ( 1.601 -0.624 2.955) 3.418 16.425 ( 2.483 -2.254 3.556) 4.888 17.495 ( -11.782 30.582 -0.326) 32.775 18.520 ( -7.046 -18.117 2.441) 19.592 19.065 ( 16.186 18.365 -20.197) 31.736 19.444 ( 6.003 -1.940 -11.475) 13.095 ======================= 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| 1.693 ( -0.558 17.935 7.354) 19.392 2.013 ( -18.807 16.499 2.668) 25.161 2.370 ( 2.789 -10.724 5.872) 12.540 2.666 ( -14.166 -12.992 2.484) 19.382 3.267 ( -5.264 12.554 2.833) 13.905 3.499 ( -3.980 -1.100 0.862) 4.219 3.834 ( 10.028 9.422 -5.734) 14.907 3.950 ( 6.413 8.662 -0.051) 10.778 4.170 ( 3.717 12.648 -2.362) 13.393 4.581 ( -3.240 -3.128 5.381) 7.017 4.697 ( -6.370 4.302 1.504) 7.833 4.917 ( -1.709 -5.063 4.476) 6.970 5.592 ( 3.917 2.647 -8.594) 9.808 5.784 ( -1.271 -4.238 -12.079) 12.864 6.238 ( 10.791 6.353 3.139) 12.910 6.550 ( 6.203 -8.079 5.498) 11.575 7.286 ( -4.211 9.346 -1.813) 10.410 7.686 ( -0.540 -8.034 -5.025) 9.491 7.966 ( 2.188 5.930 4.234) 7.608 8.329 ( 8.885 -6.086 -0.025) 10.770 8.723 ( -2.394 0.303 4.561) 5.160 8.871 ( -14.229 -7.859 15.682) 22.587 9.604 ( 0.667 29.698 -1.870) 29.764 9.937 ( 7.891 0.808 -4.023) 8.894 10.173 ( 10.462 -8.319 -0.564) 13.378 10.852 ( -3.390 -7.848 -7.361) 11.281 11.016 ( -15.397 -7.952 -0.802) 17.348 11.227 ( -19.569 -9.418 0.400) 21.721 11.319 ( -2.206 2.287 -1.642) 3.577 11.562 ( -0.742 -12.161 -2.088) 12.361 11.776 ( 3.595 5.375 1.602) 6.662 12.000 ( 4.557 -3.061 -0.274) 5.497 12.503 ( 9.024 11.705 1.340) 14.840 12.750 ( 4.471 5.917 -4.214) 8.529 12.866 ( -0.598 5.862 5.438) 8.019 13.207 ( 3.039 -4.668 -3.083) 6.366 13.642 ( -2.866 -4.016 3.382) 5.981 13.924 ( 0.514 -12.225 7.545) 14.375 14.151 ( 2.339 0.816 -4.140) 4.825 14.387 ( 0.524 -8.597 -1.136) 8.687 16.147 ( 0.048 0.479 1.469) 1.546 16.244 ( 2.443 -3.812 3.032) 5.449 16.394 ( -1.663 0.947 -2.042) 2.798 16.487 ( 1.243 -2.820 0.697) 3.160 17.316 ( -9.533 31.379 4.877) 33.156 18.392 ( -7.755 -19.397 0.728) 20.903 19.253 ( 23.582 15.856 -13.647) 31.524 19.484 ( 7.989 1.571 -6.680) 10.531 ======================= 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| 1.728 ( -3.784 18.215 4.914) 19.242 1.834 ( -4.070 15.503 10.293) 19.048 2.454 ( -7.800 -8.431 8.414) 14.238 2.525 ( 1.601 -11.149 4.411) 12.096 3.274 ( -1.942 15.568 9.423) 18.300 3.534 ( 2.987 -0.524 5.772) 6.520 3.864 ( -1.386 9.630 -0.060) 9.729 4.063 ( 4.850 6.603 -1.479) 8.325 4.268 ( 9.090 8.575 -3.600) 13.005 4.535 ( -9.717 -4.321 7.449) 12.984 4.683 ( 2.688 7.729 5.550) 9.888 4.988 ( 2.554 -4.968 7.853) 9.637 5.609 ( 5.075 -2.603 -5.694) 8.059 5.645 ( -1.134 -2.405 -7.409) 7.872 6.402 ( 0.646 5.654 6.490) 8.632 6.631 ( -5.215 -4.711 8.709) 11.191 7.302 ( 4.428 10.614 4.668) 12.412 7.700 ( 3.789 -8.529 3.349) 9.916 8.028 ( 0.323 9.516 3.926) 10.299 8.508 ( 9.600 -7.270 2.331) 12.265 8.731 ( -1.551 -3.605 3.848) 5.496 8.835 ( -3.466 -8.930 11.485) 14.955 9.523 ( -6.705 34.051 -4.989) 35.062 10.135 ( 12.601 3.708 -1.606) 13.233 10.353 ( -6.481 -6.106 -2.207) 9.174 10.541 ( 7.486 -2.193 -11.362) 13.782 10.692 ( -13.263 -6.792 -11.927) 19.086 11.077 ( -3.447 -16.757 3.293) 17.422 11.320 ( 2.318 -3.292 -1.275) 4.223 11.457 ( -4.674 -13.631 -5.312) 15.358 11.882 ( 4.074 7.280 2.922) 8.840 12.081 ( 4.089 -1.225 -0.671) 4.321 12.652 ( -2.634 9.347 -1.851) 9.886 12.743 ( 7.356 13.175 3.853) 15.573 12.951 ( 0.715 1.406 5.185) 5.419 13.200 ( 2.123 -5.481 -6.563) 8.810 13.454 ( -12.024 -3.173 -7.760) 14.658 13.845 ( -11.380 -16.424 -3.747) 20.330 14.147 ( 1.067 2.700 -3.311) 4.403 14.422 ( 1.492 -9.076 0.640) 9.220 16.101 ( -3.022 1.686 -3.972) 5.268 16.220 ( -4.714 -2.314 -4.387) 6.843 16.342 ( -0.520 0.592 -3.480) 3.569 16.464 ( -2.309 -3.653 -3.996) 5.886 17.289 ( -2.266 28.761 11.884) 31.202 18.292 ( -3.985 -17.627 2.004) 18.183 19.552 ( 10.498 6.864 -6.384) 14.074 19.633 ( 21.266 3.886 -4.067) 21.998 ======================= 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| 2.058 ( 6.484 -5.687 4.938) 9.938 2.058 ( 6.484 5.687 4.938) 9.938 2.438 ( 2.090 -8.534 7.304) 11.426 2.438 ( 2.090 8.534 7.304) 11.426 3.595 ( -0.289 -7.640 7.221) 10.516 3.595 ( -0.289 7.640 7.221) 10.516 3.980 ( -3.617 -6.557 1.549) 7.647 3.980 ( -3.617 6.557 1.549) 7.647 4.438 ( -2.010 -1.542 1.412) 2.900 4.438 ( -2.010 1.542 1.412) 2.900 5.048 ( 9.188 -6.707 8.541) 14.225 5.048 ( 9.188 6.707 8.541) 14.225 5.645 ( 6.630 -3.039 -1.012) 7.364 5.645 ( 6.630 3.039 -1.012) 7.364 6.498 ( -8.360 -4.117 8.601) 12.681 6.498 ( -8.360 4.117 8.601) 12.681 7.743 ( 10.331 -9.437 10.931) 17.756 7.743 ( 10.331 9.437 10.931) 17.756 8.346 ( -1.469 -16.955 6.425) 18.191 8.346 ( -1.469 16.955 6.425) 18.191 8.844 ( 8.120 -4.938 5.792) 11.129 8.844 ( 8.120 4.938 5.792) 11.129 9.778 ( -16.042 -16.819 -13.227) 26.743 9.778 ( -16.042 16.819 -13.227) 26.743 10.412 ( -9.849 -26.351 -6.821) 28.947 10.412 ( -9.849 26.351 -6.821) 28.947 10.718 ( 20.451 -2.910 -2.306) 20.785 10.718 ( 20.451 2.910 -2.306) 20.785 11.316 ( 1.306 -1.146 1.043) 2.026 11.316 ( 1.306 1.146 1.043) 2.026 12.087 ( 2.311 -3.880 -0.358) 4.530 12.087 ( 2.311 3.880 -0.358) 4.530 12.717 ( -6.105 -12.710 -7.112) 15.792 12.717 ( -6.105 12.710 -7.112) 15.792 13.098 ( -7.646 -3.356 -7.208) 11.031 13.098 ( -7.646 3.356 -7.208) 11.031 13.281 ( -1.518 -6.405 3.709) 7.556 13.281 ( -1.518 6.405 3.709) 7.556 14.188 ( -2.949 -9.076 -5.803) 11.169 14.188 ( -2.949 9.076 -5.803) 11.169 16.042 ( -4.475 -3.093 -4.285) 6.925 16.042 ( -4.475 3.093 -4.285) 6.925 16.267 ( -3.575 -2.706 -7.478) 8.719 16.267 ( -3.575 2.706 -7.478) 8.719 17.915 ( 1.129 -21.018 9.338) 23.027 17.915 ( 1.129 21.018 9.338) 23.027 19.803 ( 8.358 -8.893 -5.048) 13.207 19.803 ( 8.358 8.893 -5.048) 13.207 ======================= 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| 2.314 ( 14.762 -1.903 3.965) 15.403 2.314 ( 14.762 1.903 3.965) 15.403 2.548 ( 3.984 -5.934 3.678) 8.039 2.548 ( 3.984 5.934 3.678) 8.039 3.553 ( -9.595 -9.377 5.528) 14.510 3.553 ( -9.595 9.377 5.528) 14.510 3.991 ( 0.614 -2.270 1.787) 2.953 3.991 ( 0.614 2.270 1.787) 2.953 4.421 ( -1.021 -2.847 2.820) 4.136 4.421 ( -1.021 2.847 2.820) 4.136 5.317 ( 10.744 -3.827 6.264) 13.012 5.317 ( 10.744 3.827 6.264) 13.012 5.781 ( 7.169 -2.371 0.721) 7.586 5.781 ( 7.169 2.371 0.721) 7.586 6.422 ( -8.510 -3.395 7.587) 11.896 6.422 ( -8.510 3.395 7.587) 11.896 8.063 ( 9.128 -4.318 10.994) 14.928 8.063 ( 9.128 4.318 10.994) 14.928 8.341 ( -4.561 -13.005 7.672) 15.773 8.341 ( -4.561 13.005 7.672) 15.773 9.044 ( 2.084 -4.551 3.505) 6.110 9.044 ( 2.084 4.551 3.505) 6.110 9.459 ( 1.130 -8.806 -11.440) 14.481 9.459 ( 1.130 8.806 -11.440) 14.481 10.106 ( -11.945 -26.546 -10.712) 31.018 10.106 ( -11.945 26.546 -10.712) 31.018 11.020 ( 10.736 -2.577 2.087) 11.237 11.020 ( 10.736 2.577 2.087) 11.237 11.382 ( 3.508 -2.345 2.696) 5.007 11.382 ( 3.508 2.345 2.696) 5.007 12.066 ( -0.797 -4.796 -7.408) 8.861 12.066 ( -0.797 4.796 -7.408) 8.861 12.568 ( -4.365 -9.830 -1.229) 10.825 12.568 ( -4.365 9.830 -1.229) 10.825 12.738 ( -13.621 -10.841 -10.255) 20.205 12.738 ( -13.621 10.841 -10.255) 20.205 13.432 ( 4.594 -4.111 7.337) 9.583 13.432 ( 4.594 4.111 7.337) 9.583 14.056 ( -3.560 -10.892 -6.344) 13.098 14.056 ( -3.560 10.892 -6.344) 13.098 15.925 ( -3.792 -3.334 -2.926) 5.836 15.925 ( -3.792 3.334 -2.926) 5.836 16.138 ( -2.453 -4.038 -6.307) 7.880 16.138 ( -2.453 4.038 -6.307) 7.880 18.051 ( 3.246 -16.065 8.385) 18.410 18.051 ( 3.246 16.065 8.385) 18.410 19.832 ( 1.408 -13.242 -6.820) 14.961 19.832 ( 1.408 13.242 -6.820) 14.961 ======================= 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| 2.572 ( 7.842 -9.480 1.262) 12.368 2.572 ( 7.842 9.480 1.262) 12.368 2.677 ( 4.657 -6.468 5.531) 9.701 2.677 ( 4.657 6.468 5.531) 9.701 3.454 ( -1.263 -4.648 -0.720) 4.870 3.454 ( -1.263 4.648 -0.720) 4.870 3.978 ( -3.608 -1.349 1.429) 4.109 3.978 ( -3.608 1.349 1.429) 4.109 4.458 ( 1.232 -1.475 2.157) 2.889 4.458 ( 1.232 1.475 2.157) 2.889 5.517 ( 5.718 -1.709 1.233) 6.094 5.517 ( 5.718 1.709 1.233) 6.094 5.885 ( 3.917 -0.918 -0.882) 4.118 5.885 ( 3.917 0.918 -0.882) 4.118 6.351 ( -5.593 -5.907 3.574) 8.885 6.351 ( -5.593 5.907 3.574) 8.885 8.047 ( -10.318 -21.108 -3.302) 23.725 8.047 ( -10.318 21.108 -3.302) 23.725 8.556 ( 10.319 -16.119 13.993) 23.709 8.556 ( 10.319 16.119 13.993) 23.709 8.934 ( -10.449 -7.252 1.903) 12.861 8.934 ( -10.449 7.252 1.903) 12.861 9.537 ( 5.961 -9.176 -10.134) 14.914 9.537 ( 5.961 9.176 -10.134) 14.914 9.889 ( 1.768 -15.658 -0.787) 15.777 9.889 ( 1.768 15.658 -0.787) 15.777 11.135 ( -0.685 -6.506 3.369) 7.359 11.135 ( -0.685 6.506 3.369) 7.359 11.490 ( 4.942 -4.065 3.574) 7.330 11.490 ( 4.942 4.065 3.574) 7.330 11.932 ( -1.288 -6.937 -12.622) 14.460 11.932 ( -1.288 6.937 -12.622) 14.460 12.388 ( -9.301 -10.429 -5.663) 15.077 12.388 ( -9.301 10.429 -5.663) 15.077 12.619 ( 0.936 -11.709 4.835) 12.703 12.619 ( 0.936 11.709 4.835) 12.703 13.538 ( 0.418 -5.511 3.599) 6.595 13.538 ( 0.418 5.511 3.599) 6.595 13.967 ( -0.739 -11.485 -2.437) 11.764 13.967 ( -0.739 11.485 -2.437) 11.764 15.856 ( -1.854 -2.836 -0.365) 3.408 15.856 ( -1.854 2.836 -0.365) 3.408 16.064 ( -0.435 -4.656 -2.606) 5.354 16.064 ( -0.435 4.656 -2.606) 5.354 18.187 ( 3.244 -10.234 6.045) 12.321 18.187 ( 3.244 10.234 6.045) 12.321 19.730 ( -3.074 -15.125 -9.019) 17.876 19.730 ( -3.074 15.125 -9.019) 17.876 ======================= 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| 2.617 ( -9.552 -3.264 5.500) 11.496 2.617 ( -9.552 3.264 5.500) 11.496 2.741 ( 1.453 -2.346 1.576) 3.178 2.741 ( 1.453 2.346 1.576) 3.178 3.557 ( 16.843 -6.573 -9.265) 20.316 3.557 ( 16.843 6.573 -9.265) 20.316 3.912 ( -5.513 -2.830 2.771) 6.788 3.912 ( -5.513 2.830 2.771) 6.788 4.475 ( -0.431 -0.441 -1.020) 1.191 4.475 ( -0.431 0.441 -1.020) 1.191 5.514 ( -6.309 -3.713 -0.861) 7.371 5.514 ( -6.309 3.713 -0.861) 7.371 5.915 ( 3.622 -2.585 -6.111) 7.559 5.915 ( 3.622 2.585 -6.111) 7.559 6.277 ( -2.363 -8.852 -4.698) 10.296 6.277 ( -2.363 8.852 -4.698) 10.296 7.812 ( -7.712 -20.332 -6.436) 22.678 7.812 ( -7.712 20.332 -6.436) 22.678 8.717 ( -2.767 -14.013 -9.615) 17.218 8.717 ( -2.767 14.013 -9.615) 17.218 8.813 ( -8.295 -7.184 15.098) 18.665 8.813 ( -8.295 7.184 15.098) 18.665 9.525 ( 5.814 -19.940 2.215) 20.888 9.525 ( 5.814 19.940 2.215) 20.888 10.079 ( 8.496 -1.598 6.426) 10.772 10.079 ( 8.496 1.598 6.426) 10.772 11.105 ( -5.234 -6.485 4.199) 9.332 11.105 ( -5.234 6.485 4.199) 9.332 11.634 ( 7.280 -4.778 1.482) 8.834 11.634 ( 7.280 4.778 1.482) 8.834 11.811 ( 2.404 -5.554 -11.020) 12.573 11.811 ( 2.404 5.554 -11.020) 12.573 12.251 ( -1.790 -7.068 -0.641) 7.319 12.251 ( -1.790 7.068 -0.641) 7.319 12.705 ( 0.109 -11.682 8.339) 14.354 12.705 ( 0.109 11.682 8.339) 14.354 13.518 ( -3.689 -5.270 -1.269) 6.557 13.518 ( -3.689 5.270 -1.269) 6.557 13.981 ( 1.947 -12.464 2.362) 12.834 13.981 ( 1.947 12.464 2.362) 12.834 15.849 ( -0.089 -2.090 2.383) 3.170 15.849 ( -0.089 2.090 2.383) 3.170 16.075 ( 1.977 -4.092 2.041) 4.982 16.075 ( 1.977 4.092 2.041) 4.982 18.280 ( 1.306 -5.869 3.564) 6.989 18.280 ( 1.306 5.869 3.564) 6.989 19.563 ( -3.244 -15.190 -11.178) 19.137 19.563 ( -3.244 15.190 -11.178) 19.137 ======================= 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| 2.370 ( -19.234 -2.007 4.184) 19.785 2.370 ( -19.234 2.007 4.184) 19.785 2.805 ( 4.111 -5.824 -1.896) 7.377 2.805 ( 4.111 5.824 -1.896) 7.377 3.731 ( 8.198 -5.541 -10.430) 14.377 3.731 ( 8.198 5.541 -10.430) 14.377 3.869 ( 1.189 -6.884 -0.050) 6.986 3.869 ( 1.189 6.884 -0.050) 6.986 4.439 ( -0.375 -0.207 -2.213) 2.254 4.439 ( -0.375 0.207 -2.213) 2.254 5.301 ( -14.942 -5.556 -0.277) 15.944 5.301 ( -14.942 5.556 -0.277) 15.944 5.905 ( 5.256 -2.204 -10.899) 12.299 5.905 ( 5.256 2.204 -10.899) 12.299 6.164 ( -0.218 -9.882 -12.255) 15.745 6.164 ( -0.218 9.882 -12.255) 15.745 7.680 ( -0.031 -16.021 -5.109) 16.816 7.680 ( -0.031 16.021 -5.109) 16.816 8.435 ( -10.878 -16.416 -14.237) 24.301 8.435 ( -10.878 16.416 -14.237) 24.301 8.836 ( -6.453 -9.543 15.198) 19.071 8.836 ( -6.453 9.543 15.198) 19.071 9.749 ( 9.811 -20.006 5.391) 22.925 9.749 ( 9.811 20.006 5.391) 22.925 10.229 ( -2.539 -9.053 11.635) 14.959 10.229 ( -2.539 9.053 11.635) 14.959 11.083 ( -1.557 -6.153 5.703) 8.533 11.083 ( -1.557 6.153 5.703) 8.533 11.733 ( 7.316 -4.252 -8.497) 11.991 11.733 ( 7.316 4.252 -8.497) 11.991 11.836 ( 6.959 -5.229 -2.616) 9.089 11.836 ( 6.959 5.229 -2.616) 9.089 12.286 ( 0.874 -5.008 5.655) 7.605 12.286 ( 0.874 5.008 5.655) 7.605 12.803 ( 1.149 -14.015 11.835) 18.380 12.803 ( 1.149 14.015 11.835) 18.380 13.395 ( -5.366 -3.334 -5.062) 8.096 13.395 ( -5.366 3.334 -5.062) 8.096 14.068 ( 3.366 -12.756 4.232) 13.854 14.068 ( 3.366 12.756 4.232) 13.854 15.897 ( 1.231 -1.558 4.716) 5.117 15.897 ( 1.231 1.558 4.716) 5.117 16.168 ( 3.574 -2.910 5.436) 7.127 16.168 ( 3.574 2.910 5.436) 7.127 18.296 ( -2.635 -12.223 1.719) 12.621 18.296 ( -2.635 12.223 1.719) 12.621 19.410 ( 0.654 -13.577 -13.401) 19.088 19.410 ( 0.654 13.577 -13.401) 19.088 ======================= 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| 2.095 ( -12.407 -9.270 1.981) 15.613 2.095 ( -12.407 9.270 1.981) 15.613 2.806 ( -3.525 -11.143 -0.962) 11.727 2.806 ( -3.525 11.143 -0.962) 11.727 3.699 ( 1.420 -2.775 -7.824) 8.422 3.699 ( 1.420 2.775 -7.824) 8.422 3.844 ( -1.503 -6.604 -7.068) 9.789 3.844 ( -1.503 6.604 -7.068) 9.789 4.454 ( 2.378 -3.959 -0.111) 4.620 4.454 ( 2.378 3.959 -0.111) 4.620 5.031 ( -12.601 -6.299 -0.005) 14.087 5.031 ( -12.601 6.299 -0.005) 14.087 5.895 ( 5.703 -4.234 -12.630) 14.491 5.895 ( 5.703 4.234 -12.630) 14.491 6.057 ( 4.051 -8.532 -11.600) 14.959 6.057 ( 4.051 8.532 -11.600) 14.959 7.690 ( 4.762 -11.913 -4.150) 13.484 7.690 ( 4.762 11.913 -4.150) 13.484 8.106 ( -9.445 -14.404 -10.705) 20.280 8.106 ( -9.445 14.404 -10.705) 20.280 8.874 ( -6.709 -9.290 14.401) 18.404 8.874 ( -6.709 9.290 14.401) 18.404 9.895 ( 3.056 -15.601 -1.116) 15.936 9.895 ( 3.056 15.601 -1.116) 15.936 10.256 ( -5.301 -15.038 11.351) 19.572 10.256 ( -5.301 15.038 11.351) 19.572 11.174 ( 2.639 -6.156 8.683) 10.966 11.174 ( 2.639 6.156 8.683) 10.966 11.765 ( 2.800 -5.774 -4.332) 7.742 11.765 ( 2.800 5.774 -4.332) 7.742 11.876 ( -2.877 -1.608 -3.058) 4.496 11.876 ( -2.877 1.608 -3.058) 4.496 12.359 ( 5.906 -0.738 -0.010) 5.952 12.359 ( 5.906 0.738 -0.010) 5.952 13.033 ( 6.123 -18.035 16.054) 24.909 13.033 ( 6.123 18.035 16.054) 24.909 13.270 ( -1.151 -3.357 -2.730) 4.477 13.270 ( -1.151 3.357 -2.730) 4.477 14.168 ( 3.254 -10.652 2.411) 11.396 14.168 ( 3.254 10.652 2.411) 11.396 15.985 ( 2.244 -1.395 6.197) 6.736 15.985 ( 2.244 1.395 6.197) 6.736 16.295 ( 3.508 -1.417 5.797) 6.922 16.295 ( 3.508 1.417 5.797) 6.922 18.219 ( -7.130 -20.625 1.064) 21.849 18.219 ( -7.130 20.625 1.064) 21.849 19.328 ( 6.299 -11.145 -15.044) 19.754 19.328 ( 6.299 11.145 -15.044) 19.754 ======================= 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| 1.996 ( -1.534 -15.049 3.070) 15.435 1.996 ( -1.534 15.049 3.070) 15.435 2.640 ( -13.808 -14.260 0.510) 19.856 2.640 ( -13.808 14.260 0.510) 19.856 3.569 ( -7.898 -4.951 -4.412) 10.313 3.569 ( -7.898 4.951 -4.412) 10.313 3.837 ( 10.536 -4.597 -7.879) 13.936 3.837 ( 10.537 4.597 -7.879) 13.936 4.464 ( -2.583 -9.269 2.290) 9.891 4.464 ( -2.583 9.270 2.290) 9.891 4.871 ( -6.075 -3.711 0.799) 7.164 4.871 ( -6.075 3.711 0.799) 7.164 5.809 ( 1.360 -7.016 -14.801) 16.436 5.809 ( 1.360 7.016 -14.801) 16.436 6.151 ( 12.279 -7.852 -1.831) 14.689 6.151 ( 12.279 7.852 -1.831) 14.689 7.646 ( -4.491 -9.686 -7.883) 13.271 7.646 ( -4.491 9.686 -7.883) 13.271 7.995 ( 4.551 -9.889 0.257) 10.890 7.995 ( 4.551 9.889 0.257) 10.890 8.854 ( -9.966 -6.477 11.058) 16.234 8.854 ( -9.966 6.477 11.058) 16.234 9.883 ( 1.094 -6.651 -3.713) 7.695 9.883 ( 1.094 6.651 -3.713) 7.695 10.307 ( 0.454 -23.093 6.734) 24.059 10.307 ( 0.454 23.093 6.734) 24.059 11.294 ( -0.659 -5.453 6.255) 8.324 11.294 ( -0.659 5.453 6.255) 8.324 11.583 ( -17.289 -3.745 -3.258) 17.987 11.583 ( -17.289 3.745 -3.258) 17.987 11.826 ( 3.528 -4.844 -2.485) 6.488 11.826 ( 3.528 4.844 -2.485) 6.488 12.525 ( 11.593 -6.523 -1.401) 13.375 12.525 ( 11.593 6.523 -1.401) 13.375 13.105 ( -0.824 -8.179 -3.261) 8.844 13.105 ( -0.824 8.179 -3.261) 8.844 13.478 ( 8.412 -7.240 17.261) 20.521 13.478 ( 8.412 7.240 17.261) 20.521 14.221 ( 2.139 -7.820 -1.730) 8.290 14.221 ( 2.139 7.820 -1.730) 8.290 16.096 ( 2.691 -1.680 5.965) 6.756 16.096 ( 2.691 1.680 5.965) 6.756 16.394 ( 2.065 -0.687 3.156) 3.834 16.394 ( 2.065 0.687 3.156) 3.834 18.073 ( -9.805 -25.265 1.491) 27.142 18.073 ( -9.805 25.265 1.491) 27.142 19.339 ( 11.266 -8.768 -14.030) 20.016 19.339 ( 11.266 8.768 -14.030) 20.016 ======================= 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| 2.046 ( 0.557 -15.156 3.553) 15.577 2.046 ( 0.557 15.156 3.553) 15.577 2.381 ( -14.192 -14.046 4.724) 20.519 2.381 ( -14.192 14.046 4.724) 20.519 3.436 ( -3.704 -5.082 1.864) 6.559 3.436 ( -3.704 5.082 1.864) 6.559 3.985 ( 11.429 -4.045 -6.467) 13.741 3.985 ( 11.429 4.045 -6.467) 13.741 4.436 ( -3.482 -10.959 3.995) 12.173 4.436 ( -3.482 10.959 3.995) 12.173 4.804 ( -3.425 -5.630 3.840) 7.627 4.804 ( -3.425 5.630 3.840) 7.627 5.681 ( 0.160 -5.363 -11.969) 13.117 5.681 ( 0.160 5.363 -11.969) 13.117 6.384 ( 9.136 -7.776 5.080) 13.029 6.384 ( 9.136 7.776 5.080) 13.029 7.493 ( -3.207 -10.205 -3.360) 11.212 7.493 ( -3.207 10.205 -3.360) 11.212 8.141 ( 6.409 -10.244 3.799) 12.667 8.141 ( 6.409 10.244 3.799) 12.667 8.758 ( -10.145 -3.187 8.837) 13.826 8.758 ( -10.145 3.187 8.837) 13.826 9.948 ( 11.584 -3.337 -4.138) 12.745 9.948 ( 11.584 3.337 -4.138) 12.745 10.373 ( 0.197 -28.802 2.241) 28.890 10.373 ( 0.197 28.802 2.241) 28.890 11.064 ( -20.069 -6.534 -6.569) 22.105 11.064 ( -20.069 6.534 -6.569) 22.105 11.392 ( -3.026 -5.010 -1.133) 5.962 11.392 ( -3.026 5.010 -1.133) 5.962 11.905 ( 5.061 -5.883 1.678) 7.940 11.905 ( 5.061 5.883 1.678) 7.940 12.720 ( 9.516 -7.741 1.385) 12.345 12.720 ( 9.516 7.741 1.385) 12.345 13.051 ( -1.312 -9.919 -3.535) 10.612 13.051 ( -1.312 9.919 -3.535) 10.612 13.691 ( -1.469 -8.451 6.653) 10.855 13.691 ( -1.469 8.451 6.653) 10.855 14.232 ( 2.675 -6.220 -2.920) 7.374 14.232 ( 2.675 6.220 -2.920) 7.374 16.177 ( 0.799 -2.477 1.966) 3.262 16.177 ( 0.799 2.477 1.966) 3.262 16.431 ( 0.301 -2.442 -0.245) 2.472 16.431 ( 0.301 2.442 -0.245) 2.472 17.918 ( -8.905 -26.586 3.260) 28.227 17.918 ( -8.905 26.586 3.260) 28.227 19.456 ( 14.482 -4.918 -9.605) 18.060 19.456 ( 14.482 4.918 -9.605) 18.060 ======================= 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| 2.011 ( -5.277 -4.169 3.597) 7.627 2.011 ( -5.277 4.169 3.597) 7.627 2.333 ( -0.765 -2.711 9.263) 9.682 2.333 ( -0.765 2.711 9.263) 9.682 3.477 ( 2.625 -5.471 6.460) 8.863 3.477 ( 2.625 5.471 6.460) 8.863 4.049 ( -0.022 -6.644 -3.045) 7.308 4.049 ( -0.022 6.644 -3.045) 7.308 4.434 ( -0.609 -6.464 3.115) 7.202 4.434 ( -0.609 6.464 3.115) 7.202 4.851 ( 2.652 -8.041 7.467) 11.289 4.851 ( 2.652 8.041 7.467) 11.289 5.600 ( 2.171 -1.421 -6.588) 7.081 5.600 ( 2.171 1.421 -6.588) 7.081 6.520 ( -2.140 -5.767 8.146) 10.208 6.520 ( -2.140 5.767 8.146) 10.208 7.514 ( 5.140 -9.698 4.428) 11.836 7.514 ( 5.140 9.698 4.428) 11.836 8.270 ( 3.234 -13.443 4.393) 14.507 8.270 ( 3.234 13.443 4.393) 14.507 8.720 ( -2.466 -2.273 8.052) 8.723 8.720 ( -2.466 2.273 8.052) 8.723 10.125 ( -1.043 -17.502 -4.913) 18.208 10.125 ( -1.043 17.502 -4.913) 18.208 10.349 ( 8.080 -19.706 -3.250) 21.545 10.349 ( 8.080 19.706 -3.250) 21.545 10.696 ( -9.258 -11.959 -8.640) 17.418 10.696 ( -9.258 11.959 -8.640) 17.418 11.325 ( -2.045 -3.107 -1.393) 3.972 11.325 ( -2.045 3.107 -1.393) 3.972 12.015 ( 4.414 -5.103 1.719) 6.963 12.015 ( 4.414 5.103 1.719) 6.963 12.850 ( 0.105 -7.777 -1.287) 7.883 12.850 ( 0.105 7.777 -1.287) 7.883 13.022 ( 4.044 -10.373 0.326) 11.138 13.022 ( 4.044 10.373 0.326) 11.138 13.548 ( -12.406 -11.164 -6.046) 17.752 13.548 ( -12.406 11.164 -6.046) 17.752 14.251 ( 1.071 -7.106 -2.713) 7.681 14.251 ( 1.071 7.106 -2.713) 7.681 16.151 ( -2.687 -3.253 -2.991) 5.172 16.151 ( -2.687 3.253 -2.991) 5.172 16.391 ( -2.301 -3.280 -4.577) 6.083 16.391 ( -2.301 3.280 -4.577) 6.083 17.849 ( -3.819 -25.006 7.109) 26.276 17.849 ( -3.819 25.006 7.109) 26.276 19.647 ( 13.799 -2.261 -5.571) 15.052 19.647 ( 13.799 2.261 -5.571) 15.052 ======================= 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| 1.655 ( -2.625 0.000 22.882) 23.032 1.674 ( 6.801 0.000 20.946) 22.022 2.596 ( -3.824 0.000 -4.087) 5.598 2.803 ( -2.552 0.000 13.928) 14.160 3.039 ( 11.777 0.000 3.063) 12.169 3.706 ( -4.758 0.000 13.198) 14.030 3.830 ( 4.628 0.000 -10.822) 11.770 3.893 ( 1.556 0.000 20.958) 21.016 3.993 ( 14.106 0.000 11.125) 17.965 4.502 ( 6.624 0.000 1.786) 6.860 4.941 ( -6.995 0.000 -2.170) 7.324 5.058 ( 0.309 0.000 -7.586) 7.593 5.419 ( -6.238 0.000 4.261) 7.554 5.939 ( -0.775 0.000 -5.400) 5.455 6.428 ( 6.670 0.000 12.242) 13.941 6.640 ( -8.738 0.000 3.934) 9.582 6.954 ( 2.740 0.000 -0.226) 2.749 7.377 ( -15.508 0.000 -9.132) 17.997 8.054 ( -1.504 0.000 7.320) 7.473 8.422 ( 7.992 0.000 -2.589) 8.401 8.804 ( 4.497 0.000 13.279) 14.020 9.043 ( 9.664 0.000 17.417) 19.918 9.687 ( 13.395 0.000 -17.490) 22.030 9.767 ( 0.978 0.000 -5.280) 5.369 10.051 ( -12.433 0.000 -8.955) 15.322 10.618 ( 3.693 0.000 -25.277) 25.545 10.901 ( -29.763 0.000 10.630) 31.605 11.382 ( 11.577 0.000 3.687) 12.150 11.521 ( 4.464 0.000 2.315) 5.028 11.690 ( -4.394 0.000 2.338) 4.978 12.044 ( 5.572 0.000 3.679) 6.677 12.245 ( -14.819 0.000 -2.210) 14.983 12.386 ( 1.594 0.000 2.362) 2.849 12.478 ( 2.371 0.000 -7.594) 7.956 12.780 ( 6.641 0.000 -1.240) 6.756 13.075 ( -7.266 0.000 -3.400) 8.022 13.614 ( -8.142 0.000 -4.375) 9.243 13.685 ( 1.389 0.000 -5.921) 6.082 15.126 ( -6.354 0.000 1.326) 6.491 15.285 ( 1.767 0.000 -3.001) 3.483 15.514 ( 7.958 0.000 8.427) 11.590 15.712 ( -2.922 0.000 -0.435) 2.954 16.277 ( -5.602 0.000 -3.130) 6.417 16.470 ( -0.805 0.000 -5.347) 5.407 16.950 ( 3.948 0.000 23.272) 23.604 18.218 ( 7.187 0.000 -11.415) 13.490 19.426 ( -10.560 0.000 6.146) 12.218 19.865 ( 34.147 0.000 -6.457) 34.752 ======================= 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| 1.856 ( 2.486 0.000 16.556) 16.741 2.047 ( 9.281 0.000 21.319) 23.252 2.571 ( 6.986 0.000 -7.752) 10.436 2.787 ( -0.691 0.000 -6.502) 6.538 3.340 ( 13.502 0.000 4.120) 14.117 3.680 ( -11.375 0.000 9.788) 15.006 3.727 ( -3.585 0.000 -11.356) 11.908 4.140 ( 0.205 0.000 23.525) 23.525 4.352 ( 12.812 0.000 9.416) 15.900 4.647 ( 7.770 0.000 -0.583) 7.792 4.774 ( -5.623 0.000 -6.301) 8.445 4.955 ( -0.222 0.000 -12.264) 12.266 5.370 ( -7.416 0.000 10.428) 12.797 5.843 ( -2.774 0.000 -5.917) 6.536 6.511 ( -8.285 0.000 0.084) 8.285 6.638 ( 1.511 0.000 12.975) 13.062 7.027 ( -13.326 0.000 -6.847) 14.982 7.088 ( 9.175 0.000 5.231) 10.562 8.068 ( -5.118 0.000 7.646) 9.201 8.396 ( -2.144 0.000 -7.119) 7.435 9.025 ( 4.043 0.000 9.555) 10.375 9.487 ( -16.001 0.000 -4.531) 16.630 9.555 ( 19.840 0.000 19.987) 28.162 9.729 ( 10.817 0.000 -16.595) 19.810 9.981 ( 6.873 0.000 -4.565) 8.251 10.363 ( -2.688 0.000 -23.004) 23.160 10.653 ( -10.489 0.000 9.574) 14.202 11.534 ( 4.948 0.000 0.011) 4.948 11.597 ( -4.799 0.000 -1.889) 5.158 11.710 ( 3.824 0.000 6.050) 7.157 11.927 ( -11.600 0.000 0.384) 11.607 12.207 ( 3.833 0.000 5.704) 6.873 12.359 ( -3.253 0.000 0.130) 3.256 12.504 ( 5.212 0.000 -3.739) 6.414 12.841 ( -11.486 0.000 -8.401) 14.230 12.958 ( 8.202 0.000 5.113) 9.665 13.472 ( -4.675 0.000 -0.495) 4.701 13.669 ( 2.196 0.000 -3.843) 4.426 15.043 ( -4.561 0.000 2.393) 5.151 15.306 ( 2.668 0.000 -0.678) 2.753 15.619 ( -4.718 0.000 -3.996) 6.183 15.700 ( 5.879 0.000 3.328) 6.755 16.187 ( -3.956 0.000 2.816) 4.856 16.389 ( -1.847 0.000 -4.529) 4.891 17.312 ( 8.241 0.000 23.012) 24.444 18.164 ( 5.005 0.000 -19.131) 19.775 19.193 ( -18.778 0.000 1.150) 18.813 20.202 ( 14.943 0.000 -13.477) 20.123 ======================= 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| 2.075 ( 6.981 0.000 9.489) 11.781 2.379 ( 0.162 0.000 21.283) 21.283 2.650 ( 11.472 0.000 -12.636) 17.067 2.678 ( 1.443 0.000 -13.611) 13.687 3.474 ( -14.608 0.000 2.117) 14.761 3.483 ( -10.500 0.000 -9.726) 14.312 3.602 ( 11.653 0.000 -1.144) 11.709 4.331 ( -3.197 0.000 17.073) 17.370 4.581 ( 5.354 0.000 -3.082) 6.178 4.629 ( -4.199 0.000 -4.612) 6.237 4.774 ( 7.877 0.000 -5.364) 9.530 4.828 ( 1.988 0.000 -8.339) 8.573 5.348 ( -7.940 0.000 10.920) 13.501 5.729 ( -1.986 0.000 -7.613) 7.868 6.335 ( -7.714 0.000 -5.514) 9.482 6.669 ( -9.885 0.000 6.040) 11.584 6.838 ( -3.691 0.000 3.957) 5.411 7.365 ( 11.216 0.000 9.815) 14.904 8.011 ( -7.593 0.000 2.967) 8.152 8.266 ( -2.803 0.000 -7.511) 8.017 8.978 ( -14.887 0.000 6.063) 16.075 9.381 ( 6.455 0.000 -1.542) 6.637 9.633 ( 1.220 0.000 -23.700) 23.732 9.979 ( 4.939 0.000 -1.950) 5.310 10.171 ( 10.159 0.000 11.253) 15.160 10.306 ( 13.955 0.000 10.928) 17.724 10.640 ( 4.094 0.000 -2.525) 4.810 11.438 ( -19.209 0.000 1.089) 19.240 11.496 ( -3.467 0.000 -2.932) 4.540 11.684 ( 5.746 0.000 4.632) 7.381 12.082 ( 8.589 0.000 5.205) 10.043 12.206 ( -4.793 0.000 0.027) 4.794 12.353 ( -2.352 0.000 4.435) 5.020 12.437 ( -10.582 0.000 -6.573) 12.457 12.622 ( 2.289 0.000 -8.399) 8.706 13.139 ( 4.863 0.000 6.395) 8.034 13.447 ( 0.622 0.000 4.085) 4.132 13.686 ( 2.243 0.000 -0.723) 2.357 15.014 ( -2.011 0.000 4.005) 4.481 15.365 ( 1.943 0.000 2.532) 3.192 15.490 ( -2.614 0.000 -5.582) 6.164 15.806 ( 3.469 0.000 1.394) 3.738 16.175 ( -3.024 0.000 6.358) 7.040 16.333 ( -0.562 0.000 -1.232) 1.354 17.627 ( 3.092 0.000 12.242) 12.627 18.029 ( 5.132 0.000 -25.560) 26.070 18.812 ( -19.626 0.000 -1.591) 19.690 20.195 ( 1.748 0.000 -15.131) 15.232 ======================= 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| 2.306 ( 10.852 0.000 4.189) 11.633 2.322 ( -14.147 0.000 -2.107) 14.303 2.649 ( 2.261 0.000 -17.701) 17.845 2.674 ( 0.615 0.000 3.360) 3.416 3.192 ( -14.939 0.000 0.774) 14.959 3.220 ( -5.895 0.000 -7.030) 9.175 3.794 ( 11.255 0.000 -7.229) 13.376 4.363 ( -7.438 0.000 9.359) 11.955 4.489 ( -2.804 0.000 -13.782) 14.064 4.515 ( -6.705 0.000 1.869) 6.961 4.697 ( 4.555 0.000 -18.974) 19.513 4.973 ( 4.239 0.000 6.637) 7.875 5.250 ( -10.566 0.000 2.810) 10.934 5.620 ( -0.217 0.000 -9.903) 9.905 6.152 ( -2.067 0.000 -9.801) 10.016 6.573 ( -8.942 0.000 8.799) 12.545 6.842 ( -0.159 0.000 4.562) 4.565 7.601 ( 3.041 0.000 5.398) 6.196 7.856 ( -7.974 0.000 -3.822) 8.842 8.195 ( 3.126 0.000 -4.715) 5.657 8.834 ( -8.709 0.000 10.950) 13.991 9.316 ( -6.105 0.000 -22.532) 23.344 9.510 ( 2.520 0.000 7.637) 8.042 10.029 ( 2.550 0.000 2.940) 3.892 10.531 ( 13.666 0.000 13.682) 19.338 10.696 ( 9.700 0.000 8.473) 12.880 10.747 ( 16.107 0.000 -12.000) 20.085 11.125 ( -15.971 0.000 3.873) 16.434 11.416 ( -2.455 0.000 -1.934) 3.125 11.912 ( 9.081 0.000 11.331) 14.521 11.937 ( -12.800 0.000 -12.881) 18.159 12.116 ( -4.553 0.000 -0.165) 4.556 12.292 ( -8.069 0.000 3.102) 8.645 12.385 ( 1.401 0.000 0.013) 1.401 12.625 ( 5.718 0.000 -2.529) 6.253 13.258 ( 0.779 0.000 6.356) 6.404 13.589 ( 7.255 0.000 9.041) 11.591 13.739 ( 2.345 0.000 3.469) 4.187 15.052 ( 0.580 0.000 6.022) 6.050 15.344 ( -3.634 0.000 0.095) 3.635 15.513 ( 6.556 0.000 -0.237) 6.560 15.867 ( 2.238 0.000 0.959) 2.434 16.195 ( -2.640 0.000 7.846) 8.279 16.350 ( 1.612 0.000 2.322) 2.826 17.507 ( -18.429 0.000 -10.226) 21.076 17.829 ( 4.284 0.000 -31.213) 31.506 18.625 ( -1.550 0.000 6.532) 6.714 19.999 ( -5.169 0.000 -15.804) 16.628 ======================= 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| 1.981 ( -16.393 0.000 -5.318) 17.234 2.336 ( -14.835 0.000 -12.754) 19.563 2.581 ( 15.698 0.000 -0.763) 15.717 2.670 ( -6.104 0.000 7.149) 9.401 3.008 ( -5.168 0.000 -0.436) 5.187 3.156 ( 5.373 0.000 -8.933) 10.424 3.745 ( -10.634 0.000 -6.488) 12.457 4.175 ( -16.530 0.000 -4.442) 17.116 4.262 ( -7.640 0.000 -11.792) 14.051 4.522 ( -0.723 0.000 14.000) 14.019 4.582 ( 5.164 0.000 -19.110) 19.796 5.051 ( -0.256 0.000 1.658) 1.678 5.125 ( -0.612 0.000 -0.750) 0.968 5.519 ( 1.284 0.000 -11.095) 11.169 6.131 ( 11.140 0.000 -8.761) 14.173 6.415 ( -14.144 0.000 1.555) 14.229 7.008 ( 10.849 0.000 7.474) 13.175 7.569 ( -5.436 0.000 -3.224) 6.320 7.693 ( -3.565 0.000 -5.409) 6.478 8.206 ( 1.250 0.000 -9.251) 9.335 8.874 ( -3.525 0.000 16.969) 17.332 9.085 ( -0.894 0.000 -5.939) 6.005 9.579 ( -7.041 0.000 12.339) 14.206 10.114 ( 0.588 0.000 7.389) 7.413 10.665 ( -15.080 0.000 -1.197) 15.127 10.898 ( 17.587 0.000 2.131) 17.716 10.978 ( 20.495 0.000 -11.829) 23.664 11.003 ( -2.893 0.000 0.368) 2.916 11.376 ( -0.790 0.000 0.977) 1.256 11.603 ( -9.368 0.000 -6.745) 11.544 12.036 ( -4.615 0.000 -0.568) 4.650 12.182 ( -6.400 0.000 6.053) 8.809 12.227 ( 8.276 0.000 8.908) 12.159 12.339 ( 5.004 0.000 -8.779) 10.105 12.767 ( 5.472 0.000 6.590) 8.565 13.278 ( -4.568 0.000 3.791) 5.936 13.855 ( 3.278 0.000 9.509) 10.058 13.856 ( 8.918 0.000 11.821) 14.808 15.153 ( 2.009 0.000 8.719) 8.948 15.317 ( 0.307 0.000 2.037) 2.060 15.637 ( 5.876 0.000 0.573) 5.904 15.904 ( -0.042 0.000 0.906) 0.907 16.245 ( -0.756 0.000 8.604) 8.637 16.425 ( 2.892 0.000 3.429) 4.486 16.925 ( -23.301 0.000 -19.572) 30.431 17.533 ( 0.475 0.000 -36.871) 36.874 18.772 ( 6.496 0.000 7.973) 10.284 19.709 ( -8.486 0.000 -15.974) 18.088 ======================= 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| 1.701 ( -11.744 0.000 2.229) 11.954 1.910 ( -19.299 0.000 -5.836) 20.162 2.630 ( -3.345 0.000 1.870) 3.833 2.888 ( 18.257 0.000 -2.098) 18.377 2.969 ( -4.893 0.000 8.018) 9.393 3.175 ( 5.998 0.000 -8.145) 10.115 3.315 ( -25.886 0.000 -3.094) 26.070 3.836 ( -13.940 0.000 -1.721) 14.046 3.975 ( -12.518 0.000 -7.510) 14.597 4.526 ( 6.533 0.000 -13.526) 15.022 4.675 ( 2.141 0.000 11.478) 11.676 5.024 ( -0.902 0.000 -2.673) 2.821 5.236 ( 10.531 0.000 2.201) 10.758 5.484 ( 8.541 0.000 -11.828) 14.589 6.149 ( -11.753 0.000 -5.128) 12.823 6.359 ( 18.945 0.000 -3.111) 19.199 7.318 ( 14.031 0.000 6.052) 15.281 7.401 ( -7.549 0.000 -5.237) 9.188 7.637 ( 1.696 0.000 -1.711) 2.409 8.030 ( -3.876 0.000 -15.413) 15.893 9.006 ( -2.202 0.000 17.336) 17.475 9.121 ( 1.997 0.000 4.423) 4.853 9.494 ( -14.908 0.000 11.020) 18.539 10.181 ( -10.367 0.000 12.060) 15.904 10.301 ( -8.786 0.000 -11.418) 14.407 10.930 ( -1.829 0.000 -3.572) 4.013 11.135 ( 8.903 0.000 -12.099) 15.022 11.220 ( 18.911 0.000 -6.367) 19.954 11.443 ( 4.623 0.000 4.552) 6.488 11.450 ( -4.473 0.000 -1.577) 4.743 11.939 ( -2.607 0.000 -1.227) 2.882 12.241 ( 2.759 0.000 10.323) 10.685 12.277 ( 6.597 0.000 -7.212) 9.775 12.507 ( 7.326 0.000 0.481) 7.342 12.962 ( 6.718 0.000 10.126) 12.152 13.182 ( -7.247 0.000 0.229) 7.251 14.033 ( 2.746 0.000 12.446) 12.745 14.108 ( 5.905 0.000 9.832) 11.469 15.280 ( 0.508 0.000 10.264) 10.276 15.432 ( 6.958 0.000 9.539) 11.807 15.717 ( 2.919 0.000 -0.155) 2.923 15.788 ( -13.573 0.000 -6.139) 14.897 16.347 ( 2.663 0.000 7.522) 7.979 16.422 ( -7.159 0.000 -7.725) 10.532 16.535 ( 2.548 0.000 0.100) 2.549 17.073 ( -7.922 0.000 -41.334) 42.086 18.978 ( 7.291 0.000 7.331) 10.340 19.384 ( -9.643 0.000 -14.551) 17.457 ======================= 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| 1.545 ( -14.116 0.000 9.218) 16.859 1.570 ( -17.219 0.000 6.482) 18.399 2.525 ( -12.062 0.000 2.420) 12.303 2.843 ( -15.198 0.000 17.428) 23.124 3.112 ( 8.475 0.000 -7.249) 11.152 3.145 ( 6.721 0.000 0.796) 6.769 3.258 ( 8.410 0.000 0.049) 8.410 3.647 ( -10.052 0.000 7.115) 12.315 3.700 ( -8.352 0.000 -4.636) 9.552 4.502 ( 0.769 0.000 -6.421) 6.467 4.833 ( 2.555 0.000 11.232) 11.519 5.007 ( 2.406 0.000 -2.104) 3.196 5.506 ( 15.146 0.000 3.424) 15.528 5.595 ( 16.452 0.000 -12.103) 20.424 5.904 ( -7.602 0.000 -8.099) 11.107 6.694 ( 15.804 0.000 2.938) 16.075 7.200 ( -8.434 0.000 -5.093) 9.852 7.585 ( 10.484 0.000 0.533) 10.498 7.741 ( 7.125 0.000 6.406) 9.582 7.849 ( 0.263 0.000 -10.657) 10.661 9.070 ( -5.656 0.000 0.328) 5.666 9.153 ( -3.093 0.000 1.732) 3.545 9.334 ( -14.192 0.000 19.804) 24.364 9.809 ( -18.120 0.000 -4.832) 18.753 10.384 ( 12.746 0.000 -4.080) 13.383 10.906 ( 1.731 0.000 -0.481) 1.796 11.102 ( -0.712 0.000 -9.472) 9.498 11.370 ( 5.539 0.000 -7.509) 9.331 11.383 ( -1.833 0.000 0.023) 1.833 11.600 ( 8.741 0.000 3.515) 9.422 11.978 ( 5.363 0.000 1.245) 5.505 12.374 ( 8.775 0.000 -2.996) 9.272 12.394 ( 3.589 0.000 1.508) 3.893 12.574 ( 4.441 0.000 -6.525) 7.893 13.074 ( -1.799 0.000 -2.584) 3.149 13.166 ( 3.484 0.000 8.936) 9.591 14.140 ( -2.119 0.000 2.978) 3.655 14.245 ( 1.477 0.000 1.767) 2.303 15.346 ( -5.289 0.000 1.282) 5.442 15.378 ( -16.910 0.000 0.895) 16.934 15.621 ( 0.486 0.000 -3.841) 3.872 15.959 ( 20.758 0.000 24.213) 31.893 16.370 ( 1.001 0.000 2.887) 3.055 16.423 ( -13.631 0.000 -26.451) 29.757 16.478 ( -0.096 0.000 -1.409) 1.412 16.608 ( 3.353 0.000 0.783) 3.443 19.088 ( -7.992 0.000 -10.438) 13.147 19.181 ( 6.172 0.000 8.152) 10.225 ======================= 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| 1.387 ( -15.625 0.000 18.416) 24.151 1.437 ( -11.922 0.000 19.391) 22.763 2.403 ( -13.212 0.000 25.158) 28.416 2.872 ( 4.478 0.000 0.136) 4.480 3.050 ( -10.519 0.000 -1.961) 10.700 3.347 ( 7.590 0.000 10.544) 12.991 3.388 ( 6.502 0.000 4.248) 7.766 3.607 ( -6.198 0.000 13.525) 14.878 3.681 ( 11.066 0.000 -8.124) 13.728 4.430 ( -2.427 0.000 -2.468) 3.462 4.978 ( 0.218 0.000 11.001) 11.003 5.056 ( 3.942 0.000 -1.530) 4.229 5.689 ( -3.274 0.000 -11.405) 11.866 5.797 ( 15.935 0.000 -8.910) 18.257 5.847 ( 13.432 0.000 7.389) 15.330 6.894 ( -2.272 0.000 5.150) 5.629 7.023 ( -3.313 0.000 -3.984) 5.181 7.751 ( 6.939 0.000 2.003) 7.223 7.866 ( 8.973 0.000 -1.331) 9.071 7.920 ( 2.616 0.000 4.911) 5.565 8.813 ( -13.291 0.000 -4.881) 14.159 9.043 ( -8.094 0.000 -0.330) 8.100 9.430 ( 0.829 0.000 16.455) 16.475 9.576 ( 1.272 0.000 -9.660) 9.743 10.588 ( 17.551 0.000 -12.671) 21.647 10.874 ( -14.108 0.000 -7.954) 16.196 10.976 ( 4.370 0.000 2.971) 5.285 11.388 ( 1.047 0.000 2.026) 2.281 11.424 ( 5.960 0.000 -0.755) 6.007 11.779 ( 5.389 0.000 1.814) 5.686 12.061 ( 1.002 0.000 1.217) 1.576 12.329 ( -5.879 0.000 -8.038) 9.958 12.487 ( 2.961 0.000 -0.226) 2.969 12.567 ( 6.045 0.000 -11.215) 12.740 13.008 ( -2.110 0.000 -11.283) 11.479 13.244 ( -2.393 0.000 4.604) 5.189 13.961 ( -10.734 0.000 -10.009) 14.677 14.144 ( -7.666 0.000 -10.367) 12.894 15.140 ( -6.164 0.000 9.128) 11.014 15.332 ( -6.566 0.000 5.254) 8.409 15.460 ( -5.587 0.000 -12.421) 13.620 15.890 ( -10.051 0.000 -7.341) 12.446 16.440 ( 1.249 0.000 5.290) 5.435 16.503 ( 0.524 0.000 -2.311) 2.369 16.665 ( 1.119 0.000 2.719) 2.940 17.002 ( 45.029 0.000 37.112) 58.351 18.928 ( 0.455 0.000 -3.793) 3.820 19.358 ( 3.130 0.000 9.290) 9.803 ======================= 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| 1.416 ( -3.707 0.000 22.197) 22.505 1.498 ( -7.165 0.000 24.958) 25.967 2.563 ( -4.331 0.000 34.687) 34.956 2.789 ( -13.406 0.000 -1.408) 13.480 2.937 ( 6.771 0.000 -7.969) 10.457 3.589 ( 2.768 0.000 15.102) 15.354 3.636 ( 12.053 0.000 9.697) 15.470 3.685 ( -1.234 0.000 16.051) 16.098 3.799 ( 10.832 0.000 -10.645) 15.188 4.407 ( 1.624 0.000 0.668) 1.756 5.033 ( -4.539 0.000 6.291) 7.757 5.091 ( 2.515 0.000 -3.953) 4.685 5.522 ( -4.668 0.000 -5.358) 7.106 5.944 ( 7.462 0.000 -6.130) 9.657 6.160 ( 11.137 0.000 8.573) 14.055 6.775 ( -10.310 0.000 3.524) 10.896 6.969 ( -2.180 0.000 -1.445) 2.615 7.735 ( -11.739 0.000 -6.050) 13.206 7.970 ( 2.872 0.000 4.851) 5.637 8.136 ( 16.602 0.000 5.211) 17.401 8.666 ( -3.777 0.000 9.112) 9.864 8.927 ( -5.061 0.000 3.888) 6.382 9.602 ( 12.918 0.000 -14.696) 19.567 9.637 ( 10.203 0.000 2.231) 10.445 10.473 ( -21.116 0.000 -5.683) 21.868 10.706 ( 12.797 0.000 -20.979) 24.574 11.134 ( 8.873 0.000 5.017) 10.193 11.423 ( -19.031 0.000 -1.520) 19.091 11.446 ( 2.571 0.000 1.913) 3.204 11.696 ( -5.777 0.000 1.647) 6.007 12.023 ( -5.360 0.000 1.432) 5.547 12.251 ( 5.808 0.000 3.004) 6.539 12.439 ( -4.342 0.000 -3.350) 5.484 12.558 ( 2.060 0.000 -10.238) 10.443 12.804 ( -2.166 0.000 -10.974) 11.186 13.195 ( -5.233 0.000 0.903) 5.311 13.749 ( -2.141 0.000 -6.962) 7.284 13.854 ( -10.556 0.000 -9.060) 13.911 15.230 ( -4.209 0.000 1.302) 4.406 15.276 ( 1.781 0.000 14.360) 14.470 15.311 ( -0.527 0.000 -5.711) 5.735 15.760 ( -3.642 0.000 0.767) 3.722 16.422 ( -4.087 0.000 -5.733) 7.041 16.498 ( 1.476 0.000 -0.409) 1.532 16.734 ( -0.685 0.000 13.109) 13.127 18.002 ( 27.965 0.000 5.674) 28.535 19.186 ( 31.360 0.000 4.461) 31.675 19.463 ( -2.498 0.000 8.975) 9.316 ======================= 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| 1.648 ( 3.608 3.509 19.378) 20.020 1.825 ( 3.814 9.201 20.955) 23.201 2.530 ( -2.591 -4.107 -2.946) 5.679 2.867 ( -0.469 1.759 -0.731) 1.962 3.097 ( 4.454 7.709 14.496) 17.012 3.735 ( -3.779 2.702 11.924) 12.797 3.873 ( 4.880 2.864 -3.452) 6.628 3.900 ( 4.500 1.760 11.294) 12.284 4.067 ( 9.570 6.500 11.359) 16.213 4.569 ( 7.183 6.060 1.917) 9.592 4.850 ( -6.837 -5.797 0.562) 8.981 5.118 ( 0.870 3.069 -8.574) 9.148 5.438 ( -3.658 2.071 4.529) 6.179 5.886 ( -0.140 -4.044 -2.667) 4.847 6.468 ( 3.875 3.221 11.755) 12.790 6.690 ( -10.152 3.589 4.461) 11.655 7.032 ( 5.131 8.171 0.351) 9.654 7.476 ( -13.937 8.926 -9.143) 18.908 8.144 ( 0.244 8.373 4.914) 9.712 8.472 ( 8.423 4.680 -2.207) 9.885 8.729 ( 4.731 -5.078 13.331) 15.030 9.108 ( 9.111 3.520 13.595) 16.740 9.456 ( 11.039 -10.862 -4.561) 16.145 9.893 ( -20.030 -1.703 -9.375) 22.181 10.097 ( 5.991 7.347 -13.109) 16.178 10.488 ( -4.868 -10.559 -7.347) 13.754 10.865 ( -7.242 -2.604 -2.034) 7.960 11.395 ( 7.015 0.138 0.775) 7.059 11.513 ( 1.042 -2.145 3.282) 4.057 11.715 ( -4.035 1.206 0.110) 4.213 11.917 ( 1.419 -11.000 -0.446) 11.100 12.209 ( -5.050 1.682 -2.011) 5.690 12.290 ( -1.975 -8.929 -0.389) 9.153 12.591 ( 2.988 9.943 0.937) 10.424 12.845 ( -0.533 -0.141 -3.492) 3.535 13.069 ( -1.499 2.843 -0.320) 3.230 13.483 ( -3.043 -9.816 -4.406) 11.182 13.676 ( -4.875 -2.609 -7.730) 9.504 14.820 ( -7.009 -21.681 4.368) 23.201 15.057 ( 4.596 -18.386 -0.287) 18.954 15.659 ( -0.996 9.453 0.807) 9.539 15.840 ( -0.168 6.836 -2.305) 7.216 16.250 ( -5.849 -2.448 -3.354) 7.173 16.435 ( -1.149 -3.491 -5.918) 6.967 17.081 ( 5.267 12.158 23.531) 27.005 18.297 ( 5.162 6.179 -11.483) 14.025 19.425 ( -9.218 0.140 5.772) 10.877 19.887 ( 30.786 1.449 -7.301) 31.673 ======================= 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| 1.914 ( 4.783 5.018 16.036) 17.470 2.133 ( 8.067 7.768 17.332) 20.635 2.535 ( 8.154 -2.765 -7.142) 11.186 2.817 ( 0.112 1.572 -8.110) 8.261 3.332 ( 8.705 0.315 6.144) 10.660 3.709 ( -11.367 2.621 8.452) 14.406 3.804 ( -2.113 6.365 -9.230) 11.409 4.126 ( -0.238 -1.157 20.392) 20.426 4.359 ( 10.832 0.674 6.859) 12.839 4.653 ( -2.120 -3.127 -1.359) 4.014 4.790 ( 4.292 6.281 -1.503) 7.754 5.026 ( 1.621 5.428 -12.384) 13.618 5.442 ( -4.862 6.697 10.164) 13.107 5.820 ( -2.199 -1.826 -4.718) 5.516 6.535 ( -9.889 1.710 0.462) 10.047 6.633 ( -0.264 -0.300 12.579) 12.585 7.106 ( -9.616 8.340 -3.130) 13.108 7.234 ( 6.802 13.068 1.060) 14.770 8.159 ( -4.314 8.731 6.132) 11.508 8.445 ( -1.240 4.503 -8.522) 9.718 9.027 ( 7.853 -0.666 12.050) 14.399 9.412 ( -18.842 -6.878 -5.987) 20.933 9.530 ( 16.193 -2.509 13.328) 21.122 9.615 ( 11.551 -6.592 -6.477) 14.793 10.026 ( -0.345 -1.372 -2.125) 2.553 10.412 ( 6.897 6.411 -18.638) 20.882 10.659 ( -10.595 0.348 1.693) 10.735 11.503 ( 1.349 -1.978 -0.903) 2.559 11.623 ( -2.227 -0.893 -2.103) 3.191 11.668 ( 10.088 -5.808 4.181) 12.368 11.844 ( -11.722 -3.636 -0.054) 12.273 12.116 ( 0.456 -5.816 3.313) 6.709 12.330 ( 0.070 -1.919 4.767) 5.139 12.574 ( -1.252 3.630 -7.263) 8.215 12.763 ( -7.952 -4.040 -0.049) 8.919 13.101 ( 6.146 8.904 0.227) 10.821 13.392 ( -4.494 -6.533 -0.374) 7.939 13.584 ( 1.492 -7.443 -4.538) 8.844 14.747 ( -5.765 -21.552 5.244) 22.918 15.130 ( 5.439 -17.543 -2.842) 18.585 15.667 ( -1.397 5.667 2.239) 6.252 15.811 ( 0.611 5.479 -2.724) 6.149 16.148 ( -4.253 -3.320 2.219) 5.834 16.355 ( -1.403 -3.222 -4.387) 5.621 17.440 ( 7.829 11.196 21.582) 25.543 18.228 ( 4.156 5.314 -17.788) 19.025 19.216 ( -17.253 2.301 1.186) 17.446 20.176 ( 13.316 -2.734 -13.275) 19.001 ======================= 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| 2.138 ( 6.275 5.210 8.289) 11.628 2.414 ( 1.478 3.750 15.229) 15.753 2.620 ( 8.163 -0.753 -10.235) 13.113 2.739 ( 4.893 3.357 -11.285) 12.750 3.411 ( -11.024 -1.614 -4.437) 11.993 3.574 ( -3.050 1.893 3.515) 5.024 3.666 ( 0.229 7.614 -5.652) 9.485 4.286 ( -3.455 -3.606 16.085) 16.843 4.517 ( 3.281 -4.436 -5.776) 7.988 4.574 ( -2.688 -3.875 -0.477) 4.740 4.865 ( 7.478 7.591 -9.750) 14.444 4.962 ( 2.903 10.841 -5.525) 12.509 5.443 ( -6.760 8.527 9.270) 14.294 5.724 ( -1.969 -0.321 -6.559) 6.856 6.336 ( -9.105 -0.040 -5.085) 10.428 6.662 ( -8.243 -1.263 7.618) 11.295 6.913 ( -5.781 7.863 1.356) 9.853 7.482 ( 10.347 11.110 7.802) 17.069 8.100 ( -6.999 8.133 1.166) 10.793 8.327 ( -1.898 6.067 -6.447) 9.055 8.958 ( -17.245 -2.967 2.988) 17.752 9.324 ( 8.702 -4.432 -1.304) 9.853 9.591 ( 1.167 -4.513 -20.655) 21.174 9.872 ( 6.413 -5.943 10.274) 13.490 10.285 ( 16.332 0.418 14.570) 21.890 10.322 ( 0.486 6.646 1.847) 6.915 10.633 ( 9.254 -0.176 -8.019) 12.246 11.439 ( -13.859 0.628 0.951) 13.905 11.489 ( -5.052 -1.191 -3.847) 6.461 11.679 ( 1.433 -2.014 4.135) 4.818 11.961 ( 10.356 -7.450 2.036) 12.919 12.155 ( -3.437 -5.873 0.930) 6.869 12.313 ( -5.486 -4.629 1.558) 7.345 12.425 ( -4.878 0.530 -3.113) 5.811 12.655 ( -1.300 2.489 -2.915) 4.048 13.225 ( 3.315 5.361 2.666) 6.843 13.346 ( 0.115 -7.135 2.506) 7.563 13.615 ( 3.469 -6.696 1.177) 7.632 14.723 ( -3.740 -20.247 6.805) 21.684 15.206 ( 5.906 -17.181 -2.446) 18.332 15.635 ( -2.339 10.463 0.485) 10.732 15.831 ( 2.136 1.712 0.882) 2.876 16.130 ( -2.632 -3.721 5.751) 7.338 16.312 ( -0.048 -2.135 -0.760) 2.267 17.727 ( 2.089 8.771 9.545) 13.130 18.108 ( 5.632 6.777 -20.915) 22.696 18.860 ( -18.701 4.737 -2.076) 19.403 20.153 ( 1.190 -4.185 -14.870) 15.493 ======================= 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| 2.263 ( -1.615 -0.472 -3.555) 3.934 2.429 ( 0.313 7.129 2.523) 7.568 2.651 ( -1.054 0.610 -1.401) 1.856 2.738 ( 1.215 4.901 -8.550) 9.929 3.095 ( -11.118 -2.398 -3.778) 11.985 3.425 ( -7.781 11.778 -2.831) 14.397 3.801 ( 11.873 0.216 -6.743) 13.656 4.300 ( -6.461 -4.598 3.747) 8.771 4.441 ( -3.713 -4.498 -1.594) 6.047 4.494 ( -3.673 -0.471 -5.681) 6.781 4.819 ( 2.293 9.233 -14.842) 17.630 5.036 ( 3.907 6.480 2.798) 8.068 5.340 ( -10.605 8.014 1.505) 13.377 5.616 ( -0.695 -0.222 -9.165) 9.194 6.129 ( -3.858 -2.064 -9.618) 10.566 6.568 ( -9.872 -1.316 6.672) 11.988 6.893 ( 0.698 5.524 4.098) 6.914 7.658 ( 0.896 5.870 2.055) 6.284 7.934 ( -6.978 6.510 -6.184) 11.372 8.299 ( 3.573 10.099 -1.214) 10.781 8.776 ( -8.437 -5.141 8.349) 12.935 9.306 ( -6.309 -2.205 -19.110) 20.245 9.459 ( 2.917 -3.530 6.625) 8.053 10.046 ( 3.720 0.564 6.122) 7.186 10.466 ( 4.748 -3.603 15.729) 16.821 10.743 ( 15.594 1.074 7.209) 17.214 10.780 ( 18.381 3.318 -13.440) 23.012 11.147 ( -16.237 2.660 3.276) 16.776 11.414 ( -2.146 -0.209 -2.473) 3.281 11.812 ( 5.381 -9.087 6.071) 12.181 11.874 ( -10.990 -4.649 -8.733) 14.787 12.124 ( 2.102 -0.912 0.993) 2.497 12.310 ( -0.453 -4.140 2.183) 4.702 12.332 ( -6.163 2.535 1.521) 6.836 12.647 ( 2.581 1.263 0.252) 2.884 13.280 ( 0.972 -0.610 2.657) 2.894 13.432 ( 3.437 -7.663 5.021) 9.785 13.740 ( 5.536 -3.308 7.454) 9.856 14.734 ( -3.051 -20.052 6.813) 21.397 15.289 ( 5.361 -19.028 -2.314) 19.903 15.636 ( 0.712 16.058 3.841) 16.526 15.891 ( 2.576 1.450 2.523) 3.887 16.160 ( -1.385 -2.932 7.320) 8.006 16.342 ( 1.831 -1.060 2.966) 3.643 17.556 ( -15.667 6.420 -14.967) 22.598 18.015 ( 3.793 14.962 -22.474) 27.264 18.653 ( -2.760 2.653 5.481) 6.685 19.956 ( -5.132 -4.275 -15.478) 16.858 ======================= 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| 2.030 ( -13.341 4.973 -4.359) 14.890 2.356 ( -17.371 1.824 -8.667) 19.499 2.604 ( 8.905 1.835 0.243) 9.096 2.683 ( -3.744 1.516 7.033) 8.111 3.024 ( 6.084 3.028 -8.978) 11.260 3.301 ( -1.574 10.881 -4.837) 12.011 3.801 ( -5.896 4.500 -5.794) 9.412 4.098 ( -13.117 -4.233 -7.513) 15.697 4.294 ( -9.599 0.123 -8.758) 12.995 4.463 ( 1.265 -1.829 5.774) 6.187 4.700 ( 0.508 8.238 -8.708) 11.998 5.086 ( -0.815 3.434 0.215) 3.536 5.187 ( -2.034 5.760 -2.375) 6.554 5.529 ( 2.324 1.083 -10.425) 10.736 6.068 ( 8.037 -5.481 -7.882) 12.520 6.385 ( -12.100 -3.235 -1.686) 12.638 7.055 ( 10.110 4.392 6.473) 12.783 7.575 ( -6.118 1.831 -4.825) 8.004 7.775 ( -2.270 6.423 -6.575) 9.467 8.323 ( -0.127 10.229 -8.432) 13.258 8.776 ( -3.971 -6.910 12.213) 14.583 9.121 ( -0.482 1.106 -1.260) 1.744 9.545 ( -5.156 -2.109 13.157) 14.288 10.145 ( -0.232 2.189 7.497) 7.813 10.599 ( -9.624 -5.078 5.173) 12.048 10.949 ( 8.366 2.782 -1.688) 8.976 10.967 ( 7.243 -0.290 -5.117) 8.872 11.050 ( 11.627 3.846 -5.150) 13.285 11.367 ( -0.999 0.581 0.471) 1.248 11.616 ( -5.675 0.758 -5.317) 7.814 11.953 ( -0.063 -7.486 2.790) 7.989 12.220 ( 2.032 1.314 6.766) 7.185 12.254 ( 2.732 -5.883 -5.299) 8.376 12.286 ( -0.965 5.563 2.714) 6.265 12.743 ( 3.158 -2.361 6.635) 7.718 13.281 ( -4.119 -0.080 1.543) 4.399 13.586 ( 6.288 -13.922 8.820) 17.640 13.949 ( 6.526 -0.592 10.300) 12.208 14.743 ( -2.989 -21.702 5.645) 22.623 15.321 ( 1.272 -23.135 -5.520) 23.818 15.751 ( 4.490 19.654 9.436) 22.259 15.989 ( 3.960 4.599 5.795) 8.391 16.233 ( 0.756 -1.083 8.210) 8.315 16.422 ( 2.696 -0.545 3.872) 4.750 17.010 ( -20.936 10.026 -20.180) 30.758 17.765 ( 0.515 19.692 -32.407) 37.924 18.780 ( 5.815 0.485 7.876) 9.802 19.675 ( -7.944 -3.379 -15.511) 17.752 ======================= 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| 1.778 ( -14.415 5.690 5.175) 16.338 1.966 ( -16.135 6.531 -3.530) 17.761 2.630 ( -2.715 -1.254 5.498) 6.259 2.884 ( 15.409 0.918 -2.197) 15.592 3.027 ( -1.651 5.266 -4.503) 7.122 3.238 ( 0.986 7.300 -6.271) 9.674 3.523 ( -17.095 16.480 0.634) 23.753 3.769 ( -13.053 -5.283 -3.156) 14.431 3.996 ( -12.873 1.214 -6.416) 14.434 4.526 ( 5.964 0.282 -7.232) 9.379 4.716 ( 0.854 3.643 6.427) 7.437 5.039 ( -1.259 1.445 -3.152) 3.689 5.246 ( 8.342 1.168 0.290) 8.428 5.518 ( 9.375 3.273 -10.733) 14.622 6.078 ( -8.734 -6.040 -4.210) 11.423 6.322 ( 17.257 -4.005 -5.300) 18.492 7.320 ( 8.599 0.007 2.231) 8.884 7.404 ( -3.014 1.791 -3.841) 5.200 7.740 ( 3.213 8.102 -1.277) 8.809 8.123 ( -5.152 7.818 -15.390) 18.014 8.876 ( -1.551 -8.214 15.521) 17.629 9.155 ( -1.075 0.757 2.682) 2.988 9.532 ( -11.750 2.996 15.453) 19.642 10.202 ( -4.817 1.060 10.544) 11.641 10.285 ( -16.242 -1.033 -7.361) 17.862 10.961 ( -0.787 2.898 -2.707) 4.043 11.107 ( 8.300 -3.977 -5.475) 10.709 11.234 ( 14.565 3.787 -9.716) 17.913 11.438 ( 5.245 0.553 4.645) 7.028 11.539 ( -0.058 5.962 -2.431) 6.439 11.912 ( -2.114 -2.780 -1.139) 3.674 12.253 ( 7.024 -3.413 -8.417) 11.482 12.275 ( -0.222 2.532 8.588) 8.957 12.444 ( 6.027 -3.620 2.595) 7.494 12.903 ( 4.916 -5.086 10.283) 12.481 13.173 ( -6.951 -1.180 -0.556) 7.072 13.826 ( 6.446 -13.596 13.850) 20.450 14.145 ( 4.219 -0.768 6.534) 7.815 14.739 ( -3.494 -25.767 5.376) 26.552 15.195 ( -5.749 -25.774 -10.674) 28.484 15.976 ( 6.950 14.346 12.641) 20.344 16.153 ( 3.540 17.241 11.892) 21.241 16.331 ( -0.045 1.866 4.573) 4.939 16.486 ( -6.009 7.142 -5.360) 10.763 16.524 ( -2.578 0.983 -5.077) 5.778 17.389 ( -1.854 27.446 -38.031) 46.937 18.966 ( 5.533 -1.552 6.937) 9.008 19.374 ( -7.841 -1.043 -13.757) 15.869 ======================= 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| 1.583 ( -14.623 3.395 10.132) 18.112 1.716 ( -16.383 12.790 7.726) 22.174 2.653 ( 0.423 8.494 -2.034) 8.745 2.784 ( -14.930 -1.308 9.951) 17.990 3.130 ( 7.075 0.983 1.168) 7.238 3.264 ( 4.799 8.121 -3.418) 10.033 3.393 ( 0.807 13.532 3.290) 13.950 3.593 ( -6.453 -2.778 4.147) 8.158 3.745 ( -8.431 2.926 -1.704) 9.085 4.523 ( 0.709 2.084 -5.796) 6.200 4.818 ( 0.862 -0.997 9.772) 9.861 5.018 ( 1.977 0.765 -1.303) 2.489 5.438 ( 12.508 -4.057 -1.654) 13.253 5.680 ( 17.575 5.854 -6.405) 19.600 5.868 ( -6.163 -3.291 -8.138) 10.726 6.651 ( 17.163 -4.425 1.846) 17.820 7.187 ( -7.694 -0.258 -4.257) 8.797 7.589 ( 11.324 0.050 -0.187) 11.326 7.876 ( 7.903 9.745 6.340) 14.057 7.911 ( -1.747 6.839 -11.255) 13.286 8.995 ( -1.712 -9.428 10.914) 14.524 9.058 ( -8.261 -0.292 -2.901) 8.761 9.437 ( -15.359 5.488 12.830) 20.752 9.884 ( -14.654 5.343 -2.212) 15.753 10.317 ( 9.006 -5.493 -1.571) 10.665 10.905 ( -1.621 0.009 -3.552) 3.905 11.175 ( 2.887 5.346 -5.855) 8.438 11.289 ( 1.688 -2.033 -4.115) 4.890 11.497 ( -0.549 4.282 -1.357) 4.525 11.618 ( 9.192 3.107 0.376) 9.710 11.944 ( 5.217 -3.108 0.932) 6.144 12.324 ( 5.782 -10.270 -5.935) 13.196 12.360 ( 3.487 -1.026 3.241) 4.870 12.500 ( 0.124 -3.308 -4.306) 5.432 13.049 ( -1.960 -7.894 8.156) 11.519 13.105 ( 2.196 0.423 0.140) 2.240 14.040 ( 1.026 -8.426 7.327) 11.214 14.165 ( -2.713 -7.731 -5.890) 10.090 14.742 ( -3.106 -27.423 9.308) 29.125 14.980 ( -6.392 -20.881 -3.491) 22.115 16.057 ( -8.256 18.941 -3.331) 20.929 16.290 ( 5.396 5.135 8.430) 11.250 16.387 ( 2.415 7.435 11.066) 13.549 16.458 ( 0.542 -1.201 0.618) 1.455 16.531 ( -1.667 1.857 -4.481) 5.130 17.077 ( 11.763 47.590 -20.457) 53.119 19.019 ( -5.719 -5.403 -2.789) 8.347 19.233 ( 4.056 3.329 0.819) 5.311 ======================= 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| 1.480 ( -16.395 5.646 16.322) 23.814 1.504 ( -11.685 9.756 16.122) 22.173 2.613 ( -10.249 17.661 22.116) 30.101 2.820 ( 5.864 -4.642 -0.851) 7.527 3.043 ( -11.732 -1.099 -0.229) 11.785 3.413 ( 7.765 6.638 4.617) 11.211 3.514 ( 4.822 10.873 8.816) 14.805 3.601 ( -3.313 0.091 11.808) 12.264 3.720 ( 9.437 3.623 -6.350) 11.938 4.459 ( -1.841 2.773 -2.316) 4.055 4.918 ( -0.384 -4.222 7.589) 8.693 5.075 ( 2.835 0.694 2.532) 3.864 5.625 ( 8.290 -6.162 -11.092) 15.156 5.714 ( 0.677 -2.559 -1.355) 2.973 5.980 ( 16.868 7.551 0.517) 18.488 6.882 ( 1.495 -1.720 5.182) 5.661 7.035 ( -3.752 1.903 -2.649) 4.972 7.777 ( 8.590 0.409 0.870) 8.644 7.851 ( 4.260 1.486 -3.219) 5.542 8.091 ( 5.959 13.527 6.536) 16.162 8.794 ( -12.592 -0.227 -3.517) 13.076 9.059 ( -1.271 -2.678 -0.034) 2.965 9.264 ( -9.422 -3.180 7.010) 12.166 9.780 ( 3.375 9.741 -0.000) 10.309 10.502 ( 15.915 -7.428 -9.288) 19.868 10.815 ( -7.336 -5.272 -3.447) 9.669 10.981 ( -9.796 -0.051 -5.683) 11.325 11.378 ( 3.715 -0.503 2.702) 4.621 11.505 ( 4.321 6.118 -1.512) 7.641 11.740 ( 1.083 -4.336 -0.946) 4.568 12.030 ( 0.944 -2.689 1.503) 3.222 12.298 ( 0.250 -9.901 -7.536) 12.446 12.382 ( -3.901 -8.315 -5.668) 10.793 12.467 ( 4.233 -0.999 0.971) 4.457 13.072 ( 0.371 3.948 -10.858) 11.559 13.100 ( -4.265 -9.516 8.330) 13.347 13.829 ( -9.624 -9.011 -12.150) 17.929 14.111 ( -3.671 -3.039 -5.596) 7.350 14.819 ( 0.390 -16.932 8.303) 18.862 14.927 ( -4.450 -22.446 9.692) 24.851 15.887 ( -5.450 20.227 -4.649) 21.458 16.086 ( -12.670 9.174 -13.480) 20.649 16.465 ( 0.150 -2.200 -2.884) 3.630 16.508 ( 1.604 5.290 5.870) 8.063 16.595 ( 3.534 -1.311 7.680) 8.555 17.573 ( 37.891 41.639 11.309) 57.423 18.916 ( 1.419 -1.264 -0.864) 2.088 19.367 ( 3.592 0.816 6.908) 7.829 ======================= 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| 1.446 ( -5.058 4.423 19.654) 20.771 1.588 ( -3.341 7.714 23.302) 24.772 2.649 ( -10.943 3.596 12.091) 16.699 2.850 ( -4.887 3.512 8.789) 10.652 2.935 ( 3.137 4.955 1.499) 6.053 3.612 ( 5.391 3.045 10.846) 12.489 3.669 ( 1.063 1.804 11.670) 11.856 3.776 ( 6.182 8.451 14.042) 17.516 3.841 ( 11.068 4.262 -8.822) 14.781 4.454 ( 2.821 4.427 0.754) 5.303 4.937 ( -4.311 -6.041 4.041) 8.450 5.139 ( 1.578 1.748 0.349) 2.381 5.509 ( -2.655 -1.393 -7.246) 7.842 5.847 ( 6.426 -6.283 -0.418) 8.997 6.259 ( 9.667 6.822 5.998) 13.266 6.824 ( -9.753 3.556 5.212) 11.616 6.997 ( 0.151 3.502 -1.526) 3.823 7.777 ( -7.906 3.337 -4.595) 9.734 8.021 ( 8.861 1.939 3.785) 9.829 8.235 ( 8.138 12.041 4.376) 15.178 8.642 ( -4.172 -0.876 6.564) 7.827 8.988 ( -2.877 3.238 1.631) 4.629 9.307 ( 7.137 -11.899 -0.136) 13.876 9.928 ( 14.188 12.592 -6.832) 20.163 10.420 ( -19.787 -4.644 -8.025) 21.852 10.660 ( 4.770 -4.969 -15.609) 17.061 10.891 ( -0.740 -17.259 4.379) 17.821 11.412 ( -2.737 -0.455 -0.352) 2.797 11.517 ( -6.987 -0.113 0.735) 7.027 11.680 ( 1.366 0.781 4.368) 4.642 11.984 ( -4.384 -5.370 -2.923) 7.523 12.246 ( -0.368 -4.688 -2.401) 5.280 12.343 ( 3.970 -5.909 -5.363) 8.913 12.516 ( 0.503 4.301 2.793) 5.153 12.932 ( -0.128 6.465 -11.924) 13.564 13.094 ( -3.832 -6.278 4.894) 8.835 13.609 ( -4.117 -8.538 -8.118) 12.480 13.897 ( -8.779 0.302 -9.317) 12.805 14.878 ( -3.672 -19.205 5.987) 20.449 14.971 ( 0.882 -19.257 6.046) 20.203 15.730 ( -4.599 18.660 -5.635) 20.028 15.877 ( -2.833 6.542 -2.061) 7.421 16.392 ( -3.552 -2.638 -5.465) 7.032 16.505 ( -0.314 -1.039 -4.784) 4.906 16.793 ( 2.308 8.273 19.646) 21.442 18.205 ( 17.846 14.892 -2.844) 23.416 19.236 ( 31.396 4.627 4.942) 32.118 19.469 ( 0.097 0.850 6.798) 6.851 ======================= 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| 1.784 ( 6.180 8.844 12.920) 16.832 2.005 ( 5.598 7.998 17.775) 20.279 2.461 ( -1.503 -2.578 -5.397) 6.167 2.822 ( 2.779 -5.015 -4.850) 7.510 3.348 ( -6.258 14.499 17.117) 23.289 3.797 ( -2.199 2.704 10.119) 10.703 3.904 ( 5.827 1.197 8.971) 10.764 3.985 ( 3.665 4.778 -4.357) 7.432 4.235 ( 5.178 9.264 8.634) 13.681 4.654 ( -5.363 -1.952 3.925) 6.927 4.815 ( 6.233 5.875 2.795) 9.010 5.148 ( 4.408 -0.211 -9.947) 10.882 5.514 ( 2.043 5.310 6.605) 8.717 5.817 ( -0.093 -2.197 2.290) 3.174 6.535 ( -0.288 3.075 10.695) 11.132 6.742 ( -10.812 1.058 5.454) 12.156 7.296 ( 8.356 16.816 2.913) 19.003 7.698 ( -8.584 11.643 -6.649) 15.920 8.330 ( 10.623 5.119 6.051) 13.254 8.623 ( 0.835 10.291 6.400) 12.147 8.671 ( 2.792 3.277 -6.118) 7.481 9.071 ( 12.273 -7.957 5.662) 15.684 9.325 ( 4.244 -3.353 9.128) 10.610 9.797 ( -24.991 -3.983 -5.677) 25.935 10.128 ( -16.356 -7.519 -3.721) 18.382 10.394 ( 16.863 4.416 -8.019) 19.187 10.803 ( 10.166 -3.491 -7.534) 13.126 11.292 ( -0.385 -14.162 -5.246) 15.107 11.444 ( -0.443 -2.446 4.452) 5.099 11.559 ( -0.923 -10.898 -3.786) 11.574 11.871 ( 2.256 3.964 3.584) 5.801 12.131 ( -1.614 -5.424 0.161) 5.661 12.302 ( -2.755 5.400 -2.321) 6.491 12.709 ( -3.402 0.007 -8.608) 9.256 12.857 ( -4.185 5.842 4.056) 8.252 13.180 ( 2.303 3.742 -3.480) 5.605 13.261 ( -0.284 -9.466 -0.620) 9.491 13.587 ( -8.180 -5.583 -8.504) 13.054 14.349 ( -6.460 -21.730 5.084) 23.233 14.679 ( 2.192 -17.891 -2.764) 18.235 15.806 ( -3.814 5.100 -2.158) 6.724 15.940 ( -0.425 3.240 -4.252) 5.363 16.186 ( -5.964 -3.514 -3.943) 7.967 16.334 ( -1.314 -5.945 -6.322) 8.777 17.402 ( 5.050 17.889 21.077) 28.103 18.395 ( 1.838 1.778 -7.766) 8.176 19.447 ( -5.439 2.498 2.997) 6.694 19.893 ( 23.029 -1.436 -8.241) 24.501 ======================= 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| 2.041 ( 7.486 7.021 11.204) 15.195 2.314 ( 8.937 8.327 13.158) 17.953 2.484 ( 11.156 -1.674 -7.851) 13.744 2.795 ( 2.366 -4.140 -9.054) 10.233 3.395 ( -2.607 5.930 9.031) 11.114 3.768 ( -11.060 2.510 6.326) 12.986 3.940 ( -1.537 5.848 -5.154) 7.945 4.094 ( 0.688 -1.962 13.174) 13.337 4.393 ( 4.502 2.753 4.448) 6.902 4.561 ( -5.861 -4.324 1.988) 7.550 4.979 ( 9.602 9.660 -5.103) 14.545 5.156 ( 7.184 7.150 -7.541) 12.633 5.624 ( -0.244 10.240 9.332) 13.857 5.793 ( -1.907 -0.197 -1.939) 2.727 6.549 ( -11.508 -0.316 4.321) 12.296 6.638 ( -4.342 0.547 9.083) 10.083 7.372 ( -9.283 16.986 -3.253) 19.629 7.578 ( 8.870 19.349 1.396) 21.331 8.416 ( -2.701 15.737 1.981) 16.089 8.566 ( 0.031 6.864 -8.964) 11.290 8.934 ( 12.903 -9.438 10.007) 18.860 9.233 ( -15.788 -10.347 -5.797) 19.747 9.432 ( 10.138 -4.851 -1.298) 11.314 9.579 ( 7.722 1.994 11.652) 14.120 9.881 ( -8.271 -10.714 6.784) 15.140 10.547 ( 10.693 -0.067 -12.280) 16.283 10.692 ( -7.026 6.344 -11.030) 14.536 11.349 ( 10.492 -16.660 -6.869) 20.852 11.476 ( -0.520 -1.818 3.405) 3.895 11.607 ( 5.178 -2.997 2.831) 6.618 11.859 ( -9.116 1.456 1.886) 9.423 12.062 ( -0.953 0.063 1.626) 1.886 12.289 ( -1.930 -1.546 -0.336) 2.496 12.516 ( -6.949 -5.593 -3.207) 9.479 12.775 ( -6.907 1.893 -1.045) 7.238 13.148 ( 4.341 -7.973 -3.540) 9.744 13.304 ( -3.511 0.169 0.584) 3.563 13.467 ( 1.858 -0.095 -0.862) 2.051 14.308 ( -4.505 -19.344 7.255) 21.146 14.703 ( 4.376 -22.334 -3.570) 23.037 15.764 ( -0.867 3.591 1.486) 3.982 15.895 ( -0.166 2.997 -3.590) 4.680 16.068 ( -4.511 -4.156 0.982) 6.212 16.264 ( -0.479 -5.395 -3.919) 6.686 17.711 ( 6.311 14.011 18.175) 23.800 18.329 ( 2.193 3.319 -12.276) 12.904 19.294 ( -12.541 5.539 -0.397) 13.716 20.078 ( 9.419 -6.930 -12.447) 17.079 ======================= 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| 2.248 ( 5.616 5.195 4.451) 8.851 2.540 ( 6.350 7.972 3.451) 10.761 2.630 ( 6.969 1.605 -4.341) 8.366 2.778 ( 7.177 -0.075 -6.445) 9.646 3.391 ( -8.753 -0.530 -1.848) 8.961 3.594 ( -4.753 0.278 3.659) 6.004 3.834 ( -5.093 7.287 -3.029) 9.392 4.203 ( -3.110 -4.452 11.926) 13.104 4.454 ( 0.753 -1.170 -4.785) 4.984 4.503 ( -1.417 -2.468 1.353) 3.151 5.043 ( 8.130 9.288 -12.309) 17.431 5.220 ( 4.897 12.848 -5.136) 14.678 5.640 ( -3.774 7.975 0.485) 8.836 5.744 ( -2.896 4.122 -0.014) 5.038 6.329 ( -12.278 -0.436 -2.654) 12.569 6.619 ( -7.729 -2.681 6.992) 10.762 7.153 ( -8.256 14.852 -1.951) 17.104 7.798 ( 8.176 18.701 2.919) 20.618 8.296 ( -7.447 8.816 -6.794) 13.392 8.530 ( 1.337 14.162 -0.090) 14.225 8.813 ( -13.908 -10.129 -4.185) 17.707 9.248 ( 5.371 -3.919 6.459) 9.269 9.457 ( 0.684 -6.544 -13.670) 15.171 9.784 ( 3.154 -3.429 14.104) 14.853 10.170 ( 19.189 -9.986 14.994) 26.320 10.410 ( -6.943 -2.836 1.107) 7.581 10.706 ( 15.347 8.877 -13.743) 22.432 11.406 ( 2.086 -7.098 -6.690) 9.974 11.471 ( -4.774 2.208 0.732) 5.311 11.598 ( -7.620 -3.433 2.858) 8.832 11.832 ( 6.776 -5.593 0.524) 8.802 12.030 ( -5.642 -8.134 -4.762) 10.985 12.235 ( -1.150 1.038 6.415) 6.600 12.445 ( -2.599 0.688 0.970) 2.858 12.648 ( -4.668 -4.528 0.351) 6.512 13.220 ( -1.943 -0.329 -1.294) 2.357 13.268 ( 5.612 -6.508 4.660) 9.776 13.518 ( 1.700 0.823 1.927) 2.698 14.321 ( -3.587 -17.787 8.326) 19.964 14.764 ( 5.534 -23.952 -2.844) 24.747 15.788 ( 0.475 3.742 3.424) 5.095 15.880 ( 1.116 3.702 0.184) 3.871 16.044 ( -1.591 -4.431 4.465) 6.489 16.247 ( 0.956 -4.079 0.127) 4.191 17.941 ( 1.093 11.123 6.489) 12.923 18.252 ( 5.126 6.000 -11.065) 13.591 19.007 ( -14.956 9.466 -4.423) 18.244 20.019 ( -0.135 -8.866 -13.978) 16.553 ======================= 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| 2.303 ( 0.987 4.451 -6.075) 7.595 2.605 ( -1.221 9.389 4.291) 10.395 2.670 ( -1.059 1.051 -0.076) 1.494 2.833 ( -2.475 3.707 -4.430) 6.285 3.091 ( -7.026 1.637 -6.432) 9.665 3.638 ( -2.247 7.134 -3.239) 8.151 3.777 ( 8.471 -2.335 -5.150) 10.185 4.204 ( -5.969 -5.168 4.270) 8.976 4.379 ( -1.453 -0.543 -6.074) 6.269 4.478 ( -3.542 -0.695 1.540) 3.924 5.025 ( 2.816 10.338 -12.342) 16.345 5.227 ( 1.987 10.952 -4.351) 11.951 5.535 ( -6.121 8.955 -4.118) 11.603 5.630 ( -4.988 3.071 -5.230) 7.853 6.079 ( -7.553 -2.471 -8.653) 11.749 6.502 ( -10.609 -4.934 2.140) 11.895 7.070 ( -0.099 11.242 1.760) 11.380 7.842 ( -2.723 11.595 -4.472) 12.722 8.059 ( -5.997 3.340 -12.422) 14.193 8.532 ( -3.238 6.660 4.113) 8.471 8.732 ( 0.535 8.343 6.723) 10.728 9.177 ( -5.992 -9.291 -10.648) 15.350 9.432 ( 0.790 0.458 7.369) 7.425 10.004 ( 6.471 -5.113 9.293) 12.425 10.403 ( 0.320 -3.926 10.491) 11.206 10.695 ( 17.481 -5.533 11.318) 21.548 10.870 ( 15.210 5.198 -9.862) 18.858 11.218 ( -11.047 3.276 -3.883) 12.159 11.423 ( 0.064 1.671 -1.153) 2.031 11.600 ( 1.952 -9.649 2.619) 10.186 11.775 ( -4.644 -4.872 -8.001) 10.456 12.013 ( 3.688 -8.382 1.004) 9.213 12.281 ( -2.135 1.609 3.671) 4.541 12.427 ( -0.631 5.740 4.662) 7.422 12.623 ( -1.952 -4.158 4.705) 6.575 13.206 ( 2.167 -1.172 -1.100) 2.698 13.393 ( 0.466 -1.583 3.433) 3.809 13.614 ( 5.163 -6.952 8.655) 12.243 14.327 ( -4.712 -18.668 7.724) 20.745 14.828 ( 4.287 -23.869 -3.312) 24.476 15.849 ( 1.523 3.579 4.915) 6.268 15.950 ( 3.108 5.160 5.843) 8.392 16.094 ( 1.271 -3.052 6.161) 6.992 16.301 ( 2.414 -2.910 3.788) 5.352 17.780 ( -11.633 14.365 -12.896) 22.539 18.323 ( 7.637 12.358 -9.046) 17.114 18.745 ( -7.022 7.278 -1.364) 10.205 19.822 ( -4.901 -8.793 -14.570) 17.709 ======================= 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| 2.179 ( -11.146 8.798 -1.269) 14.257 2.411 ( -15.057 3.498 -5.679) 16.468 2.615 ( -10.560 -0.647 8.487) 13.564 2.763 ( 6.565 5.776 0.482) 8.758 3.127 ( 14.121 6.372 -14.149) 20.981 3.513 ( -4.270 8.747 -5.839) 11.350 3.823 ( -0.516 -3.851 -6.790) 7.823 4.072 ( -8.177 -0.223 -4.838) 9.504 4.276 ( -4.896 1.175 -5.902) 7.758 4.463 ( -0.956 0.922 6.838) 6.966 4.894 ( -4.409 10.143 -7.181) 13.186 5.183 ( -3.033 5.445 -3.718) 7.257 5.350 ( -4.743 9.837 -5.539) 12.245 5.569 ( 5.142 3.011 -8.784) 10.614 5.940 ( 3.161 -6.163 -7.799) 10.430 6.279 ( -9.642 -6.971 -6.755) 13.682 7.175 ( 7.777 7.000 2.839) 10.841 7.668 ( -7.556 7.316 -7.798) 13.093 7.890 ( 0.006 2.399 -8.659) 8.986 8.502 ( -4.790 3.257 -6.392) 8.627 8.698 ( -5.186 1.368 5.539) 7.710 9.145 ( 3.362 5.146 5.420) 8.195 9.522 ( -4.777 -0.849 15.981) 16.702 10.157 ( 1.362 -1.803 5.603) 6.042 10.489 ( -6.577 -5.529 9.831) 13.056 10.928 ( -3.045 -4.409 5.191) 7.461 10.992 ( 5.971 2.076 -2.460) 6.783 11.149 ( 14.282 5.335 -9.219) 17.817 11.440 ( 2.738 5.916 -2.141) 6.862 11.624 ( 1.437 -0.049 -3.557) 3.837 11.761 ( 4.198 -9.905 5.223) 11.959 12.062 ( 3.665 -9.044 -4.261) 10.648 12.280 ( 0.138 2.870 4.668) 5.481 12.460 ( -3.660 9.802 4.497) 11.388 12.668 ( 0.721 -4.468 7.893) 9.099 13.257 ( 0.493 -2.185 -1.498) 2.694 13.379 ( 0.267 -5.249 3.403) 6.262 13.856 ( 7.940 -8.511 11.942) 16.676 14.309 ( -5.011 -19.628 6.090) 21.154 14.830 ( 0.812 -22.914 -6.530) 23.840 15.944 ( 2.804 2.370 6.167) 7.178 16.088 ( 2.378 1.921 9.692) 10.163 16.228 ( 5.479 1.460 8.136) 9.917 16.393 ( 2.549 -2.324 4.434) 5.617 17.375 ( -15.520 24.135 -13.236) 31.600 18.224 ( 3.173 22.878 -25.339) 34.286 18.771 ( 3.110 -1.822 7.009) 7.882 19.568 ( -6.179 -7.136 -14.545) 17.339 ======================= 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| 1.880 ( -20.379 4.947 7.361) 22.226 2.197 ( -7.115 14.431 -0.383) 16.094 2.549 ( -4.823 -6.180 7.306) 10.716 2.939 ( 11.730 3.669 -1.232) 12.352 3.192 ( 3.659 10.094 -11.146) 15.476 3.389 ( 1.349 5.505 -8.851) 10.511 3.658 ( -9.255 -4.323 -3.238) 10.716 3.852 ( -9.841 8.415 -2.662) 13.219 4.056 ( -12.948 9.193 -0.908) 15.906 4.545 ( 4.234 1.463 0.668) 4.529 4.809 ( -2.210 5.142 1.609) 5.823 5.075 ( -3.292 1.626 -3.646) 5.174 5.300 ( 4.145 4.625 -4.514) 7.677 5.611 ( 10.580 5.433 -8.926) 14.870 5.936 ( -4.298 -7.036 -4.312) 9.304 6.192 ( 15.362 -8.284 -8.200) 19.284 7.337 ( 3.869 2.235 -1.627) 4.755 7.483 ( -0.492 5.464 -5.365) 7.674 7.886 ( 4.540 4.007 -0.754) 6.103 8.248 ( -6.122 1.424 -14.335) 15.652 8.773 ( -2.018 0.345 15.103) 15.241 9.216 ( -0.153 7.691 -0.270) 7.697 9.562 ( -11.435 -1.309 20.027) 23.099 10.175 ( -2.591 -2.904 -0.292) 3.903 10.290 ( -20.713 0.547 8.439) 22.373 10.959 ( 2.461 -6.289 0.123) 6.754 11.085 ( 6.026 4.353 -1.554) 7.595 11.321 ( 13.150 3.141 -9.758) 16.673 11.474 ( 1.432 3.358 2.776) 4.587 11.665 ( 4.318 6.077 -1.325) 7.572 11.834 ( 0.261 -4.170 0.213) 4.184 12.060 ( 1.572 -11.383 -5.298) 12.653 12.386 ( -4.860 2.405 2.225) 5.861 12.425 ( 5.498 3.730 5.907) 8.890 12.791 ( 2.482 -4.100 7.389) 8.807 13.139 ( -5.035 -1.544 -2.502) 5.831 13.582 ( 9.493 -9.090 11.680) 17.584 14.085 ( 5.039 -4.341 4.243) 7.889 14.262 ( -4.843 -21.188 4.713) 22.240 14.728 ( -2.332 -19.430 -9.043) 21.558 16.076 ( 3.787 1.043 7.618) 8.571 16.212 ( 1.596 -2.560 6.413) 7.087 16.402 ( 3.392 0.715 5.620) 6.603 16.469 ( 1.935 -2.611 2.263) 3.960 17.038 ( -11.305 34.131 -1.523) 35.987 18.021 ( 7.452 30.844 -29.685) 43.452 18.890 ( 0.641 -6.548 6.155) 9.010 19.335 ( -2.748 -2.990 -12.290) 12.944 ======================= 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| 1.681 ( -12.381 6.644 12.342) 18.701 2.037 ( -15.933 17.175 6.519) 24.317 2.584 ( 1.537 -8.651 4.608) 9.921 3.024 ( -3.322 16.271 -4.365) 17.171 3.105 ( -1.654 -4.184 2.184) 5.002 3.411 ( 7.536 5.093 -4.114) 9.983 3.565 ( 0.862 2.078 1.582) 2.750 3.696 ( -4.017 7.256 -0.147) 8.295 3.885 ( -7.235 15.697 4.805) 17.939 4.583 ( 0.690 3.422 -3.336) 4.828 4.809 ( -2.528 0.385 6.788) 7.254 5.024 ( 0.158 -0.520 -0.034) 0.545 5.379 ( 8.591 -1.057 -3.705) 9.415 5.782 ( -2.925 -4.785 -9.120) 10.706 5.813 ( 17.738 6.929 -3.652) 19.390 6.512 ( 19.526 -8.762 0.390) 21.406 7.220 ( -6.266 3.816 -3.453) 8.108 7.595 ( 10.000 0.621 -2.537) 10.336 7.952 ( -1.073 0.240 -2.742) 2.954 8.136 ( 7.657 8.028 -0.845) 11.126 8.862 ( -4.008 -1.812 10.725) 11.592 9.150 ( -3.590 10.755 -3.238) 11.791 9.488 ( -16.918 -1.376 15.414) 22.928 9.952 ( -10.893 0.634 -1.821) 11.062 10.211 ( -0.234 -3.779 4.997) 6.270 10.903 ( -4.572 -0.383 -7.259) 8.587 11.208 ( 7.400 -2.115 0.566) 7.717 11.335 ( -4.406 4.330 -10.258) 11.975 11.544 ( 2.580 2.228 5.452) 6.430 11.688 ( 0.706 -1.187 -4.657) 4.857 11.884 ( 5.848 -2.129 0.481) 6.242 11.994 ( -4.082 -15.633 -3.329) 16.496 12.349 ( -2.467 -1.726 4.672) 5.558 12.494 ( 2.040 4.381 -4.887) 6.873 12.901 ( 0.973 -4.133 9.945) 10.813 13.125 ( 4.066 0.507 -2.797) 4.961 13.850 ( 1.872 -9.316 6.584) 11.560 14.004 ( -0.960 -5.590 -8.394) 10.131 14.347 ( 1.472 -14.868 9.713) 17.820 14.611 ( -1.651 -15.287 -4.789) 16.105 16.175 ( -1.791 -0.151 0.499) 1.865 16.279 ( 3.644 -2.326 3.032) 5.280 16.427 ( -2.398 -1.563 -1.799) 3.381 16.512 ( 1.776 -1.472 0.340) 2.331 16.909 ( -9.255 31.949 8.146) 34.245 18.006 ( 20.956 38.785 -19.525) 48.214 18.871 ( -5.851 -9.178 2.395) 11.145 19.284 ( 5.457 1.097 -3.500) 6.575 ======================= 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| 1.633 ( -10.084 9.961 14.307) 20.140 1.793 ( -14.807 16.302 9.806) 24.107 2.682 ( 4.303 -7.959 3.123) 9.571 2.897 ( -14.618 -0.626 4.225) 15.229 3.099 ( 0.123 13.770 10.048) 17.047 3.573 ( 9.644 7.189 -1.069) 12.076 3.599 ( -2.440 0.795 10.366) 10.679 3.769 ( 8.788 8.505 0.510) 12.240 3.880 ( 1.496 15.382 4.547) 16.110 4.542 ( -0.425 5.257 -1.820) 5.580 4.837 ( -3.019 -3.498 7.112) 8.481 5.069 ( 1.934 -1.379 3.949) 4.608 5.502 ( 8.038 -4.825 -7.374) 11.927 5.661 ( -0.407 -3.135 -3.800) 4.943 6.138 ( 16.757 7.875 1.702) 18.593 6.803 ( 7.460 -5.940 4.327) 10.472 7.121 ( -2.086 6.298 0.036) 6.634 7.753 ( 9.403 -3.305 0.729) 9.994 7.892 ( -0.087 2.639 -3.186) 4.138 8.363 ( 9.856 8.900 7.147) 15.081 8.809 ( -6.277 -0.077 -1.745) 6.515 9.068 ( -4.776 11.940 2.398) 13.081 9.296 ( -13.954 1.714 6.637) 15.547 9.889 ( 4.046 0.796 1.475) 4.379 10.330 ( 11.856 -8.406 -2.816) 14.804 10.680 ( -12.086 -5.967 -5.771) 14.662 10.992 ( -18.418 1.098 -10.502) 21.230 11.339 ( 4.707 -4.099 1.140) 6.345 11.553 ( -9.345 -10.387 -2.281) 14.157 11.657 ( 4.743 5.285 1.260) 7.212 11.866 ( -3.392 -21.780 -6.983) 23.122 12.003 ( 4.836 -1.372 0.597) 5.062 12.419 ( 4.413 7.141 6.889) 10.859 12.500 ( 2.409 4.582 -2.700) 5.838 12.996 ( -0.774 -1.075 7.502) 7.618 13.121 ( 1.530 0.569 -9.795) 9.930 13.657 ( -7.652 -7.475 -10.897) 15.270 14.052 ( -0.119 -1.911 -4.510) 4.899 14.410 ( -3.287 -21.295 7.596) 22.847 14.609 ( 2.250 -11.406 1.895) 11.779 16.077 ( -3.601 2.543 -5.275) 6.874 16.249 ( -8.807 4.883 -8.386) 13.105 16.368 ( 1.070 -5.495 -1.584) 5.818 16.522 ( -0.311 -2.670 -2.830) 3.903 16.903 ( -2.085 26.743 15.401) 30.931 18.310 ( 20.157 23.869 -8.535) 32.387 18.892 ( 10.339 1.258 5.152) 11.620 19.388 ( 5.552 0.983 1.662) 5.878 ======================= 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| 1.610 ( -4.157 11.021 14.230) 18.473 1.796 ( -2.252 12.028 16.582) 20.608 2.633 ( -11.511 -4.122 -2.758) 12.534 2.788 ( 2.536 -5.616 1.792) 6.417 3.247 ( -2.994 17.871 19.821) 26.855 3.690 ( 0.799 2.731 10.489) 10.868 3.724 ( 4.873 4.702 5.909) 8.987 3.920 ( 8.187 5.471 -3.810) 10.559 4.033 ( 6.706 13.303 8.590) 17.196 4.579 ( 5.236 7.386 0.928) 9.101 4.819 ( -6.717 -5.320 6.561) 10.792 5.143 ( 3.014 -1.574 -0.522) 3.440 5.472 ( 1.501 -1.381 -6.261) 6.585 5.741 ( 4.139 -4.053 4.420) 7.286 6.398 ( 6.889 6.667 6.037) 11.330 6.851 ( -6.536 -1.312 5.915) 8.912 7.152 ( 4.485 11.123 1.333) 12.067 7.849 ( -2.663 3.172 -2.166) 4.673 8.004 ( 13.076 -2.514 7.489) 15.277 8.593 ( 8.380 14.445 2.839) 16.940 8.662 ( -4.891 5.852 -2.464) 8.015 8.981 ( -3.811 0.912 -1.993) 4.396 9.212 ( -3.777 0.188 10.465) 11.127 10.097 ( 16.976 2.593 -2.544) 17.361 10.296 ( -19.668 -5.786 -5.493) 21.225 10.525 ( -17.567 -5.680 -9.829) 20.915 10.597 ( 13.780 -10.890 -3.592) 17.927 11.376 ( -4.571 -5.982 -0.194) 7.531 11.414 ( -1.980 -4.793 4.447) 6.831 11.702 ( -4.440 -20.786 -10.135) 23.547 11.769 ( 5.793 5.748 0.825) 8.202 12.086 ( 3.582 -3.536 0.955) 5.123 12.425 ( -3.732 6.124 -4.697) 8.573 12.649 ( 7.989 9.211 6.103) 13.635 12.974 ( -4.849 -0.414 -6.157) 7.849 13.082 ( 3.513 2.988 1.392) 4.818 13.430 ( -7.211 -8.727 -8.268) 14.019 13.862 ( -9.034 -3.741 -11.270) 14.921 14.408 ( -5.172 -22.649 5.988) 23.991 14.661 ( 1.715 -13.133 0.081) 13.244 15.948 ( -5.938 3.732 -5.488) 8.906 16.019 ( -4.168 7.166 -6.409) 10.479 16.319 ( -2.433 -4.284 -5.205) 7.167 16.439 ( -2.624 -4.581 -6.561) 8.421 17.112 ( 2.938 21.260 21.003) 30.029 18.419 ( 3.247 3.578 -5.504) 7.324 19.351 ( 23.145 5.876 2.968) 24.064 19.508 ( 10.008 2.877 0.816) 10.445 ======================= 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| 1.977 ( 7.522 9.142 5.975) 13.261 2.140 ( 4.670 4.203 8.335) 10.438 2.431 ( 0.546 0.553 -1.836) 1.994 2.687 ( 1.695 -7.841 -2.076) 8.286 3.621 ( -8.021 11.079 13.228) 19.028 3.826 ( -1.502 -0.185 8.711) 8.842 3.937 ( 3.841 2.341 4.475) 6.346 4.050 ( 1.310 0.655 -2.309) 2.734 4.416 ( 0.370 7.510 6.110) 9.689 4.581 ( -10.583 -3.145 7.747) 13.487 4.973 ( 13.629 7.056 -1.440) 15.415 5.123 ( 10.057 -1.760 -8.453) 13.255 5.638 ( 5.483 6.181 8.835) 12.097 5.789 ( 1.265 -1.138 7.009) 7.213 6.599 ( -4.406 3.412 9.291) 10.834 6.732 ( -9.330 -1.879 6.629) 11.599 7.666 ( 12.939 17.398 6.542) 22.647 7.941 ( -2.003 11.656 -0.146) 11.827 8.275 ( 14.268 -5.858 9.128) 17.923 8.775 ( 5.083 8.383 -1.211) 9.878 8.800 ( 1.801 -15.344 0.793) 15.469 9.050 ( -1.677 21.508 -9.375) 23.522 9.209 ( -4.157 -7.123 13.168) 15.538 9.749 ( -18.654 -4.623 -8.924) 21.189 10.031 ( -18.842 2.796 2.175) 19.172 10.473 ( 11.705 0.022 -11.253) 16.237 10.718 ( 20.767 -4.958 -4.440) 21.807 10.895 ( -0.719 -19.099 -6.710) 20.257 11.383 ( 1.476 -2.513 4.263) 5.164 11.438 ( 1.411 -2.717 5.025) 5.884 11.942 ( 0.326 2.766 -3.111) 4.176 12.064 ( 0.372 -2.070 -2.768) 3.476 12.414 ( -3.383 6.431 -3.687) 8.148 12.757 ( -9.679 4.629 -7.986) 13.375 12.861 ( -2.875 -8.769 -4.671) 10.343 13.060 ( -9.305 -4.386 -5.827) 11.823 13.313 ( 5.769 5.351 6.166) 9.997 13.472 ( -3.178 -4.447 -0.634) 5.503 14.034 ( -4.078 -7.325 -0.248) 8.387 14.326 ( -1.471 -16.058 -5.895) 17.169 15.892 ( -3.913 3.695 -2.848) 6.089 15.985 ( -2.008 1.141 -4.384) 4.955 16.117 ( -4.987 -2.678 -4.987) 7.544 16.209 ( -1.689 -5.739 -6.541) 8.864 17.776 ( 2.628 17.832 15.810) 23.976 18.338 ( -0.151 -7.301 0.573) 7.325 19.537 ( 0.288 6.133 -2.255) 6.541 19.820 ( 14.473 -5.503 -7.947) 17.404 ======================= 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| 2.193 ( 9.923 7.569 2.747) 12.779 2.403 ( 15.495 -0.294 5.652) 16.496 2.502 ( 9.604 3.395 -3.192) 10.675 2.673 ( 1.927 -6.593 -6.106) 9.191 3.549 ( -11.407 8.239 9.264) 16.847 3.785 ( -11.814 -1.383 5.999) 13.322 4.014 ( -1.410 1.358 -1.386) 2.399 4.053 ( 0.627 -1.784 6.393) 6.667 4.456 ( -0.869 2.817 3.994) 4.964 4.505 ( -4.236 -1.002 3.500) 5.586 5.152 ( 11.831 7.281 -9.370) 16.757 5.279 ( 13.127 3.288 -5.777) 14.714 5.814 ( 2.822 6.901 8.090) 11.002 5.826 ( -2.082 3.208 1.910) 4.275 6.550 ( -11.937 0.902 7.240) 13.990 6.633 ( -7.988 -1.291 7.855) 11.277 7.766 ( -10.679 20.351 -5.697) 23.679 7.988 ( 13.084 19.733 5.811) 24.379 8.591 ( -2.224 -12.812 -2.395) 13.222 8.668 ( 5.262 0.279 -0.234) 5.275 8.846 ( 2.559 12.210 -4.208) 13.166 9.047 ( -1.425 -1.558 1.125) 2.392 9.328 ( 6.888 -7.131 1.133) 9.979 9.562 ( 5.074 -8.422 4.534) 10.828 9.760 ( -15.316 4.950 9.891) 18.892 10.350 ( -6.952 -16.714 -9.465) 20.428 10.867 ( 8.743 7.666 -10.325) 15.551 11.086 ( 17.480 -7.668 -4.793) 19.680 11.454 ( 1.101 -0.288 4.996) 5.125 11.540 ( 3.860 -3.343 4.096) 6.546 11.843 ( -6.916 -1.586 -2.606) 7.559 11.998 ( -2.178 -7.120 -8.477) 11.283 12.353 ( -5.036 8.381 0.783) 9.809 12.501 ( -6.854 4.516 1.038) 8.273 12.734 ( -12.665 -5.690 -5.716) 15.016 12.900 ( 3.178 -13.378 1.827) 13.872 13.387 ( -1.229 7.560 1.522) 7.809 13.530 ( 4.026 3.343 1.592) 5.470 13.999 ( -1.707 -9.921 4.321) 10.955 14.260 ( 1.217 -19.766 -4.880) 20.396 15.827 ( -1.647 2.884 0.306) 3.335 15.939 ( 0.467 0.458 -2.021) 2.124 15.995 ( -4.125 -1.619 -1.116) 4.569 16.146 ( 0.157 -5.772 -3.270) 6.636 17.987 ( 3.922 12.452 13.198) 18.564 18.334 ( 0.770 -3.098 -2.829) 4.266 19.448 ( -6.033 9.374 -4.567) 12.047 19.896 ( 4.761 -10.487 -10.896) 15.855 ======================= 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| 2.366 ( 7.474 6.723 -1.112) 10.114 2.651 ( 3.818 -1.980 -4.775) 6.426 2.690 ( 13.832 5.305 -4.987) 15.631 2.745 ( 12.283 -1.049 4.330) 13.066 3.404 ( -12.248 2.332 2.166) 12.654 3.571 ( -12.012 -2.804 3.309) 12.771 3.946 ( -4.529 3.907 -1.001) 6.065 4.106 ( -2.332 -4.729 6.054) 8.028 4.463 ( -0.869 1.360 -1.798) 2.416 4.480 ( -0.887 0.013 1.665) 1.887 5.233 ( 8.972 8.797 -12.006) 17.379 5.408 ( 8.127 3.722 -8.588) 12.396 5.754 ( -2.965 6.308 -4.899) 8.520 5.881 ( -2.120 4.912 1.887) 5.673 6.344 ( -15.050 2.776 2.080) 15.445 6.550 ( -9.809 -4.254 5.653) 12.094 7.498 ( -9.886 18.282 -6.218) 21.694 8.157 ( -0.439 6.436 -6.816) 9.385 8.335 ( -5.168 0.899 -11.205) 12.372 8.731 ( -4.282 4.966 0.133) 6.559 8.892 ( 5.144 18.542 6.657) 20.361 9.085 ( -1.041 -8.944 1.480) 9.125 9.396 ( 0.113 -1.584 2.382) 2.863 9.666 ( -0.363 -10.168 8.670) 13.367 9.954 ( 18.984 -7.137 10.506) 22.841 10.220 ( 0.873 -13.657 1.376) 13.754 10.925 ( 8.016 10.725 -7.846) 15.519 11.268 ( 9.264 -5.888 -6.498) 12.756 11.513 ( 1.192 1.663 1.548) 2.566 11.563 ( -7.686 -0.065 -2.419) 8.058 11.733 ( 0.612 -3.926 0.836) 4.060 11.841 ( -3.814 -8.609 -7.104) 11.795 12.284 ( -3.456 1.445 7.250) 8.161 12.472 ( -6.167 -4.722 -2.631) 8.200 12.554 ( -0.208 5.590 7.499) 9.356 13.037 ( 3.662 -11.750 9.773) 15.716 13.357 ( -1.190 9.711 -2.205) 10.029 13.565 ( -0.175 1.697 -0.926) 1.941 14.026 ( -1.879 -10.063 5.304) 11.529 14.287 ( 4.409 -21.084 -0.795) 21.555 15.832 ( 0.211 1.769 2.778) 3.300 15.953 ( -1.799 -3.134 3.590) 5.094 15.969 ( 3.144 3.249 1.377) 4.726 16.153 ( 1.843 -4.885 1.086) 5.333 18.151 ( 1.173 8.812 5.426) 10.415 18.326 ( 3.074 0.934 -1.962) 3.765 19.240 ( -9.203 12.898 -7.901) 17.705 19.796 ( -1.924 -12.557 -12.503) 17.824 ======================= 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| 2.436 ( 4.469 7.916 -5.971) 10.876 2.673 ( -1.561 -1.206 -0.711) 2.096 2.778 ( -5.705 6.189 6.062) 10.373 2.877 ( -5.863 0.479 1.087) 5.982 3.171 ( 1.638 6.837 -9.489) 11.810 3.585 ( 11.498 -9.267 -5.592) 15.791 3.830 ( -5.967 5.566 -2.637) 8.575 4.080 ( -4.993 -6.551 2.041) 8.486 4.413 ( -1.462 2.736 -2.845) 4.209 4.471 ( -2.302 -0.184 2.150) 3.155 5.226 ( 2.642 8.764 -11.144) 14.421 5.396 ( 1.004 3.185 -9.697) 10.256 5.659 ( 1.355 6.630 -8.608) 10.949 5.776 ( -7.679 6.381 -3.742) 10.662 6.060 ( -12.750 2.089 -5.650) 14.101 6.371 ( -12.222 -7.797 -1.551) 14.580 7.333 ( -2.226 14.006 -3.353) 14.572 7.940 ( -4.970 -11.654 -12.522) 17.814 8.139 ( -7.020 14.581 -11.645) 19.937 8.659 ( -5.727 4.314 0.933) 7.230 8.911 ( -8.689 0.213 -4.518) 9.796 9.147 ( 6.491 13.140 13.753) 20.098 9.439 ( -3.547 0.282 11.743) 12.270 9.843 ( 11.278 -10.068 3.489) 15.515 10.279 ( 5.917 -6.342 7.030) 11.165 10.503 ( 15.678 -12.983 14.570) 25.033 11.000 ( 4.580 7.950 -0.770) 9.207 11.310 ( 1.791 6.440 -13.388) 14.964 11.375 ( -3.306 -7.527 5.316) 9.790 11.529 ( 2.884 1.044 -6.160) 6.881 11.688 ( 0.368 -2.279 -6.153) 6.572 11.854 ( 3.841 -6.748 1.613) 7.931 12.316 ( -1.659 1.383 6.006) 6.382 12.465 ( 0.516 -5.596 9.771) 11.272 12.630 ( -0.174 10.204 6.786) 12.256 13.214 ( 1.736 -9.351 13.170) 16.245 13.304 ( 0.586 3.228 -4.512) 5.579 13.520 ( -3.405 -3.218 -1.716) 4.990 14.034 ( -2.249 -7.719 5.014) 9.475 14.369 ( 3.932 -19.810 0.346) 20.200 15.885 ( 1.456 1.525 4.580) 5.042 15.987 ( -0.127 -2.352 6.258) 6.687 16.088 ( 5.498 2.853 5.752) 8.453 16.229 ( 3.086 -3.777 4.504) 6.639 18.089 ( -5.796 14.418 -5.182) 16.381 18.441 ( 6.479 -0.659 2.841) 7.105 18.984 ( -7.142 15.087 -11.415) 20.221 19.599 ( -4.571 -12.787 -13.537) 19.175 ======================= 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| 2.346 ( -18.222 6.482 1.894) 19.433 2.478 ( -7.654 1.173 -2.470) 8.128 2.633 ( -12.256 4.596 5.651) 14.258 2.852 ( 5.695 1.029 0.003) 5.787 3.281 ( 16.299 8.926 -14.804) 23.759 3.657 ( -2.418 3.187 -6.466) 7.604 3.700 ( -0.080 -4.574 -8.138) 9.336 3.981 ( -3.650 -7.284 -5.370) 9.757 4.371 ( -1.610 5.496 0.543) 5.752 4.476 ( -0.253 0.025 5.761) 5.767 5.089 ( -7.543 8.265 -6.083) 12.736 5.264 ( -5.422 1.239 -7.277) 9.159 5.573 ( -6.106 11.156 -7.143) 14.586 5.654 ( 6.660 4.838 -7.947) 11.441 5.848 ( -0.256 -2.239 -9.306) 9.575 6.106 ( -8.294 -9.646 -10.321) 16.382 7.338 ( 4.942 9.080 -1.942) 10.519 7.782 ( -0.832 -7.361 -11.928) 14.041 7.897 ( -6.282 10.111 -5.706) 13.201 8.430 ( -10.380 -9.878 -12.466) 18.992 8.847 ( -3.761 13.948 12.017) 18.791 9.360 ( 0.502 5.704 13.351) 14.527 9.495 ( -2.811 4.225 9.447) 10.724 10.062 ( 8.320 -8.407 0.681) 11.847 10.387 ( -5.681 -1.860 11.706) 13.144 10.764 ( -3.887 -11.420 10.598) 16.057 11.072 ( 3.335 5.774 3.788) 7.669 11.237 ( 5.984 2.034 -7.337) 9.684 11.527 ( 7.543 0.423 -6.495) 9.962 11.551 ( 13.412 -4.873 -0.198) 14.271 11.704 ( 3.834 4.629 0.062) 6.011 11.914 ( 2.450 -5.354 -2.109) 6.254 12.346 ( -1.514 3.547 5.645) 6.836 12.520 ( -6.604 -4.630 6.778) 10.535 12.742 ( 4.385 13.337 8.751) 16.543 13.231 ( 0.250 0.318 -4.068) 4.088 13.325 ( -4.031 -1.656 -1.004) 4.472 13.547 ( 4.686 -21.094 15.981) 26.876 14.057 ( -0.168 -3.275 2.809) 4.318 14.414 ( 1.778 -17.308 -2.403) 17.565 15.975 ( 2.436 1.529 6.048) 6.697 16.066 ( 0.990 -2.398 7.320) 7.766 16.261 ( 5.448 1.228 7.083) 9.020 16.337 ( 2.827 -2.812 4.914) 6.328 17.896 ( -9.188 24.549 -3.636) 26.463 18.559 ( 5.996 0.124 -4.252) 7.352 18.779 ( -2.446 11.236 -9.937) 15.198 19.380 ( -3.232 -11.234 -14.201) 18.394 ======================= 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| 2.007 ( -18.432 7.534 6.936) 21.085 2.365 ( -5.804 -7.103 4.669) 10.293 2.534 ( -6.350 13.335 2.730) 15.019 2.966 ( 5.205 -2.907 0.249) 5.968 3.393 ( 9.059 7.597 -9.546) 15.195 3.482 ( -3.953 6.807 -11.432) 13.881 3.597 ( -1.329 -2.594 -5.119) 5.891 3.833 ( -4.865 -5.727 -7.563) 10.661 4.337 ( -5.900 12.619 4.426) 14.616 4.566 ( 2.916 -0.090 4.384) 5.267 4.916 ( -6.144 5.120 0.184) 8.000 5.083 ( -7.178 -1.301 -3.158) 7.950 5.446 ( 0.951 9.216 -9.266) 13.103 5.721 ( 10.127 4.155 -6.956) 12.970 5.811 ( -0.578 -4.450 -8.033) 9.201 6.007 ( 14.298 -9.053 -8.801) 19.075 7.424 ( 4.061 6.237 -2.847) 7.969 7.605 ( -1.829 4.912 -10.177) 11.448 7.880 ( 3.618 -2.272 1.245) 4.451 8.152 ( -5.069 -9.152 -10.038) 14.499 8.919 ( -4.531 12.276 14.198) 19.308 9.427 ( -8.090 -3.647 13.677) 16.303 9.510 ( -1.980 11.242 2.358) 11.656 10.099 ( -4.663 -6.676 -1.555) 8.290 10.302 ( -14.607 3.267 12.140) 19.273 10.756 ( -1.309 -12.803 5.256) 13.902 11.186 ( 5.246 4.592 -0.827) 7.021 11.333 ( 10.204 -1.928 -5.705) 11.849 11.580 ( 1.481 6.467 0.780) 6.680 11.735 ( 0.398 -0.220 -1.007) 1.105 11.803 ( 5.125 1.700 -1.074) 5.506 11.873 ( -1.966 -6.419 -3.886) 7.756 12.371 ( -5.037 -0.273 3.306) 6.031 12.479 ( 1.847 -1.499 9.160) 9.463 12.847 ( 1.855 9.371 -2.908) 9.985 13.116 ( -0.684 -1.241 -5.927) 6.094 13.457 ( 8.804 -2.827 12.769) 15.765 13.825 ( 4.405 -18.519 16.383) 25.115 14.058 ( 1.008 0.368 -4.211) 4.346 14.386 ( 0.236 -14.125 -5.927) 15.320 16.090 ( 2.809 0.825 6.537) 7.163 16.158 ( 1.417 -2.373 5.591) 6.237 16.395 ( 2.354 -0.792 3.531) 4.317 16.417 ( 1.872 -2.190 2.666) 3.925 17.712 ( -10.324 30.488 2.652) 32.298 18.553 ( 7.835 12.580 -17.815) 23.174 18.710 ( -2.115 -3.448 1.281) 4.243 19.233 ( 3.169 -7.534 -12.400) 14.851 ======================= 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| 1.865 ( -7.679 11.034 10.649) 17.150 2.357 ( -8.811 -2.760 3.941) 10.039 2.404 ( -5.870 7.549 7.512) 12.160 2.952 ( -10.167 -10.175 4.103) 14.957 3.336 ( 0.422 13.176 -3.735) 13.702 3.504 ( 12.300 4.985 -6.310) 14.695 3.591 ( -0.484 -0.660 0.343) 0.887 3.735 ( 6.074 -1.728 -6.766) 9.255 4.270 ( -6.537 17.508 6.660) 19.840 4.632 ( 0.912 0.025 1.267) 1.561 4.839 ( -5.486 2.629 3.382) 6.960 4.988 ( -2.170 -2.991 1.729) 4.080 5.413 ( 4.471 4.384 -6.833) 9.268 5.671 ( -0.856 -5.976 -10.501) 12.113 5.964 ( 18.459 7.665 -1.757) 20.064 6.315 ( 20.502 -9.782 -0.075) 22.717 7.341 ( -4.666 7.543 -3.868) 9.676 7.596 ( 4.320 -1.605 -5.143) 6.906 7.935 ( 1.933 0.223 0.174) 1.953 8.156 ( 9.973 -4.953 0.670) 11.155 8.934 ( -8.429 7.755 11.249) 16.054 9.353 ( -15.563 -7.919 15.519) 23.362 9.503 ( 2.766 17.648 -3.292) 18.164 9.926 ( -8.568 -2.888 -0.980) 9.095 10.194 ( -8.140 3.606 8.171) 12.084 10.805 ( 1.603 -12.925 -2.004) 13.177 11.168 ( -3.931 1.765 -5.954) 7.349 11.402 ( -2.103 1.637 -5.323) 5.953 11.534 ( -9.008 -8.275 -4.616) 13.074 11.575 ( -9.352 -4.197 0.819) 10.283 11.739 ( -0.289 -0.589 -0.777) 1.017 11.910 ( 4.198 -2.689 -1.297) 5.151 12.402 ( 4.541 7.827 7.331) 11.646 12.621 ( 4.781 4.632 -1.114) 6.750 12.877 ( 4.158 2.023 3.432) 5.758 13.107 ( 3.514 -2.892 -5.745) 7.329 13.706 ( 0.385 -3.044 5.224) 6.059 13.940 ( 3.438 -3.941 1.651) 5.484 14.084 ( 1.652 -7.645 0.599) 7.845 14.336 ( 1.952 -11.806 -4.642) 12.835 16.168 ( -0.636 0.057 1.298) 1.446 16.229 ( 2.375 -2.407 2.648) 4.294 16.406 ( -1.572 -0.245 -1.422) 2.133 16.468 ( 1.419 -2.510 0.356) 2.905 17.564 ( -10.830 30.604 6.464) 33.101 18.502 ( -1.283 -4.556 -7.397) 8.782 18.761 ( 12.723 12.487 -3.681) 18.203 19.255 ( 9.092 -4.359 -6.673) 12.092 ======================= 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| 1.878 ( -4.633 13.335 10.081) 17.347 2.117 ( -15.224 13.418 6.569) 21.330 2.502 ( 3.713 -8.411 4.840) 10.390 2.756 ( -14.891 -9.993 5.877) 18.872 3.390 ( 1.795 11.228 8.809) 14.383 3.598 ( -1.685 -0.860 9.109) 9.304 3.709 ( 14.169 6.245 -5.221) 16.340 3.872 ( 12.496 1.624 -5.958) 13.939 4.249 ( -3.714 17.594 8.251) 19.785 4.652 ( 2.040 2.759 -0.167) 3.436 4.782 ( -6.677 -0.127 6.741) 9.489 5.011 ( 1.039 -4.495 3.426) 5.746 5.452 ( 4.777 0.105 -5.035) 6.942 5.582 ( 1.291 -4.315 -4.176) 6.142 6.304 ( 15.805 8.339 3.104) 18.138 6.653 ( 11.974 -8.293 3.927) 15.086 7.278 ( 0.688 8.582 0.658) 8.634 7.631 ( 4.569 -7.890 0.205) 9.120 7.997 ( 3.671 7.908 -0.195) 8.721 8.386 ( 9.573 -5.540 5.712) 12.448 8.855 ( -8.904 5.728 6.488) 12.417 9.222 ( -15.083 -7.130 16.162) 23.228 9.534 ( 2.053 25.790 -4.786) 26.310 9.871 ( 5.364 -0.557 -1.547) 5.611 10.190 ( 4.024 -3.701 1.449) 5.656 10.625 ( -13.227 -1.062 -10.453) 16.892 10.953 ( -20.567 -7.648 -8.283) 23.454 11.141 ( -3.262 -15.344 -3.614) 16.098 11.358 ( -6.359 -4.056 1.987) 7.800 11.491 ( -3.653 -10.364 -3.351) 11.488 11.805 ( 5.743 6.637 -0.323) 8.783 11.987 ( 5.208 -1.497 -1.121) 5.534 12.618 ( 6.346 10.175 5.721) 13.287 12.653 ( 4.376 10.063 -1.646) 11.096 12.987 ( 1.083 -1.268 4.244) 4.560 13.086 ( 2.053 -4.263 -7.476) 8.848 13.559 ( -8.250 -0.560 -8.695) 11.999 13.970 ( -7.853 -15.416 -8.134) 19.117 14.084 ( 4.285 -0.272 2.191) 4.821 14.383 ( 3.150 -10.674 0.122) 11.130 16.112 ( -2.785 1.711 -4.055) 5.209 16.249 ( -1.946 -4.773 -2.761) 5.847 16.325 ( -2.798 2.464 -4.647) 5.958 16.456 ( -1.364 -3.533 -3.799) 5.364 17.491 ( -5.960 28.565 11.782) 31.469 18.394 ( -4.823 -11.274 -0.175) 12.264 19.086 ( 23.952 13.614 -2.562) 27.669 19.388 ( 9.790 -1.495 -2.707) 10.267 ======================= 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| 1.866 ( -3.983 13.001 8.169) 15.862 2.042 ( -3.154 10.240 9.262) 14.163 2.514 ( -6.434 -6.184 -0.939) 8.973 2.650 ( -0.265 -7.743 4.816) 9.123 3.541 ( 0.003 9.921 15.047) 18.024 3.711 ( 1.447 -0.388 11.379) 11.477 3.850 ( 4.649 6.887 -0.664) 8.336 4.006 ( 7.399 1.975 -4.431) 8.847 4.316 ( 1.477 13.432 8.179) 15.795 4.703 ( -10.711 -4.206 8.656) 14.399 4.753 ( 9.554 7.054 -0.153) 11.877 5.065 ( 4.323 -5.784 -3.439) 7.998 5.487 ( 4.250 2.967 0.898) 5.260 5.663 ( 4.075 -3.956 6.120) 8.349 6.536 ( 3.775 6.758 6.295) 9.977 6.786 ( -2.345 -4.658 5.858) 7.843 7.399 ( 9.372 11.813 4.258) 15.669 7.807 ( 9.435 -7.636 6.893) 13.958 8.061 ( 4.479 9.706 0.434) 10.698 8.596 ( 7.338 -8.396 6.134) 12.726 8.789 ( -2.386 5.510 2.212) 6.399 9.148 ( -10.153 -6.020 14.194) 18.461 9.364 ( -10.987 28.081 -8.854) 31.427 10.096 ( 12.689 1.615 -2.371) 13.009 10.255 ( -12.597 -2.730 -5.788) 14.130 10.382 ( 10.330 -6.206 -7.685) 14.293 10.463 ( -10.837 -2.931 -6.642) 13.044 11.056 ( -5.378 -25.753 -5.195) 26.817 11.328 ( 0.015 -2.635 2.689) 3.765 11.409 ( -2.423 -4.726 1.410) 5.495 11.902 ( 5.295 6.515 -1.306) 8.496 12.055 ( 3.269 -0.886 -1.641) 3.764 12.550 ( -4.321 6.842 -6.272) 10.239 12.879 ( 7.505 10.602 4.298) 13.683 12.931 ( -2.885 -4.739 -8.338) 10.015 13.115 ( 3.667 0.062 1.048) 3.814 13.312 ( -10.024 -0.744 -4.134) 10.869 13.687 ( -11.246 -14.027 -9.788) 20.470 14.108 ( -1.941 -4.116 -0.913) 4.641 14.396 ( -0.193 -12.539 -3.250) 12.955 16.006 ( -3.698 2.734 -4.717) 6.588 16.109 ( -5.678 1.349 -5.903) 8.302 16.237 ( -1.840 -2.390 -6.004) 6.719 16.342 ( -4.119 -4.574 -7.321) 9.565 17.586 ( -0.195 23.394 16.102) 28.401 18.341 ( -2.259 -10.350 2.214) 10.822 19.464 ( 13.528 4.926 -1.953) 14.529 19.559 ( 15.903 1.205 -3.500) 16.328 ======================= 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| 2.129 ( 6.172 -4.971 1.853) 8.138 2.129 ( 6.172 4.971 1.853) 8.138 2.521 ( 0.983 -7.475 1.317) 7.654 2.521 ( 0.983 7.475 1.317) 7.654 3.781 ( -3.634 -4.539 9.721) 11.327 3.781 ( -3.634 4.539 9.721) 11.327 4.007 ( 0.049 -3.943 1.053) 4.081 4.007 ( 0.049 3.943 1.053) 4.081 4.525 ( -6.139 -3.268 6.633) 9.610 4.525 ( -6.139 3.268 6.633) 9.610 5.077 ( 14.103 -3.195 -5.530) 15.482 5.077 ( 14.103 3.195 -5.530) 15.482 5.744 ( 4.377 -3.690 9.510) 11.100 5.744 ( 4.377 3.690 9.510) 11.100 6.673 ( -7.390 -3.550 7.958) 11.425 6.673 ( -7.390 3.550 7.958) 11.425 7.955 ( 14.608 -10.307 9.342) 20.172 7.955 ( 14.608 10.307 9.342) 20.172 8.414 ( 1.550 -18.630 -0.218) 18.695 8.414 ( 1.550 18.630 -0.218) 18.695 8.988 ( 0.705 -10.879 6.349) 12.616 8.988 ( 0.705 10.879 6.349) 12.616 9.514 ( -13.203 -17.900 -11.144) 24.878 9.514 ( -13.203 17.900 -11.144) 24.878 10.259 ( -13.506 -16.421 -5.167) 21.881 10.259 ( -13.506 16.421 -5.167) 21.881 10.686 ( 21.710 -3.636 -2.405) 22.144 10.686 ( 21.710 3.636 -2.405) 22.144 11.385 ( 1.103 -2.143 5.415) 5.927 11.385 ( 1.103 2.143 5.415) 5.927 12.006 ( -0.596 -3.462 -7.314) 8.114 12.006 ( -0.596 3.462 -7.314) 8.114 12.599 ( -1.495 -11.430 -2.765) 11.855 12.599 ( -1.495 11.430 -2.765) 11.855 12.926 ( -14.048 -8.279 -7.922) 18.129 12.926 ( -14.048 8.279 -7.922) 18.129 13.408 ( 4.791 -3.219 6.332) 8.568 13.408 ( 4.791 3.219 6.332) 8.568 14.057 ( -3.722 -8.671 -6.345) 11.371 14.057 ( -3.722 8.671 -6.345) 11.371 15.964 ( -3.673 -3.055 -3.087) 5.688 15.964 ( -3.673 3.055 -3.087) 5.688 16.116 ( -2.746 -2.825 -6.561) 7.653 16.116 ( -2.746 2.825 -6.561) 7.653 18.111 ( 0.331 -14.264 8.922) 16.827 18.111 ( 0.331 14.264 8.922) 16.827 19.682 ( 6.882 -7.432 -6.185) 11.868 19.682 ( 6.882 7.432 -6.185) 11.868 ======================= 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| 2.337 ( 14.911 -5.853 -1.949) 16.137 2.337 ( 14.911 5.853 -1.949) 16.137 2.568 ( 4.629 -3.396 -0.174) 5.744 2.568 ( 4.629 3.396 -0.174) 5.744 3.704 ( -13.641 -6.268 7.841) 16.936 3.704 ( -13.641 6.268 7.841) 16.936 4.027 ( -0.216 -0.690 1.926) 2.057 4.027 ( -0.216 0.690 1.926) 2.057 4.494 ( -2.878 -0.869 3.708) 4.774 4.494 ( -2.878 0.869 3.708) 4.774 5.270 ( 13.858 -3.702 -8.563) 16.706 5.270 ( 13.858 3.702 -8.563) 16.706 5.878 ( 1.031 -0.637 5.584) 5.714 5.878 ( 1.031 0.637 5.584) 5.714 6.589 ( -10.619 -2.556 8.200) 13.657 6.589 ( -10.619 2.556 8.200) 13.657 8.160 ( -5.447 -15.036 -2.867) 16.247 8.160 ( -5.447 15.036 -2.867) 16.247 8.456 ( 10.425 -13.507 2.547) 17.251 8.456 ( 10.425 13.507 2.547) 17.251 9.074 ( 0.604 -10.422 3.106) 10.892 9.074 ( 0.604 10.422 3.106) 10.892 9.330 ( 2.581 -13.389 -3.444) 14.064 9.330 ( 2.581 13.389 -3.444) 14.064 9.985 ( -11.459 -15.780 0.546) 19.509 9.985 ( -11.459 15.780 0.546) 19.509 10.983 ( 15.017 -4.170 -6.172) 16.763 10.983 ( 15.017 4.170 -6.172) 16.763 11.476 ( 2.298 -2.474 5.736) 6.656 11.476 ( 2.298 2.474 5.736) 6.656 11.863 ( -4.182 -4.284 -9.373) 11.121 11.863 ( -4.182 4.284 -9.373) 11.121 12.562 ( -12.425 -10.531 -4.681) 16.947 12.562 ( -12.425 10.531 -4.681) 16.947 12.656 ( 0.295 -9.833 6.120) 11.586 12.656 ( 0.295 9.833 6.120) 11.586 13.535 ( 2.775 -4.280 2.192) 5.551 13.535 ( 2.775 4.280 2.192) 5.551 13.957 ( -1.051 -7.374 -2.592) 7.887 13.957 ( -1.051 7.374 -2.592) 7.887 15.890 ( -2.209 -3.279 -0.328) 3.967 15.890 ( -2.209 3.279 -0.328) 3.967 16.040 ( -0.185 -4.264 -2.862) 5.138 16.040 ( -0.185 4.264 -2.862) 5.138 18.208 ( 1.590 -8.809 6.292) 10.941 18.208 ( 1.590 8.809 6.292) 10.941 19.666 ( -0.211 -11.406 -8.443) 14.193 19.666 ( -0.211 11.406 -8.443) 14.193 ======================= 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| 2.524 ( 8.375 -8.140 -4.663) 12.576 2.524 ( 8.375 8.140 -4.663) 12.576 2.749 ( 13.395 -0.783 0.848) 13.445 2.749 ( 13.395 0.783 0.848) 13.445 3.486 ( -15.108 -4.887 3.519) 16.264 3.486 ( -15.108 4.887 3.519) 16.264 4.019 ( -2.973 -3.683 1.756) 5.049 4.019 ( -2.973 3.683 1.756) 5.049 4.483 ( -1.109 -0.263 0.464) 1.230 4.483 ( -1.109 0.263 0.464) 1.230 5.382 ( 8.988 -5.077 -11.113) 15.168 5.382 ( 8.988 5.077 -11.113) 15.168 5.882 ( -1.963 -4.318 -2.552) 5.386 5.882 ( -1.963 4.318 -2.552) 5.386 6.443 ( -13.380 -5.853 4.987) 15.432 6.443 ( -13.380 5.853 4.987) 15.432 7.886 ( -10.690 -19.000 -11.041) 24.437 7.886 ( -10.690 19.000 -11.041) 24.437 8.627 ( 3.578 -15.377 -6.291) 16.995 8.627 ( 3.578 15.377 -6.291) 16.995 9.118 ( -5.244 -6.836 15.381) 17.630 9.118 ( -5.244 6.836 15.381) 17.630 9.405 ( 7.573 -10.536 -2.239) 13.167 9.405 ( 7.573 10.536 -2.239) 13.167 9.968 ( 6.623 -8.022 6.724) 12.387 9.968 ( 6.623 8.022 6.724) 12.387 11.124 ( 7.504 -8.547 -4.687) 12.301 11.124 ( 7.504 8.547 -4.687) 12.301 11.554 ( 1.123 -2.037 -1.221) 2.627 11.554 ( 1.123 2.037 -1.221) 2.627 11.712 ( -2.759 -3.195 -3.884) 5.736 11.712 ( -2.759 3.195 -3.884) 5.736 12.341 ( -6.858 -5.034 1.977) 8.734 12.341 ( -6.858 5.034 1.977) 8.734 12.784 ( 1.911 -12.828 9.830) 16.274 12.784 ( 1.911 12.828 9.830) 16.274 13.540 ( -1.356 -5.569 -3.122) 6.527 13.540 ( -1.356 5.569 -3.122) 6.527 13.974 ( 1.966 -7.001 2.802) 7.793 13.974 ( 1.966 7.001 2.802) 7.793 15.880 ( -0.312 -3.024 2.717) 4.077 15.880 ( -0.312 3.024 2.717) 4.077 16.055 ( 2.390 -4.496 1.762) 5.389 16.055 ( 2.390 4.496 1.762) 5.389 18.289 ( 1.728 -4.402 3.393) 5.821 18.289 ( 1.728 4.402 3.393) 5.821 19.520 ( -4.658 -13.966 -10.582) 18.131 19.520 ( -4.658 13.966 -10.582) 18.131 ======================= 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| 2.594 ( 3.886 -6.474 -4.644) 8.864 2.594 ( 3.886 6.474 -4.644) 8.864 2.858 ( -9.636 -2.193 6.150) 11.640 2.858 ( -9.636 2.193 6.150) 11.640 3.366 ( 8.649 -11.114 -8.092) 16.242 3.366 ( 8.649 11.114 -8.092) 16.242 3.948 ( -5.337 -6.081 -0.635) 8.115 3.948 ( -5.337 6.081 -0.635) 8.115 4.458 ( -1.720 -1.356 0.269) 2.206 4.458 ( -1.720 1.356 0.269) 2.206 5.368 ( 1.669 -4.703 -10.878) 11.969 5.368 ( 1.669 4.703 -10.878) 11.969 5.790 ( -1.139 -4.243 -7.716) 8.879 5.790 ( -1.139 4.243 -7.716) 8.879 6.191 ( -14.788 -9.056 -3.006) 17.600 6.191 ( -14.788 9.056 -3.006) 17.600 7.639 ( -4.201 -15.576 -9.141) 18.543 7.639 ( -4.201 15.576 -9.141) 18.543 8.467 ( -7.899 -15.935 -12.413) 21.689 8.467 ( -7.899 15.935 -12.413) 21.689 9.141 ( -7.788 -13.869 15.510) 22.216 9.141 ( -7.788 13.869 15.510) 22.216 9.607 ( 10.847 -13.225 3.499) 17.458 9.607 ( 10.847 13.225 3.499) 17.458 10.264 ( 12.364 -6.788 10.947) 17.854 10.264 ( 12.364 6.788 10.947) 17.854 11.189 ( -0.001 -9.781 3.836) 10.506 11.189 ( -0.001 9.781 3.836) 10.506 11.460 ( 2.685 -6.702 -14.122) 15.861 11.460 ( 2.685 6.702 -14.122) 15.861 11.733 ( 3.572 -5.047 0.925) 6.253 11.733 ( 3.572 5.047 0.925) 6.253 12.360 ( 0.316 -3.581 9.375) 10.041 12.360 ( 0.316 3.581 9.375) 10.041 12.913 ( 1.102 -15.923 11.736) 19.811 12.913 ( 1.102 15.923 11.736) 19.811 13.432 ( -5.014 -5.791 -6.290) 9.912 13.432 ( -5.014 5.791 -6.290) 9.912 14.057 ( 2.610 -9.412 4.161) 10.617 14.057 ( 2.610 9.412 4.161) 10.617 15.929 ( 1.040 -2.691 5.154) 5.906 15.929 ( 1.040 2.691 5.154) 5.906 16.154 ( 4.078 -3.455 5.310) 7.534 16.154 ( 4.078 3.455 5.310) 7.534 18.335 ( 0.495 -9.039 1.491) 9.175 18.335 ( 0.495 9.039 1.491) 9.175 19.306 ( -4.941 -15.429 -12.955) 20.744 19.306 ( -4.941 15.429 -12.955) 20.744 ======================= 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| 2.444 ( -17.877 -3.426 2.373) 18.356 2.444 ( -17.877 3.426 2.373) 18.356 2.781 ( 1.728 -7.108 -0.183) 7.317 2.781 ( 1.728 7.108 -0.183) 7.317 3.489 ( 10.703 -10.645 -10.971) 18.661 3.489 ( 10.703 10.645 -10.971) 18.661 3.820 ( -4.708 -7.823 -5.842) 10.839 3.820 ( -4.708 7.823 -5.842) 10.839 4.454 ( -0.094 -2.446 3.700) 4.436 4.454 ( -0.094 2.446 3.700) 4.436 5.223 ( -7.316 -4.698 -6.696) 10.974 5.223 ( -7.316 4.698 -6.696) 10.974 5.719 ( 1.939 -1.017 -7.122) 7.451 5.719 ( 1.939 1.017 -7.122) 7.451 5.902 ( -6.343 -8.789 -11.843) 16.054 5.902 ( -6.343 8.789 -11.843) 16.054 7.554 ( 2.916 -11.759 -6.052) 13.542 7.554 ( 2.916 11.759 -6.052) 13.542 8.170 ( -9.958 -14.081 -10.919) 20.412 8.170 ( -9.958 14.081 -10.919) 20.412 9.176 ( -6.781 -15.385 16.527) 23.575 9.176 ( -6.781 15.385 16.527) 23.575 9.792 ( 7.300 -16.235 -0.700) 17.814 9.792 ( 7.300 16.235 -0.700) 17.814 10.504 ( -2.562 -11.753 13.523) 18.099 10.504 ( -2.562 11.753 13.523) 18.099 11.197 ( -0.481 -5.273 2.873) 6.024 11.197 ( -0.481 5.273 2.873) 6.024 11.513 ( 14.508 -1.277 -8.000) 16.617 11.513 ( 14.508 1.277 -8.000) 16.617 11.815 ( 4.599 -5.038 -0.610) 6.849 11.815 ( 4.599 5.038 -0.610) 6.849 12.426 ( -4.142 -4.192 6.991) 9.144 12.426 ( -4.142 4.192 6.991) 9.144 13.088 ( 3.071 -19.769 8.693) 21.813 13.088 ( 3.071 19.769 8.693) 21.813 13.281 ( -2.665 -2.225 0.569) 3.518 13.281 ( -2.665 2.225 0.569) 3.518 14.133 ( 2.238 -9.531 1.221) 9.866 14.133 ( 2.238 9.531 1.221) 9.866 16.015 ( 1.814 -2.330 6.468) 7.110 16.015 ( 1.814 2.330 6.468) 7.110 16.288 ( 3.808 -1.752 5.729) 7.099 16.288 ( 3.808 1.752 5.729) 7.099 18.333 ( -2.786 -17.311 1.911) 17.638 18.333 ( -2.786 17.311 1.911) 17.638 19.105 ( -0.551 -15.515 -15.383) 21.855 19.105 ( -0.551 15.515 -15.383) 21.855 ======================= 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| 2.183 ( -12.916 -9.212 6.099) 16.997 2.183 ( -12.916 9.212 6.099) 16.997 2.807 ( -1.474 -11.545 0.879) 11.672 2.807 ( -1.474 11.545 0.879) 11.672 3.516 ( 5.185 -5.277 -7.999) 10.895 3.516 ( 5.185 5.277 -7.999) 10.895 3.672 ( -2.722 -9.464 -9.057) 13.379 3.672 ( -2.722 9.464 -9.057) 13.379 4.517 ( 0.598 -5.159 4.985) 7.199 4.517 ( 0.598 5.159 4.985) 7.199 5.018 ( -8.676 -4.608 -1.299) 9.909 5.018 ( -8.676 4.608 -1.299) 9.909 5.644 ( -0.969 -8.859 -10.571) 13.826 5.644 ( -0.969 8.859 -10.571) 13.826 5.853 ( 12.913 -5.584 -7.580) 15.981 5.853 ( 12.913 5.584 -7.580) 15.981 7.574 ( 3.287 -7.059 -6.023) 9.844 7.574 ( 3.287 7.059 -6.023) 9.844 7.949 ( -2.886 -8.896 -4.614) 10.429 7.949 ( -2.886 8.896 -4.614) 10.429 9.197 ( -9.680 -13.546 15.746) 22.916 9.197 ( -9.680 13.546 15.746) 22.916 9.851 ( 1.430 -16.182 -3.230) 16.563 9.851 ( 1.430 16.182 -3.230) 16.563 10.479 ( -9.891 -12.674 10.338) 19.114 10.479 ( -9.891 12.674 10.338) 19.114 11.269 ( 5.966 -3.670 -1.333) 7.130 11.269 ( 5.966 3.670 -1.333) 7.130 11.704 ( 8.371 -4.404 0.047) 9.459 11.704 ( 8.371 4.404 0.047) 9.459 11.806 ( -6.893 -0.587 -4.230) 8.108 11.806 ( -6.893 0.587 -4.230) 8.108 12.415 ( -0.014 -3.773 6.435) 7.460 12.415 ( -0.014 3.773 6.435) 7.460 13.042 ( 0.389 -7.093 -9.097) 11.542 13.042 ( 0.389 7.093 -9.097) 11.542 13.516 ( 7.732 -9.716 19.096) 22.778 13.516 ( 7.732 9.716 19.096) 22.778 14.151 ( 1.554 -8.446 -4.466) 9.679 14.151 ( 1.554 8.446 -4.466) 9.679 16.116 ( 1.977 -1.689 5.923) 6.469 16.116 ( 1.977 1.689 5.923) 6.469 16.388 ( 2.033 -0.443 2.935) 3.598 16.388 ( 2.033 0.443 2.935) 3.598 18.265 ( -7.810 -22.962 3.488) 24.503 18.265 ( -7.810 22.962 3.488) 24.503 19.007 ( 7.497 -14.751 -14.914) 22.277 19.007 ( 7.497 14.751 -14.914) 22.277 ======================= 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| 2.115 ( -3.273 -12.793 7.713) 15.293 2.115 ( -3.273 12.793 7.713) 15.293 2.703 ( -12.773 -13.849 5.252) 19.558 2.703 ( -12.773 13.849 5.252) 19.558 3.528 ( -2.575 -5.368 1.269) 6.087 3.528 ( -2.575 5.368 1.269) 6.087 3.637 ( 13.654 -7.044 -10.543) 18.633 3.637 ( 13.654 7.044 -10.543) 18.633 4.544 ( -2.345 -8.861 4.394) 10.164 4.544 ( -2.345 8.861 4.394) 10.164 4.912 ( -4.345 -4.039 2.682) 6.511 4.912 ( -4.345 4.039 2.682) 6.511 5.537 ( 1.165 -6.865 -10.007) 12.192 5.537 ( 1.165 6.865 -10.007) 12.192 6.128 ( 19.655 -8.432 -0.470) 21.392 6.128 ( 19.655 8.432 -0.470) 21.392 7.501 ( -2.510 -7.127 -5.539) 9.369 7.501 ( -2.510 7.127 -5.539) 9.369 8.014 ( 8.822 -6.925 1.801) 11.359 8.014 ( 8.822 6.925 1.801) 11.359 9.135 ( -13.664 -11.110 14.652) 22.909 9.135 ( -13.664 11.110 14.652) 22.909 9.809 ( -0.048 -9.594 -3.629) 10.258 9.809 ( -0.048 9.594 -3.629) 10.258 10.431 ( -4.315 -18.738 5.413) 19.976 10.431 ( -4.315 18.738 5.413) 19.976 11.294 ( -5.340 -8.849 -5.506) 11.710 11.294 ( -5.340 8.849 -5.506) 11.710 11.492 ( -14.195 -2.828 -4.883) 15.275 11.492 ( -14.195 2.828 -4.883) 15.275 11.820 ( 5.161 -5.297 0.483) 7.411 11.820 ( 5.161 5.297 0.483) 7.411 12.583 ( 8.311 -7.373 6.992) 13.127 12.583 ( 8.311 7.373 6.992) 13.127 12.995 ( 2.255 -7.398 -6.423) 10.053 12.995 ( 2.255 7.398 -6.423) 10.053 13.764 ( 0.955 -8.170 7.480) 11.118 13.764 ( 0.955 8.170 7.480) 11.118 14.129 ( 3.689 -7.815 -5.402) 10.191 14.129 ( 3.689 7.815 -5.402) 10.191 16.185 ( 0.497 -1.640 1.890) 2.551 16.185 ( 0.497 1.640 1.890) 2.551 16.422 ( 0.295 -1.717 -0.368) 1.781 16.422 ( 0.295 1.717 -0.368) 1.781 18.133 ( -10.016 -24.231 4.237) 26.559 18.133 ( -10.016 24.231 4.237) 26.559 19.085 ( 14.282 -12.600 -9.428) 21.252 19.085 ( 14.282 12.600 -9.428) 21.252 ======================= 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| 2.143 ( -3.444 -10.746 5.510) 12.558 2.143 ( -3.444 10.746 5.510) 12.558 2.527 ( -11.022 -10.896 7.941) 17.414 2.527 ( -11.022 10.896 7.941) 17.414 3.546 ( -0.450 -4.537 8.906) 10.005 3.546 ( -0.450 4.537 8.906) 10.005 3.833 ( 15.130 -4.929 -7.377) 17.539 3.833 ( 15.130 4.929 -7.377) 17.539 4.546 ( -2.748 -10.806 5.782) 12.560 4.546 ( -2.748 10.806 5.782) 12.560 4.888 ( -1.635 -7.094 2.799) 7.799 4.888 ( -1.635 7.094 2.799) 7.799 5.496 ( 2.681 -3.694 -3.937) 6.028 5.496 ( 2.681 3.694 -3.937) 6.028 6.478 ( 14.519 -8.537 3.789) 17.264 6.478 ( 14.519 8.537 3.789) 17.264 7.457 ( 2.440 -8.680 -0.083) 9.017 7.457 ( 2.440 8.680 -0.083) 9.017 8.201 ( 7.229 -10.910 3.128) 13.456 8.201 ( 7.229 10.910 3.128) 13.456 9.026 ( -13.592 -10.121 14.642) 22.396 9.026 ( -13.592 10.121 14.642) 22.396 9.865 ( 11.628 -3.140 -4.234) 12.767 9.865 ( 11.628 3.140 -4.234) 12.767 10.365 ( -6.762 -21.594 -3.157) 22.847 10.365 ( -6.762 21.594 -3.157) 22.847 10.903 ( -19.608 -7.311 -7.260) 22.150 10.903 ( -19.608 7.311 -7.260) 22.150 11.368 ( -2.967 -3.327 -0.538) 4.490 11.368 ( -2.967 3.327 -0.538) 4.490 11.924 ( 6.173 -4.637 -0.636) 7.747 11.924 ( 6.173 4.637 -0.636) 7.747 12.782 ( 5.972 -2.832 1.308) 6.738 12.782 ( 5.972 2.832 1.308) 6.738 12.973 ( 1.225 -3.927 -1.323) 4.321 12.973 ( 1.225 3.927 -1.323) 4.321 13.669 ( -8.129 -11.000 -7.902) 15.796 13.669 ( -8.129 11.000 -7.902) 15.796 14.185 ( 3.494 -7.992 -1.448) 8.842 14.185 ( 3.494 7.992 -1.448) 8.842 16.163 ( -2.015 -3.376 -2.996) 4.943 16.163 ( -2.015 3.376 -2.996) 4.943 16.385 ( -2.176 -3.269 -4.339) 5.853 16.385 ( -2.176 3.269 -4.339) 5.853 18.027 ( -7.037 -22.856 7.222) 24.981 18.027 ( -7.037 22.856 7.222) 24.981 19.305 ( 16.538 -7.150 -4.852) 18.660 19.305 ( 16.538 7.150 -4.852) 18.660 ======================= 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| 2.093 ( -4.757 -6.879 4.037) 9.287 2.093 ( -4.757 6.879 4.037) 9.287 2.493 ( -1.895 -5.761 5.392) 8.115 2.493 ( -1.895 5.761 5.392) 8.115 3.672 ( 1.583 -3.648 11.740) 12.395 3.672 ( 1.583 3.648 11.740) 12.395 3.978 ( 5.959 -4.545 -3.235) 8.163 3.978 ( 5.959 4.545 -3.235) 8.163 4.556 ( -4.684 -9.497 8.034) 13.292 4.556 ( -4.684 9.497 8.034) 13.292 4.922 ( 6.096 -7.951 -2.284) 10.276 4.922 ( 6.096 7.951 -2.284) 10.276 5.572 ( 4.754 -4.709 5.354) 8.570 5.572 ( 4.754 4.709 5.354) 8.570 6.671 ( 0.923 -6.285 6.191) 8.870 6.671 ( 0.923 6.285 6.191) 8.870 7.620 ( 11.905 -9.905 5.684) 16.497 7.620 ( 11.905 9.905 5.684) 16.497 8.332 ( 4.413 -15.008 2.905) 15.910 8.332 ( 4.413 15.008 2.905) 15.910 8.963 ( -8.177 -10.114 12.506) 18.044 8.963 ( -8.177 10.114 12.506) 18.044 9.913 ( -9.947 -21.640 -14.410) 27.836 9.913 ( -9.947 21.640 -14.410) 27.836 10.290 ( 16.475 -7.111 -3.056) 18.202 10.290 ( 16.475 7.111 -3.056) 18.202 10.566 ( -13.175 -16.739 -2.876) 21.495 10.566 ( -13.175 16.739 -2.876) 21.495 11.339 ( -1.035 -2.622 2.916) 4.056 11.339 ( -1.035 2.622 2.916) 4.056 12.013 ( 4.478 -3.735 -2.375) 6.296 12.013 ( 4.478 3.735 -2.375) 6.296 12.729 ( -3.882 -10.458 -8.713) 14.155 12.729 ( -3.882 10.458 -8.713) 14.155 13.079 ( 4.384 -5.076 2.329) 7.100 13.079 ( 4.384 5.076 2.329) 7.100 13.407 ( -9.852 -10.200 -4.993) 15.034 13.407 ( -9.852 10.200 -4.993) 15.034 14.172 ( -1.445 -8.303 -4.931) 9.764 14.172 ( -1.445 8.303 -4.931) 9.764 16.071 ( -3.454 -3.450 -4.363) 6.548 16.071 ( -3.454 3.450 -4.363) 6.548 16.258 ( -4.170 -3.321 -7.585) 9.271 16.258 ( -4.170 3.321 -7.585) 9.271 18.031 ( -2.483 -19.138 9.724) 21.610 18.031 ( -2.483 19.138 9.724) 21.610 19.544 ( 13.623 -2.577 -4.301) 14.516 19.544 ( 13.623 2.577 -4.301) 14.516 ======================= 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| 2.024 ( 8.582 0.000 11.881) 14.657 2.045 ( -6.152 0.000 12.156) 13.624 2.519 ( -5.244 0.000 -0.833) 5.310 2.676 ( 3.920 0.000 -12.986) 13.564 3.306 ( 0.450 0.000 14.319) 14.326 3.582 ( 4.092 0.000 -12.738) 13.379 4.012 ( -11.123 0.000 13.212) 17.270 4.155 ( 14.862 0.000 1.266) 14.916 4.346 ( 1.738 0.000 20.756) 20.828 4.534 ( 5.162 0.000 2.053) 5.555 4.794 ( -5.141 0.000 -8.651) 10.064 4.831 ( -0.587 0.000 -13.000) 13.013 5.597 ( -4.000 0.000 10.645) 11.371 5.801 ( 1.050 0.000 -8.449) 8.514 6.644 ( 10.100 0.000 7.374) 12.505 6.703 ( -10.745 0.000 1.255) 10.818 7.001 ( 6.976 0.000 5.175) 8.686 7.168 ( -12.299 0.000 -10.224) 15.993 8.199 ( -0.837 0.000 6.726) 6.777 8.330 ( 2.658 0.000 -5.792) 6.373 9.113 ( -1.143 0.000 14.878) 14.922 9.376 ( 8.374 0.000 -10.382) 13.338 9.439 ( 15.298 0.000 17.137) 22.972 9.750 ( 5.870 0.000 2.847) 6.524 9.810 ( -22.573 0.000 -11.179) 25.190 10.094 ( 2.674 0.000 -23.346) 23.498 11.137 ( -20.862 0.000 11.528) 23.836 11.339 ( 13.229 0.000 -7.095) 15.011 11.607 ( 8.116 0.000 4.830) 9.444 11.686 ( -7.670 0.000 -2.444) 8.050 12.125 ( 10.861 0.000 3.983) 11.568 12.200 ( -14.731 0.000 -2.919) 15.017 12.389 ( 4.728 0.000 -0.930) 4.819 12.400 ( -2.347 0.000 -0.704) 2.450 12.832 ( 11.574 0.000 5.567) 12.843 12.967 ( -10.603 0.000 -6.657) 12.520 13.558 ( -5.052 0.000 -0.822) 5.118 13.585 ( 2.749 0.000 -3.359) 4.341 15.162 ( -5.555 0.000 2.325) 6.022 15.220 ( 4.049 0.000 -3.155) 5.133 15.624 ( 6.320 0.000 3.449) 7.200 15.682 ( -5.185 0.000 -2.290) 5.668 16.271 ( -2.292 0.000 2.357) 3.288 16.355 ( -0.068 0.000 -5.288) 5.289 17.458 ( 3.050 0.000 24.340) 24.530 17.908 ( 1.283 0.000 -18.736) 18.780 19.565 ( -16.650 0.000 7.265) 18.166 19.719 ( 24.087 0.000 -7.512) 25.231 ======================= 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| 2.049 ( 2.200 0.000 -1.809) 2.849 2.317 ( 14.009 0.000 -2.114) 14.167 2.492 ( -1.443 0.000 4.124) 4.369 2.619 ( 0.758 0.000 -1.701) 1.863 3.422 ( 1.479 0.000 5.715) 5.903 3.469 ( -1.454 0.000 -13.896) 13.971 3.853 ( -16.038 0.000 4.270) 16.597 4.342 ( 10.520 0.000 -11.079) 15.278 4.477 ( -2.060 0.000 2.913) 3.568 4.542 ( 1.178 0.000 -18.840) 18.877 4.706 ( -2.400 0.000 7.205) 7.594 4.792 ( 4.118 0.000 7.061) 8.174 5.614 ( -7.066 0.000 11.604) 13.586 5.708 ( -2.056 0.000 -7.404) 7.684 6.479 ( -12.192 0.000 -3.692) 12.739 6.855 ( 5.128 0.000 6.261) 8.093 6.898 ( -8.908 0.000 -3.942) 9.741 7.268 ( 11.659 0.000 11.602) 16.448 8.185 ( -7.111 0.000 3.594) 7.968 8.247 ( -3.117 0.000 -7.348) 7.981 9.208 ( -0.576 0.000 7.188) 7.211 9.332 ( -14.345 0.000 -11.122) 18.151 9.345 ( 4.316 0.000 -19.174) 19.654 9.808 ( 7.249 0.000 -4.082) 8.320 9.971 ( 11.376 0.000 7.708) 13.741 10.110 ( 17.837 0.000 6.369) 18.940 10.936 ( -16.384 0.000 15.044) 22.243 11.508 ( 10.432 0.000 -2.644) 10.762 11.537 ( -4.835 0.000 -3.501) 5.970 11.768 ( -4.935 0.000 0.045) 4.935 11.975 ( 2.079 0.000 3.607) 4.163 12.288 ( -3.005 0.000 1.552) 3.383 12.370 ( 4.308 0.000 2.036) 4.765 12.449 ( 2.390 0.000 -2.109) 3.188 12.663 ( -13.588 0.000 -7.512) 15.526 13.078 ( 8.471 0.000 5.938) 10.345 13.503 ( -2.100 0.000 3.497) 4.079 13.631 ( 3.718 0.000 0.504) 3.752 15.109 ( -3.612 0.000 4.017) 5.402 15.285 ( 5.587 0.000 -1.334) 5.744 15.543 ( -6.366 0.000 -3.328) 7.183 15.750 ( 4.434 0.000 1.715) 4.754 16.282 ( -1.639 0.000 5.898) 6.121 16.319 ( 0.548 0.000 -1.850) 1.929 17.703 ( 1.422 0.000 -25.119) 25.159 17.729 ( 2.006 0.000 16.662) 16.783 19.219 ( -24.823 0.000 1.203) 24.852 19.928 ( 10.724 0.000 -12.972) 16.830 ======================= 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| 2.112 ( 10.912 0.000 -9.373) 14.385 2.320 ( 2.316 0.000 -20.274) 20.406 2.492 ( -2.574 0.000 1.099) 2.798 2.759 ( 0.928 0.000 15.100) 15.128 3.270 ( -5.338 0.000 -10.983) 12.211 3.490 ( -3.101 0.000 0.452) 3.134 3.569 ( -7.414 0.000 -2.709) 7.893 4.272 ( 1.580 0.000 -24.277) 24.328 4.387 ( 6.421 0.000 -19.872) 20.884 4.430 ( -1.216 0.000 -2.663) 2.927 4.747 ( -5.878 0.000 12.347) 13.675 4.986 ( 4.785 0.000 9.998) 11.084 5.534 ( -13.232 0.000 6.698) 14.831 5.584 ( -3.491 0.000 -6.448) 7.333 6.196 ( -11.614 0.000 -7.856) 14.021 6.785 ( -4.080 0.000 5.850) 7.132 6.935 ( -2.873 0.000 4.137) 5.037 7.588 ( 7.628 0.000 10.674) 13.119 8.001 ( -12.065 0.000 -3.583) 12.586 8.116 ( -1.369 0.000 -6.788) 6.925 9.050 ( -7.332 0.000 0.591) 7.356 9.150 ( -1.154 0.000 -20.769) 20.801 9.354 ( 10.184 0.000 0.733) 10.210 9.883 ( 9.641 0.000 -5.886) 11.296 10.269 ( 14.468 0.000 1.935) 14.597 10.560 ( 15.972 0.000 10.292) 19.001 10.835 ( -11.088 0.000 14.449) 18.214 11.439 ( -14.482 0.000 -0.734) 14.500 11.443 ( -2.613 0.000 -1.694) 3.114 11.794 ( 10.359 0.000 4.913) 11.465 12.068 ( -6.736 0.000 -3.782) 7.725 12.208 ( -4.997 0.000 1.549) 5.231 12.404 ( -2.398 0.000 -6.841) 7.249 12.427 ( -2.823 0.000 2.719) 3.920 12.503 ( 4.566 0.000 6.622) 8.043 13.257 ( 5.278 0.000 4.430) 6.891 13.571 ( 3.917 0.000 7.648) 8.593 13.730 ( 3.992 0.000 5.372) 6.693 15.116 ( -0.887 0.000 5.838) 5.905 15.378 ( 2.731 0.000 -3.872) 4.738 15.419 ( -0.715 0.000 0.917) 1.163 15.826 ( 3.079 0.000 0.555) 3.128 16.317 ( -1.975 0.000 7.046) 7.318 16.345 ( 1.820 0.000 2.443) 3.047 17.462 ( 1.908 0.000 -28.316) 28.380 17.742 ( -13.941 0.000 -1.623) 14.035 18.814 ( -15.200 0.000 1.692) 15.294 19.879 ( 0.545 0.000 -15.122) 15.132 ======================= 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| 2.102 ( -5.115 0.000 -15.347) 16.177 2.212 ( 10.545 0.000 -18.032) 20.889 2.428 ( -1.616 0.000 1.924) 2.513 2.817 ( -6.688 0.000 8.021) 10.444 3.100 ( -3.775 0.000 -4.556) 5.917 3.233 ( -14.277 0.000 2.225) 14.449 3.671 ( 9.256 0.000 -3.816) 10.012 4.066 ( 5.475 0.000 -25.883) 26.455 4.281 ( 3.993 0.000 -20.193) 20.584 4.361 ( -6.381 0.000 -1.314) 6.515 4.753 ( -6.320 0.000 12.531) 14.035 5.099 ( -1.145 0.000 3.000) 3.210 5.282 ( -15.861 0.000 1.805) 15.963 5.477 ( -2.823 0.000 -2.624) 3.855 5.953 ( -2.896 0.000 -8.978) 9.433 6.736 ( -15.312 0.000 4.841) 16.059 6.940 ( 5.003 0.000 6.130) 7.912 7.642 ( -5.641 0.000 -1.048) 5.738 7.747 ( -8.720 0.000 -5.184) 10.145 8.094 ( 2.092 0.000 -6.368) 6.703 8.995 ( 2.907 0.000 -7.385) 7.936 9.039 ( -0.081 0.000 8.093) 8.094 9.598 ( 12.651 0.000 3.178) 13.044 10.018 ( 10.529 0.000 -5.634) 11.942 10.505 ( 15.187 0.000 -8.319) 17.316 10.812 ( 1.846 0.000 4.544) 4.904 10.830 ( -2.224 0.000 8.669) 8.950 11.186 ( -13.298 0.000 2.057) 13.456 11.402 ( -1.199 0.000 0.353) 1.250 11.730 ( -11.952 0.000 -6.486) 13.598 12.141 ( 11.691 0.000 8.458) 14.430 12.147 ( -5.658 0.000 4.397) 7.166 12.246 ( -5.061 0.000 -7.689) 9.205 12.349 ( -6.682 0.000 2.793) 7.242 12.743 ( 6.630 0.000 9.863) 11.884 13.343 ( 0.342 0.000 1.280) 1.325 13.804 ( 9.911 0.000 11.596) 15.255 13.894 ( 4.745 0.000 11.334) 12.287 15.203 ( 2.370 0.000 8.774) 9.088 15.317 ( -0.243 0.000 -2.090) 2.104 15.532 ( 6.434 0.000 0.972) 6.507 15.889 ( 2.866 0.000 1.394) 3.187 16.352 ( -1.782 0.000 6.930) 7.156 16.417 ( 2.079 0.000 3.749) 4.287 17.187 ( -28.612 0.000 -20.338) 35.104 17.188 ( -0.304 0.000 -29.325) 29.327 18.769 ( 1.995 0.000 6.887) 7.170 19.673 ( -5.398 0.000 -15.295) 16.220 ======================= 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| 1.878 ( -6.791 0.000 -4.273) 8.023 2.043 ( -5.595 0.000 -14.145) 15.211 2.588 ( 12.853 0.000 1.066) 12.897 2.739 ( -6.761 0.000 2.371) 7.165 3.042 ( 0.978 0.000 -2.226) 2.432 3.073 ( -6.423 0.000 3.275) 7.210 3.720 ( -5.085 0.000 3.521) 6.185 3.959 ( 5.592 0.000 -17.928) 18.780 4.098 ( -19.645 0.000 0.160) 19.645 4.160 ( 7.343 0.000 -19.363) 20.709 4.789 ( -2.116 0.000 9.914) 10.137 5.027 ( -3.552 0.000 -4.657) 5.857 5.155 ( 0.060 0.000 4.392) 4.393 5.378 ( -4.751 0.000 -3.479) 5.889 6.003 ( 14.340 0.000 -2.628) 14.579 6.399 ( -19.784 0.000 -2.602) 19.955 7.167 ( 10.080 0.000 7.259) 12.421 7.480 ( -7.521 0.000 -4.473) 8.751 7.626 ( -1.466 0.000 0.576) 1.575 7.955 ( -4.531 0.000 -13.478) 14.219 9.095 ( 6.162 0.000 4.320) 7.525 9.147 ( 0.977 0.000 7.989) 8.049 9.794 ( -0.592 0.000 10.538) 10.555 10.118 ( 7.566 0.000 -8.976) 11.739 10.701 ( -18.062 0.000 6.399) 19.162 10.706 ( 19.560 0.000 -12.881) 23.420 10.915 ( 7.103 0.000 -1.535) 7.267 10.996 ( -9.060 0.000 0.879) 9.102 11.415 ( 2.077 0.000 1.735) 2.706 11.533 ( -6.017 0.000 -1.086) 6.114 12.050 ( -8.497 0.000 2.377) 8.823 12.097 ( 1.482 0.000 -9.201) 9.319 12.322 ( -1.475 0.000 7.122) 7.273 12.398 ( 6.629 0.000 2.869) 7.223 12.943 ( 6.345 0.000 9.524) 11.444 13.286 ( -5.399 0.000 -2.933) 6.144 14.091 ( 7.396 0.000 9.868) 12.333 14.103 ( 3.588 0.000 11.770) 12.305 15.364 ( 2.687 0.000 11.337) 11.651 15.380 ( 6.740 0.000 4.681) 8.206 15.639 ( 5.037 0.000 -0.991) 5.133 15.921 ( -4.392 0.000 0.309) 4.402 16.396 ( -0.266 0.000 5.209) 5.216 16.481 ( -0.562 0.000 0.177) 0.589 16.517 ( -13.795 0.000 -16.888) 21.806 16.843 ( -5.911 0.000 -27.422) 28.052 18.932 ( 6.523 0.000 7.999) 10.322 19.397 ( -8.026 0.000 -13.812) 15.975 ======================= 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| 1.804 ( -4.139 0.000 8.360) 9.329 1.836 ( -7.249 0.000 -0.834) 7.296 2.614 ( -7.598 0.000 -1.358) 7.718 2.815 ( 12.790 0.000 -4.574) 13.583 3.048 ( 1.263 0.000 -1.466) 1.935 3.098 ( 6.934 0.000 -0.478) 6.951 3.527 ( -24.122 0.000 20.990) 31.976 3.827 ( -6.142 0.000 -6.266) 8.775 3.883 ( -7.038 0.000 7.371) 10.191 4.241 ( 17.249 0.000 -12.576) 21.347 4.886 ( 2.487 0.000 8.599) 8.951 4.938 ( 0.343 0.000 -5.485) 5.495 5.290 ( 2.883 0.000 -7.819) 8.333 5.306 ( 9.682 0.000 4.024) 10.485 6.035 ( -14.776 0.000 -4.831) 15.546 6.345 ( 21.712 0.000 1.674) 21.776 7.291 ( -7.971 0.000 -5.237) 9.537 7.406 ( 9.885 0.000 2.935) 10.311 7.711 ( 4.867 0.000 8.936) 10.176 7.750 ( -2.197 0.000 -10.842) 11.062 9.167 ( -4.304 0.000 -0.536) 4.337 9.199 ( 0.397 0.000 1.852) 1.894 9.808 ( -11.987 0.000 18.194) 21.788 10.042 ( -6.352 0.000 -13.053) 14.517 10.439 ( -16.274 0.000 12.856) 20.740 10.891 ( -2.433 0.000 -0.005) 2.433 10.893 ( 12.567 0.000 -11.039) 16.727 11.074 ( 14.236 0.000 -6.402) 15.610 11.434 ( -3.953 0.000 -0.430) 3.977 11.512 ( 5.499 0.000 1.840) 5.799 11.960 ( -2.358 0.000 3.736) 4.418 12.135 ( 9.988 0.000 -5.794) 11.547 12.386 ( 0.324 0.000 3.755) 3.769 12.454 ( 2.380 0.000 -5.100) 5.628 13.115 ( -6.961 0.000 -6.352) 9.423 13.166 ( 6.562 0.000 8.467) 10.713 14.197 ( -1.789 0.000 1.182) 2.144 14.230 ( 1.532 0.000 0.515) 1.616 15.457 ( -4.132 0.000 3.135) 5.187 15.554 ( 2.423 0.000 -3.823) 4.526 15.632 ( -14.183 0.000 -5.201) 15.106 15.812 ( 15.465 0.000 11.409) 19.218 16.383 ( 2.059 0.000 4.850) 5.269 16.399 ( -4.116 0.000 -9.112) 9.998 16.496 ( -4.506 0.000 -3.734) 5.852 16.550 ( 4.234 0.000 1.646) 4.542 19.122 ( -7.919 0.000 -10.825) 13.412 19.152 ( 7.347 0.000 9.954) 12.372 ======================= 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| 1.786 ( -5.804 0.000 13.929) 15.090 1.826 ( -10.055 0.000 17.466) 20.154 2.499 ( 0.784 0.000 -3.520) 3.606 2.969 ( 10.673 0.000 -6.788) 12.649 3.032 ( -3.392 0.000 2.588) 4.267 3.262 ( 10.620 0.000 -0.502) 10.632 3.490 ( -7.509 0.000 27.972) 28.962 3.641 ( -9.465 0.000 -0.711) 9.492 3.896 ( -6.017 0.000 16.399) 17.467 4.388 ( 5.677 0.000 -3.934) 6.907 4.937 ( 4.802 0.000 -5.400) 7.227 5.037 ( 3.854 0.000 7.804) 8.703 5.380 ( 16.542 0.000 -8.113) 18.425 5.518 ( 9.054 0.000 -3.320) 9.644 5.821 ( -3.145 0.000 2.114) 3.790 6.754 ( 18.606 0.000 2.035) 18.717 7.083 ( -7.807 0.000 -6.544) 10.187 7.603 ( 9.522 0.000 1.748) 9.681 7.708 ( 5.616 0.000 -2.423) 6.116 7.918 ( 4.858 0.000 9.704) 10.852 8.986 ( -10.518 0.000 -4.303) 11.364 9.148 ( -4.596 0.000 -2.492) 5.228 9.690 ( -16.826 0.000 -5.805) 17.799 9.767 ( -12.673 0.000 18.228) 22.201 10.380 ( -2.103 0.000 3.433) 4.025 10.907 ( 3.850 0.000 -0.385) 3.869 10.930 ( -0.070 0.000 -7.142) 7.142 11.240 ( 10.803 0.000 -4.253) 11.610 11.398 ( -0.293 0.000 0.920) 0.965 11.655 ( 9.118 0.000 2.063) 9.349 12.053 ( 4.097 0.000 6.307) 7.521 12.281 ( 10.846 0.000 -6.522) 12.656 12.335 ( -4.907 0.000 -6.117) 7.841 12.431 ( 2.493 0.000 -5.843) 6.353 12.947 ( -3.371 0.000 -8.913) 9.529 13.308 ( 1.197 0.000 4.500) 4.656 14.042 ( -9.468 0.000 -10.243) 13.949 14.144 ( -4.772 0.000 -10.624) 11.647 15.288 ( -6.148 0.000 -0.118) 6.149 15.422 ( -4.380 0.000 -12.253) 13.012 15.510 ( -6.407 0.000 3.963) 7.534 15.954 ( -4.696 0.000 -6.504) 8.022 16.445 ( 1.371 0.000 -0.265) 1.396 16.478 ( -0.035 0.000 -1.093) 1.094 16.679 ( 28.831 0.000 28.023) 40.206 16.709 ( 3.324 0.000 14.261) 14.643 18.910 ( -4.459 0.000 -7.250) 8.511 19.388 ( 5.835 0.000 12.058) 13.395 ======================= 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| 1.788 ( -12.402 0.000 19.068) 22.746 1.875 ( -5.759 0.000 22.205) 22.940 2.592 ( 11.048 0.000 -4.295) 11.853 2.981 ( -5.216 0.000 -6.233) 8.127 3.023 ( -5.328 0.000 13.100) 14.142 3.478 ( 11.830 0.000 3.624) 12.373 3.546 ( 3.902 0.000 -3.624) 5.325 3.727 ( 1.822 0.000 25.316) 25.382 3.972 ( -6.488 0.000 20.166) 21.184 4.401 ( 0.054 0.000 -0.160) 0.169 4.963 ( 4.830 0.000 -7.747) 9.129 5.118 ( -1.359 0.000 0.050) 1.360 5.516 ( 0.464 0.000 -2.542) 2.584 5.649 ( 17.036 0.000 -5.592) 17.931 6.020 ( 12.667 0.000 8.892) 15.477 6.902 ( -4.874 0.000 -4.733) 6.794 6.980 ( 4.189 0.000 -0.250) 4.196 7.749 ( 3.189 0.000 -3.735) 4.911 7.904 ( 13.748 0.000 4.448) 14.449 8.001 ( -1.763 0.000 4.089) 4.453 8.839 ( -4.637 0.000 8.396) 9.591 9.041 ( -3.882 0.000 0.413) 3.904 9.420 ( -5.607 0.000 -5.428) 7.804 9.717 ( -8.681 0.000 10.865) 13.908 10.369 ( 2.419 0.000 -8.077) 8.432 10.726 ( -13.529 0.000 -6.816) 15.149 11.007 ( 8.071 0.000 -1.697) 8.248 11.422 ( 10.268 0.000 0.608) 10.286 11.425 ( 1.620 0.000 0.959) 1.882 11.821 ( -0.964 0.000 1.827) 2.066 12.067 ( -0.762 0.000 -2.503) 2.617 12.256 ( 0.066 0.000 3.645) 3.645 12.328 ( 4.950 0.000 -10.181) 11.321 12.469 ( 3.585 0.000 -1.464) 3.872 12.742 ( -6.045 0.000 -13.444) 14.740 13.299 ( -4.507 0.000 0.470) 4.531 13.751 ( -7.519 0.000 -9.678) 12.255 13.907 ( -7.107 0.000 -11.175) 13.244 15.255 ( -1.417 0.000 -7.847) 7.974 15.284 ( 0.501 0.000 5.213) 5.237 15.417 ( -5.825 0.000 2.096) 6.191 15.834 ( -4.090 0.000 -0.609) 4.135 16.423 ( -2.236 0.000 -4.566) 5.084 16.444 ( 1.524 0.000 -4.566) 4.813 16.924 ( 0.057 0.000 21.903) 21.903 17.552 ( 32.856 0.000 17.176) 37.075 18.864 ( 7.927 0.000 -2.760) 8.394 19.588 ( 1.471 0.000 12.855) 12.939 ======================= 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| 1.822 ( -2.983 0.000 16.771) 17.034 1.990 ( -7.055 0.000 22.204) 23.298 2.699 ( 8.643 0.000 -12.422) 15.132 2.724 ( -12.470 0.000 -5.389) 13.585 3.131 ( -1.795 0.000 20.167) 20.246 3.583 ( 7.749 0.000 -9.604) 12.340 3.820 ( 15.981 0.000 6.711) 17.333 3.992 ( -3.885 0.000 21.499) 21.847 4.085 ( -0.651 0.000 21.695) 21.705 4.433 ( 2.780 0.000 2.118) 3.495 4.940 ( 2.342 0.000 -10.493) 10.751 4.993 ( -5.599 0.000 -8.775) 10.409 5.549 ( -0.679 0.000 6.863) 6.897 5.812 ( 7.706 0.000 -7.465) 10.729 6.350 ( 12.853 0.000 8.569) 15.447 6.818 ( -3.811 0.000 1.830) 4.228 6.951 ( -2.925 0.000 -1.422) 3.253 7.527 ( -12.938 0.000 -12.510) 17.997 8.097 ( 3.596 0.000 7.007) 7.876 8.212 ( 13.331 0.000 1.265) 13.391 8.952 ( -0.357 0.000 17.630) 17.633 9.081 ( 3.808 0.000 11.054) 11.692 9.357 ( 5.360 0.000 -8.865) 10.360 9.688 ( -2.014 0.000 3.737) 4.245 10.278 ( 2.677 0.000 -19.503) 19.686 10.325 ( -20.895 0.000 -9.397) 22.911 11.163 ( 12.287 0.000 -4.668) 13.144 11.440 ( -16.697 0.000 2.960) 16.958 11.476 ( 3.082 0.000 1.814) 3.576 11.746 ( 3.194 0.000 1.985) 3.760 12.031 ( -5.564 0.000 -1.139) 5.680 12.329 ( 4.044 0.000 -4.455) 6.017 12.360 ( 4.790 0.000 6.498) 8.072 12.433 ( -5.694 0.000 -3.499) 6.683 12.627 ( 6.362 0.000 -4.831) 7.988 13.176 ( -7.233 0.000 -3.005) 7.832 13.608 ( -0.267 0.000 -6.362) 6.367 13.696 ( -6.357 0.000 -5.781) 8.592 15.203 ( 2.162 0.000 -4.941) 5.394 15.256 ( -6.308 0.000 1.357) 6.452 15.465 ( 5.482 0.000 5.186) 7.546 15.770 ( -3.399 0.000 -0.143) 3.402 16.327 ( -3.340 0.000 -2.785) 4.349 16.410 ( 0.737 0.000 -6.088) 6.132 17.167 ( 0.456 0.000 25.564) 25.568 17.977 ( 8.811 0.000 -7.082) 11.305 19.232 ( 29.833 0.000 0.348) 29.835 19.675 ( -6.276 0.000 11.435) 13.044 ======================= 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| 2.009 ( 4.536 0.962 14.813) 15.522 2.154 ( -2.005 7.265 6.351) 9.856 2.462 ( -2.141 -5.006 1.298) 5.597 2.669 ( 2.760 -0.783 -13.261) 13.567 3.402 ( -2.675 8.647 13.211) 16.014 3.655 ( 5.087 6.572 -11.587) 14.260 4.013 ( -9.600 0.080 11.859) 15.258 4.137 ( 12.184 -1.716 2.100) 12.482 4.373 ( 0.403 2.811 18.046) 18.268 4.594 ( 6.659 5.200 0.013) 8.449 4.792 ( -6.560 -0.091 -4.696) 8.068 4.859 ( 1.836 2.308 -12.858) 13.192 5.617 ( -1.575 2.209 10.161) 10.517 5.798 ( -0.374 0.119 -6.600) 6.612 6.681 ( 8.473 2.904 7.608) 11.752 6.751 ( -11.395 3.633 0.640) 11.977 7.085 ( 8.926 8.725 5.482) 13.633 7.260 ( -11.863 8.999 -10.664) 18.314 8.249 ( 0.969 5.128 5.312) 7.447 8.366 ( 1.322 3.775 -5.983) 7.197 9.057 ( 4.239 -5.792 15.470) 17.053 9.297 ( 6.089 -6.939 -5.039) 10.518 9.486 ( 11.128 4.185 13.595) 18.060 9.768 ( -22.070 -3.280 -5.324) 22.938 9.849 ( 4.776 7.868 -4.553) 10.268 10.115 ( 3.236 1.952 -20.808) 21.148 11.047 ( -13.830 -8.494 13.159) 20.894 11.301 ( 10.334 -4.906 -9.941) 15.155 11.583 ( 2.589 -2.269 3.485) 4.898 11.654 ( -4.687 -4.269 -3.648) 7.315 12.001 ( 5.247 -5.932 6.473) 10.228 12.127 ( -6.938 -3.262 -5.272) 9.304 12.374 ( 1.910 -1.067 6.466) 6.826 12.515 ( -0.313 3.807 -6.565) 7.595 12.881 ( 4.496 3.129 5.233) 7.576 13.002 ( -4.951 3.675 -5.567) 8.307 13.453 ( 0.769 -7.983 1.538) 8.166 13.532 ( -3.171 -5.017 -5.805) 8.302 14.907 ( -6.061 -19.562 4.356) 20.938 14.999 ( 4.683 -18.367 -4.296) 19.435 15.706 ( 0.891 5.713 3.161) 6.590 15.777 ( -1.155 5.271 -3.502) 6.433 16.236 ( -2.796 -3.167 1.936) 4.647 16.315 ( 0.242 -3.731 -5.266) 6.458 17.572 ( 3.448 10.133 22.997) 25.366 17.997 ( 0.584 7.679 -17.802) 19.397 19.563 ( -15.146 -0.287 7.485) 16.897 19.726 ( 22.069 0.311 -8.098) 23.510 ======================= 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| 2.101 ( 3.089 4.663 -4.708) 7.311 2.331 ( 12.289 -0.119 5.227) 13.355 2.447 ( -2.089 -1.564 -5.801) 6.361 2.650 ( 5.159 1.335 0.890) 5.402 3.429 ( -4.382 3.139 3.224) 6.280 3.599 ( 1.004 9.245 -8.403) 12.533 3.872 ( -14.536 1.853 4.126) 15.223 4.300 ( 8.856 -3.672 -8.218) 12.628 4.472 ( -4.069 0.230 3.065) 5.100 4.583 ( 0.736 2.491 -16.580) 16.782 4.704 ( -0.669 0.610 8.040) 8.090 4.870 ( 5.038 6.895 1.116) 8.613 5.640 ( -5.462 2.151 3.680) 6.928 5.726 ( -1.645 2.314 -0.902) 2.979 6.512 ( -13.450 2.906 -3.010) 14.086 6.851 ( 0.192 -0.894 7.841) 7.894 6.995 ( -6.369 9.558 -5.419) 12.699 7.369 ( 12.064 9.712 10.117) 18.499 8.227 ( -6.020 4.164 -1.948) 7.574 8.310 ( -1.878 6.403 -2.204) 7.027 9.123 ( -2.954 -12.099 -13.054) 18.042 9.265 ( -2.659 2.372 3.710) 5.144 9.391 ( -5.478 -0.670 -11.729) 12.962 9.840 ( 5.057 2.456 6.740) 8.776 10.038 ( 16.128 3.959 4.379) 17.174 10.109 ( 14.499 2.188 -1.831) 14.777 10.859 ( -16.402 -7.804 12.127) 21.840 11.417 ( 5.838 -5.227 -5.101) 9.350 11.595 ( 0.179 0.116 -1.228) 1.247 11.739 ( 7.574 -6.845 2.824) 10.592 11.843 ( -9.689 -3.033 -0.472) 10.164 12.197 ( 2.510 -6.611 3.475) 7.879 12.409 ( -1.555 2.067 -7.396) 7.835 12.435 ( -2.892 -2.445 5.149) 6.392 12.740 ( -9.367 5.463 -1.713) 10.978 13.136 ( 9.088 4.211 2.640) 10.358 13.399 ( -3.519 -8.184 0.777) 8.942 13.568 ( 4.541 -5.394 3.559) 7.898 14.862 ( -4.299 -18.511 5.571) 19.804 15.064 ( 6.370 -18.573 -3.153) 19.886 15.684 ( -2.870 8.697 -0.627) 9.180 15.795 ( 2.843 2.770 1.334) 4.187 16.233 ( -2.006 -4.203 5.322) 7.072 16.293 ( 1.235 -2.582 -0.974) 3.023 17.767 ( -1.167 7.336 -13.637) 15.529 17.862 ( 4.391 10.104 5.905) 12.500 19.249 ( -23.421 2.695 1.800) 23.644 19.903 ( 9.585 -2.496 -12.929) 16.287 ======================= 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| 2.150 ( 10.508 3.678 -10.585) 15.362 2.284 ( -1.149 -1.916 -16.781) 16.930 2.535 ( 6.044 2.613 0.917) 6.648 2.809 ( -0.294 4.192 12.579) 13.262 3.286 ( -7.544 1.824 -7.827) 11.023 3.580 ( 3.732 4.842 -2.242) 6.511 3.606 ( -14.501 5.983 -0.998) 15.718 4.264 ( -0.560 -0.568 -18.593) 18.610 4.337 ( 2.854 -2.895 -12.972) 13.594 4.500 ( 1.700 4.365 -7.622) 8.946 4.767 ( -3.947 1.874 8.980) 9.987 5.004 ( 4.874 2.578 6.162) 8.269 5.520 ( -6.578 -0.216 -3.729) 7.565 5.657 ( -8.117 5.455 1.366) 9.874 6.209 ( -13.604 1.341 -7.012) 15.364 6.820 ( -7.217 0.782 7.601) 10.510 6.948 ( -1.833 3.668 1.473) 4.357 7.651 ( 5.577 5.930 7.542) 11.098 8.026 ( -10.225 2.718 -7.122) 12.754 8.246 ( -0.506 11.845 -2.252) 12.068 8.931 ( -3.490 -9.463 -5.232) 11.363 9.188 ( -2.162 1.206 -14.079) 14.295 9.329 ( 6.587 -0.662 0.574) 6.645 9.960 ( 8.038 5.437 -0.844) 9.740 10.308 ( 15.169 4.164 -2.458) 15.921 10.539 ( 17.231 -1.947 10.627) 20.338 10.750 ( -8.955 -8.334 12.439) 17.446 11.419 ( -0.683 -1.318 -1.222) 1.922 11.456 ( -13.815 0.410 0.004) 13.821 11.765 ( 4.744 -4.036 2.707) 6.792 11.939 ( 0.788 -10.303 -1.445) 10.434 12.133 ( -4.729 -5.201 0.028) 7.029 12.346 ( -1.239 -2.520 -3.181) 4.243 12.441 ( -2.554 1.843 5.532) 6.366 12.639 ( -1.028 7.614 3.022) 8.256 13.250 ( 3.053 -2.700 -0.312) 4.088 13.436 ( 2.983 -6.544 6.319) 9.574 13.724 ( 5.697 -2.999 8.764) 10.875 14.853 ( -3.060 -17.129 5.078) 18.126 15.157 ( 6.374 -19.971 -2.457) 21.107 15.661 ( 0.210 15.030 2.426) 15.226 15.862 ( 2.906 2.049 1.977) 4.068 16.261 ( -1.386 -4.265 6.189) 7.644 16.342 ( 2.028 -1.177 3.997) 4.634 17.510 ( -2.778 6.680 -25.697) 26.696 17.926 ( -7.001 14.270 -0.968) 15.925 18.854 ( -16.111 3.768 1.280) 16.595 19.843 ( 0.108 -3.572 -14.761) 15.188 ======================= 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| 2.073 ( -2.607 -0.035 -13.026) 13.284 2.279 ( 13.759 5.813 -14.772) 21.007 2.565 ( -3.819 10.307 -0.578) 11.007 2.788 ( -7.944 -1.974 5.582) 9.908 3.087 ( -9.336 0.017 1.602) 9.472 3.372 ( -8.986 9.965 -2.481) 13.645 3.679 ( 9.004 0.448 -4.740) 10.186 4.064 ( 1.249 0.940 -18.619) 18.685 4.245 ( 2.343 -2.737 -15.805) 16.211 4.438 ( -2.221 5.874 -6.534) 9.063 4.766 ( -5.022 1.645 9.603) 10.961 5.110 ( -0.276 1.264 2.479) 2.796 5.322 ( -11.230 3.231 -2.472) 11.944 5.507 ( -6.120 3.017 -0.164) 6.825 5.929 ( -5.206 -2.047 -9.195) 10.763 6.684 ( -16.709 -5.074 3.196) 17.753 6.988 ( 4.698 4.633 5.557) 8.627 7.649 ( -6.753 1.524 -2.441) 7.341 7.786 ( -6.264 3.299 -6.151) 9.379 8.246 ( 0.346 13.076 -5.867) 14.336 8.887 ( 0.586 -6.580 1.886) 6.870 9.095 ( 1.907 1.589 -0.255) 2.496 9.537 ( 12.888 -3.049 2.710) 13.518 10.103 ( 8.305 5.708 -2.552) 10.396 10.527 ( 16.000 2.132 -9.977) 18.976 10.773 ( -1.497 -5.222 9.633) 11.060 10.833 ( 4.828 1.931 4.502) 6.878 11.219 ( -12.988 2.175 2.850) 13.474 11.396 ( -1.294 -0.098 0.795) 1.522 11.695 ( -8.495 -3.391 -4.573) 10.226 11.993 ( 2.287 -10.506 7.855) 13.316 12.128 ( 1.601 -5.271 -2.906) 6.229 12.262 ( -2.528 2.542 0.048) 3.586 12.399 ( -4.868 4.539 2.404) 7.077 12.765 ( 3.813 1.581 9.495) 10.353 13.298 ( 2.084 -5.176 -0.999) 5.668 13.588 ( 5.073 -10.986 10.583) 16.075 13.940 ( 6.406 -1.427 10.615) 12.480 14.843 ( -2.674 -17.787 3.302) 18.287 15.219 ( 3.613 -23.606 -5.058) 24.411 15.760 ( 4.638 20.456 8.141) 22.499 15.965 ( 5.150 4.624 5.364) 8.757 16.310 ( -0.370 -3.364 6.849) 7.640 16.426 ( 1.763 -0.041 4.713) 5.032 17.115 ( -12.971 6.344 -25.137) 28.989 17.577 ( -13.719 23.339 -20.234) 33.798 18.786 ( 1.380 1.390 6.515) 6.803 19.639 ( -5.331 -3.410 -14.712) 16.015 ======================= 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| 1.944 ( -1.258 6.767 -3.737) 7.832 2.159 ( -10.533 8.990 -10.204) 17.201 2.607 ( 8.922 2.412 2.090) 9.476 2.752 ( -0.989 1.594 -0.783) 2.032 2.991 ( -3.453 -1.389 4.834) 6.101 3.212 ( -5.080 7.920 -4.666) 10.502 3.747 ( 1.187 0.902 -0.881) 1.731 3.914 ( -4.266 -0.621 -9.030) 10.006 4.126 ( -3.886 0.916 -7.044) 8.097 4.255 ( -1.927 9.151 -13.312) 16.269 4.804 ( -1.215 1.490 8.799) 9.007 5.041 ( -3.801 1.271 -4.830) 6.276 5.192 ( -0.640 3.620 3.031) 4.765 5.398 ( -4.856 1.928 -3.246) 6.151 5.944 ( 13.319 -5.384 -2.692) 14.616 6.333 ( -19.325 -6.187 -3.229) 20.546 7.182 ( 8.895 1.438 5.405) 10.507 7.464 ( -7.675 -0.230 -5.035) 9.182 7.705 ( 0.395 6.478 1.268) 6.613 8.073 ( -6.031 9.644 -13.607) 17.735 8.992 ( 2.997 -6.391 8.970) 11.414 9.169 ( 2.019 -0.277 1.634) 2.612 9.782 ( 4.403 0.393 11.141) 11.986 10.167 ( 3.176 3.385 -6.932) 8.342 10.700 ( 0.793 1.924 -0.560) 2.155 10.782 ( 0.827 3.116 -2.622) 4.155 10.891 ( 7.771 0.026 -1.329) 7.884 11.042 ( -8.191 2.762 -0.191) 8.647 11.417 ( 1.931 1.127 3.721) 4.341 11.565 ( -3.486 2.263 -0.889) 4.250 11.996 ( -5.803 -5.347 2.689) 8.337 12.061 ( 1.850 -3.779 -8.948) 9.888 12.344 ( 2.205 1.274 4.489) 5.161 12.390 ( 1.277 1.482 3.641) 4.134 12.921 ( 4.122 -2.159 9.593) 10.662 13.254 ( -4.238 -3.071 -4.145) 6.676 13.855 ( 7.817 -15.072 15.954) 23.298 14.131 ( 4.085 -2.595 5.458) 7.295 14.836 ( -1.404 -21.717 4.062) 22.138 15.151 ( -2.380 -28.018 -10.956) 30.178 15.967 ( 7.064 15.729 10.344) 20.107 16.188 ( 8.012 13.746 14.784) 21.719 16.382 ( 0.503 -1.101 5.435) 5.568 16.490 ( 1.501 0.161 2.152) 2.629 16.595 ( -15.800 13.799 -18.281) 27.825 17.131 ( -8.449 25.101 -28.246) 38.721 18.936 ( 5.978 0.105 7.639) 9.700 19.374 ( -7.535 -2.379 -13.172) 15.361 ======================= 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| 1.881 ( -10.410 6.576 3.404) 12.775 1.975 ( -1.612 11.835 5.724) 13.245 2.658 ( -4.897 4.098 -1.311) 6.518 2.785 ( 7.367 -1.671 -5.237) 9.192 3.081 ( 4.722 -0.388 5.415) 7.195 3.119 ( 3.932 5.019 -4.655) 7.894 3.662 ( -15.695 9.542 9.700) 20.772 3.770 ( -4.669 -3.429 2.911) 6.483 3.930 ( -10.236 4.664 3.671) 11.832 4.297 ( 14.776 5.322 -11.026) 19.189 4.889 ( 0.351 0.464 6.655) 6.680 4.954 ( 1.661 1.429 -3.646) 4.254 5.274 ( 1.966 -0.126 -0.925) 2.177 5.362 ( 10.297 4.088 -2.638) 11.388 5.975 ( -13.795 -5.484 -4.701) 15.572 6.279 ( 21.727 -6.147 1.038) 22.603 7.275 ( -7.325 -0.624 -4.070) 8.403 7.395 ( 9.640 -0.523 1.628) 9.790 7.826 ( 6.130 8.946 8.965) 14.071 7.841 ( -3.683 7.909 -10.894) 13.957 9.113 ( 0.006 -5.760 7.221) 9.237 9.136 ( -4.156 -3.054 -4.465) 6.822 9.863 ( -12.100 4.318 14.057) 19.043 10.062 ( -4.583 1.591 -9.235) 10.431 10.480 ( -18.377 3.370 13.065) 22.798 10.906 ( -2.946 0.821 -2.126) 3.724 10.951 ( 12.917 4.852 -10.111) 17.106 11.072 ( 13.341 0.153 -4.213) 13.992 11.488 ( -2.628 4.745 -2.832) 6.119 11.529 ( 4.814 1.885 3.212) 6.086 11.926 ( -2.386 -3.237 3.392) 5.261 12.093 ( 8.941 -4.753 -6.526) 12.046 12.380 ( -1.710 -0.346 1.586) 2.358 12.442 ( 2.713 0.224 -1.852) 3.292 13.096 ( -5.183 -1.866 -6.431) 8.468 13.115 ( 4.926 -4.851 8.888) 11.260 14.096 ( 1.435 -9.069 7.598) 11.917 14.142 ( -1.990 -8.500 -6.917) 11.138 14.886 ( -2.544 -28.012 7.820) 29.194 14.984 ( -0.292 -25.612 -6.144) 26.340 16.165 ( -8.648 12.783 -5.752) 16.470 16.248 ( 7.909 6.369 7.519) 12.636 16.443 ( 1.823 7.516 5.669) 9.589 16.460 ( 1.073 3.192 1.119) 3.548 16.568 ( -4.737 13.784 2.872) 14.856 16.749 ( 5.517 31.162 -13.817) 34.531 19.093 ( -5.384 -2.523 -2.507) 6.453 19.164 ( 4.851 0.418 1.740) 5.170 ======================= 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| 1.805 ( -5.942 4.035 11.992) 13.979 1.957 ( -14.373 9.651 14.788) 22.769 2.599 ( 3.341 8.290 -2.830) 9.375 2.867 ( 7.841 -4.268 -1.417) 9.039 3.131 ( 1.086 3.201 -2.345) 4.114 3.306 ( 9.248 4.908 4.783) 11.511 3.560 ( -5.188 3.746 9.737) 11.652 3.707 ( -8.019 8.259 10.206) 15.384 3.887 ( -6.017 0.021 15.334) 16.472 4.418 ( 4.712 2.916 -3.332) 6.466 4.911 ( 2.891 -1.644 -2.915) 4.422 5.061 ( 4.125 1.502 6.057) 7.481 5.347 ( 10.746 -1.925 -5.216) 12.099 5.585 ( 11.629 5.002 -5.499) 13.802 5.788 ( 0.182 -2.701 2.817) 3.907 6.694 ( 19.776 -5.716 1.589) 20.646 7.100 ( -6.523 1.894 -4.649) 8.231 7.595 ( 10.519 -0.692 1.653) 10.671 7.751 ( 2.533 4.641 -3.315) 6.241 8.062 ( 6.546 11.563 10.336) 16.834 8.955 ( -8.920 -2.526 -5.013) 10.539 9.119 ( -3.561 -2.539 0.797) 4.446 9.591 ( -19.013 -1.475 -0.691) 19.082 9.938 ( -10.081 8.357 9.877) 16.402 10.371 ( -5.367 -0.615 5.501) 7.710 10.845 ( -0.764 -3.131 -2.247) 3.929 11.005 ( 0.377 3.948 -8.965) 9.804 11.256 ( 10.807 0.440 -1.056) 10.867 11.434 ( 0.150 3.832 -2.738) 4.712 11.650 ( 7.052 -0.543 1.125) 7.161 12.010 ( 3.958 -3.755 5.632) 7.841 12.165 ( 4.469 -11.301 -8.589) 14.881 12.339 ( -0.722 1.194 -4.416) 4.631 12.436 ( 0.939 0.874 -1.709) 2.138 12.968 ( -1.009 1.394 -8.894) 9.059 13.232 ( -1.210 -6.781 5.575) 8.861 13.862 ( -9.389 -12.701 -15.109) 21.858 14.117 ( -3.251 -3.826 -4.865) 6.991 14.865 ( 0.007 -17.262 1.158) 17.300 15.065 ( -0.267 -28.458 9.358) 29.958 15.936 ( -6.644 18.254 -7.602) 20.860 16.164 ( -11.573 11.273 -14.751) 21.877 16.425 ( 0.069 -2.997 -3.852) 4.881 16.504 ( 0.458 1.719 -1.641) 2.420 16.635 ( 9.354 8.282 19.161) 22.874 17.166 ( 23.275 32.589 18.489) 44.109 18.913 ( -4.228 -0.116 -5.922) 7.277 19.372 ( 5.913 -1.653 10.697) 12.334 ======================= 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| 1.830 ( -14.525 4.047 17.448) 23.060 1.890 ( -3.250 2.821 19.987) 20.445 2.652 ( 5.314 2.705 -7.150) 9.310 2.997 ( -7.463 0.824 -4.920) 8.976 3.073 ( 2.552 6.114 13.792) 15.300 3.534 ( 10.944 4.658 5.645) 13.165 3.586 ( 4.069 4.240 -3.250) 6.715 3.816 ( 1.135 7.803 20.647) 22.101 3.971 ( -4.857 0.486 19.700) 20.296 4.431 ( 0.282 2.880 0.083) 2.895 4.936 ( 3.561 -1.810 -4.798) 6.243 5.127 ( -1.149 0.095 -2.157) 2.446 5.448 ( 3.948 -4.073 -1.525) 5.874 5.690 ( 9.827 1.760 -1.353) 10.074 6.063 ( 16.128 4.312 6.497) 17.914 6.947 ( 6.262 -3.259 -0.620) 7.086 6.963 ( -3.474 5.666 -3.260) 7.403 7.761 ( 3.785 1.404 -2.915) 4.979 7.879 ( 10.708 -0.217 5.561) 12.068 8.196 ( 0.648 15.342 3.310) 15.708 8.797 ( -5.789 -3.544 4.725) 8.271 9.049 ( -2.661 -0.371 0.956) 2.852 9.337 ( -6.968 -2.238 0.645) 7.347 9.869 ( -6.654 9.698 6.589) 13.481 10.343 ( 0.918 -2.192 -5.527) 6.017 10.715 ( -13.323 -1.419 -6.601) 14.936 10.908 ( 2.095 -8.658 -3.192) 9.462 11.416 ( 1.782 -1.137 0.481) 2.168 11.465 ( 9.416 3.380 -1.259) 10.083 11.753 ( -1.272 -5.930 1.752) 6.312 12.014 ( -2.551 -6.988 -5.413) 9.200 12.161 ( 4.181 -11.253 -3.182) 12.419 12.297 ( -0.164 3.682 -0.453) 3.713 12.491 ( 3.710 2.219 0.218) 4.329 12.816 ( -2.353 4.829 -12.422) 13.533 13.214 ( -4.050 -6.954 3.315) 8.703 13.602 ( -5.098 -8.104 -9.603) 13.560 13.933 ( -6.779 -1.030 -10.482) 12.525 14.903 ( 2.254 -14.674 0.610) 14.858 15.088 ( -4.863 -24.743 4.984) 25.704 15.752 ( -4.668 20.914 -6.587) 22.418 15.919 ( -5.000 4.403 -4.007) 7.775 16.374 ( -0.607 -3.544 -5.145) 6.276 16.457 ( -0.893 -0.358 -5.839) 5.918 16.975 ( 3.407 7.831 24.246) 25.706 17.818 ( 25.809 21.270 9.605) 34.796 18.891 ( 9.398 2.446 -1.737) 9.865 19.564 ( 1.853 -2.319 11.926) 12.290 ======================= 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| 1.831 ( -4.354 1.959 17.234) 17.883 2.055 ( -3.022 4.712 21.319) 22.042 2.592 ( -3.244 -5.526 -10.044) 11.914 2.774 ( -5.029 0.932 -6.422) 8.210 3.274 ( 0.663 12.128 15.478) 19.675 3.640 ( 7.351 5.265 -8.408) 12.347 3.834 ( 13.528 1.301 7.597) 15.570 4.003 ( -5.530 0.491 18.790) 19.593 4.143 ( 2.395 5.746 19.837) 20.791 4.474 ( 3.986 3.809 1.577) 5.734 4.920 ( -0.514 -1.036 -5.372) 5.495 4.999 ( -2.840 -0.310 -11.558) 11.905 5.529 ( 1.263 -1.181 7.039) 7.248 5.817 ( 4.811 0.515 -3.343) 5.882 6.405 ( 13.333 4.816 7.025) 15.821 6.904 ( -5.956 6.304 2.867) 9.134 6.959 ( 2.063 2.355 -2.303) 3.887 7.600 ( -11.090 6.491 -11.197) 17.044 8.121 ( 6.940 2.858 5.678) 9.411 8.305 ( 8.141 8.916 1.368) 12.151 8.833 ( 0.568 -9.349 12.074) 15.281 9.118 ( 3.687 0.024 11.042) 11.641 9.324 ( 3.015 1.062 0.669) 3.266 9.831 ( -0.506 10.403 -1.103) 10.473 10.228 ( -8.856 -3.217 -11.377) 14.772 10.328 ( -10.862 -1.023 -15.033) 18.575 10.983 ( 6.030 -15.366 1.578) 16.582 11.383 ( -5.330 -1.520 -1.783) 5.822 11.556 ( -2.033 1.324 2.284) 3.332 11.759 ( 3.670 1.128 2.419) 4.538 11.871 ( -4.396 -13.954 -5.243) 15.542 12.249 ( 5.197 -7.286 -0.972) 9.002 12.280 ( -2.940 0.442 2.687) 4.007 12.541 ( 2.551 4.806 -2.433) 5.961 12.744 ( 5.028 7.751 -4.341) 10.208 13.159 ( -5.812 -1.024 1.117) 6.006 13.460 ( -1.311 -9.520 -5.662) 11.154 13.706 ( -6.644 -1.904 -8.751) 11.151 14.940 ( 1.383 -15.380 -0.472) 15.450 15.017 ( -4.964 -22.436 0.815) 22.993 15.673 ( -0.199 12.588 -0.370) 12.595 15.836 ( -2.010 3.833 -2.106) 4.813 16.298 ( -2.846 -2.723 -3.040) 4.976 16.378 ( -0.291 -3.119 -6.765) 7.455 17.272 ( 2.112 10.232 25.351) 27.419 18.095 ( 5.625 9.623 -8.503) 14.020 19.276 ( 28.883 3.960 -0.382) 29.156 19.655 ( -5.341 -1.915 10.904) 12.292 ======================= 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| 2.051 ( 4.209 2.604 12.800) 13.723 2.291 ( -3.136 2.494 -8.460) 9.361 2.357 ( 3.741 -1.589 13.676) 14.267 2.639 ( 0.501 -2.126 -11.929) 12.127 3.618 ( -6.434 11.254 10.490) 16.676 3.814 ( 5.609 7.835 -8.767) 13.027 4.015 ( -6.314 0.031 8.834) 10.858 4.092 ( 7.681 -2.362 3.083) 8.607 4.461 ( -2.050 5.508 13.346) 14.583 4.714 ( 7.017 5.684 -3.762) 9.782 4.785 ( -9.281 -0.656 -0.526) 9.319 4.910 ( 8.592 2.233 -9.584) 13.064 5.700 ( 3.192 5.828 9.083) 11.254 5.827 ( -2.976 2.956 -2.534) 4.901 6.733 ( 3.852 1.918 7.434) 8.589 6.809 ( -8.862 1.628 0.241) 9.013 7.368 ( 10.370 18.167 5.116) 21.535 7.522 ( -9.563 15.678 -9.180) 20.531 8.415 ( 5.144 10.624 3.255) 12.244 8.499 ( -2.672 9.260 -5.655) 11.174 8.878 ( 10.357 -10.393 12.845) 19.501 9.097 ( 0.214 -12.849 -5.659) 14.042 9.562 ( 7.292 1.064 11.351) 13.533 9.703 ( -20.031 -2.750 -2.339) 20.354 10.007 ( -4.228 6.345 -2.238) 7.947 10.179 ( 8.926 4.595 -13.916) 17.159 10.830 ( -0.187 -10.898 9.287) 14.320 11.075 ( 0.999 -16.520 -12.886) 20.975 11.530 ( -1.316 -2.353 3.276) 4.243 11.558 ( 1.861 -2.949 0.618) 3.542 11.965 ( 3.706 -0.521 5.330) 6.512 12.076 ( -3.961 -3.436 -4.908) 7.182 12.350 ( -0.213 0.152 6.292) 6.298 12.518 ( -1.296 -0.713 -9.297) 9.414 12.923 ( -1.435 -0.271 3.327) 3.633 13.029 ( -2.465 -3.781 -7.097) 8.411 13.345 ( 4.386 0.302 4.895) 6.580 13.446 ( -4.868 -1.683 -5.360) 7.433 14.464 ( -4.705 -21.892 5.979) 23.176 14.587 ( 2.848 -20.461 -5.664) 21.420 15.802 ( -1.447 3.576 1.495) 4.137 15.857 ( 0.066 2.771 -3.602) 4.545 16.154 ( -3.483 -4.533 0.845) 5.779 16.215 ( 0.760 -5.661 -4.755) 7.432 17.822 ( 3.001 13.170 19.123) 23.412 18.169 ( -0.268 7.899 -14.133) 16.193 19.551 ( -11.066 -0.791 6.830) 13.028 19.715 ( 16.952 -1.684 -8.683) 19.121 ======================= 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| 2.212 ( 6.452 5.279 -9.774) 12.846 2.279 ( 4.986 -3.382 6.072) 8.554 2.478 ( 3.810 3.089 -8.441) 9.763 2.644 ( 9.505 -1.857 3.821) 10.411 3.547 ( -10.444 7.582 5.970) 14.220 3.781 ( -2.372 7.018 -4.825) 8.841 3.928 ( -8.821 3.623 2.365) 9.825 4.210 ( 5.908 -4.720 -4.469) 8.784 4.497 ( -6.486 2.091 5.392) 8.690 4.598 ( -6.105 -0.600 -2.462) 6.611 4.772 ( 6.578 5.801 -5.392) 10.295 5.028 ( 9.344 7.002 -5.694) 12.991 5.692 ( -5.438 3.444 -5.387) 8.394 5.818 ( -0.121 5.898 4.647) 7.510 6.581 ( -14.691 3.476 -0.640) 15.110 6.823 ( -3.450 -1.664 7.339) 8.279 7.264 ( -7.949 15.851 -5.580) 18.589 7.651 ( 11.757 17.111 5.002) 21.355 8.357 ( -6.551 7.938 -6.589) 12.221 8.516 ( 1.985 13.493 2.636) 13.890 8.839 ( -4.963 -13.967 -13.029) 19.735 9.192 ( 7.546 -10.139 -3.220) 13.042 9.426 ( -10.118 3.854 2.334) 11.076 9.885 ( 4.711 1.159 15.548) 16.287 10.011 ( 10.959 -4.433 5.651) 13.103 10.271 ( 14.580 8.666 -11.980) 20.765 10.634 ( -14.510 -11.525 2.520) 18.701 11.233 ( 11.886 -13.333 -2.234) 18.001 11.522 ( -1.512 -2.417 0.495) 2.894 11.625 ( 5.252 -3.746 -1.611) 6.649 11.858 ( -9.898 0.661 -2.092) 10.138 12.083 ( -1.007 -7.011 1.058) 7.162 12.353 ( -3.603 0.598 4.032) 5.440 12.460 ( 0.398 0.880 0.164) 0.980 12.788 ( -8.038 -2.456 2.919) 8.898 13.162 ( 9.766 -3.291 3.551) 10.900 13.278 ( -5.387 -0.800 -2.546) 6.012 13.495 ( 4.257 0.065 3.631) 5.596 14.457 ( -3.022 -19.764 6.489) 21.020 14.625 ( 5.951 -22.452 -3.487) 23.487 15.819 ( 0.169 3.541 3.494) 4.978 15.846 ( 1.794 3.239 -0.879) 3.805 16.131 ( -2.198 -5.410 4.647) 7.463 16.218 ( 2.316 -4.459 -0.035) 5.025 17.968 ( -1.961 10.974 -10.583) 15.371 18.081 ( 5.057 10.077 5.506) 12.547 19.317 ( -19.060 3.745 2.329) 19.563 19.819 ( 6.519 -5.723 -12.188) 14.960 ======================= 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| 2.228 ( 0.764 2.541 -9.030) 9.412 2.312 ( 12.695 6.108 -14.577) 20.272 2.569 ( 7.885 0.627 -0.329) 7.917 2.883 ( 5.346 1.901 8.312) 10.064 3.350 ( -13.176 4.400 -2.456) 14.107 3.638 ( -8.382 2.055 0.899) 8.677 3.778 ( -6.624 7.540 -3.333) 10.576 4.210 ( 2.083 -4.875 -10.894) 12.115 4.339 ( -4.410 3.571 -7.282) 9.232 4.563 ( -0.455 1.127 0.302) 1.252 4.837 ( 3.203 5.610 -1.522) 6.637 5.107 ( 5.706 6.563 -3.955) 9.554 5.531 ( -4.557 1.566 -7.452) 8.874 5.771 ( -6.778 4.777 -1.489) 8.425 6.261 ( -17.866 3.985 -3.515) 18.640 6.767 ( -10.476 -4.579 6.458) 13.131 7.121 ( -3.975 11.475 -0.920) 12.179 7.823 ( 2.473 10.646 0.096) 10.930 8.082 ( -10.950 0.482 -12.423) 16.567 8.562 ( 1.154 16.693 1.759) 16.825 8.765 ( 2.897 -2.114 -0.692) 3.653 9.133 ( -1.016 -5.903 -10.334) 11.944 9.383 ( 1.339 5.204 2.287) 5.840 10.018 ( 3.542 -1.044 6.258) 7.266 10.416 ( 12.479 -0.404 -10.016) 16.007 10.457 ( 16.820 -9.003 11.554) 22.304 10.560 ( 3.841 -0.436 8.114) 8.988 11.324 ( -0.687 -8.998 -0.724) 9.053 11.472 ( -4.266 0.837 -0.067) 4.347 11.641 ( -3.622 -6.017 1.513) 7.185 11.742 ( 1.694 -7.000 -5.364) 8.980 12.013 ( -3.685 -6.790 0.947) 7.784 12.358 ( -1.552 3.031 2.355) 4.140 12.494 ( -0.817 4.192 7.196) 8.368 12.731 ( -3.656 -0.134 5.654) 6.735 13.168 ( -0.959 -0.872 -3.280) 3.527 13.379 ( 5.798 -2.325 4.412) 7.648 13.629 ( 4.341 -4.698 9.729) 11.644 14.470 ( -2.959 -20.049 5.685) 21.048 14.703 ( 5.451 -21.729 -3.174) 22.626 15.875 ( 1.169 2.816 4.591) 5.512 15.922 ( 5.236 6.744 4.315) 9.567 16.160 ( -0.781 -5.258 6.286) 8.232 16.294 ( 3.098 -3.306 4.530) 6.407 17.745 ( -3.515 15.017 -20.260) 25.462 18.212 ( 0.648 11.812 2.716) 12.138 18.962 ( -17.678 6.655 -0.301) 18.891 19.730 ( -1.228 -7.341 -13.411) 15.338 ======================= 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| 2.136 ( 1.657 5.862 -9.505) 11.290 2.452 ( 14.577 10.849 -12.227) 21.902 2.695 ( 8.143 -1.222 -3.554) 8.968 2.822 ( -19.694 7.680 6.434) 22.096 3.098 ( -12.478 0.803 3.295) 12.931 3.551 ( -4.529 6.261 -5.047) 9.230 3.662 ( 3.635 -2.294 -5.920) 7.316 4.082 ( -1.770 -2.476 -12.295) 12.666 4.242 ( 0.995 5.471 -6.681) 8.692 4.543 ( -1.189 3.243 -2.025) 4.004 4.844 ( -0.372 6.358 -0.442) 6.384 5.157 ( 1.291 3.014 -2.580) 4.173 5.390 ( -2.651 3.365 -6.834) 8.066 5.597 ( -8.727 4.895 -0.051) 10.007 5.897 ( -12.901 0.019 -7.878) 15.116 6.540 ( -18.568 -8.572 0.771) 20.466 7.115 ( 2.281 7.300 2.571) 8.068 7.726 ( -8.192 5.715 -7.514) 12.499 7.842 ( -2.708 0.932 -5.360) 6.077 8.513 ( -5.603 8.563 -9.067) 13.672 8.805 ( 0.405 1.139 4.821) 4.970 9.119 ( 3.790 4.144 2.716) 6.238 9.545 ( 11.939 3.462 4.467) 13.209 10.144 ( 4.817 -3.788 1.712) 6.363 10.554 ( 12.449 -4.276 -5.298) 14.189 10.671 ( 7.504 0.369 0.723) 7.548 10.894 ( 9.846 4.361 8.375) 13.643 11.212 ( -9.375 -3.592 1.448) 10.143 11.427 ( -1.687 2.291 2.376) 3.706 11.589 ( -1.822 -6.482 -0.994) 6.806 11.761 ( 2.057 -10.110 4.564) 11.282 11.991 ( 0.304 -6.826 -2.442) 7.256 12.338 ( -2.536 4.424 2.805) 5.820 12.527 ( -1.186 8.195 1.840) 8.482 12.775 ( -0.800 -1.370 9.717) 9.846 13.172 ( 3.923 -4.155 -1.908) 6.025 13.454 ( -0.983 -3.442 4.385) 5.661 13.850 ( 6.322 -6.603 12.036) 15.114 14.454 ( -4.395 -20.888 4.351) 21.785 14.731 ( 2.300 -21.193 -6.452) 22.272 15.958 ( 2.481 2.356 5.706) 6.653 16.116 ( 6.766 7.024 9.853) 13.864 16.231 ( 1.724 -3.963 6.586) 7.877 16.400 ( 2.317 -2.413 5.367) 6.324 17.439 ( -7.543 22.979 -18.423) 30.403 18.066 ( -9.747 22.645 -13.091) 27.914 18.809 ( -1.272 0.604 4.701) 4.907 19.529 ( -5.416 -7.352 -13.124) 15.988 ======================= 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| 2.127 ( 5.269 9.951 -4.016) 11.955 2.333 ( -17.745 6.959 -2.906) 19.281 2.704 ( 1.198 6.521 4.090) 7.790 2.802 ( 6.843 2.628 -4.749) 8.734 2.977 ( -1.703 0.552 5.146) 5.449 3.349 ( -7.122 5.699 -9.956) 13.503 3.707 ( 2.885 -4.069 -2.929) 5.784 3.910 ( -4.237 -2.670 -10.113) 11.285 4.233 ( -0.498 9.899 1.751) 10.065 4.456 ( -2.118 8.955 -7.869) 12.108 4.857 ( 0.104 4.008 4.412) 5.962 5.073 ( -3.572 1.731 -6.067) 7.250 5.302 ( -1.530 6.911 -0.266) 7.084 5.460 ( -6.000 4.180 -2.549) 7.744 5.806 ( 10.714 -7.342 -3.383) 13.422 6.165 ( -18.315 -9.702 -4.366) 21.181 7.228 ( 6.348 3.197 2.700) 7.603 7.497 ( -7.342 3.333 -7.731) 11.171 7.830 ( 2.606 3.954 2.881) 5.543 8.236 ( -8.724 3.409 -13.840) 16.712 8.919 ( 1.633 1.561 11.311) 11.534 9.188 ( 1.565 4.646 -2.332) 5.429 9.823 ( 6.120 2.403 12.716) 14.315 10.189 ( 0.334 -2.864 -3.747) 4.728 10.706 ( -4.332 -3.638 8.948) 10.586 10.807 ( 15.287 2.297 -10.671) 18.785 10.964 ( -2.822 5.319 2.152) 6.394 11.085 ( -3.357 1.520 -2.268) 4.327 11.470 ( 2.366 2.842 5.955) 7.010 11.609 ( 2.200 2.466 0.619) 3.362 11.845 ( 0.553 -8.576 3.299) 9.206 11.953 ( 0.810 -5.630 -5.804) 8.126 12.372 ( 3.049 2.752 3.998) 5.731 12.503 ( -2.372 8.200 -0.629) 8.559 12.852 ( -0.293 -4.448 9.277) 10.292 13.168 ( -2.311 -5.004 -6.970) 8.886 13.580 ( 6.225 -9.783 15.724) 19.537 14.038 ( 3.584 -5.200 2.512) 6.797 14.404 ( -4.969 -21.924 4.531) 22.932 14.652 ( -0.862 -19.266 -10.165) 21.800 16.084 ( 3.936 1.435 7.336) 8.448 16.258 ( 0.069 -2.662 4.882) 5.561 16.385 ( 5.264 0.173 5.998) 7.982 16.468 ( 0.550 -2.006 2.259) 3.071 17.190 ( -4.790 35.752 -1.986) 36.126 17.716 ( -6.582 29.220 -22.430) 37.420 18.913 ( 4.283 -2.985 6.766) 8.546 19.289 ( -6.287 -6.208 -11.895) 14.818 ======================= 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| 2.023 ( -14.336 6.836 6.020) 16.985 2.252 ( 4.077 13.513 4.549) 14.830 2.677 ( -6.571 -3.147 5.466) 9.109 2.851 ( 4.541 7.736 -8.549) 12.392 3.115 ( 2.324 3.867 1.582) 4.781 3.200 ( 9.183 2.828 -5.171) 10.912 3.678 ( -7.503 -3.759 3.796) 9.211 3.773 ( -1.550 -0.917 -1.711) 2.484 4.159 ( -12.033 15.974 8.745) 21.827 4.444 ( 8.568 8.181 -7.257) 13.892 4.909 ( -2.131 1.557 4.672) 5.366 4.987 ( 2.134 1.569 -2.509) 3.648 5.294 ( -1.683 2.329 1.612) 3.295 5.467 ( 13.049 6.093 -4.382) 15.054 5.831 ( -11.321 -7.998 -4.785) 14.663 6.111 ( 21.253 -9.550 0.140) 23.301 7.293 ( -6.038 2.643 -3.007) 7.245 7.405 ( 8.458 1.684 0.038) 8.624 7.955 ( -2.551 2.812 -1.911) 4.251 8.014 ( 5.300 5.292 0.495) 7.505 9.037 ( -2.675 0.878 8.885) 9.320 9.133 ( -0.436 4.578 -6.030) 7.584 9.923 ( -12.557 -0.139 11.336) 16.917 10.093 ( -3.476 0.727 -3.451) 4.952 10.536 ( -19.587 1.341 12.627) 23.342 10.896 ( -1.527 -1.878 -5.999) 6.469 11.031 ( 10.600 1.620 -1.851) 10.881 11.116 ( 11.579 4.432 -8.461) 15.011 11.571 ( -0.220 3.394 2.335) 4.125 11.613 ( 1.518 4.890 -3.080) 5.975 11.850 ( -0.709 -3.250 2.426) 4.116 11.936 ( 3.033 -9.009 -5.469) 10.966 12.428 ( -3.140 5.362 0.056) 6.214 12.468 ( 0.979 2.061 0.922) 2.461 12.975 ( 0.881 -7.966 8.129) 11.415 13.042 ( 0.658 -3.602 -5.435) 6.554 13.884 ( 4.474 -9.702 11.891) 15.986 13.938 ( -3.916 -8.817 -12.745) 15.985 14.437 ( -0.114 -17.318 9.956) 19.976 14.546 ( 0.792 -17.675 -8.116) 19.466 16.213 ( -2.340 -1.117 -0.623) 2.667 16.246 ( 2.897 -1.874 2.053) 4.015 16.452 ( -1.764 -1.298 -0.507) 2.248 16.482 ( 1.731 -1.247 0.041) 2.133 17.179 ( -10.336 34.363 10.049) 37.264 17.519 ( 13.954 37.129 -13.898) 42.029 19.007 ( -6.132 -6.359 2.414) 9.158 19.145 ( 5.935 -2.849 -2.978) 7.225 ======================= 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| 1.925 ( -6.784 7.088 11.068) 14.791 2.209 ( -17.239 14.538 10.171) 24.738 2.650 ( -0.964 -5.105 1.855) 5.516 2.939 ( 16.733 11.249 -4.801) 20.726 3.141 ( -1.582 -1.673 0.107) 2.306 3.420 ( 8.958 5.058 5.640) 11.731 3.598 ( 0.457 0.425 0.151) 0.642 3.801 ( -2.712 -1.282 12.362) 12.721 4.070 ( -7.573 17.165 10.484) 21.492 4.505 ( 2.414 5.237 -2.111) 6.141 4.892 ( 0.238 0.037 -0.449) 0.510 5.076 ( 2.723 -0.269 5.128) 5.812 5.331 ( 4.684 0.609 -1.052) 4.839 5.633 ( -0.964 -2.602 -4.346) 5.156 5.791 ( 18.941 5.388 1.950) 19.789 6.533 ( 21.878 -9.481 1.103) 23.869 7.166 ( -3.907 4.574 -2.258) 6.426 7.593 ( 9.581 0.404 3.404) 10.176 7.846 ( -0.108 3.366 -4.239) 5.414 8.277 ( 9.990 6.325 11.106) 16.222 8.928 ( -7.100 1.845 -4.575) 8.645 9.132 ( -1.405 6.364 1.732) 6.744 9.629 ( -18.486 3.495 -2.045) 18.924 10.036 ( -8.185 0.009 9.730) 12.714 10.360 ( -11.220 -0.381 8.530) 14.100 10.768 ( -4.987 -4.124 -5.403) 8.430 11.100 ( -3.647 5.817 -11.072) 13.028 11.222 ( 8.228 -4.105 0.014) 9.195 11.532 ( 1.024 3.523 -6.211) 7.213 11.607 ( 1.466 -3.969 -1.760) 4.582 11.872 ( -2.280 -14.411 -5.063) 15.444 11.938 ( 3.202 -3.116 1.834) 4.830 12.404 ( 1.948 5.251 -3.613) 6.665 12.473 ( -0.483 3.587 5.789) 6.827 12.976 ( 2.560 -0.878 -7.816) 8.271 13.099 ( -1.587 -4.637 5.243) 7.177 13.644 ( -5.070 -7.710 -13.855) 16.647 14.020 ( -0.830 -4.332 -2.281) 4.966 14.500 ( 0.937 -24.975 1.341) 25.029 14.579 ( 2.450 -12.997 5.505) 14.326 16.085 ( -3.836 2.048 -6.342) 7.689 16.295 ( -2.508 0.446 -4.839) 5.469 16.348 ( -3.915 -2.710 -4.969) 6.882 16.493 ( 0.068 -2.086 -2.845) 3.528 17.105 ( -3.216 31.032 12.345) 33.551 17.862 ( 22.128 31.927 4.400) 39.094 18.883 ( -3.251 -3.271 -1.798) 4.950 19.315 ( 6.909 -4.082 6.694) 10.450 ======================= 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| 1.942 ( -10.148 6.736 15.601) 19.793 2.029 ( -8.624 10.345 12.861) 18.622 2.637 ( 0.049 -3.488 -4.612) 5.782 2.973 ( -13.611 -3.224 0.210) 13.989 3.279 ( 15.625 12.022 5.531) 20.475 3.623 ( 8.431 3.873 4.643) 10.375 3.707 ( 8.030 5.678 -0.701) 9.860 3.900 ( -3.175 -0.936 16.661) 16.986 4.119 ( 0.068 14.294 13.453) 19.629 4.513 ( 0.738 4.854 0.212) 4.914 4.911 ( 1.762 -0.590 -0.816) 2.030 5.102 ( -2.865 -2.485 -2.570) 4.581 5.400 ( 3.795 -0.132 2.460) 4.524 5.693 ( 6.224 -1.282 4.459) 7.763 6.190 ( 19.375 7.628 3.200) 21.067 6.847 ( 10.706 -6.365 -0.702) 12.475 7.118 ( 0.325 8.838 -0.334) 8.850 7.825 ( 6.831 4.683 1.529) 8.422 7.860 ( 6.044 -2.581 5.534) 8.592 8.527 ( 5.380 12.436 6.688) 15.111 8.756 ( -7.586 2.040 -1.568) 8.010 9.065 ( -5.174 5.751 -1.728) 7.927 9.382 ( -5.432 4.915 2.224) 7.656 10.001 ( -4.120 1.220 6.915) 8.141 10.295 ( -1.483 -2.519 0.346) 2.944 10.607 ( -9.278 -9.804 -3.402) 13.920 10.766 ( -15.490 -2.096 -10.942) 19.080 11.346 ( 4.452 -7.072 -1.003) 8.417 11.494 ( -0.224 -3.454 -2.400) 4.212 11.661 ( 5.600 0.272 0.049) 5.607 11.724 ( -7.061 -16.511 -4.865) 18.605 12.016 ( 4.269 -4.019 0.445) 5.880 12.412 ( 1.007 5.868 -3.205) 6.762 12.575 ( 4.849 7.308 2.654) 9.163 12.887 ( 0.341 1.409 -10.691) 10.788 13.105 ( -0.723 -2.675 3.211) 4.242 13.474 ( -4.878 -4.692 -6.210) 9.185 13.870 ( -5.720 -4.470 -11.830) 13.880 14.524 ( -0.642 -25.387 1.625) 25.447 14.641 ( -0.415 -14.113 2.124) 14.278 15.969 ( -2.618 2.219 -4.894) 5.977 16.063 ( -8.675 8.481 -8.740) 14.952 16.285 ( -0.228 -5.046 -5.544) 7.500 16.418 ( -2.631 -3.208 -6.538) 7.743 17.296 ( 2.096 21.880 21.704) 30.890 18.240 ( 12.275 16.405 -0.656) 20.500 18.959 ( 14.921 4.344 1.086) 15.579 19.495 ( 3.550 -4.306 8.783) 10.405 ======================= 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| 1.917 ( -5.873 6.071 15.256) 17.438 2.145 ( 0.862 3.781 16.637) 17.083 2.504 ( -7.350 -2.878 -8.660) 11.718 2.759 ( -5.708 -2.312 -4.091) 7.394 3.547 ( 4.847 12.955 7.933) 15.945 3.773 ( 6.635 6.488 -4.991) 10.537 3.874 ( 8.563 2.728 6.983) 11.381 3.997 ( -4.421 -1.124 14.666) 15.359 4.310 ( 2.591 9.984 15.155) 18.332 4.576 ( 7.156 5.628 -0.768) 9.137 4.905 ( -2.258 -0.801 -0.996) 2.595 4.970 ( -3.119 -2.256 -8.485) 9.317 5.536 ( 4.333 2.460 8.220) 9.612 5.832 ( 2.682 0.744 3.083) 4.154 6.520 ( 12.027 5.953 5.054) 14.339 6.912 ( -1.464 -2.107 -0.718) 2.664 7.179 ( 5.481 14.695 2.284) 15.850 7.764 ( -6.418 9.256 -5.402) 12.492 8.192 ( 13.001 1.125 9.598) 16.199 8.578 ( 0.964 17.285 -2.524) 17.495 8.660 ( -2.064 -3.571 2.647) 4.901 9.045 ( 0.641 -6.714 7.722) 10.253 9.416 ( 1.051 5.561 6.566) 8.668 10.024 ( 1.944 6.572 -2.266) 7.219 10.172 ( -18.211 -2.363 -6.547) 19.496 10.277 ( -4.611 -2.954 -12.464) 13.614 10.630 ( 4.617 -16.560 3.375) 17.519 11.303 ( -5.873 -10.433 -6.907) 13.822 11.501 ( 0.367 -5.331 2.635) 5.958 11.572 ( -4.958 -9.731 0.644) 10.940 11.804 ( 7.952 2.411 2.364) 8.639 12.106 ( 4.109 -6.276 0.064) 7.502 12.351 ( -3.511 4.707 -1.135) 5.981 12.613 ( 2.030 4.202 -8.806) 9.967 12.861 ( 4.267 1.835 -3.266) 5.679 13.166 ( 1.926 2.143 4.081) 4.996 13.290 ( -7.492 -6.145 -4.838) 10.830 13.634 ( -6.792 -4.310 -9.802) 12.680 14.502 ( -3.935 -24.982 2.900) 25.456 14.620 ( -0.541 -15.916 -3.222) 16.248 15.861 ( -4.757 4.897 -2.588) 7.302 15.906 ( -1.056 4.067 -4.756) 6.346 16.221 ( -1.412 -4.653 -4.008) 6.301 16.292 ( -2.697 -4.839 -6.778) 8.754 17.563 ( 2.382 16.928 21.967) 27.835 18.285 ( 0.815 7.226 -8.298) 11.033 19.368 ( 24.785 4.346 -1.814) 25.228 19.599 ( -2.299 -3.302 8.446) 9.356 ======================= 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| 2.100 ( 2.821 2.074 6.242) 7.157 2.213 ( 2.599 -4.485 -2.961) 5.970 2.446 ( 0.758 4.887 5.375) 7.304 2.587 ( -0.589 -2.746 -6.730) 7.293 3.822 ( -6.089 7.746 6.739) 11.937 3.927 ( 1.772 2.160 -2.814) 3.966 4.021 ( -1.509 0.902 4.908) 5.214 4.057 ( 3.766 -0.658 2.380) 4.503 4.584 ( -5.797 5.970 10.168) 13.139 4.751 ( -13.734 -2.013 8.315) 16.180 4.824 ( 11.087 4.287 -11.233) 16.354 4.933 ( 14.407 -0.265 -8.794) 16.881 5.833 ( 4.615 6.242 7.798) 11.003 5.900 ( -2.198 3.176 1.798) 4.260 6.767 ( -0.570 1.656 6.120) 6.366 6.820 ( -5.348 -0.314 1.224) 5.495 7.775 ( 14.131 19.719 4.657) 24.702 7.878 ( -8.816 19.060 -4.999) 21.587 8.476 ( 14.410 -11.524 10.676) 21.318 8.681 ( -6.685 -1.419 -7.478) 10.131 8.814 ( -1.709 -0.942 0.950) 2.170 8.887 ( 2.572 14.204 -6.243) 15.727 9.453 ( -0.464 -11.461 9.597) 14.956 9.608 ( -10.314 -8.714 -5.619) 14.624 10.127 ( -13.506 6.262 6.303) 16.166 10.275 ( 8.311 3.040 -7.739) 11.756 10.658 ( 13.510 -5.472 -0.146) 14.577 10.739 ( -2.292 -13.140 -7.125) 15.122 11.496 ( 0.326 -0.662 5.225) 5.277 11.529 ( 1.478 -0.708 2.496) 2.986 11.890 ( 0.449 -5.330 -0.624) 5.385 11.957 ( -1.547 -7.443 -6.419) 9.950 12.428 ( 0.378 7.495 5.198) 9.129 12.584 ( -5.084 6.461 -8.732) 11.993 12.828 ( 6.391 -7.622 1.647) 10.082 12.917 ( -12.550 -5.872 -6.495) 15.303 13.427 ( 3.176 5.541 3.865) 7.465 13.468 ( -0.556 2.779 -0.554) 2.888 14.076 ( -1.616 -14.231 4.238) 14.936 14.193 ( -0.773 -17.002 -6.587) 18.250 15.865 ( -1.891 2.954 0.380) 3.528 15.904 ( -0.143 2.054 -3.192) 3.798 16.061 ( -3.347 -4.210 -0.398) 5.393 16.098 ( 0.723 -5.336 -3.850) 6.620 18.077 ( 1.366 11.031 12.864) 17.001 18.282 ( -0.532 2.369 -6.463) 6.904 19.542 ( -4.827 0.383 3.063) 5.730 19.656 ( 10.192 -3.794 -7.380) 13.143 ======================= 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| 2.236 ( 7.507 -0.357 0.263) 7.520 2.285 ( 11.016 1.041 -9.609) 14.655 2.533 ( 3.453 1.992 -5.319) 6.647 2.598 ( 8.587 -1.936 5.385) 10.319 3.709 ( -13.422 7.503 6.349) 16.635 3.859 ( -8.270 0.941 0.492) 8.338 4.002 ( -3.131 2.825 -0.581) 4.257 4.119 ( 2.697 -3.952 -2.121) 5.234 4.546 ( -7.599 2.353 5.835) 9.865 4.588 ( -8.562 -0.243 4.079) 9.487 4.914 ( 11.140 7.386 -11.078) 17.360 5.107 ( 13.229 0.276 -10.002) 16.587 5.798 ( -6.220 6.414 -5.115) 10.295 5.919 ( -0.708 2.819 0.492) 2.948 6.654 ( -13.073 3.793 2.623) 13.862 6.785 ( -6.245 -2.123 5.950) 8.883 7.615 ( -11.006 17.792 -7.651) 22.276 8.030 ( 8.876 18.193 -1.283) 20.283 8.357 ( -12.526 -11.888 -14.760) 22.718 8.722 ( 4.265 0.517 3.149) 5.327 8.851 ( 4.548 18.068 3.806) 19.016 8.973 ( 8.769 -3.012 -4.755) 10.420 9.442 ( -3.035 -4.224 4.983) 7.203 9.735 ( 12.880 -17.421 11.694) 24.620 9.980 ( -11.050 3.070 9.792) 15.080 10.248 ( -4.521 -8.591 -1.273) 9.791 10.619 ( 9.051 8.433 -12.040) 17.263 10.970 ( 15.044 -10.553 -4.840) 19.003 11.517 ( -0.643 0.884 -0.475) 1.192 11.560 ( 1.456 -2.188 -3.093) 4.059 11.822 ( -6.456 -3.765 -0.825) 7.519 11.901 ( -2.673 -8.733 2.998) 9.612 12.413 ( -4.188 3.287 1.489) 5.528 12.543 ( -0.286 6.340 4.727) 7.914 12.686 ( -6.996 -3.474 3.453) 8.540 13.032 ( 8.088 -8.274 8.811) 14.543 13.371 ( -3.866 7.765 -3.086) 9.207 13.530 ( 2.782 1.731 -1.054) 3.442 14.096 ( -0.991 -13.979 2.765) 14.284 14.200 ( 4.687 -17.746 0.952) 18.379 15.861 ( -0.248 1.957 2.560) 3.232 15.921 ( 3.213 3.024 1.045) 4.534 16.026 ( -1.937 -4.184 3.579) 5.836 16.120 ( 2.941 -4.893 0.945) 5.786 18.174 ( -0.854 8.328 -4.908) 9.704 18.245 ( 3.661 5.345 3.551) 7.388 19.402 ( -12.150 4.715 0.239) 13.035 19.676 ( 1.918 -7.785 -9.670) 12.561 ======================= 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| 2.297 ( 3.175 4.688 -6.266) 8.445 2.448 ( 18.700 3.414 -11.436) 22.184 2.585 ( 5.534 3.277 -2.672) 6.965 2.861 ( 12.688 -4.093 3.121) 13.692 3.461 ( -18.964 6.006 3.086) 20.130 3.647 ( -15.513 -1.534 3.832) 16.052 3.895 ( -5.311 4.481 -5.190) 8.673 4.099 ( 0.258 -5.544 -7.560) 9.378 4.437 ( -4.624 4.947 -0.028) 6.772 4.557 ( -2.811 -1.189 5.359) 6.167 4.988 ( 8.239 8.149 -9.816) 15.187 5.197 ( 8.194 0.672 -10.439) 13.287 5.612 ( -5.307 6.491 -8.473) 11.920 5.820 ( -5.245 -0.443 -7.208) 8.926 6.376 ( -19.516 6.917 0.559) 20.713 6.658 ( -13.996 -5.966 4.000) 15.731 7.376 ( -6.970 12.990 -4.930) 15.545 7.927 ( -8.478 -10.498 -12.789) 18.592 8.119 ( -2.180 14.004 -8.083) 16.316 8.726 ( -4.263 -4.216 -4.314) 7.387 8.940 ( 3.531 12.746 -3.294) 13.630 9.148 ( 7.865 15.540 11.808) 21.042 9.488 ( 2.138 3.277 2.981) 4.919 9.857 ( -4.380 -16.533 6.563) 18.319 10.155 ( 10.806 -9.506 6.737) 15.891 10.322 ( 15.089 -10.227 8.322) 20.038 10.746 ( 14.550 11.726 -7.476) 20.127 11.121 ( 7.278 -8.504 -5.362) 12.411 11.470 ( -1.392 -1.162 -4.912) 5.236 11.522 ( -2.337 -5.115 -2.151) 6.021 11.696 ( -5.793 1.598 0.971) 6.087 11.879 ( -3.788 -5.983 4.258) 8.263 12.402 ( -1.348 1.730 4.692) 5.179 12.585 ( -0.700 -3.463 12.036) 12.543 12.716 ( -1.152 8.285 7.382) 11.156 13.238 ( 1.420 -1.834 -2.245) 3.228 13.290 ( 2.521 0.723 6.181) 6.714 13.550 ( 0.010 -3.758 1.197) 3.944 14.108 ( -0.875 -11.884 2.463) 12.168 14.309 ( 3.929 -16.501 2.589) 17.158 15.908 ( 1.368 1.843 4.458) 5.014 16.039 ( 5.664 2.020 5.100) 7.885 16.058 ( -0.059 -2.320 6.343) 6.754 16.216 ( 3.882 -4.142 4.916) 7.509 18.064 ( -0.716 14.702 -11.452) 18.649 18.363 ( 4.007 2.308 3.118) 5.577 19.126 ( -15.492 9.203 -3.066) 18.278 19.549 ( -3.996 -10.074 -10.694) 15.226 ======================= 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| 2.290 ( 4.763 8.561 -8.290) 12.834 2.608 ( 2.906 -4.916 -4.479) 7.257 2.709 ( 17.014 11.609 -10.603) 23.166 2.954 ( -11.567 2.902 6.980) 13.818 3.135 ( -15.927 4.183 2.316) 16.630 3.507 ( 1.674 -8.747 -0.874) 8.949 3.710 ( -6.753 6.015 -8.907) 12.693 3.981 ( -2.868 -6.160 -10.354) 12.385 4.398 ( -0.587 7.297 1.553) 7.484 4.563 ( -2.018 -0.976 4.283) 4.834 5.005 ( 3.761 8.125 -8.349) 12.242 5.196 ( 1.971 -0.142 -8.711) 8.933 5.482 ( 0.898 5.794 -7.814) 9.769 5.649 ( -2.896 -0.353 -7.724) 8.257 5.972 ( -22.108 7.169 -2.490) 23.375 6.349 ( -20.620 -9.736 -1.018) 22.826 7.279 ( -0.300 8.758 -1.395) 8.874 7.701 ( -3.307 -9.069 -9.732) 13.708 7.961 ( -6.539 11.980 -5.237) 14.618 8.492 ( -10.357 -8.933 -11.946) 18.159 8.992 ( 0.606 16.661 7.355) 18.223 9.347 ( 3.519 14.739 4.301) 15.752 9.631 ( 7.390 3.314 6.922) 10.654 9.916 ( 4.722 -17.427 2.254) 18.196 10.412 ( 12.775 -4.382 4.721) 14.307 10.692 ( 13.455 -5.042 -0.063) 14.369 11.018 ( 14.923 7.170 5.501) 17.446 11.139 ( -0.517 0.332 -2.117) 2.205 11.369 ( -2.651 -6.571 -4.797) 8.556 11.476 ( -0.770 -6.616 4.241) 7.897 11.675 ( 0.893 2.417 2.121) 3.338 11.867 ( 0.243 -5.337 0.370) 5.356 12.436 ( -1.746 5.289 5.711) 7.977 12.693 ( -2.969 -4.829 8.593) 10.294 12.760 ( 0.842 13.344 4.954) 14.259 13.162 ( 0.530 1.761 -6.383) 6.642 13.403 ( -2.087 -1.994 2.388) 3.746 13.638 ( 3.555 -15.481 15.572) 22.244 14.102 ( -2.062 -8.441 0.945) 8.740 14.367 ( 1.078 -14.957 -0.959) 15.027 15.996 ( 2.331 1.997 5.947) 6.692 16.126 ( 0.596 -3.906 6.646) 7.732 16.225 ( 6.430 2.489 6.989) 9.817 16.338 ( 3.041 -3.257 5.617) 7.170 17.937 ( -0.940 23.167 -9.192) 24.941 18.417 ( 0.670 7.818 -4.454) 9.023 18.843 ( -9.499 5.455 -2.406) 11.215 19.336 ( -6.633 -11.387 -10.994) 17.162 ======================= 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| 2.319 ( 6.402 8.205 -5.789) 11.909 2.434 ( -16.676 2.918 0.339) 16.933 2.790 ( -13.225 0.694 7.733) 15.336 2.825 ( 6.543 -0.761 -5.400) 8.517 3.087 ( 10.005 10.958 -0.090) 14.839 3.477 ( -7.530 6.802 -10.982) 14.952 3.584 ( 4.097 -7.883 -1.102) 8.953 3.808 ( -3.979 -6.644 -9.825) 12.510 4.439 ( 0.689 8.445 5.089) 9.884 4.573 ( -0.315 2.159 1.173) 2.477 4.969 ( -0.408 6.201 -3.151) 6.967 5.100 ( -2.370 0.412 -7.472) 7.850 5.455 ( 2.526 7.246 -5.100) 9.214 5.571 ( -10.424 6.539 -0.632) 12.322 5.673 ( 6.817 -5.010 -5.772) 10.242 5.954 ( -17.461 -10.462 -4.468) 20.840 7.321 ( 4.542 5.976 0.983) 7.571 7.558 ( -3.664 0.262 -8.686) 9.431 7.863 ( -0.215 1.960 1.752) 2.638 8.178 ( -9.641 -7.644 -11.089) 16.563 9.105 ( 0.234 15.629 11.747) 19.553 9.388 ( 1.885 13.303 -4.988) 14.332 9.799 ( -2.219 -6.789 13.933) 15.657 10.024 ( 7.118 -12.485 -4.817) 15.157 10.636 ( -0.860 -0.148 11.152) 11.186 10.837 ( 8.100 -1.382 -6.796) 10.663 11.054 ( -5.644 3.121 1.243) 6.568 11.122 ( 1.124 2.118 -4.851) 5.411 11.492 ( 9.458 0.131 6.497) 11.475 11.642 ( 11.635 -4.504 4.585) 13.292 11.720 ( 0.913 1.683 0.674) 2.030 11.866 ( -0.807 -3.077 -2.337) 3.947 12.461 ( -0.840 5.543 6.072) 8.264 12.662 ( -4.740 2.563 2.350) 5.879 12.785 ( -1.106 2.330 0.130) 2.582 13.062 ( -3.578 -5.197 -11.085) 12.755 13.482 ( 4.801 0.229 15.662) 16.383 13.907 ( 6.002 -14.319 15.922) 22.238 14.027 ( -4.205 -5.652 -5.786) 9.117 14.325 ( -1.295 -13.538 -6.212) 14.951 16.107 ( 2.783 1.286 6.204) 6.920 16.196 ( 0.309 -2.934 4.302) 5.216 16.378 ( 3.659 -0.417 3.824) 5.310 16.420 ( 0.907 -2.382 2.756) 3.754 17.880 ( -1.158 29.982 2.420) 30.101 18.264 ( -2.755 22.552 -15.987) 27.781 18.797 ( 0.744 -7.897 4.907) 9.327 19.108 ( -4.980 -11.604 -11.278) 16.931 ======================= 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| 2.167 ( -13.712 7.404 8.084) 17.555 2.433 ( 5.754 0.265 1.434) 5.936 2.652 ( -9.900 4.694 8.174) 13.669 2.937 ( 10.043 -1.752 -4.691) 11.223 3.234 ( -4.416 7.997 -11.255) 14.495 3.306 ( 10.469 8.435 3.040) 13.784 3.585 ( -5.097 -5.577 2.235) 7.879 3.695 ( 0.997 -6.243 -3.173) 7.073 4.457 ( -5.920 11.387 5.646) 14.021 4.585 ( 3.255 4.497 -2.723) 6.183 4.951 ( -2.946 2.378 3.093) 4.889 5.009 ( 0.078 0.329 -2.141) 2.168 5.376 ( -4.786 5.528 1.648) 7.496 5.605 ( 15.359 7.033 -4.269) 17.424 5.665 ( -8.596 -7.901 -4.321) 12.450 5.915 ( 19.737 -9.001 -0.784) 21.707 7.381 ( -4.373 5.436 -3.183) 7.668 7.459 ( 5.886 3.010 -0.895) 6.671 7.935 ( -2.859 -3.260 -1.499) 4.588 8.008 ( 7.048 -4.616 1.670) 8.589 9.183 ( -5.952 12.372 9.822) 16.881 9.351 ( 3.091 15.254 -7.272) 17.179 9.813 ( -11.549 -10.264 13.426) 20.469 10.028 ( -1.030 -8.610 -5.923) 10.502 10.565 ( -16.940 3.158 13.066) 21.625 10.823 ( -3.919 -5.603 -0.658) 6.869 11.066 ( 6.461 3.235 -5.048) 8.815 11.189 ( 11.752 1.415 -7.420) 13.971 11.648 ( -2.370 2.937 -1.402) 4.026 11.668 ( -3.492 2.152 -1.983) 4.556 11.756 ( -4.487 -5.668 -3.387) 7.983 11.832 ( 4.290 -2.021 0.560) 4.775 12.513 ( -3.204 4.006 9.492) 10.789 12.589 ( -2.410 7.450 -3.494) 8.574 12.829 ( 4.490 -5.292 7.654) 10.332 12.949 ( 4.609 -5.288 -9.422) 11.746 13.759 ( 0.646 -1.365 7.809) 7.954 13.851 ( 1.714 0.402 -7.324) 7.533 14.120 ( -0.420 -13.699 7.337) 15.546 14.229 ( 2.503 -13.613 -7.142) 15.575 16.193 ( -1.118 -0.488 0.305) 1.258 16.213 ( 1.667 -1.230 1.285) 2.438 16.422 ( -1.409 -1.259 -0.606) 1.985 16.444 ( 1.420 -2.004 0.183) 2.463 17.847 ( -11.800 29.681 8.702) 33.105 18.187 ( 13.602 26.605 -12.210) 32.279 18.819 ( -7.072 -11.534 5.399) 14.567 19.025 ( 8.631 -9.207 -6.082) 14.010 ======================= 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| 2.091 ( -6.286 9.120 10.780) 15.457 2.472 ( -12.046 -2.748 7.227) 14.314 2.549 ( -5.217 9.219 6.100) 12.223 3.026 ( -3.070 -6.775 1.353) 7.560 3.215 ( 14.857 11.465 -6.451) 19.844 3.521 ( 6.607 5.272 7.283) 11.157 3.564 ( 8.621 -4.088 -5.289) 10.909 3.745 ( -0.519 -4.032 9.973) 10.770 4.403 ( -3.935 13.408 3.971) 14.527 4.602 ( 1.248 3.012 -2.075) 3.865 4.917 ( -2.590 2.430 2.597) 4.400 5.048 ( -0.398 -2.432 5.169) 5.726 5.374 ( 1.139 3.355 2.149) 4.144 5.546 ( -1.089 -4.646 -0.019) 4.772 5.947 ( 22.749 8.616 0.149) 24.327 6.327 ( 23.180 -10.083 0.970) 25.297 7.283 ( -1.711 6.674 -1.696) 7.096 7.568 ( 3.838 -4.207 2.744) 6.321 7.916 ( 4.071 5.544 -0.409) 6.891 8.267 ( 11.380 -6.253 9.048) 15.826 9.083 ( -8.746 12.827 1.050) 15.560 9.378 ( 3.559 14.498 -1.784) 15.035 9.661 ( -15.097 -2.347 6.352) 16.546 9.921 ( -5.508 -9.481 0.405) 10.972 10.374 ( -15.461 2.775 8.178) 17.709 10.705 ( -6.653 -3.450 -5.350) 9.208 11.091 ( -0.609 -5.060 -1.268) 5.252 11.247 ( -9.016 6.835 -9.331) 14.665 11.395 ( -3.011 -11.559 -6.136) 13.428 11.551 ( -4.201 -7.342 -2.935) 8.953 11.722 ( 0.218 2.525 -1.799) 3.108 11.883 ( 3.295 -3.025 -1.165) 4.622 12.546 ( 2.446 8.138 -4.917) 9.818 12.617 ( 3.197 9.446 10.976) 14.830 12.934 ( 3.606 -3.128 -8.486) 9.737 13.027 ( 3.008 -3.496 6.955) 8.345 13.561 ( -4.183 0.243 -12.424) 13.111 13.953 ( -3.551 -7.073 -11.128) 13.656 14.060 ( 3.354 -11.775 3.852) 12.835 14.326 ( 3.804 -11.830 2.606) 12.697 16.115 ( -2.784 1.581 -5.107) 6.028 16.232 ( 0.061 -3.982 -2.908) 4.931 16.347 ( -4.270 1.014 -4.367) 6.191 16.437 ( -0.839 -2.993 -3.407) 4.612 17.735 ( -7.784 28.683 9.648) 31.247 18.367 ( 8.249 12.559 -1.880) 15.143 18.802 ( 5.332 -0.827 3.090) 6.218 19.195 ( 10.113 -7.930 1.729) 12.968 ======================= 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| 2.102 ( -6.502 8.503 11.305) 15.569 2.260 ( -13.619 9.472 7.372) 18.154 2.554 ( -1.398 -2.526 1.092) 3.086 2.860 ( -14.138 -7.885 3.071) 16.477 3.516 ( 17.946 10.491 -0.615) 20.797 3.695 ( 7.845 3.032 3.956) 9.294 3.769 ( 12.420 0.308 -0.727) 12.445 3.856 ( -1.132 -2.918 13.956) 14.302 4.418 ( 0.857 12.898 5.237) 13.947 4.608 ( 2.126 3.456 -1.633) 4.374 4.906 ( -1.915 0.221 2.120) 2.865 5.033 ( -6.241 -4.113 2.785) 7.976 5.447 ( 4.011 4.427 5.723) 8.273 5.645 ( 5.684 -3.346 7.898) 10.290 6.359 ( 19.210 8.523 1.998) 21.111 6.698 ( 14.900 -7.849 0.216) 16.843 7.305 ( 4.261 9.198 2.100) 10.352 7.709 ( 7.656 -9.751 7.489) 14.484 8.013 ( 3.398 12.088 2.535) 12.810 8.550 ( 8.186 -8.302 9.736) 15.190 8.928 ( -8.669 14.073 0.525) 16.537 9.390 ( -5.185 21.876 -9.852) 24.546 9.463 ( -5.632 0.386 6.152) 8.349 9.886 ( 1.819 -9.753 2.212) 10.165 10.213 ( -3.865 -4.363 0.109) 5.830 10.474 ( -13.682 -4.712 -5.210) 15.381 10.746 ( -21.340 -0.501 -8.403) 22.941 11.087 ( -3.146 -15.505 -1.537) 15.896 11.392 ( -0.876 -3.575 2.141) 4.259 11.474 ( -3.102 -6.691 1.686) 7.565 11.755 ( 6.578 5.909 -3.639) 9.562 11.950 ( 5.515 -3.008 -2.590) 6.795 12.522 ( 0.114 5.835 -6.311) 8.595 12.790 ( 5.682 8.893 2.478) 10.840 12.848 ( -0.566 -1.894 -12.001) 12.163 13.099 ( 1.027 1.118 5.193) 5.411 13.416 ( -4.888 -0.815 -4.055) 6.403 13.717 ( -5.552 -12.348 -13.483) 19.107 14.127 ( 0.215 -9.002 0.681) 9.030 14.365 ( 0.066 -12.862 -2.125) 13.037 16.010 ( -2.619 2.321 -5.298) 6.349 16.155 ( -5.004 -1.872 -5.646) 7.773 16.200 ( -2.496 0.634 -7.051) 7.506 16.341 ( -3.722 -3.956 -6.642) 8.580 17.777 ( -2.289 23.135 15.054) 27.697 18.394 ( -1.735 -2.128 -0.151) 2.750 19.089 ( 19.736 8.191 1.311) 21.409 19.392 ( 7.766 -5.646 3.793) 10.323 ======================= 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| 2.057 ( -7.536 6.869 10.225) 14.441 2.202 ( -2.430 1.304 5.725) 6.355 2.480 ( -5.715 1.019 -0.852) 5.868 2.679 ( -5.409 -5.401 -1.730) 7.837 3.771 ( 6.925 8.405 3.357) 11.396 3.859 ( 6.795 2.184 0.358) 7.146 3.940 ( 5.859 2.364 2.365) 6.747 3.967 ( -1.256 -1.200 10.999) 11.135 4.526 ( 0.679 10.235 9.893) 14.251 4.681 ( 10.754 3.952 -5.402) 12.667 4.874 ( -2.291 -1.999 -0.780) 3.139 4.913 ( -7.850 -3.376 1.593) 8.692 5.632 ( 6.448 6.335 9.746) 13.292 5.830 ( 3.874 -1.440 7.998) 9.002 6.643 ( 8.762 5.966 3.504) 11.164 6.851 ( 2.433 -3.789 0.015) 4.503 7.485 ( 11.162 14.239 4.776) 18.712 7.960 ( 3.760 2.766 6.237) 7.791 8.109 ( 8.929 0.588 6.636) 11.140 8.747 ( 4.162 -11.935 6.381) 14.160 8.799 ( -5.534 14.723 0.270) 15.731 9.082 ( -10.884 20.129 -11.210) 25.481 9.446 ( -5.806 -4.907 6.301) 9.874 9.969 ( -10.249 -13.059 -9.834) 19.295 10.135 ( 7.204 0.899 -5.902) 9.356 10.268 ( 3.294 -0.362 -3.007) 4.475 10.440 ( -6.814 0.943 4.219) 8.070 10.947 ( -9.113 -19.600 -3.136) 21.841 11.424 ( 0.170 -1.721 6.055) 6.297 11.480 ( -0.273 -2.243 4.309) 4.865 11.849 ( 6.079 2.174 -2.874) 7.067 12.001 ( 3.025 -4.316 -4.182) 6.728 12.438 ( -2.202 4.553 -3.367) 6.075 12.719 ( 0.194 -1.636 -10.611) 10.738 12.818 ( 0.844 2.793 -7.277) 7.840 13.191 ( -6.322 -4.850 -2.392) 8.320 13.272 ( 1.916 6.802 3.418) 7.850 13.535 ( -4.441 -5.350 -3.206) 7.657 14.101 ( -2.680 -11.692 0.218) 11.998 14.297 ( -2.362 -14.884 -5.886) 16.179 15.920 ( -2.232 2.522 -3.440) 4.814 15.991 ( -4.696 3.081 -5.157) 7.625 16.120 ( -0.531 -4.363 -5.150) 6.771 16.193 ( -4.443 -4.581 -6.145) 8.860 17.918 ( 0.080 16.692 15.389) 22.704 18.347 ( -1.752 -1.700 -2.385) 3.412 19.439 ( 17.257 2.528 -2.179) 17.576 19.532 ( 3.330 -2.897 3.190) 5.446 ======================= 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| 2.143 ( 2.624 -2.439 -0.044) 3.583 2.143 ( 2.624 2.439 -0.044) 3.583 2.528 ( 0.062 -3.197 -0.057) 3.198 2.528 ( 0.062 3.197 -0.057) 3.198 3.920 ( -2.198 -2.195 2.632) 4.072 3.920 ( -2.198 2.195 2.632) 4.072 4.047 ( 0.633 -1.136 2.594) 2.901 4.047 ( 0.633 1.136 2.594) 2.901 4.689 ( -10.933 -4.059 8.947) 14.699 4.689 ( -10.933 4.059 8.947) 14.699 4.899 ( 14.334 -2.874 -10.035) 17.732 4.899 ( 14.334 2.874 -10.035) 17.732 5.920 ( 1.742 -1.684 5.395) 5.914 5.920 ( 1.742 1.684 5.395) 5.914 6.801 ( -3.153 -1.465 3.660) 5.048 6.801 ( -3.153 1.465 3.660) 5.048 8.134 ( 13.334 -13.544 8.217) 20.707 8.134 ( 13.334 13.544 8.217) 20.707 8.333 ( -5.295 -18.064 -6.910) 20.052 8.333 ( -5.295 18.064 -6.910) 20.052 9.089 ( -1.133 -13.369 4.266) 14.079 9.089 ( -1.133 13.369 4.266) 14.079 9.326 ( -4.508 -15.035 -7.041) 17.204 9.326 ( -4.508 15.035 -7.041) 17.204 10.252 ( -9.559 -4.885 2.924) 11.126 10.252 ( -9.559 4.885 2.924) 11.126 10.605 ( 12.377 -0.893 -4.226) 13.109 10.605 ( 12.377 0.893 -4.226) 13.109 11.508 ( 0.945 -1.364 5.049) 5.314 11.508 ( 0.945 1.364 5.049) 5.314 11.843 ( -1.707 -1.946 -6.385) 6.890 11.843 ( -1.707 1.946 -6.385) 6.890 12.609 ( 4.071 -8.140 2.618) 9.471 12.609 ( 4.071 8.140 2.618) 9.471 12.781 ( -9.542 -6.409 -5.618) 12.794 12.781 ( -9.542 6.409 -5.618) 12.794 13.507 ( 2.390 -0.672 2.717) 3.681 13.507 ( 2.390 0.672 2.717) 3.681 13.954 ( -1.888 -3.880 -2.966) 5.236 13.954 ( -1.888 3.880 -2.966) 5.236 15.921 ( -1.502 -1.620 -1.026) 2.436 15.921 ( -1.502 1.620 -1.026) 2.436 16.018 ( -0.902 -1.463 -2.641) 3.151 16.018 ( -0.902 1.463 -2.641) 3.151 18.251 ( -0.097 -5.330 3.895) 6.602 18.251 ( -0.097 5.330 3.895) 6.602 19.579 ( 2.705 -3.131 -3.037) 5.132 19.579 ( 2.705 3.131 -3.037) 5.132 ======================= 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| 2.261 ( 11.563 -2.236 -4.465) 12.596 2.261 ( 11.563 2.236 -4.465) 12.596 2.567 ( 4.930 -1.454 -0.076) 5.141 2.567 ( 4.930 1.454 -0.076) 5.141 3.830 ( -11.839 -3.802 4.117) 13.098 3.830 ( -11.839 3.802 4.117) 13.098 4.051 ( -0.746 -2.643 -1.078) 2.950 4.051 ( -0.746 2.643 -1.078) 2.950 4.580 ( -8.102 -0.837 5.377) 9.760 4.580 ( -8.102 0.837 5.377) 9.760 5.050 ( 13.352 -5.287 -11.637) 18.484 5.050 ( 13.352 5.287 -11.637) 18.484 5.911 ( -3.825 -3.511 -3.194) 6.096 5.911 ( -3.825 3.511 -3.194) 6.096 6.730 ( -9.519 -3.323 4.626) 11.093 6.730 ( -9.519 3.323 4.626) 11.093 7.981 ( -13.242 -17.413 -11.843) 24.876 7.981 ( -13.242 17.413 -11.843) 24.876 8.460 ( 9.192 -18.133 -1.442) 20.381 8.460 ( 9.192 18.133 -1.442) 20.381 9.200 ( 7.858 -8.951 1.423) 11.996 9.200 ( 7.858 8.951 1.423) 11.996 9.309 ( 2.585 -15.768 8.289) 18.001 9.309 ( 2.585 15.768 8.289) 18.001 10.086 ( -11.063 -6.757 6.807) 14.642 10.086 ( -11.063 6.757 6.807) 14.642 10.794 ( 15.541 -7.869 -10.840) 20.517 10.794 ( 15.541 7.869 -10.840) 20.517 11.535 ( -0.300 -0.718 -2.321) 2.448 11.535 ( -0.300 0.718 -2.321) 2.448 11.782 ( -2.710 -1.770 3.250) 4.587 11.782 ( -2.710 1.770 3.250) 4.587 12.504 ( -8.579 -5.333 -0.212) 10.103 12.504 ( -8.579 5.333 -0.212) 10.103 12.828 ( 4.799 -11.239 9.430) 15.436 12.828 ( 4.799 11.239 9.430) 15.436 13.516 ( -0.526 -4.305 -3.605) 5.640 13.516 ( -0.526 4.305 -3.605) 5.640 13.964 ( 2.414 -2.994 2.982) 4.867 13.964 ( 2.414 2.994 2.982) 4.867 15.913 ( -0.113 -2.983 2.449) 3.861 15.913 ( -0.113 2.983 2.449) 3.861 16.027 ( 2.404 -3.736 1.728) 4.767 16.027 ( 2.404 3.736 1.728) 4.767 18.283 ( 1.224 -1.822 0.331) 2.219 18.283 ( 1.224 1.822 0.331) 2.219 19.521 ( -4.446 -6.920 -4.872) 9.560 19.521 ( -4.446 6.920 -4.872) 9.560 ======================= 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| 2.405 ( 9.130 -5.062 -6.482) 12.288 2.405 ( 9.130 5.062 -6.482) 12.288 2.729 ( 13.617 -8.090 -2.242) 15.997 2.729 ( 13.617 8.090 -2.242) 15.997 3.578 ( -19.992 -4.935 5.029) 21.198 3.578 ( -19.992 4.935 5.029) 21.198 3.989 ( -2.405 -5.019 -5.938) 8.138 3.989 ( -2.405 5.019 -5.938) 8.138 4.518 ( -3.839 -2.822 3.831) 6.114 4.518 ( -3.839 2.822 3.831) 6.114 5.137 ( 9.083 -5.728 -11.645) 15.841 5.137 ( 9.083 5.728 -11.645) 15.841 5.753 ( -5.090 -5.815 -9.193) 12.009 5.753 ( -5.090 5.815 -9.193) 12.009 6.523 ( -17.539 -7.054 2.259) 19.039 6.523 ( -17.539 7.054 2.259) 19.039 7.654 ( -8.705 -14.003 -10.178) 19.377 7.654 ( -8.705 14.003 -10.178) 19.377 8.456 ( -2.809 -16.914 -8.631) 19.195 8.456 ( -2.809 16.914 -8.631) 19.195 9.331 ( 4.663 -19.713 1.390) 20.304 9.331 ( 4.663 19.713 1.390) 20.304 9.507 ( 2.249 -13.362 12.997) 18.775 9.507 ( 2.249 13.362 12.997) 18.775 10.116 ( 9.616 -5.837 7.119) 13.312 10.116 ( 9.616 5.837 7.119) 13.312 10.962 ( 14.719 -8.673 -9.318) 19.460 10.962 ( 14.719 8.673 -9.318) 19.460 11.458 ( -3.888 -1.099 -4.567) 6.098 11.458 ( -3.888 1.099 -4.567) 6.098 11.767 ( -4.223 -4.803 5.122) 8.194 11.767 ( -4.223 4.803 5.122) 8.194 12.466 ( -1.013 -4.946 9.160) 10.460 12.466 ( -1.013 4.946 9.160) 10.460 12.990 ( 2.420 -15.070 9.069) 17.754 12.990 ( 2.420 15.070 9.069) 17.754 13.443 ( -2.392 -7.119 -4.740) 8.881 13.443 ( -2.392 7.119 -4.740) 8.881 14.057 ( 2.520 -6.434 4.656) 8.332 14.057 ( 2.520 6.434 4.656) 8.332 15.963 ( 1.182 -3.569 5.046) 6.293 15.963 ( 1.182 3.569 5.046) 6.293 16.131 ( 4.504 -4.042 5.400) 8.111 16.131 ( 4.504 4.042 5.400) 8.111 18.304 ( 2.346 -7.818 -2.433) 8.517 18.304 ( 2.346 7.818 -2.433) 8.517 19.332 ( -9.186 -10.626 -6.791) 15.602 19.332 ( -9.186 10.626 -6.791) 15.602 ======================= 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| 2.466 ( 5.691 -8.156 -7.642) 12.542 2.466 ( 5.691 8.156 -7.642) 12.542 2.911 ( 2.779 -6.578 -1.775) 7.359 2.911 ( 2.779 6.578 -1.775) 7.359 3.296 ( -9.232 -10.445 2.468) 14.157 3.296 ( -9.232 10.445 2.468) 14.157 3.845 ( -4.773 -6.837 -9.012) 12.277 3.845 ( -4.773 6.837 -9.012) 12.277 4.512 ( -1.466 -3.928 4.594) 6.219 4.512 ( -1.466 3.928 4.594) 6.219 5.143 ( 3.567 -4.880 -9.979) 11.667 5.143 ( 3.567 4.880 -9.979) 11.667 5.597 ( -0.188 -4.504 -9.735) 10.728 5.597 ( -0.188 4.504 -9.735) 10.728 6.150 ( -22.561 -9.447 -1.375) 24.498 6.150 ( -22.561 9.447 -1.375) 24.498 7.481 ( -1.610 -10.875 -5.340) 12.222 7.481 ( -1.610 10.875 -5.340) 12.222 8.240 ( -9.235 -14.073 -9.347) 19.254 8.240 ( -9.235 14.073 -9.347) 19.254 9.405 ( -0.978 -19.390 8.272) 21.103 9.405 ( -0.978 19.390 8.272) 21.103 9.644 ( 5.984 -5.753 1.020) 8.363 9.644 ( 5.984 5.753 1.020) 8.363 10.479 ( 16.014 -10.530 8.025) 20.778 10.479 ( 16.014 10.530 8.025) 20.778 11.158 ( 14.256 -4.963 -6.750) 16.536 11.158 ( 14.256 4.963 -6.750) 16.536 11.323 ( -6.680 -5.964 2.655) 9.341 11.323 ( -6.680 5.964 2.655) 9.341 11.763 ( 0.363 -4.944 2.068) 5.371 11.763 ( 0.363 4.944 2.068) 5.371 12.561 ( -1.291 -6.743 9.212) 11.489 12.561 ( -1.291 6.743 9.212) 11.489 13.082 ( 0.610 -14.035 -2.269) 14.230 13.082 ( 0.610 14.035 -2.269) 14.230 13.385 ( -1.825 -3.155 8.564) 9.307 13.385 ( -1.825 3.155 8.564) 9.307 14.122 ( 0.505 -8.012 1.572) 8.181 14.122 ( 0.505 8.012 1.572) 8.181 16.050 ( 1.815 -3.274 6.179) 7.225 16.050 ( 1.815 3.274 6.179) 7.225 16.276 ( 4.233 -2.696 6.035) 7.849 16.276 ( 4.233 2.696 6.035) 7.849 18.327 ( 3.287 -13.699 -2.523) 14.312 18.327 ( 3.287 13.699 -2.523) 14.312 19.071 ( -10.031 -13.816 -8.737) 19.179 19.071 ( -10.031 13.816 -8.737) 19.179 ======================= 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| 2.440 ( -3.533 -2.886 -3.194) 5.569 2.440 ( -3.533 2.886 -3.194) 5.569 2.795 ( -5.868 -1.043 1.224) 6.084 2.795 ( -5.868 1.043 1.224) 6.084 3.350 ( 7.930 -12.911 -1.365) 15.213 3.350 ( 7.930 12.911 -1.365) 15.213 3.652 ( -5.670 -8.242 -9.029) 13.476 3.652 ( -5.670 8.242 -9.029) 13.476 4.558 ( 0.702 -3.279 5.156) 6.151 4.558 ( 0.702 3.279 5.156) 6.151 5.073 ( -1.431 -3.301 -6.689) 7.596 5.073 ( -1.431 3.301 -6.689) 7.596 5.574 ( 7.287 -4.355 -6.710) 10.821 5.574 ( 7.287 4.355 -6.710) 10.821 5.747 ( -17.110 -9.351 -2.762) 19.694 5.747 ( -17.110 9.351 -2.762) 19.694 7.466 ( 2.861 -7.392 -2.026) 8.181 7.466 ( 2.861 7.392 -2.026) 8.181 7.990 ( -7.590 -9.259 -6.407) 13.579 7.990 ( -7.590 9.259 -6.407) 13.579 9.470 ( -3.087 -16.112 10.509) 19.483 9.470 ( -3.087 16.112 10.509) 19.483 9.738 ( 5.368 -12.833 -3.682) 14.390 9.738 ( 5.368 12.833 -3.682) 14.390 10.730 ( 1.876 -7.354 6.276) 9.848 10.730 ( 1.876 7.354 6.276) 9.848 11.120 ( -1.286 -2.625 -5.464) 6.197 11.120 ( -1.286 2.625 -5.464) 6.197 11.531 ( 13.648 -4.131 6.689) 15.751 11.531 ( 13.648 4.131 6.689) 15.751 11.799 ( 1.379 -3.826 -1.230) 4.249 11.799 ( 1.379 3.826 -1.230) 4.249 12.584 ( -5.057 -6.014 8.603) 11.651 12.584 ( -5.057 6.014 8.603) 11.651 12.939 ( -3.306 -7.553 -12.882) 15.295 12.939 ( -3.306 7.553 -12.882) 15.295 13.596 ( 5.640 -11.245 18.778) 22.602 13.596 ( 5.640 11.245 18.778) 22.602 14.094 ( -1.553 -8.389 -5.213) 9.998 14.094 ( -1.553 8.389 -5.213) 9.998 16.143 ( 1.649 -2.224 5.191) 5.883 16.143 ( 1.649 2.224 5.191) 5.883 16.383 ( 2.009 -1.048 3.067) 3.814 16.383 ( 2.009 1.048 3.067) 3.814 18.374 ( 1.660 -15.955 1.619) 16.123 18.374 ( 1.660 15.955 1.619) 16.123 18.824 ( -4.999 -14.234 -10.193) 18.207 18.824 ( -4.999 14.234 -10.193) 18.207 ======================= 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| 2.325 ( -8.575 -7.606 7.076) 13.470 2.325 ( -8.575 7.606 7.076) 13.470 2.817 ( 4.969 -8.396 -0.476) 9.768 2.817 ( 4.969 8.396 -0.476) 9.768 3.406 ( -1.277 -6.359 -4.235) 7.746 3.406 ( -1.277 6.359 -4.235) 7.746 3.536 ( 2.589 -7.480 -0.771) 7.953 3.536 ( 2.589 7.480 -0.771) 7.953 4.603 ( -0.639 -2.951 1.790) 3.510 4.603 ( -0.639 2.951 1.790) 3.510 4.996 ( -2.294 -1.595 0.312) 2.811 4.996 ( -2.294 1.595 0.312) 2.811 5.510 ( -6.571 -7.207 -1.592) 9.882 5.510 ( -6.571 7.207 -1.592) 9.882 5.750 ( 17.434 -7.269 -2.582) 19.065 5.750 ( 17.434 7.269 -2.582) 19.065 7.476 ( -0.388 -2.476 -2.919) 3.847 7.476 ( -0.388 2.476 -2.919) 3.847 7.912 ( 3.432 -2.542 1.049) 4.398 7.912 ( 3.432 2.542 1.049) 4.398 9.475 ( -8.025 -13.088 9.784) 18.205 9.475 ( -8.025 13.088 9.784) 18.205 9.758 ( 1.936 -14.543 -5.385) 15.628 9.758 ( 1.936 14.543 -5.385) 15.628 10.681 ( -12.218 -7.306 8.596) 16.630 10.681 ( -12.218 7.306 8.596) 16.630 11.156 ( 9.576 -4.158 -6.990) 12.564 11.156 ( 9.576 4.158 -6.990) 12.564 11.676 ( -8.950 -2.090 -6.278) 11.130 11.676 ( -8.950 2.090 -6.278) 11.130 11.760 ( 2.342 -4.736 2.117) 5.692 11.760 ( 2.342 4.736 2.117) 5.692 12.617 ( -1.336 -4.817 11.172) 12.239 12.617 ( -1.336 4.817 11.172) 12.239 12.834 ( 5.636 -5.367 -9.119) 11.988 12.834 ( 5.636 5.367 -9.119) 11.988 13.833 ( -0.425 -6.779 6.392) 9.327 13.833 ( -0.425 6.779 6.392) 9.327 14.000 ( 2.929 -6.898 -5.824) 9.491 14.000 ( 2.929 6.898 -5.824) 9.491 16.195 ( 0.136 -0.567 0.811) 0.999 16.195 ( 0.136 0.567 0.811) 0.999 16.414 ( 0.133 -0.633 -0.204) 0.679 16.414 ( 0.133 0.633 -0.204) 0.679 18.353 ( -7.963 -16.792 4.011) 19.013 18.353 ( -7.963 16.792 4.011) 19.013 18.772 ( 9.524 -13.246 -5.990) 17.380 18.772 ( 9.524 13.246 -5.990) 17.380 ======================= 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| 2.291 ( -5.121 -9.960 8.947) 14.335 2.291 ( -5.121 9.960 8.947) 14.335 2.823 ( -9.478 -12.386 5.658) 16.591 2.823 ( -9.478 12.386 5.658) 16.591 3.429 ( 14.959 -8.787 -9.098) 19.590 3.429 ( 14.959 8.787 -9.098) 19.590 3.639 ( 2.302 -5.915 9.074) 11.073 3.639 ( 2.302 5.915 9.074) 11.073 4.590 ( -0.023 -4.673 -1.176) 4.819 4.590 ( -0.023 4.673 -1.176) 4.819 4.984 ( -3.318 -3.569 5.104) 7.057 4.984 ( -3.318 3.569 5.104) 7.057 5.455 ( -0.131 -4.258 2.436) 4.908 5.455 ( -0.131 4.258 2.436) 4.908 6.129 ( 23.349 -9.145 0.582) 25.083 6.129 ( 23.349 9.145 0.582) 25.083 7.434 ( -0.285 -7.658 -0.685) 7.694 7.434 ( -0.285 7.658 -0.685) 7.694 8.087 ( 9.525 -9.871 5.462) 14.765 8.087 ( 9.525 9.871 5.462) 14.765 9.391 ( -10.785 -14.575 8.619) 20.076 9.391 ( -10.785 14.575 8.619) 20.076 9.719 ( 1.115 -10.580 -5.246) 11.862 9.719 ( 1.115 10.580 -5.246) 11.862 10.526 ( -11.989 -11.403 2.922) 16.802 10.526 ( -11.989 11.403 2.922) 16.802 11.150 ( -10.394 -9.615 -5.887) 15.334 11.150 ( -10.394 9.615 -5.887) 15.334 11.399 ( -4.425 -6.918 -4.116) 9.186 11.399 ( -4.425 6.918 -4.116) 9.186 11.807 ( 3.323 -4.296 -1.733) 5.701 11.807 ( 3.323 4.296 -1.733) 5.701 12.700 ( 3.106 -4.706 -1.338) 5.795 12.700 ( 3.106 4.706 -1.338) 5.795 12.931 ( 5.090 -5.005 4.825) 8.616 12.931 ( 5.090 5.005 4.825) 8.616 13.675 ( -5.220 -11.034 -13.734) 18.374 13.675 ( -5.220 11.034 -13.734) 18.374 14.111 ( 4.315 -8.323 2.130) 9.613 14.111 ( 4.315 8.323 2.130) 9.613 16.161 ( -1.696 -2.884 -3.938) 5.167 16.161 ( -1.696 2.884 -3.938) 5.167 16.381 ( -2.037 -2.300 -3.679) 4.793 16.381 ( -2.037 2.300 -3.679) 4.793 18.238 ( -8.070 -19.064 5.471) 21.413 18.238 ( -8.070 19.064 5.471) 21.413 18.981 ( 14.860 -12.582 -0.354) 19.475 18.981 ( 14.860 12.582 -0.354) 19.475 ======================= 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| 2.268 ( -7.086 -6.697 6.553) 11.747 2.268 ( -7.086 6.697 6.553) 11.747 2.661 ( -11.177 -10.537 4.686) 16.060 2.661 ( -11.177 10.537 4.686) 16.060 3.687 ( 17.601 -5.392 -5.137) 19.112 3.687 ( 17.601 5.392 -5.137) 19.112 3.788 ( 2.321 -3.153 11.549) 12.195 3.788 ( 2.321 3.153 11.549) 12.195 4.604 ( 3.701 -4.686 -1.974) 6.289 4.604 ( 3.701 4.686 -1.974) 6.289 4.945 ( -7.120 -3.777 5.658) 9.847 4.945 ( -7.120 3.777 5.658) 9.847 5.555 ( 4.856 -5.313 8.265) 10.960 5.555 ( 4.856 5.313 8.265) 10.960 6.532 ( 17.711 -8.242 1.283) 19.577 6.532 ( 17.711 8.242 1.283) 19.577 7.500 ( 6.209 -9.964 4.572) 12.600 7.500 ( 6.209 9.964 4.572) 12.600 8.298 ( 5.744 -14.520 6.394) 16.873 8.298 ( 5.744 14.520 6.394) 16.873 9.269 ( -11.307 -16.730 7.578) 21.568 9.269 ( -11.307 16.730 7.578) 21.568 9.743 ( 7.831 -8.057 -8.497) 14.087 9.743 ( 7.831 8.057 -8.497) 14.087 10.258 ( -13.078 -11.395 -6.557) 18.544 10.258 ( -13.078 11.395 -6.557) 18.544 10.832 ( -16.101 -8.929 1.590) 18.480 10.832 ( -16.101 8.929 1.590) 18.480 11.386 ( 0.097 -2.444 2.337) 3.383 11.386 ( 0.097 2.444 2.337) 3.383 11.871 ( 6.499 -4.910 -4.322) 9.221 11.871 ( 6.499 4.910 -4.322) 9.221 12.670 ( -0.340 -8.322 -9.514) 12.645 12.670 ( -0.340 8.322 -9.514) 12.645 13.052 ( 1.928 -8.138 4.236) 9.375 13.052 ( 1.928 8.138 4.236) 9.375 13.466 ( -3.818 -7.611 -8.460) 12.003 13.466 ( -3.818 7.611 -8.460) 12.003 14.142 ( -0.185 -7.617 -3.185) 8.258 14.142 ( -0.185 7.617 -3.185) 8.258 16.073 ( -2.312 -3.845 -5.258) 6.912 16.073 ( -2.312 3.845 -5.258) 6.912 16.263 ( -4.516 -3.600 -6.847) 8.957 16.263 ( -4.516 3.600 -6.847) 8.957 18.192 ( -4.563 -16.184 7.737) 18.509 18.192 ( -4.563 16.184 7.737) 18.509 19.258 ( 14.407 -7.572 0.459) 16.282 19.258 ( 14.407 7.572 0.459) 16.282 ======================= 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| 2.174 ( -7.346 -4.016 3.942) 9.254 2.174 ( -7.346 4.016 3.942) 9.254 2.556 ( -3.926 -5.772 1.307) 7.102 2.556 ( -3.926 5.772 1.307) 7.102 3.873 ( 4.377 -1.570 2.380) 5.224 3.873 ( 4.377 1.570 2.380) 5.224 3.956 ( 5.515 -1.075 4.821) 7.404 3.956 ( 5.515 1.075 4.821) 7.404 4.691 ( 6.557 -4.454 -0.595) 7.949 4.691 ( 6.557 4.454 -0.595) 7.949 4.854 ( -6.631 -1.179 3.090) 7.410 4.854 ( -6.631 1.179 3.090) 7.410 5.761 ( 5.859 -5.302 10.209) 12.909 5.761 ( 5.859 5.302 10.209) 12.909 6.759 ( 5.560 -5.126 1.815) 7.777 6.759 ( 5.560 5.126 1.815) 7.777 7.761 ( 14.339 -12.955 8.612) 21.157 7.761 ( 14.339 12.955 8.612) 21.157 8.404 ( -0.078 -18.519 3.675) 18.880 8.404 ( -0.078 18.519 3.675) 18.880 9.147 ( -8.649 -16.677 4.987) 19.436 9.147 ( -8.649 16.677 4.987) 19.436 9.594 ( -9.573 -21.659 -15.657) 28.388 9.594 ( -9.573 21.659 -15.657) 28.388 10.208 ( 12.732 -4.562 -4.828) 14.361 10.208 ( 12.732 4.562 -4.828) 14.361 10.603 ( -13.278 -12.954 6.271) 19.581 10.603 ( -13.278 12.954 6.271) 19.581 11.434 ( 0.554 -2.064 5.704) 6.092 11.434 ( 0.554 2.064 5.704) 6.092 11.913 ( 3.041 -4.069 -6.872) 8.545 11.913 ( 3.041 4.069 -6.872) 8.545 12.565 ( 0.421 -7.800 -6.031) 9.869 12.565 ( 0.421 7.800 -6.031) 9.869 13.015 ( -5.052 -11.093 -7.762) 14.450 13.015 ( -5.052 11.093 -7.762) 14.450 13.419 ( 0.792 -6.376 4.700) 7.960 13.419 ( 0.792 6.376 4.700) 7.960 14.058 ( -3.256 -6.582 -5.626) 9.251 14.058 ( -3.256 6.582 -5.626) 9.251 15.982 ( -2.176 -3.268 -4.035) 5.630 15.982 ( -2.176 3.268 -4.035) 5.630 16.110 ( -4.030 -3.153 -6.092) 7.956 16.110 ( -4.030 3.153 -6.092) 7.956 18.212 ( -1.856 -11.107 6.904) 13.208 18.212 ( -1.856 11.107 6.904) 13.208 19.483 ( 9.868 -2.058 -1.067) 10.137 19.483 ( 9.868 2.058 -1.067) 10.137 =================== 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 4020.512 8236.028 6787.097 0.000 -144.692 0.000 3/31104 20.0 693.904 916.727 899.952 0.000 144.281 0.000 3/31104 30.0 250.523 294.715 290.414 0.000 51.691 0.000 3/31104 40.0 130.292 143.602 142.613 0.000 24.808 0.000 3/31104 50.0 81.692 86.601 86.889 0.000 14.538 0.000 3/31104 60.0 57.039 58.924 59.781 0.000 9.613 0.000 3/31104 70.0 42.622 43.199 44.306 0.000 6.862 0.000 3/31104 80.0 33.373 33.323 34.511 0.000 5.159 0.000 3/31104 90.0 27.052 26.691 27.867 0.000 4.028 0.000 3/31104 100.0 22.530 22.020 23.137 0.000 3.240 0.000 3/31104 110.0 19.180 18.607 19.644 0.000 2.670 0.000 3/31104 120.0 16.626 16.037 16.989 0.000 2.247 0.000 3/31104 130.0 14.631 14.053 14.920 0.000 1.924 0.000 3/31104 140.0 13.042 12.487 13.275 0.000 1.673 0.000 3/31104 150.0 11.752 11.226 11.943 0.000 1.474 0.000 3/31104 160.0 10.688 10.194 10.847 0.000 1.314 0.000 3/31104 170.0 9.799 9.336 9.933 0.000 1.183 0.000 3/31104 180.0 9.046 8.614 9.160 0.000 1.075 0.000 3/31104 190.0 8.401 7.998 8.499 0.000 0.984 0.000 3/31104 200.0 7.843 7.467 7.929 0.000 0.907 0.000 3/31104 210.0 7.357 7.006 7.432 0.000 0.841 0.000 3/31104 220.0 6.928 6.600 6.995 0.000 0.783 0.000 3/31104 230.0 6.549 6.241 6.609 0.000 0.734 0.000 3/31104 240.0 6.210 5.921 6.264 0.000 0.690 0.000 3/31104 250.0 5.906 5.635 5.955 0.000 0.651 0.000 3/31104 260.0 5.631 5.376 5.677 0.000 0.616 0.000 3/31104 270.0 5.382 5.141 5.424 0.000 0.585 0.000 3/31104 280.0 5.155 4.927 5.194 0.000 0.557 0.000 3/31104 290.0 4.947 4.731 4.983 0.000 0.532 0.000 3/31104 300.0 4.756 4.551 4.790 0.000 0.509 0.000 3/31104 310.0 4.580 4.385 4.611 0.000 0.488 0.000 3/31104 320.0 4.416 4.231 4.446 0.000 0.469 0.000 3/31104 330.0 4.265 4.088 4.293 0.000 0.451 0.000 3/31104 340.0 4.124 3.955 4.151 0.000 0.435 0.000 3/31104 350.0 3.992 3.831 4.018 0.000 0.419 0.000 3/31104 360.0 3.869 3.715 3.894 0.000 0.405 0.000 3/31104 370.0 3.754 3.605 3.777 0.000 0.392 0.000 3/31104 380.0 3.645 3.503 3.668 0.000 0.380 0.000 3/31104 390.0 3.543 3.406 3.565 0.000 0.368 0.000 3/31104 400.0 3.447 3.315 3.468 0.000 0.358 0.000 3/31104 410.0 3.355 3.228 3.376 0.000 0.347 0.000 3/31104 420.0 3.269 3.146 3.289 0.000 0.338 0.000 3/31104 430.0 3.187 3.069 3.206 0.000 0.329 0.000 3/31104 440.0 3.110 2.995 3.128 0.000 0.320 0.000 3/31104 450.0 3.036 2.925 3.054 0.000 0.312 0.000 3/31104 460.0 2.965 2.858 2.983 0.000 0.305 0.000 3/31104 470.0 2.898 2.794 2.915 0.000 0.297 0.000 3/31104 480.0 2.834 2.733 2.851 0.000 0.290 0.000 3/31104 490.0 2.773 2.675 2.789 0.000 0.284 0.000 3/31104 500.0 2.714 2.619 2.730 0.000 0.277 0.000 3/31104 510.0 2.658 2.565 2.674 0.000 0.271 0.000 3/31104 520.0 2.605 2.514 2.620 0.000 0.266 0.000 3/31104 530.0 2.553 2.465 2.568 0.000 0.260 0.000 3/31104 540.0 2.504 2.418 2.518 0.000 0.255 0.000 3/31104 550.0 2.456 2.372 2.470 0.000 0.250 0.000 3/31104 560.0 2.410 2.329 2.424 0.000 0.245 0.000 3/31104 570.0 2.366 2.286 2.380 0.000 0.240 0.000 3/31104 580.0 2.324 2.246 2.337 0.000 0.236 0.000 3/31104 590.0 2.283 2.207 2.296 0.000 0.232 0.000 3/31104 600.0 2.243 2.169 2.256 0.000 0.227 0.000 3/31104 610.0 2.205 2.132 2.218 0.000 0.223 0.000 3/31104 620.0 2.169 2.097 2.181 0.000 0.220 0.000 3/31104 630.0 2.133 2.063 2.145 0.000 0.216 0.000 3/31104 640.0 2.099 2.030 2.111 0.000 0.212 0.000 3/31104 650.0 2.065 1.998 2.077 0.000 0.209 0.000 3/31104 660.0 2.033 1.967 2.045 0.000 0.205 0.000 3/31104 670.0 2.002 1.937 2.013 0.000 0.202 0.000 3/31104 680.0 1.971 1.908 1.983 0.000 0.199 0.000 3/31104 690.0 1.942 1.880 1.953 0.000 0.196 0.000 3/31104 700.0 1.914 1.852 1.925 0.000 0.193 0.000 3/31104 710.0 1.886 1.826 1.897 0.000 0.190 0.000 3/31104 720.0 1.859 1.800 1.870 0.000 0.187 0.000 3/31104 730.0 1.833 1.775 1.844 0.000 0.185 0.000 3/31104 740.0 1.808 1.751 1.818 0.000 0.182 0.000 3/31104 750.0 1.783 1.727 1.793 0.000 0.180 0.000 3/31104 760.0 1.759 1.704 1.769 0.000 0.177 0.000 3/31104 770.0 1.736 1.681 1.746 0.000 0.175 0.000 3/31104 780.0 1.713 1.659 1.723 0.000 0.172 0.000 3/31104 790.0 1.691 1.638 1.701 0.000 0.170 0.000 3/31104 800.0 1.669 1.617 1.679 0.000 0.168 0.000 3/31104 810.0 1.648 1.597 1.658 0.000 0.166 0.000 3/31104 820.0 1.628 1.577 1.637 0.000 0.164 0.000 3/31104 830.0 1.608 1.558 1.617 0.000 0.162 0.000 3/31104 840.0 1.588 1.539 1.598 0.000 0.160 0.000 3/31104 850.0 1.569 1.521 1.578 0.000 0.158 0.000 3/31104 860.0 1.551 1.503 1.560 0.000 0.156 0.000 3/31104 870.0 1.533 1.486 1.542 0.000 0.154 0.000 3/31104 880.0 1.515 1.469 1.524 0.000 0.152 0.000 3/31104 890.0 1.498 1.452 1.506 0.000 0.150 0.000 3/31104 900.0 1.481 1.436 1.489 0.000 0.149 0.000 3/31104 910.0 1.464 1.420 1.473 0.000 0.147 0.000 3/31104 920.0 1.448 1.404 1.457 0.000 0.145 0.000 3/31104 930.0 1.432 1.389 1.441 0.000 0.144 0.000 3/31104 940.0 1.417 1.374 1.425 0.000 0.142 0.000 3/31104 950.0 1.402 1.359 1.410 0.000 0.141 0.000 3/31104 960.0 1.387 1.345 1.395 0.000 0.139 0.000 3/31104 970.0 1.372 1.331 1.380 0.000 0.138 0.000 3/31104 980.0 1.358 1.317 1.366 0.000 0.136 0.000 3/31104 990.0 1.344 1.304 1.352 0.000 0.135 0.000 3/31104 1000.0 1.331 1.291 1.339 0.000 0.133 0.000 3/31104 Thermal conductivity related properties were written into "kappa-m989.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 00:12:59]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|