----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 05:45:19]------------------------- 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 3 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/m (11) Number of symmetry operations in supercell: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.172692100838123 0.000000000000000 0.000000000000000 b 0.000000000000000 3.843663830000000 0.000000000000000 c -2.600836225512723 0.000000000000000 6.211216230110679 Atomic positions (fractional): *1 H 0.19625219386034 0.25000000000000 0.81179660171412 1.008 2 H 0.80374780613966 0.75000000000000 0.18820339828588 1.008 *3 H 0.61653770528552 0.25000000000000 0.27545045276768 1.008 4 H 0.38346229471448 0.75000000000000 0.72454954723232 1.008 *5 O 0.40003204909452 0.75000000000000 0.58541892856119 15.999 6 O 0.59996795090548 0.25000000000000 0.41458107143881 15.999 *7 O 0.92767585196709 0.75000000000000 0.33345443705105 15.999 8 O 0.07232414803291 0.25000000000000 0.66654556294895 15.999 *9 Cl 0.74800957060352 0.25000000000000 0.94614469116751 35.453 10 Cl 0.25199042939648 0.75000000000000 0.05385530883249 35.453 *11 Nd 0.80954630750177 0.75000000000000 0.63332393664453 144.242 12 Nd 0.19045369249823 0.25000000000000 0.36667606335547 144.242 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.172692100838123 0.000000000000000 0.000000000000000 b 0.000000000000000 3.843663830000000 0.000000000000000 c -2.600836225512723 0.000000000000000 6.211216230110679 Atomic positions (fractional): *1 H 0.19625219386034 0.25000000000000 0.81179660171412 1.008 > 1 2 H 0.80374780613966 0.75000000000000 0.18820339828588 1.008 > 2 *3 H 0.61653770528552 0.25000000000000 0.27545045276768 1.008 > 3 4 H 0.38346229471448 0.75000000000000 0.72454954723232 1.008 > 4 *5 O 0.40003204909452 0.75000000000000 0.58541892856119 15.999 > 5 6 O 0.59996795090548 0.25000000000000 0.41458107143881 15.999 > 6 *7 O 0.92767585196709 0.75000000000000 0.33345443705105 15.999 > 7 8 O 0.07232414803291 0.25000000000000 0.66654556294895 15.999 > 8 *9 Cl 0.74800957060352 0.25000000000000 0.94614469116751 35.453 > 9 10 Cl 0.25199042939648 0.75000000000000 0.05385530883249 35.453 > 10 *11 Nd 0.80954630750177 0.75000000000000 0.63332393664453 144.242 > 11 12 Nd 0.19045369249823 0.25000000000000 0.36667606335547 144.242 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.345384201676247 0.000000000000000 0.000000000000000 b 0.000000000000000 11.530991490000000 0.000000000000000 c -5.201672451025446 0.000000000000000 12.422432460221358 Atomic positions (fractional): *1 H 0.09812609693017 0.08333333333333 0.40589830085706 1.008 > 1 2 H 0.59812609693017 0.08333333333333 0.40589830085706 1.008 > 1 3 H 0.09812609693017 0.41666666666667 0.40589830085706 1.008 > 1 4 H 0.59812609693017 0.41666666666667 0.40589830085706 1.008 > 1 5 H 0.09812609693017 0.75000000000000 0.40589830085706 1.008 > 1 6 H 0.59812609693017 0.75000000000000 0.40589830085706 1.008 > 1 7 H 0.09812609693017 0.08333333333333 0.90589830085706 1.008 > 1 8 H 0.59812609693017 0.08333333333333 0.90589830085706 1.008 > 1 9 H 0.09812609693017 0.41666666666667 0.90589830085706 1.008 > 1 10 H 0.59812609693017 0.41666666666667 0.90589830085706 1.008 > 1 11 H 0.09812609693017 0.75000000000000 0.90589830085706 1.008 > 1 12 H 0.59812609693017 0.75000000000000 0.90589830085706 1.008 > 1 13 H 0.40187390306983 0.25000000000000 0.09410169914294 1.008 > 2 14 H 0.90187390306983 0.25000000000000 0.09410169914294 1.008 > 2 15 H 0.40187390306983 0.58333333333333 0.09410169914294 1.008 > 2 16 H 0.90187390306983 0.58333333333333 0.09410169914294 1.008 > 2 17 H 0.40187390306983 0.91666666666667 0.09410169914294 1.008 > 2 18 H 0.90187390306983 0.91666666666667 0.09410169914294 1.008 > 2 19 H 0.40187390306983 0.25000000000000 0.59410169914294 1.008 > 2 20 H 0.90187390306983 0.25000000000000 0.59410169914294 1.008 > 2 21 H 0.40187390306983 0.58333333333333 0.59410169914294 1.008 > 2 22 H 0.90187390306983 0.58333333333333 0.59410169914294 1.008 > 2 23 H 0.40187390306983 0.91666666666667 0.59410169914294 1.008 > 2 24 H 0.90187390306983 0.91666666666667 0.59410169914294 1.008 > 2 *25 H 0.30826885264276 0.08333333333333 0.13772522638384 1.008 > 3 26 H 0.80826885264276 0.08333333333333 0.13772522638384 1.008 > 3 27 H 0.30826885264276 0.41666666666667 0.13772522638384 1.008 > 3 28 H 0.80826885264276 0.41666666666667 0.13772522638384 1.008 > 3 29 H 0.30826885264276 0.75000000000000 0.13772522638384 1.008 > 3 30 H 0.80826885264276 0.75000000000000 0.13772522638384 1.008 > 3 31 H 0.30826885264276 0.08333333333333 0.63772522638384 1.008 > 3 32 H 0.80826885264276 0.08333333333333 0.63772522638384 1.008 > 3 33 H 0.30826885264276 0.41666666666667 0.63772522638384 1.008 > 3 34 H 0.80826885264276 0.41666666666667 0.63772522638384 1.008 > 3 35 H 0.30826885264276 0.75000000000000 0.63772522638384 1.008 > 3 36 H 0.80826885264276 0.75000000000000 0.63772522638384 1.008 > 3 37 H 0.19173114735724 0.25000000000000 0.36227477361616 1.008 > 4 38 H 0.69173114735724 0.25000000000000 0.36227477361616 1.008 > 4 39 H 0.19173114735724 0.58333333333333 0.36227477361616 1.008 > 4 40 H 0.69173114735724 0.58333333333333 0.36227477361616 1.008 > 4 41 H 0.19173114735724 0.91666666666667 0.36227477361616 1.008 > 4 42 H 0.69173114735724 0.91666666666667 0.36227477361616 1.008 > 4 43 H 0.19173114735724 0.25000000000000 0.86227477361616 1.008 > 4 44 H 0.69173114735724 0.25000000000000 0.86227477361616 1.008 > 4 45 H 0.19173114735724 0.58333333333333 0.86227477361616 1.008 > 4 46 H 0.69173114735724 0.58333333333333 0.86227477361616 1.008 > 4 47 H 0.19173114735724 0.91666666666667 0.86227477361616 1.008 > 4 48 H 0.69173114735724 0.91666666666667 0.86227477361616 1.008 > 4 *49 O 0.20001602454726 0.25000000000000 0.29270946428060 15.999 > 5 50 O 0.70001602454726 0.25000000000000 0.29270946428060 15.999 > 5 51 O 0.20001602454726 0.58333333333333 0.29270946428060 15.999 > 5 52 O 0.70001602454726 0.58333333333333 0.29270946428060 15.999 > 5 53 O 0.20001602454726 0.91666666666667 0.29270946428060 15.999 > 5 54 O 0.70001602454726 0.91666666666667 0.29270946428060 15.999 > 5 55 O 0.20001602454726 0.25000000000000 0.79270946428060 15.999 > 5 56 O 0.70001602454726 0.25000000000000 0.79270946428060 15.999 > 5 57 O 0.20001602454726 0.58333333333333 0.79270946428060 15.999 > 5 58 O 0.70001602454726 0.58333333333333 0.79270946428060 15.999 > 5 59 O 0.20001602454726 0.91666666666667 0.79270946428060 15.999 > 5 60 O 0.70001602454726 0.91666666666667 0.79270946428060 15.999 > 5 61 O 0.29998397545274 0.08333333333333 0.20729053571940 15.999 > 6 62 O 0.79998397545274 0.08333333333333 0.20729053571940 15.999 > 6 63 O 0.29998397545274 0.41666666666667 0.20729053571940 15.999 > 6 64 O 0.79998397545274 0.41666666666667 0.20729053571940 15.999 > 6 65 O 0.29998397545274 0.75000000000000 0.20729053571940 15.999 > 6 66 O 0.79998397545274 0.75000000000000 0.20729053571940 15.999 > 6 67 O 0.29998397545274 0.08333333333333 0.70729053571940 15.999 > 6 68 O 0.79998397545274 0.08333333333333 0.70729053571940 15.999 > 6 69 O 0.29998397545274 0.41666666666667 0.70729053571940 15.999 > 6 70 O 0.79998397545274 0.41666666666667 0.70729053571940 15.999 > 6 71 O 0.29998397545274 0.75000000000000 0.70729053571940 15.999 > 6 72 O 0.79998397545274 0.75000000000000 0.70729053571940 15.999 > 6 *73 O 0.46383792598355 0.25000000000000 0.16672721852552 15.999 > 7 74 O 0.96383792598355 0.25000000000000 0.16672721852552 15.999 > 7 75 O 0.46383792598355 0.58333333333333 0.16672721852552 15.999 > 7 76 O 0.96383792598355 0.58333333333333 0.16672721852552 15.999 > 7 77 O 0.46383792598355 0.91666666666667 0.16672721852552 15.999 > 7 78 O 0.96383792598355 0.91666666666667 0.16672721852552 15.999 > 7 79 O 0.46383792598355 0.25000000000000 0.66672721852552 15.999 > 7 80 O 0.96383792598355 0.25000000000000 0.66672721852552 15.999 > 7 81 O 0.46383792598355 0.58333333333333 0.66672721852552 15.999 > 7 82 O 0.96383792598355 0.58333333333333 0.66672721852552 15.999 > 7 83 O 0.46383792598355 0.91666666666667 0.66672721852552 15.999 > 7 84 O 0.96383792598355 0.91666666666667 0.66672721852552 15.999 > 7 85 O 0.03616207401645 0.08333333333333 0.33327278147447 15.999 > 8 86 O 0.53616207401645 0.08333333333333 0.33327278147447 15.999 > 8 87 O 0.03616207401645 0.41666666666667 0.33327278147447 15.999 > 8 88 O 0.53616207401645 0.41666666666667 0.33327278147447 15.999 > 8 89 O 0.03616207401645 0.75000000000000 0.33327278147447 15.999 > 8 90 O 0.53616207401645 0.75000000000000 0.33327278147447 15.999 > 8 91 O 0.03616207401645 0.08333333333333 0.83327278147447 15.999 > 8 92 O 0.53616207401645 0.08333333333333 0.83327278147447 15.999 > 8 93 O 0.03616207401645 0.41666666666667 0.83327278147447 15.999 > 8 94 O 0.53616207401645 0.41666666666667 0.83327278147447 15.999 > 8 95 O 0.03616207401645 0.75000000000000 0.83327278147447 15.999 > 8 96 O 0.53616207401645 0.75000000000000 0.83327278147447 15.999 > 8 *97 Cl 0.37400478530176 0.08333333333333 0.47307234558376 35.453 > 9 98 Cl 0.87400478530176 0.08333333333333 0.47307234558376 35.453 > 9 99 Cl 0.37400478530176 0.41666666666667 0.47307234558376 35.453 > 9 100 Cl 0.87400478530176 0.41666666666667 0.47307234558376 35.453 > 9 101 Cl 0.37400478530176 0.75000000000000 0.47307234558376 35.453 > 9 102 Cl 0.87400478530176 0.75000000000000 0.47307234558376 35.453 > 9 103 Cl 0.37400478530176 0.08333333333333 0.97307234558376 35.453 > 9 104 Cl 0.87400478530176 0.08333333333333 0.97307234558376 35.453 > 9 105 Cl 0.37400478530176 0.41666666666667 0.97307234558376 35.453 > 9 106 Cl 0.87400478530176 0.41666666666667 0.97307234558376 35.453 > 9 107 Cl 0.37400478530176 0.75000000000000 0.97307234558376 35.453 > 9 108 Cl 0.87400478530176 0.75000000000000 0.97307234558376 35.453 > 9 109 Cl 0.12599521469824 0.25000000000000 0.02692765441624 35.453 > 10 110 Cl 0.62599521469824 0.25000000000000 0.02692765441624 35.453 > 10 111 Cl 0.12599521469824 0.58333333333333 0.02692765441624 35.453 > 10 112 Cl 0.62599521469824 0.58333333333333 0.02692765441624 35.453 > 10 113 Cl 0.12599521469824 0.91666666666667 0.02692765441624 35.453 > 10 114 Cl 0.62599521469824 0.91666666666667 0.02692765441624 35.453 > 10 115 Cl 0.12599521469824 0.25000000000000 0.52692765441624 35.453 > 10 116 Cl 0.62599521469824 0.25000000000000 0.52692765441624 35.453 > 10 117 Cl 0.12599521469824 0.58333333333333 0.52692765441624 35.453 > 10 118 Cl 0.62599521469824 0.58333333333333 0.52692765441624 35.453 > 10 119 Cl 0.12599521469824 0.91666666666667 0.52692765441624 35.453 > 10 120 Cl 0.62599521469824 0.91666666666667 0.52692765441624 35.453 > 10 *121 Nd 0.40477315375089 0.25000000000000 0.31666196832226 144.242 > 11 122 Nd 0.90477315375089 0.25000000000000 0.31666196832226 144.242 > 11 123 Nd 0.40477315375089 0.58333333333333 0.31666196832226 144.242 > 11 124 Nd 0.90477315375089 0.58333333333333 0.31666196832226 144.242 > 11 125 Nd 0.40477315375089 0.91666666666667 0.31666196832226 144.242 > 11 126 Nd 0.90477315375089 0.91666666666667 0.31666196832226 144.242 > 11 127 Nd 0.40477315375089 0.25000000000000 0.81666196832226 144.242 > 11 128 Nd 0.90477315375089 0.25000000000000 0.81666196832226 144.242 > 11 129 Nd 0.40477315375089 0.58333333333333 0.81666196832226 144.242 > 11 130 Nd 0.90477315375089 0.58333333333333 0.81666196832226 144.242 > 11 131 Nd 0.40477315375089 0.91666666666667 0.81666196832226 144.242 > 11 132 Nd 0.90477315375089 0.91666666666667 0.81666196832226 144.242 > 11 133 Nd 0.09522684624911 0.08333333333333 0.18333803167774 144.242 > 12 134 Nd 0.59522684624911 0.08333333333333 0.18333803167774 144.242 > 12 135 Nd 0.09522684624911 0.41666666666667 0.18333803167774 144.242 > 12 136 Nd 0.59522684624911 0.41666666666667 0.18333803167774 144.242 > 12 137 Nd 0.09522684624911 0.75000000000000 0.18333803167774 144.242 > 12 138 Nd 0.59522684624911 0.75000000000000 0.18333803167774 144.242 > 12 139 Nd 0.09522684624911 0.08333333333333 0.68333803167774 144.242 > 12 140 Nd 0.59522684624911 0.08333333333333 0.68333803167774 144.242 > 12 141 Nd 0.09522684624911 0.41666666666667 0.68333803167774 144.242 > 12 142 Nd 0.59522684624911 0.41666666666667 0.68333803167774 144.242 > 12 143 Nd 0.09522684624911 0.75000000000000 0.68333803167774 144.242 > 12 144 Nd 0.59522684624911 0.75000000000000 0.68333803167774 144.242 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.6182178 0.0000000 -0.0488143 0.0000000 3.7730546 0.0000000 -0.0488142 0.0000000 3.7031287 -------------------------- Born effective charges -------------------------- 1 H 0.3210188 0.0000000 -0.0732399 0.0000000 0.5952653 0.0000000 -0.0233695 0.0000000 0.5196345 2 H 0.3210188 0.0000000 -0.0732399 0.0000000 0.5952653 0.0000000 -0.0233695 0.0000000 0.5196345 3 H 0.5197827 0.0000000 -0.0741090 0.0000000 0.4074077 0.0000000 -0.0754298 0.0000000 0.4596081 4 H 0.5197827 0.0000000 -0.0741090 0.0000000 0.4074077 0.0000000 -0.0754298 0.0000000 0.4596081 5 O -1.8394715 0.0000000 -0.3818032 0.0000000 -1.8719449 0.0000000 -0.3303493 0.0000000 -1.4302754 6 O -1.8394715 0.0000000 -0.3818032 0.0000000 -1.8719449 0.0000000 -0.3303493 0.0000000 -1.4302754 7 O -1.7726504 0.0000000 0.4318633 0.0000000 -1.8695540 0.0000000 0.3352182 0.0000000 -1.6489818 8 O -1.7726504 0.0000000 0.4318633 0.0000000 -1.8695540 0.0000000 0.3352182 0.0000000 -1.6489818 9 Cl -1.0235290 0.0000000 0.0850466 0.0000000 -1.2910727 0.0000000 0.1336954 0.0000000 -1.5259219 10 Cl -1.0235290 0.0000000 0.0850466 0.0000000 -1.2910727 0.0000000 0.1336954 0.0000000 -1.5259219 11 Nd 3.7948494 0.0000000 0.0122422 0.0000000 4.0298986 0.0000000 -0.0397649 0.0000000 3.6259364 12 Nd 3.7948494 0.0000000 0.0122422 0.0000000 4.0298986 0.0000000 -0.0397649 0.0000000 3.6259364 ---------------------------------------------------------------------------- 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: 432/432 Permutation basis: 8352/8352 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2160 Number of blocks in projector: 2160 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 239 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 69 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 565 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 336 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: - (2160, 2131), data: False |-- (288, 288), data: True |-- (288, 288), data: True |-- (336, 330), data: True |-- (336, 330), data: True |-- (336, 330), data: True |-- (576, 565), data: False |-- (576, 565), data: False |-- (576, 18), data: (576, 29) @ (29, 18) |-- (76, 69), data: True |-- (250, 239), data: True |-- (250, 239), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.007 Solver_block: 100 / 400 - Time: 0.895 Solver_block: 200 / 400 - Time: 0.772 Solver_block: 300 / 400 - Time: 0.941 Solver_block: 400 / 400 - Time: 1.070 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 4.039 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 432/432 Permutation basis: 8352/8352 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2160 Number of blocks in projector: 2160 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 239 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 69 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 565 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 336 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: - (2160, 2131), data: False |-- (288, 288), data: True |-- (288, 288), data: True |-- (336, 330), data: True |-- (336, 330), data: True |-- (336, 330), data: True |-- (576, 565), data: False |-- (576, 565), data: False |-- (576, 18), data: (576, 29) @ (29, 18) |-- (76, 69), data: True |-- (250, 239), data: True |-- (250, 239), 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 05:45:56]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 05:45:57]------------------------- 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 3 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/m (11) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.172692100838123 0.000000000000000 0.000000000000000 b 0.000000000000000 3.843663830000000 0.000000000000000 c -2.600836225512723 0.000000000000000 6.211216230110679 Atomic positions (fractional): 1 H 0.19625219386034 0.25000000000000 0.81179660171412 1.008 2 H 0.80374780613966 0.75000000000000 0.18820339828588 1.008 3 H 0.61653770528552 0.25000000000000 0.27545045276768 1.008 4 H 0.38346229471448 0.75000000000000 0.72454954723232 1.008 5 O 0.40003204909452 0.75000000000000 0.58541892856119 15.999 6 O 0.59996795090548 0.25000000000000 0.41458107143881 15.999 7 O 0.92767585196709 0.75000000000000 0.33345443705105 15.999 8 O 0.07232414803291 0.25000000000000 0.66654556294895 15.999 9 Cl 0.74800957060352 0.25000000000000 0.94614469116751 35.453 10 Cl 0.25199042939648 0.75000000000000 0.05385530883249 35.453 11 Nd 0.80954630750177 0.75000000000000 0.63332393664453 144.242 12 Nd 0.19045369249823 0.25000000000000 0.36667606335547 144.242 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.345384201676247 0.000000000000000 0.000000000000000 b 0.000000000000000 11.530991490000000 0.000000000000000 c -5.201672451025446 0.000000000000000 12.422432460221358 Atomic positions (fractional): 1 H 0.09812609693017 0.08333333333333 0.40589830085706 1.008 > 1 2 H 0.59812609693017 0.08333333333333 0.40589830085706 1.008 > 1 3 H 0.09812609693017 0.41666666666667 0.40589830085706 1.008 > 1 4 H 0.59812609693017 0.41666666666667 0.40589830085706 1.008 > 1 5 H 0.09812609693017 0.75000000000000 0.40589830085706 1.008 > 1 6 H 0.59812609693017 0.75000000000000 0.40589830085706 1.008 > 1 7 H 0.09812609693017 0.08333333333333 0.90589830085706 1.008 > 1 8 H 0.59812609693017 0.08333333333333 0.90589830085706 1.008 > 1 9 H 0.09812609693017 0.41666666666667 0.90589830085706 1.008 > 1 10 H 0.59812609693017 0.41666666666667 0.90589830085706 1.008 > 1 11 H 0.09812609693017 0.75000000000000 0.90589830085706 1.008 > 1 12 H 0.59812609693017 0.75000000000000 0.90589830085706 1.008 > 1 13 H 0.40187390306983 0.25000000000000 0.09410169914294 1.008 > 13 14 H 0.90187390306983 0.25000000000000 0.09410169914294 1.008 > 13 15 H 0.40187390306983 0.58333333333333 0.09410169914294 1.008 > 13 16 H 0.90187390306983 0.58333333333333 0.09410169914294 1.008 > 13 17 H 0.40187390306983 0.91666666666667 0.09410169914294 1.008 > 13 18 H 0.90187390306983 0.91666666666667 0.09410169914294 1.008 > 13 19 H 0.40187390306983 0.25000000000000 0.59410169914294 1.008 > 13 20 H 0.90187390306983 0.25000000000000 0.59410169914294 1.008 > 13 21 H 0.40187390306983 0.58333333333333 0.59410169914294 1.008 > 13 22 H 0.90187390306983 0.58333333333333 0.59410169914294 1.008 > 13 23 H 0.40187390306983 0.91666666666667 0.59410169914294 1.008 > 13 24 H 0.90187390306983 0.91666666666667 0.59410169914294 1.008 > 13 25 H 0.30826885264276 0.08333333333333 0.13772522638384 1.008 > 25 26 H 0.80826885264276 0.08333333333333 0.13772522638384 1.008 > 25 27 H 0.30826885264276 0.41666666666667 0.13772522638384 1.008 > 25 28 H 0.80826885264276 0.41666666666667 0.13772522638384 1.008 > 25 29 H 0.30826885264276 0.75000000000000 0.13772522638384 1.008 > 25 30 H 0.80826885264276 0.75000000000000 0.13772522638384 1.008 > 25 31 H 0.30826885264276 0.08333333333333 0.63772522638384 1.008 > 25 32 H 0.80826885264276 0.08333333333333 0.63772522638384 1.008 > 25 33 H 0.30826885264276 0.41666666666667 0.63772522638384 1.008 > 25 34 H 0.80826885264276 0.41666666666667 0.63772522638384 1.008 > 25 35 H 0.30826885264276 0.75000000000000 0.63772522638384 1.008 > 25 36 H 0.80826885264276 0.75000000000000 0.63772522638384 1.008 > 25 37 H 0.19173114735724 0.25000000000000 0.36227477361616 1.008 > 37 38 H 0.69173114735724 0.25000000000000 0.36227477361616 1.008 > 37 39 H 0.19173114735724 0.58333333333333 0.36227477361616 1.008 > 37 40 H 0.69173114735724 0.58333333333333 0.36227477361616 1.008 > 37 41 H 0.19173114735724 0.91666666666667 0.36227477361616 1.008 > 37 42 H 0.69173114735724 0.91666666666667 0.36227477361616 1.008 > 37 43 H 0.19173114735724 0.25000000000000 0.86227477361616 1.008 > 37 44 H 0.69173114735724 0.25000000000000 0.86227477361616 1.008 > 37 45 H 0.19173114735724 0.58333333333333 0.86227477361616 1.008 > 37 46 H 0.69173114735724 0.58333333333333 0.86227477361616 1.008 > 37 47 H 0.19173114735724 0.91666666666667 0.86227477361616 1.008 > 37 48 H 0.69173114735724 0.91666666666667 0.86227477361616 1.008 > 37 49 O 0.20001602454726 0.25000000000000 0.29270946428060 15.999 > 49 50 O 0.70001602454726 0.25000000000000 0.29270946428060 15.999 > 49 51 O 0.20001602454726 0.58333333333333 0.29270946428060 15.999 > 49 52 O 0.70001602454726 0.58333333333333 0.29270946428060 15.999 > 49 53 O 0.20001602454726 0.91666666666667 0.29270946428060 15.999 > 49 54 O 0.70001602454726 0.91666666666667 0.29270946428060 15.999 > 49 55 O 0.20001602454726 0.25000000000000 0.79270946428060 15.999 > 49 56 O 0.70001602454726 0.25000000000000 0.79270946428060 15.999 > 49 57 O 0.20001602454726 0.58333333333333 0.79270946428060 15.999 > 49 58 O 0.70001602454726 0.58333333333333 0.79270946428060 15.999 > 49 59 O 0.20001602454726 0.91666666666667 0.79270946428060 15.999 > 49 60 O 0.70001602454726 0.91666666666667 0.79270946428060 15.999 > 49 61 O 0.29998397545274 0.08333333333333 0.20729053571940 15.999 > 61 62 O 0.79998397545274 0.08333333333333 0.20729053571940 15.999 > 61 63 O 0.29998397545274 0.41666666666667 0.20729053571940 15.999 > 61 64 O 0.79998397545274 0.41666666666667 0.20729053571940 15.999 > 61 65 O 0.29998397545274 0.75000000000000 0.20729053571940 15.999 > 61 66 O 0.79998397545274 0.75000000000000 0.20729053571940 15.999 > 61 67 O 0.29998397545274 0.08333333333333 0.70729053571940 15.999 > 61 68 O 0.79998397545274 0.08333333333333 0.70729053571940 15.999 > 61 69 O 0.29998397545274 0.41666666666667 0.70729053571940 15.999 > 61 70 O 0.79998397545274 0.41666666666667 0.70729053571940 15.999 > 61 71 O 0.29998397545274 0.75000000000000 0.70729053571940 15.999 > 61 72 O 0.79998397545274 0.75000000000000 0.70729053571940 15.999 > 61 73 O 0.46383792598355 0.25000000000000 0.16672721852552 15.999 > 73 74 O 0.96383792598355 0.25000000000000 0.16672721852552 15.999 > 73 75 O 0.46383792598355 0.58333333333333 0.16672721852552 15.999 > 73 76 O 0.96383792598355 0.58333333333333 0.16672721852552 15.999 > 73 77 O 0.46383792598355 0.91666666666667 0.16672721852552 15.999 > 73 78 O 0.96383792598355 0.91666666666667 0.16672721852552 15.999 > 73 79 O 0.46383792598355 0.25000000000000 0.66672721852552 15.999 > 73 80 O 0.96383792598355 0.25000000000000 0.66672721852552 15.999 > 73 81 O 0.46383792598355 0.58333333333333 0.66672721852552 15.999 > 73 82 O 0.96383792598355 0.58333333333333 0.66672721852552 15.999 > 73 83 O 0.46383792598355 0.91666666666667 0.66672721852552 15.999 > 73 84 O 0.96383792598355 0.91666666666667 0.66672721852552 15.999 > 73 85 O 0.03616207401645 0.08333333333333 0.33327278147447 15.999 > 85 86 O 0.53616207401645 0.08333333333333 0.33327278147447 15.999 > 85 87 O 0.03616207401645 0.41666666666667 0.33327278147447 15.999 > 85 88 O 0.53616207401645 0.41666666666667 0.33327278147447 15.999 > 85 89 O 0.03616207401645 0.75000000000000 0.33327278147447 15.999 > 85 90 O 0.53616207401645 0.75000000000000 0.33327278147447 15.999 > 85 91 O 0.03616207401645 0.08333333333333 0.83327278147447 15.999 > 85 92 O 0.53616207401645 0.08333333333333 0.83327278147447 15.999 > 85 93 O 0.03616207401645 0.41666666666667 0.83327278147447 15.999 > 85 94 O 0.53616207401645 0.41666666666667 0.83327278147447 15.999 > 85 95 O 0.03616207401645 0.75000000000000 0.83327278147447 15.999 > 85 96 O 0.53616207401645 0.75000000000000 0.83327278147447 15.999 > 85 97 Cl 0.37400478530176 0.08333333333333 0.47307234558376 35.453 > 97 98 Cl 0.87400478530176 0.08333333333333 0.47307234558376 35.453 > 97 99 Cl 0.37400478530176 0.41666666666667 0.47307234558376 35.453 > 97 100 Cl 0.87400478530176 0.41666666666667 0.47307234558376 35.453 > 97 101 Cl 0.37400478530176 0.75000000000000 0.47307234558376 35.453 > 97 102 Cl 0.87400478530176 0.75000000000000 0.47307234558376 35.453 > 97 103 Cl 0.37400478530176 0.08333333333333 0.97307234558376 35.453 > 97 104 Cl 0.87400478530176 0.08333333333333 0.97307234558376 35.453 > 97 105 Cl 0.37400478530176 0.41666666666667 0.97307234558376 35.453 > 97 106 Cl 0.87400478530176 0.41666666666667 0.97307234558376 35.453 > 97 107 Cl 0.37400478530176 0.75000000000000 0.97307234558376 35.453 > 97 108 Cl 0.87400478530176 0.75000000000000 0.97307234558376 35.453 > 97 109 Cl 0.12599521469824 0.25000000000000 0.02692765441624 35.453 > 109 110 Cl 0.62599521469824 0.25000000000000 0.02692765441624 35.453 > 109 111 Cl 0.12599521469824 0.58333333333333 0.02692765441624 35.453 > 109 112 Cl 0.62599521469824 0.58333333333333 0.02692765441624 35.453 > 109 113 Cl 0.12599521469824 0.91666666666667 0.02692765441624 35.453 > 109 114 Cl 0.62599521469824 0.91666666666667 0.02692765441624 35.453 > 109 115 Cl 0.12599521469824 0.25000000000000 0.52692765441624 35.453 > 109 116 Cl 0.62599521469824 0.25000000000000 0.52692765441624 35.453 > 109 117 Cl 0.12599521469824 0.58333333333333 0.52692765441624 35.453 > 109 118 Cl 0.62599521469824 0.58333333333333 0.52692765441624 35.453 > 109 119 Cl 0.12599521469824 0.91666666666667 0.52692765441624 35.453 > 109 120 Cl 0.62599521469824 0.91666666666667 0.52692765441624 35.453 > 109 121 Nd 0.40477315375089 0.25000000000000 0.31666196832226 144.242 > 121 122 Nd 0.90477315375089 0.25000000000000 0.31666196832226 144.242 > 121 123 Nd 0.40477315375089 0.58333333333333 0.31666196832226 144.242 > 121 124 Nd 0.90477315375089 0.58333333333333 0.31666196832226 144.242 > 121 125 Nd 0.40477315375089 0.91666666666667 0.31666196832226 144.242 > 121 126 Nd 0.90477315375089 0.91666666666667 0.31666196832226 144.242 > 121 127 Nd 0.40477315375089 0.25000000000000 0.81666196832226 144.242 > 121 128 Nd 0.90477315375089 0.25000000000000 0.81666196832226 144.242 > 121 129 Nd 0.40477315375089 0.58333333333333 0.81666196832226 144.242 > 121 130 Nd 0.90477315375089 0.58333333333333 0.81666196832226 144.242 > 121 131 Nd 0.40477315375089 0.91666666666667 0.81666196832226 144.242 > 121 132 Nd 0.90477315375089 0.91666666666667 0.81666196832226 144.242 > 121 133 Nd 0.09522684624911 0.08333333333333 0.18333803167774 144.242 > 133 134 Nd 0.59522684624911 0.08333333333333 0.18333803167774 144.242 > 133 135 Nd 0.09522684624911 0.41666666666667 0.18333803167774 144.242 > 133 136 Nd 0.59522684624911 0.41666666666667 0.18333803167774 144.242 > 133 137 Nd 0.09522684624911 0.75000000000000 0.18333803167774 144.242 > 133 138 Nd 0.59522684624911 0.75000000000000 0.18333803167774 144.242 > 133 139 Nd 0.09522684624911 0.08333333333333 0.68333803167774 144.242 > 133 140 Nd 0.59522684624911 0.08333333333333 0.68333803167774 144.242 > 133 141 Nd 0.09522684624911 0.41666666666667 0.68333803167774 144.242 > 133 142 Nd 0.59522684624911 0.41666666666667 0.68333803167774 144.242 > 133 143 Nd 0.09522684624911 0.75000000000000 0.68333803167774 144.242 > 133 144 Nd 0.59522684624911 0.75000000000000 0.68333803167774 144.242 > 133 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.6182178 0.0000000 -0.0488143 0.0000000 3.7730546 0.0000000 -0.0488142 0.0000000 3.7031287 -------------------------- Born effective charges -------------------------- 1 H 0.3210188 0.0000000 -0.0732399 0.0000000 0.5952653 0.0000000 -0.0233695 0.0000000 0.5196345 2 H 0.3210188 0.0000000 -0.0732399 0.0000000 0.5952653 0.0000000 -0.0233695 0.0000000 0.5196345 3 H 0.5197827 0.0000000 -0.0741090 0.0000000 0.4074077 0.0000000 -0.0754298 0.0000000 0.4596081 4 H 0.5197827 0.0000000 -0.0741090 0.0000000 0.4074077 0.0000000 -0.0754298 0.0000000 0.4596081 5 O -1.8394715 0.0000000 -0.3818032 0.0000000 -1.8719449 0.0000000 -0.3303493 0.0000000 -1.4302754 6 O -1.8394715 0.0000000 -0.3818032 0.0000000 -1.8719449 0.0000000 -0.3303493 0.0000000 -1.4302754 7 O -1.7726504 0.0000000 0.4318633 0.0000000 -1.8695540 0.0000000 0.3352182 0.0000000 -1.6489818 8 O -1.7726504 0.0000000 0.4318633 0.0000000 -1.8695540 0.0000000 0.3352182 0.0000000 -1.6489818 9 Cl -1.0235290 0.0000000 0.0850466 0.0000000 -1.2910727 0.0000000 0.1336954 0.0000000 -1.5259219 10 Cl -1.0235290 0.0000000 0.0850466 0.0000000 -1.2910727 0.0000000 0.1336954 0.0000000 -1.5259219 11 Nd 3.7948494 0.0000000 0.0122422 0.0000000 4.0298986 0.0000000 -0.0397649 0.0000000 3.6259364 12 Nd 3.7948494 0.0000000 0.0122422 0.0000000 4.0298986 0.0000000 -0.0397649 0.0000000 3.6259364 ---------------------------------------------------------------------------- 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] [-0.0039 0.0000 0.0092] [ 0.0039 0.0000 -0.0092] Computing fc3[ 25, 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] [-0.0039 0.0000 0.0092] [ 0.0039 0.0000 -0.0092] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0039 0.0000 0.0092] [ 0.0039 0.0000 -0.0092] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0039 0.0000 0.0092] [ 0.0039 0.0000 -0.0092] 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] [-0.0039 0.0000 0.0092] [ 0.0039 0.0000 -0.0092] Computing fc3[ 121, 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] [-0.0039 0.0000 0.0092] [ 0.0039 0.0000 -0.0092] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000005 (zzz) -0.00000005 (zzz) -0.00000005 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000001 (xz) -0.00000001 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 05:46:26]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 05:46:27]------------------------- 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 3 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/m (11) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.172692100838123 0.000000000000000 0.000000000000000 b 0.000000000000000 3.843663830000000 0.000000000000000 c -2.600836225512723 0.000000000000000 6.211216230110679 Atomic positions (fractional): 1 H 0.19625219386034 0.25000000000000 0.81179660171412 1.008 2 H 0.80374780613966 0.75000000000000 0.18820339828588 1.008 3 H 0.61653770528552 0.25000000000000 0.27545045276768 1.008 4 H 0.38346229471448 0.75000000000000 0.72454954723232 1.008 5 O 0.40003204909452 0.75000000000000 0.58541892856119 15.999 6 O 0.59996795090548 0.25000000000000 0.41458107143881 15.999 7 O 0.92767585196709 0.75000000000000 0.33345443705105 15.999 8 O 0.07232414803291 0.25000000000000 0.66654556294895 15.999 9 Cl 0.74800957060352 0.25000000000000 0.94614469116751 35.453 10 Cl 0.25199042939648 0.75000000000000 0.05385530883249 35.453 11 Nd 0.80954630750177 0.75000000000000 0.63332393664453 144.242 12 Nd 0.19045369249823 0.25000000000000 0.36667606335547 144.242 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.345384201676247 0.000000000000000 0.000000000000000 b 0.000000000000000 11.530991490000000 0.000000000000000 c -5.201672451025446 0.000000000000000 12.422432460221358 Atomic positions (fractional): 1 H 0.09812609693017 0.08333333333333 0.40589830085706 1.008 > 1 2 H 0.59812609693017 0.08333333333333 0.40589830085706 1.008 > 1 3 H 0.09812609693017 0.41666666666667 0.40589830085706 1.008 > 1 4 H 0.59812609693017 0.41666666666667 0.40589830085706 1.008 > 1 5 H 0.09812609693017 0.75000000000000 0.40589830085706 1.008 > 1 6 H 0.59812609693017 0.75000000000000 0.40589830085706 1.008 > 1 7 H 0.09812609693017 0.08333333333333 0.90589830085706 1.008 > 1 8 H 0.59812609693017 0.08333333333333 0.90589830085706 1.008 > 1 9 H 0.09812609693017 0.41666666666667 0.90589830085706 1.008 > 1 10 H 0.59812609693017 0.41666666666667 0.90589830085706 1.008 > 1 11 H 0.09812609693017 0.75000000000000 0.90589830085706 1.008 > 1 12 H 0.59812609693017 0.75000000000000 0.90589830085706 1.008 > 1 13 H 0.40187390306983 0.25000000000000 0.09410169914294 1.008 > 13 14 H 0.90187390306983 0.25000000000000 0.09410169914294 1.008 > 13 15 H 0.40187390306983 0.58333333333333 0.09410169914294 1.008 > 13 16 H 0.90187390306983 0.58333333333333 0.09410169914294 1.008 > 13 17 H 0.40187390306983 0.91666666666667 0.09410169914294 1.008 > 13 18 H 0.90187390306983 0.91666666666667 0.09410169914294 1.008 > 13 19 H 0.40187390306983 0.25000000000000 0.59410169914294 1.008 > 13 20 H 0.90187390306983 0.25000000000000 0.59410169914294 1.008 > 13 21 H 0.40187390306983 0.58333333333333 0.59410169914294 1.008 > 13 22 H 0.90187390306983 0.58333333333333 0.59410169914294 1.008 > 13 23 H 0.40187390306983 0.91666666666667 0.59410169914294 1.008 > 13 24 H 0.90187390306983 0.91666666666667 0.59410169914294 1.008 > 13 25 H 0.30826885264276 0.08333333333333 0.13772522638384 1.008 > 25 26 H 0.80826885264276 0.08333333333333 0.13772522638384 1.008 > 25 27 H 0.30826885264276 0.41666666666667 0.13772522638384 1.008 > 25 28 H 0.80826885264276 0.41666666666667 0.13772522638384 1.008 > 25 29 H 0.30826885264276 0.75000000000000 0.13772522638384 1.008 > 25 30 H 0.80826885264276 0.75000000000000 0.13772522638384 1.008 > 25 31 H 0.30826885264276 0.08333333333333 0.63772522638384 1.008 > 25 32 H 0.80826885264276 0.08333333333333 0.63772522638384 1.008 > 25 33 H 0.30826885264276 0.41666666666667 0.63772522638384 1.008 > 25 34 H 0.80826885264276 0.41666666666667 0.63772522638384 1.008 > 25 35 H 0.30826885264276 0.75000000000000 0.63772522638384 1.008 > 25 36 H 0.80826885264276 0.75000000000000 0.63772522638384 1.008 > 25 37 H 0.19173114735724 0.25000000000000 0.36227477361616 1.008 > 37 38 H 0.69173114735724 0.25000000000000 0.36227477361616 1.008 > 37 39 H 0.19173114735724 0.58333333333333 0.36227477361616 1.008 > 37 40 H 0.69173114735724 0.58333333333333 0.36227477361616 1.008 > 37 41 H 0.19173114735724 0.91666666666667 0.36227477361616 1.008 > 37 42 H 0.69173114735724 0.91666666666667 0.36227477361616 1.008 > 37 43 H 0.19173114735724 0.25000000000000 0.86227477361616 1.008 > 37 44 H 0.69173114735724 0.25000000000000 0.86227477361616 1.008 > 37 45 H 0.19173114735724 0.58333333333333 0.86227477361616 1.008 > 37 46 H 0.69173114735724 0.58333333333333 0.86227477361616 1.008 > 37 47 H 0.19173114735724 0.91666666666667 0.86227477361616 1.008 > 37 48 H 0.69173114735724 0.91666666666667 0.86227477361616 1.008 > 37 49 O 0.20001602454726 0.25000000000000 0.29270946428060 15.999 > 49 50 O 0.70001602454726 0.25000000000000 0.29270946428060 15.999 > 49 51 O 0.20001602454726 0.58333333333333 0.29270946428060 15.999 > 49 52 O 0.70001602454726 0.58333333333333 0.29270946428060 15.999 > 49 53 O 0.20001602454726 0.91666666666667 0.29270946428060 15.999 > 49 54 O 0.70001602454726 0.91666666666667 0.29270946428060 15.999 > 49 55 O 0.20001602454726 0.25000000000000 0.79270946428060 15.999 > 49 56 O 0.70001602454726 0.25000000000000 0.79270946428060 15.999 > 49 57 O 0.20001602454726 0.58333333333333 0.79270946428060 15.999 > 49 58 O 0.70001602454726 0.58333333333333 0.79270946428060 15.999 > 49 59 O 0.20001602454726 0.91666666666667 0.79270946428060 15.999 > 49 60 O 0.70001602454726 0.91666666666667 0.79270946428060 15.999 > 49 61 O 0.29998397545274 0.08333333333333 0.20729053571940 15.999 > 61 62 O 0.79998397545274 0.08333333333333 0.20729053571940 15.999 > 61 63 O 0.29998397545274 0.41666666666667 0.20729053571940 15.999 > 61 64 O 0.79998397545274 0.41666666666667 0.20729053571940 15.999 > 61 65 O 0.29998397545274 0.75000000000000 0.20729053571940 15.999 > 61 66 O 0.79998397545274 0.75000000000000 0.20729053571940 15.999 > 61 67 O 0.29998397545274 0.08333333333333 0.70729053571940 15.999 > 61 68 O 0.79998397545274 0.08333333333333 0.70729053571940 15.999 > 61 69 O 0.29998397545274 0.41666666666667 0.70729053571940 15.999 > 61 70 O 0.79998397545274 0.41666666666667 0.70729053571940 15.999 > 61 71 O 0.29998397545274 0.75000000000000 0.70729053571940 15.999 > 61 72 O 0.79998397545274 0.75000000000000 0.70729053571940 15.999 > 61 73 O 0.46383792598355 0.25000000000000 0.16672721852552 15.999 > 73 74 O 0.96383792598355 0.25000000000000 0.16672721852552 15.999 > 73 75 O 0.46383792598355 0.58333333333333 0.16672721852552 15.999 > 73 76 O 0.96383792598355 0.58333333333333 0.16672721852552 15.999 > 73 77 O 0.46383792598355 0.91666666666667 0.16672721852552 15.999 > 73 78 O 0.96383792598355 0.91666666666667 0.16672721852552 15.999 > 73 79 O 0.46383792598355 0.25000000000000 0.66672721852552 15.999 > 73 80 O 0.96383792598355 0.25000000000000 0.66672721852552 15.999 > 73 81 O 0.46383792598355 0.58333333333333 0.66672721852552 15.999 > 73 82 O 0.96383792598355 0.58333333333333 0.66672721852552 15.999 > 73 83 O 0.46383792598355 0.91666666666667 0.66672721852552 15.999 > 73 84 O 0.96383792598355 0.91666666666667 0.66672721852552 15.999 > 73 85 O 0.03616207401645 0.08333333333333 0.33327278147447 15.999 > 85 86 O 0.53616207401645 0.08333333333333 0.33327278147447 15.999 > 85 87 O 0.03616207401645 0.41666666666667 0.33327278147447 15.999 > 85 88 O 0.53616207401645 0.41666666666667 0.33327278147447 15.999 > 85 89 O 0.03616207401645 0.75000000000000 0.33327278147447 15.999 > 85 90 O 0.53616207401645 0.75000000000000 0.33327278147447 15.999 > 85 91 O 0.03616207401645 0.08333333333333 0.83327278147447 15.999 > 85 92 O 0.53616207401645 0.08333333333333 0.83327278147447 15.999 > 85 93 O 0.03616207401645 0.41666666666667 0.83327278147447 15.999 > 85 94 O 0.53616207401645 0.41666666666667 0.83327278147447 15.999 > 85 95 O 0.03616207401645 0.75000000000000 0.83327278147447 15.999 > 85 96 O 0.53616207401645 0.75000000000000 0.83327278147447 15.999 > 85 97 Cl 0.37400478530176 0.08333333333333 0.47307234558376 35.453 > 97 98 Cl 0.87400478530176 0.08333333333333 0.47307234558376 35.453 > 97 99 Cl 0.37400478530176 0.41666666666667 0.47307234558376 35.453 > 97 100 Cl 0.87400478530176 0.41666666666667 0.47307234558376 35.453 > 97 101 Cl 0.37400478530176 0.75000000000000 0.47307234558376 35.453 > 97 102 Cl 0.87400478530176 0.75000000000000 0.47307234558376 35.453 > 97 103 Cl 0.37400478530176 0.08333333333333 0.97307234558376 35.453 > 97 104 Cl 0.87400478530176 0.08333333333333 0.97307234558376 35.453 > 97 105 Cl 0.37400478530176 0.41666666666667 0.97307234558376 35.453 > 97 106 Cl 0.87400478530176 0.41666666666667 0.97307234558376 35.453 > 97 107 Cl 0.37400478530176 0.75000000000000 0.97307234558376 35.453 > 97 108 Cl 0.87400478530176 0.75000000000000 0.97307234558376 35.453 > 97 109 Cl 0.12599521469824 0.25000000000000 0.02692765441624 35.453 > 109 110 Cl 0.62599521469824 0.25000000000000 0.02692765441624 35.453 > 109 111 Cl 0.12599521469824 0.58333333333333 0.02692765441624 35.453 > 109 112 Cl 0.62599521469824 0.58333333333333 0.02692765441624 35.453 > 109 113 Cl 0.12599521469824 0.91666666666667 0.02692765441624 35.453 > 109 114 Cl 0.62599521469824 0.91666666666667 0.02692765441624 35.453 > 109 115 Cl 0.12599521469824 0.25000000000000 0.52692765441624 35.453 > 109 116 Cl 0.62599521469824 0.25000000000000 0.52692765441624 35.453 > 109 117 Cl 0.12599521469824 0.58333333333333 0.52692765441624 35.453 > 109 118 Cl 0.62599521469824 0.58333333333333 0.52692765441624 35.453 > 109 119 Cl 0.12599521469824 0.91666666666667 0.52692765441624 35.453 > 109 120 Cl 0.62599521469824 0.91666666666667 0.52692765441624 35.453 > 109 121 Nd 0.40477315375089 0.25000000000000 0.31666196832226 144.242 > 121 122 Nd 0.90477315375089 0.25000000000000 0.31666196832226 144.242 > 121 123 Nd 0.40477315375089 0.58333333333333 0.31666196832226 144.242 > 121 124 Nd 0.90477315375089 0.58333333333333 0.31666196832226 144.242 > 121 125 Nd 0.40477315375089 0.91666666666667 0.31666196832226 144.242 > 121 126 Nd 0.90477315375089 0.91666666666667 0.31666196832226 144.242 > 121 127 Nd 0.40477315375089 0.25000000000000 0.81666196832226 144.242 > 121 128 Nd 0.90477315375089 0.25000000000000 0.81666196832226 144.242 > 121 129 Nd 0.40477315375089 0.58333333333333 0.81666196832226 144.242 > 121 130 Nd 0.90477315375089 0.58333333333333 0.81666196832226 144.242 > 121 131 Nd 0.40477315375089 0.91666666666667 0.81666196832226 144.242 > 121 132 Nd 0.90477315375089 0.91666666666667 0.81666196832226 144.242 > 121 133 Nd 0.09522684624911 0.08333333333333 0.18333803167774 144.242 > 133 134 Nd 0.59522684624911 0.08333333333333 0.18333803167774 144.242 > 133 135 Nd 0.09522684624911 0.41666666666667 0.18333803167774 144.242 > 133 136 Nd 0.59522684624911 0.41666666666667 0.18333803167774 144.242 > 133 137 Nd 0.09522684624911 0.75000000000000 0.18333803167774 144.242 > 133 138 Nd 0.59522684624911 0.75000000000000 0.18333803167774 144.242 > 133 139 Nd 0.09522684624911 0.08333333333333 0.68333803167774 144.242 > 133 140 Nd 0.59522684624911 0.08333333333333 0.68333803167774 144.242 > 133 141 Nd 0.09522684624911 0.41666666666667 0.68333803167774 144.242 > 133 142 Nd 0.59522684624911 0.41666666666667 0.68333803167774 144.242 > 133 143 Nd 0.09522684624911 0.75000000000000 0.68333803167774 144.242 > 133 144 Nd 0.59522684624911 0.75000000000000 0.68333803167774 144.242 > 133 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.6182178 0.0000000 -0.0488143 0.0000000 3.7730546 0.0000000 -0.0488142 0.0000000 3.7031287 -------------------------- Born effective charges -------------------------- 1 H 0.3210188 0.0000000 -0.0732399 0.0000000 0.5952653 0.0000000 -0.0233695 0.0000000 0.5196345 2 H 0.3210188 0.0000000 -0.0732399 0.0000000 0.5952653 0.0000000 -0.0233695 0.0000000 0.5196345 3 H 0.5197827 0.0000000 -0.0741090 0.0000000 0.4074077 0.0000000 -0.0754298 0.0000000 0.4596081 4 H 0.5197827 0.0000000 -0.0741090 0.0000000 0.4074077 0.0000000 -0.0754298 0.0000000 0.4596081 5 O -1.8394715 0.0000000 -0.3818032 0.0000000 -1.8719449 0.0000000 -0.3303493 0.0000000 -1.4302754 6 O -1.8394715 0.0000000 -0.3818032 0.0000000 -1.8719449 0.0000000 -0.3303493 0.0000000 -1.4302754 7 O -1.7726504 0.0000000 0.4318633 0.0000000 -1.8695540 0.0000000 0.3352182 0.0000000 -1.6489818 8 O -1.7726504 0.0000000 0.4318633 0.0000000 -1.8695540 0.0000000 0.3352182 0.0000000 -1.6489818 9 Cl -1.0235290 0.0000000 0.0850466 0.0000000 -1.2910727 0.0000000 0.1336954 0.0000000 -1.5259219 10 Cl -1.0235290 0.0000000 0.0850466 0.0000000 -1.2910727 0.0000000 0.1336954 0.0000000 -1.5259219 11 Nd 3.7948494 0.0000000 0.0122422 0.0000000 4.0298986 0.0000000 -0.0397649 0.0000000 3.6259364 12 Nd 3.7948494 0.0000000 0.0122422 0.0000000 4.0298986 0.0000000 -0.0397649 0.0000000 3.6259364 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000005 (zzz) -0.00000005 (zzz) -0.00000005 (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 13 8 ] 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: 0.79, Number of G-points: 289, Lambda: 0.16 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/259) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 3.077 ( 0.000 0.000 0.000) 0.000 3.362 ( 0.000 0.000 0.000) 0.000 3.412 ( 0.000 0.000 0.000) 0.000 4.142 ( 0.000 0.000 0.000) 0.000 4.575 ( 0.000 0.000 0.000) 0.000 4.604 ( 0.000 0.000 0.000) 0.000 4.777 ( 0.000 0.000 0.000) 0.000 5.096 ( 0.000 0.000 0.000) 0.000 5.283 ( 0.000 0.000 0.000) 0.000 7.969 ( 0.000 0.000 0.000) 0.000 8.114 ( 0.000 0.000 0.000) 0.000 8.345 ( 0.000 0.000 0.000) 0.000 9.100 ( 0.000 0.000 0.000) 0.000 9.407 ( 0.000 0.000 0.000) 0.000 9.496 ( 0.000 0.000 0.000) 0.000 10.000 ( 0.000 0.000 0.000) 0.000 10.664 ( 0.000 0.000 0.000) 0.000 10.993 ( 0.000 0.000 0.000) 0.000 11.083 ( 0.000 0.000 0.000) 0.000 12.145 ( 0.000 0.000 0.000) 0.000 13.068 ( 0.000 0.000 0.000) 0.000 14.725 ( 0.000 0.000 0.000) 0.000 15.420 ( 0.000 0.000 0.000) 0.000 19.798 ( 0.000 0.000 0.000) 0.000 20.281 ( 0.000 0.000 0.000) 0.000 20.624 ( 0.000 0.000 0.000) 0.000 20.691 ( 0.000 0.000 0.000) 0.000 21.291 ( 0.000 0.000 0.000) 0.000 22.356 ( 0.000 0.000 0.000) 0.000 107.883 ( 0.000 0.000 0.000) 0.000 107.936 ( 0.000 0.000 0.000) 0.000 108.441 ( 0.000 0.000 0.000) 0.000 108.502 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/259) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.456 ( 11.587 0.000 31.613) 33.670 0.615 ( 29.140 0.000 10.867) 31.101 0.837 ( 40.374 0.000 8.796) 41.321 3.283 ( -3.976 0.000 -6.795) 7.873 3.372 ( -3.502 0.000 -2.088) 4.077 3.658 ( 9.668 0.000 -15.506) 18.273 4.149 ( 0.864 0.000 -0.434) 0.967 4.563 ( -1.399 0.000 0.251) 1.421 4.608 ( 0.641 0.000 -0.822) 1.042 4.711 ( -6.866 0.000 0.783) 6.910 5.251 ( -7.020 0.000 14.513) 16.121 5.314 ( -11.643 0.000 30.165) 32.334 7.954 ( -1.419 0.000 0.546) 1.521 8.103 ( -1.088 0.000 -0.016) 1.088 8.912 ( 11.612 0.000 -8.885) 14.621 8.969 ( -10.987 0.000 0.036) 10.987 9.524 ( 9.496 0.000 0.125) 9.497 10.001 ( 0.159 0.000 -0.029) 0.162 10.508 ( -17.463 0.000 3.672) 17.845 10.857 ( -8.480 0.000 3.655) 9.234 11.222 ( 13.637 0.000 -14.021) 19.559 11.446 ( 11.566 0.000 -26.818) 29.206 12.231 ( 9.432 0.000 -1.300) 9.522 13.099 ( -9.181 0.000 15.899) 18.360 14.746 ( 2.022 0.000 0.823) 2.183 15.400 ( -1.670 0.000 -1.285) 2.107 19.822 ( 1.899 0.000 1.436) 2.381 20.292 ( 1.058 0.000 0.230) 1.083 20.678 ( -1.344 0.000 -0.125) 1.350 21.288 ( -2.150 0.000 11.731) 11.927 22.206 ( 10.029 0.000 -39.027) 40.295 22.389 ( 10.469 0.000 -19.609) 22.228 107.933 ( -0.894 0.000 1.352) 1.621 107.954 ( -2.309 0.000 6.391) 6.795 108.446 ( 1.539 0.000 -3.333) 3.671 108.500 ( -0.271 0.000 0.017) 0.272 ======================= Grid point 2 (3/259) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.885 ( 10.658 0.000 28.660) 30.578 1.204 ( 27.182 0.000 10.062) 28.985 1.534 ( 29.115 0.000 6.106) 29.748 3.172 ( -1.246 0.000 -7.658) 7.759 3.255 ( -7.091 0.000 -3.732) 8.013 3.694 ( 5.763 0.000 -12.119) 13.420 4.165 ( 1.434 0.000 -0.947) 1.718 4.532 ( -2.348 0.000 0.520) 2.405 4.568 ( -7.836 0.000 3.969) 8.783 4.624 ( -0.177 0.000 -0.850) 0.868 5.251 ( -0.747 0.000 4.013) 4.082 5.302 ( -9.352 0.000 16.362) 18.846 7.942 ( -0.487 0.000 1.164) 1.262 8.077 ( -1.632 0.000 -0.047) 1.633 8.769 ( -10.673 0.000 0.177) 10.675 9.090 ( 12.414 0.000 -3.336) 12.855 9.692 ( 8.591 0.000 0.101) 8.592 10.003 ( 0.008 0.000 -0.045) 0.046 10.181 ( -19.656 0.000 2.765) 19.849 10.736 ( -6.182 0.000 -2.310) 6.600 11.329 ( 11.636 0.000 -17.767) 21.238 11.454 ( -0.198 0.000 2.884) 2.891 12.423 ( 12.063 0.000 -1.867) 12.207 13.032 ( -7.245 0.000 5.725) 9.234 14.808 ( 3.756 0.000 1.636) 4.097 15.342 ( -3.213 0.000 -2.339) 3.974 19.882 ( 2.839 0.000 2.473) 3.765 20.322 ( 2.016 0.000 0.408) 2.056 20.642 ( -2.453 0.000 -0.247) 2.465 21.358 ( 0.783 0.000 9.626) 9.657 22.070 ( -1.483 0.000 -16.896) 16.961 22.425 ( 7.429 0.000 -13.642) 15.534 107.927 ( -0.698 0.000 0.979) 1.202 107.961 ( -0.685 0.000 2.491) 2.583 108.449 ( 0.794 0.000 -1.328) 1.547 108.493 ( -0.449 0.000 0.030) 0.450 ======================= Grid point 3 (4/259) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.264 ( 9.516 0.000 23.087) 24.971 1.733 ( 23.317 0.000 8.603) 24.854 1.917 ( 9.680 0.000 1.113) 9.744 3.064 ( -10.366 0.000 -4.736) 11.397 3.150 ( 4.805 0.000 -6.535) 8.111 3.688 ( 4.458 0.000 -13.628) 14.339 4.184 ( 1.479 0.000 -1.163) 1.881 4.492 ( -2.359 0.000 0.661) 2.450 4.505 ( -3.439 0.000 9.037) 9.669 4.617 ( -0.268 0.000 -0.719) 0.767 5.216 ( -8.822 0.000 5.679) 10.491 5.284 ( 0.107 0.000 4.378) 4.379 7.953 ( 0.603 0.000 0.981) 1.152 8.049 ( -1.395 0.000 -0.068) 1.396 8.604 ( -7.445 0.000 0.232) 7.449 9.284 ( 10.454 0.000 -1.396) 10.547 9.826 ( 6.223 0.000 0.055) 6.223 9.886 ( -14.226 0.000 1.812) 14.341 9.998 ( -0.640 0.000 -0.047) 0.642 10.601 ( -6.020 0.000 -3.357) 6.893 11.363 ( 2.206 0.000 -5.437) 5.867 11.507 ( 4.423 0.000 0.287) 4.432 12.606 ( 9.496 0.000 -2.409) 9.796 12.931 ( -7.098 0.000 2.628) 7.569 14.903 ( 4.959 0.000 2.381) 5.501 15.251 ( -4.478 0.000 -2.994) 5.387 19.951 ( 2.491 0.000 2.521) 3.543 20.369 ( 2.674 0.000 0.485) 2.717 20.589 ( -3.057 0.000 -0.345) 3.077 21.457 ( 2.434 0.000 8.928) 9.254 21.905 ( -4.554 0.000 -11.650) 12.509 22.453 ( 4.724 0.000 -8.029) 9.315 107.923 ( -0.413 0.000 0.572) 0.706 107.967 ( -0.248 0.000 1.174) 1.200 108.454 ( 0.500 0.000 -0.591) 0.774 108.485 ( -0.456 0.000 0.037) 0.458 ======================= Grid point 4 (5/259) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.553 ( 6.090 0.000 12.117) 13.562 1.947 ( -1.954 0.000 -3.594) 4.091 2.135 ( 13.188 0.000 4.909) 14.072 2.840 ( -8.699 0.000 -3.601) 9.415 3.206 ( 3.416 0.000 -2.093) 4.006 3.661 ( 1.702 0.000 -6.872) 7.080 4.198 ( 0.683 0.000 -0.571) 0.890 4.463 ( -1.047 0.000 0.343) 1.102 4.566 ( 1.648 0.000 5.850) 6.078 4.608 ( 0.021 0.000 -0.355) 0.356 5.092 ( -6.011 0.000 1.125) 6.116 5.314 ( 0.477 0.000 1.282) 1.368 7.969 ( 0.423 0.000 0.306) 0.522 8.030 ( -0.538 0.000 -0.035) 0.539 8.513 ( -2.665 0.000 0.110) 2.668 9.418 ( 4.412 0.000 -0.424) 4.433 9.718 ( -5.144 0.000 0.862) 5.216 9.915 ( 3.486 0.000 0.030) 3.486 9.977 ( -1.568 0.000 -0.034) 1.569 10.494 ( -2.895 0.000 -1.581) 3.298 11.355 ( -0.225 0.000 -0.470) 0.521 11.580 ( 2.830 0.000 -0.624) 2.898 12.722 ( 5.261 0.000 -2.211) 5.707 12.833 ( -5.024 0.000 1.848) 5.353 15.018 ( 5.477 0.000 2.942) 6.217 15.139 ( -5.286 0.000 -3.183) 6.170 19.998 ( 0.997 0.000 1.102) 1.486 20.419 ( 2.081 0.000 0.337) 2.108 20.535 ( -2.232 0.000 -0.282) 2.249 21.578 ( 3.650 0.000 8.294) 9.062 21.740 ( -4.672 0.000 -9.138) 10.263 22.471 ( 1.681 0.000 -2.630) 3.121 107.920 ( -0.135 0.000 0.190) 0.233 107.970 ( -0.064 0.000 0.357) 0.363 108.458 ( 0.210 0.000 -0.180) 0.276 108.479 ( -0.223 0.000 0.025) 0.225 ======================= Grid point 9 (6/259) ======================= q-point: ( 0.00 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.517 ( 0.000 25.894 0.000) 25.894 0.628 ( 0.000 30.999 0.000) 30.999 1.054 ( 0.000 51.744 0.000) 51.744 3.077 ( 0.000 0.559 0.000) 0.559 3.362 ( 0.000 -0.063 0.000) 0.063 3.555 ( 0.000 13.260 0.000) 13.260 4.569 ( 0.000 -3.175 0.000) 3.175 4.607 ( 0.000 3.104 0.000) 3.104 4.755 ( 0.000 -2.146 0.000) 2.146 5.039 ( 0.000 0.921 0.000) 0.921 5.081 ( 0.000 -1.470 0.000) 1.470 5.258 ( 0.000 -2.079 0.000) 2.079 7.985 ( 0.000 1.485 0.000) 1.485 8.327 ( 0.000 -1.974 0.000) 1.974 8.858 ( 0.000 -2.127 0.000) 2.127 9.117 ( 0.000 -16.871 0.000) 16.871 9.731 ( 0.000 11.124 0.000) 11.124 9.883 ( 0.000 2.626 0.000) 2.626 9.921 ( 0.000 -6.426 0.000) 6.426 10.639 ( 0.000 -2.711 0.000) 2.711 10.999 ( 0.000 1.004 0.000) 1.004 11.162 ( 0.000 7.050 0.000) 7.050 12.151 ( 0.000 0.589 0.000) 0.589 13.038 ( 0.000 -2.922 0.000) 2.922 15.490 ( 0.000 6.867 0.000) 6.867 18.704 ( 0.000 -6.016 0.000) 6.016 19.649 ( 0.000 -11.732 0.000) 11.732 20.012 ( 0.000 -33.804 0.000) 33.804 20.598 ( 0.000 12.516 0.000) 12.516 21.005 ( 0.000 8.667 0.000) 8.667 21.605 ( 0.000 26.694 0.000) 26.694 22.349 ( 0.000 -0.533 0.000) 0.533 107.879 ( 0.000 -0.332 0.000) 0.332 107.929 ( 0.000 -0.723 0.000) 0.723 108.440 ( 0.000 -0.029 0.000) 0.029 108.497 ( 0.000 -0.521 0.000) 0.521 ======================= Grid point 10 (7/259) ======================= q-point: ( 0.11 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.664 ( 9.510 19.692 11.561) 24.736 0.767 ( 15.881 19.714 7.837) 26.500 1.399 ( 25.323 39.696 8.992) 47.936 3.189 ( 6.916 -5.560 -6.644) 11.085 3.352 ( 1.761 -4.074 1.535) 4.697 3.529 ( -2.923 12.557 -0.519) 12.903 4.476 ( -7.642 2.302 -3.058) 8.547 4.605 ( -0.876 2.324 0.587) 2.553 4.700 ( -5.702 -1.115 0.712) 5.854 4.811 ( -2.153 16.894 -18.788) 25.358 5.195 ( -6.929 -7.322 24.650) 26.632 5.230 ( -2.195 -3.272 2.344) 4.584 7.961 ( -1.760 0.886 -0.157) 1.977 8.202 ( -9.795 4.108 -0.650) 10.641 8.686 ( -1.352 -9.872 -1.847) 10.134 9.225 ( -1.837 3.463 -0.190) 3.925 9.551 ( 4.872 6.939 -2.058) 8.725 9.911 ( -0.185 -7.987 -0.817) 8.031 10.368 ( -1.990 -13.000 4.549) 13.916 10.772 ( 24.017 -16.696 0.258) 29.251 10.853 ( -7.613 -1.291 -0.238) 7.725 11.311 ( 12.437 8.003 -6.120) 16.006 12.203 ( 5.394 -0.388 0.834) 5.472 13.034 ( -2.197 -3.378 3.335) 5.231 15.469 ( -1.585 7.236 -2.278) 7.750 16.772 ( -87.734 89.486 -24.484) 127.689 19.606 ( 1.280 -16.466 0.625) 16.527 20.255 ( 6.905 -28.910 -8.552) 30.929 20.523 ( -1.644 10.665 2.195) 11.012 21.318 ( -1.496 -1.330 17.883) 17.995 22.086 ( 32.483 2.013 -26.725) 42.112 22.340 ( 3.438 0.175 -0.951) 3.571 107.909 ( -0.270 -1.815 4.036) 4.434 107.932 ( 0.423 -0.926 0.127) 1.026 108.443 ( 0.808 -0.136 -1.354) 1.582 108.494 ( -0.242 -0.499 0.001) 0.555 ======================= Grid point 11 (8/259) ======================= q-point: ( 0.22 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.988 ( 11.550 10.324 19.321) 24.764 1.203 ( 23.086 6.058 8.155) 25.223 1.912 ( 22.049 29.205 7.371) 37.328 3.142 ( -1.875 -0.140 -8.493) 8.698 3.410 ( -3.551 9.098 -1.945) 9.958 3.493 ( 6.345 -7.692 -4.603) 10.982 4.332 ( -5.094 6.369 -2.527) 8.538 4.569 ( -6.865 0.117 3.946) 7.919 4.600 ( -2.286 4.266 -0.151) 4.842 4.707 ( -0.532 10.261 -6.474) 12.144 5.217 ( -6.439 -7.424 12.722) 16.075 5.227 ( -0.008 -2.319 2.740) 3.590 7.941 ( -0.418 -0.030 0.461) 0.623 8.065 ( -5.013 -1.310 -0.466) 5.203 8.673 ( -2.286 -6.640 0.113) 7.023 9.206 ( 2.830 6.676 -0.648) 7.280 9.680 ( 7.672 -0.239 -0.513) 7.693 9.895 ( -1.183 -9.340 -0.742) 9.443 10.141 ( -17.823 -3.372 2.551) 18.318 10.727 ( -5.495 -0.798 -0.867) 5.620 11.148 ( 14.522 -18.141 -4.381) 23.647 11.477 ( 10.256 9.957 -3.692) 14.763 12.344 ( 9.066 -4.422 -0.016) 10.087 12.996 ( -5.023 -2.941 3.370) 6.726 15.383 ( -4.981 11.685 -6.502) 14.270 15.740 ( -25.352 61.267 -3.179) 66.382 19.653 ( 2.859 -17.302 1.146) 17.574 20.261 ( 1.115 -27.186 -5.710) 27.801 20.540 ( 0.335 10.894 3.992) 11.607 21.395 ( -0.855 1.175 11.478) 11.569 22.103 ( -2.577 2.887 -12.345) 12.937 22.510 ( 13.678 9.021 -11.335) 19.924 107.917 ( -0.628 -0.902 1.425) 1.800 107.945 ( 0.125 -1.317 1.393) 1.922 108.448 ( 0.645 -0.141 -0.941) 1.149 108.489 ( -0.397 -0.441 0.010) 0.593 ======================= Grid point 12 (9/259) ======================= q-point: ( 0.33 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.332 ( 10.132 6.774 18.686) 22.310 1.645 ( 18.187 -0.854 5.217) 18.940 2.243 ( 10.529 23.074 3.292) 25.575 3.035 ( -4.640 -0.116 -6.900) 8.316 3.304 ( -3.235 11.996 -2.406) 12.655 3.586 ( 8.689 -6.928 -9.939) 14.909 4.247 ( -3.051 3.676 -0.895) 4.860 4.482 ( -5.591 0.360 4.991) 7.503 4.601 ( 1.083 6.106 2.684) 6.757 4.662 ( -0.833 5.782 -2.746) 6.455 5.155 ( -7.491 -5.571 5.076) 10.626 5.263 ( 1.080 -1.847 2.798) 3.522 7.949 ( 0.235 -1.288 1.354) 1.883 8.001 ( -1.600 -3.286 -1.281) 3.873 8.602 ( -4.879 -0.287 0.732) 4.942 9.304 ( 7.190 1.054 -0.854) 7.317 9.786 ( 0.761 -3.769 -0.183) 3.850 9.807 ( -7.004 -6.992 0.578) 9.913 9.921 ( -4.779 -5.885 1.022) 7.649 10.626 ( -4.296 2.271 -1.981) 5.248 11.281 ( 4.546 -8.395 -2.159) 9.788 11.626 ( 8.378 11.962 -1.861) 14.722 12.498 ( 8.077 -8.545 -1.550) 11.860 12.909 ( -6.635 -2.033 2.352) 7.327 15.237 ( -3.877 16.390 -5.124) 17.605 15.505 ( -6.458 34.584 1.594) 35.218 19.717 ( 2.903 -17.289 1.221) 17.573 20.228 ( -0.625 -28.044 -3.433) 28.260 20.581 ( 0.799 11.583 3.466) 12.116 21.477 ( 1.257 0.881 9.841) 9.961 21.936 ( -5.579 2.809 -10.740) 12.425 22.627 ( 7.552 15.197 -7.166) 18.421 107.916 ( -0.366 -0.661 0.651) 0.997 107.955 ( -0.009 -1.123 0.900) 1.439 108.452 ( 0.436 -0.165 -0.489) 0.675 108.481 ( -0.398 -0.356 0.021) 0.534 ======================= Grid point 13 (10/259) ======================= q-point: ( 0.44 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.610 ( 6.715 5.651 11.268) 14.282 1.843 ( 2.053 -2.631 -1.985) 3.883 2.433 ( 9.610 20.497 2.053) 22.731 2.849 ( -9.406 0.890 -3.766) 10.171 3.282 ( 0.814 7.635 -0.862) 7.726 3.642 ( 4.017 -1.282 -5.930) 7.276 4.210 ( -0.868 0.883 0.133) 1.245 4.439 ( -2.181 -0.809 2.094) 3.130 4.637 ( -0.377 4.704 -0.868) 4.798 4.673 ( 2.993 6.382 2.978) 7.653 5.048 ( -5.337 -3.698 0.722) 6.533 5.295 ( 0.612 -1.752 1.005) 2.111 7.957 ( -0.491 -5.903 1.076) 6.020 7.984 ( 0.474 0.814 -1.114) 1.459 8.538 ( -2.148 2.086 0.339) 3.013 9.402 ( 3.320 -2.286 -0.537) 4.066 9.644 ( -4.933 -6.143 0.757) 7.915 9.851 ( 1.970 -6.036 0.241) 6.353 9.881 ( -1.488 -7.446 -0.134) 7.594 10.556 ( -1.811 5.206 -0.958) 5.594 11.315 ( 0.903 -3.825 -0.454) 3.956 11.732 ( 3.696 13.647 -0.530) 14.148 12.597 ( 3.854 -11.148 -1.408) 11.880 12.817 ( -4.104 -1.307 1.269) 4.491 15.178 ( -0.566 10.435 -1.493) 10.557 15.441 ( -1.986 31.588 0.566) 31.655 19.765 ( 1.316 -16.789 0.580) 16.851 20.197 ( -0.549 -29.089 -1.224) 29.120 20.612 ( 0.380 11.807 1.383) 11.894 21.594 ( 3.572 1.343 9.851) 10.564 21.755 ( -5.342 1.824 -10.362) 11.800 22.681 ( 2.495 17.748 -2.312) 18.071 107.914 ( -0.120 -0.586 0.204) 0.632 107.959 ( -0.007 -1.031 0.295) 1.072 108.456 ( 0.178 -0.209 -0.156) 0.316 108.476 ( -0.188 -0.279 0.016) 0.336 ======================= Grid point 18 (11/259) ======================= q-point: ( 0.00 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.034 ( 0.000 25.635 0.000) 25.635 1.234 ( 0.000 29.441 0.000) 29.441 2.048 ( 0.000 46.862 0.000) 46.862 3.112 ( 0.000 3.013 0.000) 3.013 3.360 ( 0.000 0.027 0.000) 0.027 3.893 ( 0.000 19.229 0.000) 19.229 4.496 ( 0.000 -3.700 0.000) 3.700 4.692 ( 0.000 -4.212 0.000) 4.212 4.696 ( 0.000 5.682 0.000) 5.682 5.008 ( 0.000 -4.651 0.000) 4.651 5.041 ( 0.000 -2.325 0.000) 2.325 5.234 ( 0.000 0.311 0.000) 0.311 8.013 ( 0.000 0.723 0.000) 0.723 8.251 ( 0.000 -6.299 0.000) 6.299 8.804 ( 0.000 -12.923 0.000) 12.923 8.815 ( 0.000 -1.586 0.000) 1.586 9.712 ( 0.000 -9.424 0.000) 9.424 9.936 ( 0.000 2.039 0.000) 2.039 9.970 ( 0.000 8.453 0.000) 8.453 10.547 ( 0.000 -6.496 0.000) 6.496 11.057 ( 0.000 5.292 0.000) 5.292 11.327 ( 0.000 8.707 0.000) 8.707 12.164 ( 0.000 0.533 0.000) 0.533 12.956 ( 0.000 -5.196 0.000) 5.196 15.682 ( 0.000 11.904 0.000) 11.904 18.511 ( 0.000 -13.227 0.000) 13.227 19.354 ( 0.000 -31.227 0.000) 31.227 19.415 ( 0.000 -10.927 0.000) 10.927 20.858 ( 0.000 12.513 0.000) 12.513 21.153 ( 0.000 7.353 0.000) 7.353 22.157 ( 0.000 26.397 0.000) 26.397 22.349 ( 0.000 1.041 0.000) 1.041 107.870 ( 0.000 -0.628 0.000) 0.628 107.909 ( 0.000 -1.286 0.000) 1.286 108.440 ( 0.000 -0.055 0.000) 0.055 108.483 ( 0.000 -0.825 0.000) 0.825 ======================= Grid point 19 (12/259) ======================= q-point: ( 0.11 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.114 ( 5.657 23.560 5.166) 24.775 1.258 ( 4.429 27.021 1.599) 27.429 2.225 ( 14.544 40.774 5.290) 43.612 3.159 ( 6.038 1.648 -3.201) 7.030 3.317 ( -3.706 -0.377 -1.079) 3.878 3.853 ( -3.977 18.328 -1.098) 18.787 4.467 ( -3.348 -1.506 0.640) 3.726 4.646 ( -4.311 -1.176 0.506) 4.497 4.685 ( -1.776 2.368 1.348) 3.252 5.021 ( 3.728 2.647 -9.968) 10.967 5.045 ( -1.119 -5.259 3.664) 6.507 5.177 ( -5.614 -1.115 3.753) 6.845 7.966 ( -3.566 -1.379 -0.402) 3.845 8.240 ( -6.851 0.219 -1.312) 6.979 8.502 ( -4.745 -8.020 0.270) 9.323 9.128 ( 10.600 -7.899 0.677) 13.237 9.684 ( -2.219 -5.739 0.536) 6.177 9.801 ( -3.508 6.112 -2.113) 7.357 10.189 ( 5.940 -4.686 3.151) 8.196 10.596 ( 7.486 -6.539 -0.221) 9.942 10.859 ( -13.467 1.845 1.709) 13.700 11.510 ( 14.394 11.086 -3.603) 18.522 12.194 ( 2.926 -0.882 0.386) 3.081 12.952 ( -1.131 -4.886 1.249) 5.168 15.669 ( -0.862 12.361 -1.753) 12.514 17.785 ( -55.540 22.251 -10.738) 60.788 19.235 ( -0.155 -21.392 -1.591) 21.452 19.619 ( 7.549 -27.508 -4.100) 28.818 20.785 ( -2.567 12.615 -0.807) 12.899 21.299 ( 3.253 1.311 11.344) 11.874 22.259 ( 2.893 6.906 -8.215) 11.115 22.452 ( 18.071 13.904 -2.024) 22.890 107.881 ( 0.204 -1.120 1.881) 2.198 107.910 ( 0.263 -1.316 -0.271) 1.369 108.441 ( 0.333 -0.104 -0.417) 0.544 108.481 ( -0.163 -0.784 -0.026) 0.801 ======================= Grid point 20 (13/259) ======================= q-point: ( 0.22 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.289 ( 9.405 18.763 5.932) 21.810 1.456 ( 12.474 17.606 6.862) 22.642 2.531 ( 12.367 29.810 4.556) 32.593 3.185 ( -2.002 4.629 -6.157) 7.958 3.316 ( 8.152 -4.020 -2.195) 9.351 3.737 ( -7.441 16.452 -1.414) 18.111 4.392 ( -5.249 1.334 0.518) 5.440 4.565 ( -5.505 -0.596 2.722) 6.170 4.669 ( -1.086 2.792 1.837) 3.514 4.941 ( -2.097 10.317 -10.358) 14.769 5.052 ( -2.113 -7.716 4.467) 9.163 5.171 ( 1.227 -3.014 3.062) 4.468 7.904 ( -3.747 -4.550 0.963) 5.973 8.064 ( -6.060 2.260 -2.604) 6.972 8.552 ( 3.859 -5.264 1.136) 6.625 9.224 ( 1.658 -5.058 0.984) 5.413 9.665 ( -0.787 -8.590 -0.094) 8.626 9.761 ( 0.088 4.249 -1.261) 4.433 10.084 ( -15.848 -1.678 1.669) 16.024 10.699 ( -3.072 -3.006 1.227) 4.470 10.854 ( 15.084 -10.180 -0.959) 18.223 11.726 ( 12.477 13.611 -3.208) 18.741 12.259 ( 3.582 -4.785 -0.028) 5.977 12.926 ( -3.176 -3.854 1.710) 5.278 15.618 ( -2.413 13.676 -4.208) 14.511 16.843 ( -37.846 42.306 -5.328) 57.013 19.262 ( 3.583 -22.617 -1.267) 22.934 19.649 ( 0.209 -28.110 -3.132) 28.285 20.769 ( -0.354 9.954 1.793) 10.121 21.402 ( 0.371 0.645 9.934) 9.961 22.174 ( -3.830 4.412 -7.967) 9.880 22.766 ( 17.322 15.073 -6.459) 23.853 107.895 ( -0.298 -1.244 1.633) 2.075 107.916 ( 0.521 -1.560 0.055) 1.646 108.445 ( 0.395 -0.181 -0.462) 0.634 108.477 ( -0.262 -0.677 -0.033) 0.727 ======================= Grid point 21 (14/259) ======================= q-point: ( 0.33 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.532 ( 10.670 12.915 8.511) 18.791 1.742 ( 12.183 9.960 5.285) 16.600 2.678 ( 3.565 16.518 -2.020) 17.018 3.096 ( -4.251 7.468 -2.019) 8.827 3.476 ( 10.395 -0.093 -5.772) 11.890 3.596 ( -5.568 13.209 0.051) 14.335 4.297 ( -4.969 1.803 -0.222) 5.290 4.497 ( -4.904 1.025 3.936) 6.371 4.682 ( 0.527 2.751 3.134) 4.204 4.843 ( -1.143 9.001 -6.571) 11.203 5.033 ( -2.793 -4.913 2.371) 6.128 5.223 ( 2.053 -1.854 1.497) 3.145 7.840 ( -3.851 -7.133 1.448) 8.234 8.014 ( 1.657 3.083 -2.764) 4.460 8.591 ( -0.641 -0.781 1.617) 1.907 9.261 ( 2.277 -6.673 -0.096) 7.051 9.624 ( -4.378 -8.981 -0.755) 10.020 9.758 ( -1.180 1.492 -0.318) 1.929 9.818 ( -10.557 -4.194 1.937) 11.523 10.667 ( -1.163 0.835 -0.059) 1.433 11.091 ( 10.843 -9.225 -0.884) 14.264 11.913 ( 10.277 15.162 -1.724) 18.397 12.308 ( 2.131 -10.351 -0.768) 10.596 12.862 ( -5.010 -2.430 1.315) 5.721 15.524 ( -3.491 15.462 -5.157) 16.669 16.353 ( -16.395 41.387 0.661) 44.521 19.333 ( 5.064 -22.902 -1.005) 23.476 19.604 ( -2.974 -28.421 -1.572) 28.620 20.782 ( -0.103 7.347 1.950) 7.602 21.492 ( 1.707 1.065 10.128) 10.326 22.019 ( -5.510 5.784 -9.930) 12.744 22.967 ( 10.000 17.160 -4.624) 20.393 107.898 ( -0.254 -1.080 0.730) 1.328 107.925 ( 0.288 -1.694 0.371) 1.758 108.448 ( 0.295 -0.253 -0.308) 0.496 108.472 ( -0.250 -0.539 -0.021) 0.594 ======================= Grid point 22 (15/259) ======================= q-point: ( 0.44 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.770 ( 8.141 10.000 7.298) 14.817 1.890 ( 0.909 7.094 -0.959) 7.216 2.729 ( 6.312 4.242 -3.598) 8.413 2.969 ( -8.499 14.051 0.517) 16.429 3.486 ( -1.415 11.278 -0.416) 11.374 3.640 ( 4.917 1.754 -2.070) 5.616 4.228 ( -2.095 1.368 -0.157) 2.507 4.451 ( -2.286 2.042 1.755) 3.532 4.718 ( 0.397 2.469 2.123) 3.281 4.808 ( 0.848 5.351 -2.423) 5.935 4.995 ( -2.000 0.370 0.510) 2.097 5.257 ( 0.792 -1.615 0.520) 1.872 7.801 ( -1.275 -8.050 0.479) 8.164 8.038 ( 1.661 4.088 -1.076) 4.541 8.577 ( -1.147 1.505 0.766) 2.041 9.281 ( -0.188 -10.143 -0.290) 10.149 9.524 ( -3.364 -5.533 0.019) 6.476 9.725 ( 0.072 -6.990 0.000) 6.990 9.758 ( -1.826 -2.083 0.535) 2.821 10.652 ( -0.417 3.057 -0.116) 3.088 11.220 ( 3.798 -5.059 -0.369) 6.337 12.049 ( 4.710 16.381 -0.389) 17.049 12.326 ( 0.635 -15.197 -0.584) 15.221 12.787 ( -3.095 -1.619 0.482) 3.526 15.445 ( -1.573 16.171 -2.182) 16.393 16.188 ( -4.207 38.433 0.947) 38.675 19.422 ( 4.988 -20.380 -0.488) 20.987 19.528 ( -4.271 -31.217 -0.359) 31.510 20.790 ( -0.115 5.510 0.744) 5.561 21.618 ( 3.356 0.496 9.486) 10.074 21.843 ( -4.843 7.765 -9.570) 13.241 23.063 ( 3.307 18.601 -1.566) 18.958 107.898 ( -0.085 -1.013 0.214) 1.039 107.931 ( 0.081 -1.692 0.160) 1.702 108.450 ( 0.113 -0.314 -0.107) 0.350 108.468 ( -0.108 -0.429 -0.004) 0.442 ======================= Grid point 27 (16/259) ======================= q-point: ( 0.00 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.532 ( 0.000 23.790 0.000) 23.790 1.803 ( 0.000 27.364 0.000) 27.364 2.860 ( 0.000 29.834 0.000) 29.834 3.198 ( 0.000 5.594 0.000) 5.594 3.403 ( 0.000 7.707 0.000) 7.707 4.276 ( 0.000 17.935 0.000) 17.935 4.431 ( 0.000 -2.570 0.000) 2.570 4.581 ( 0.000 -7.122 0.000) 7.122 4.830 ( 0.000 7.584 0.000) 7.584 4.878 ( 0.000 -7.184 0.000) 7.184 4.996 ( 0.000 -1.814 0.000) 1.814 5.254 ( 0.000 1.000 0.000) 1.000 7.990 ( 0.000 -3.472 0.000) 3.472 8.055 ( 0.000 -12.684 0.000) 12.684 8.648 ( 0.000 -2.676 0.000) 2.676 8.819 ( 0.000 2.269 0.000) 2.269 9.521 ( 0.000 -9.086 0.000) 9.086 9.939 ( 0.000 -2.224 0.000) 2.224 10.113 ( 0.000 5.535 0.000) 5.535 10.391 ( 0.000 -8.493 0.000) 8.493 11.218 ( 0.000 10.553 0.000) 10.553 11.493 ( 0.000 7.632 0.000) 7.632 12.167 ( 0.000 -0.344 0.000) 0.344 12.836 ( 0.000 -6.688 0.000) 6.688 15.951 ( 0.000 14.616 0.000) 14.616 18.192 ( 0.000 -17.997 0.000) 17.997 18.787 ( 0.000 -24.908 0.000) 24.908 19.205 ( 0.000 -10.602 0.000) 10.602 21.082 ( 0.000 9.808 0.000) 9.808 21.308 ( 0.000 7.863 0.000) 7.863 22.407 ( 0.000 4.953 0.000) 4.953 22.622 ( 0.000 19.566 0.000) 19.566 107.855 ( 0.000 -0.835 0.000) 0.835 107.880 ( 0.000 -1.545 0.000) 1.545 108.438 ( 0.000 -0.077 0.000) 0.077 108.466 ( 0.000 -0.839 0.000) 0.839 ======================= Grid point 28 (17/259) ======================= q-point: ( 0.11 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.580 ( 4.195 22.559 1.780) 23.015 1.800 ( 0.301 26.673 0.685) 26.683 2.917 ( 4.351 22.671 0.489) 23.089 3.225 ( 3.185 4.347 -0.547) 5.417 3.387 ( -0.476 11.847 -0.976) 11.897 4.200 ( -6.353 14.459 -2.704) 16.024 4.438 ( -1.454 -1.403 2.510) 3.222 4.577 ( -0.567 -3.889 0.534) 3.966 4.745 ( -5.568 1.148 1.600) 5.906 4.930 ( 1.685 -2.156 -0.518) 2.785 5.035 ( 4.391 -1.082 -0.134) 4.525 5.209 ( -3.013 2.696 -3.531) 5.368 7.882 ( -5.915 -6.746 -0.468) 8.984 8.180 ( 5.778 -6.801 -0.126) 8.924 8.431 ( -10.150 1.638 -0.458) 10.292 9.000 ( 8.440 -4.169 0.591) 9.432 9.511 ( -0.701 -8.327 -0.709) 8.386 9.931 ( -2.637 3.195 0.946) 4.250 10.127 ( 2.371 -2.255 0.725) 3.351 10.460 ( 6.042 -6.710 0.120) 9.031 10.937 ( -19.156 6.039 0.433) 20.090 11.735 ( 16.763 11.134 -1.216) 20.160 12.159 ( -0.817 -2.793 -0.157) 2.914 12.845 ( 0.582 -5.635 0.471) 5.685 15.947 ( 0.150 15.133 -1.607) 15.218 17.928 ( -25.767 -4.076 -1.893) 26.156 18.745 ( -1.197 -25.042 -2.345) 25.180 19.233 ( 1.758 -13.517 -0.346) 13.636 21.009 ( -3.902 9.900 -3.149) 11.097 21.371 ( 1.461 5.163 7.147) 8.937 22.369 ( -1.667 6.222 -3.862) 7.511 22.782 ( 15.356 15.904 -1.705) 22.173 107.860 ( 0.131 -1.022 0.943) 1.397 107.880 ( 0.194 -1.559 -0.271) 1.594 108.439 ( 0.159 -0.110 -0.185) 0.268 108.465 ( -0.058 -0.789 -0.040) 0.792 ======================= Grid point 29 (18/259) ======================= q-point: ( 0.22 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.689 ( 6.554 20.159 0.511) 21.204 1.861 ( 4.957 22.150 4.047) 23.056 2.944 ( -1.360 8.492 -2.996) 9.107 3.275 ( 1.478 2.653 -0.106) 3.039 3.432 ( 7.023 18.047 -0.846) 19.384 4.030 ( -10.454 11.399 -0.856) 15.491 4.402 ( -3.937 -1.133 1.589) 4.394 4.557 ( -2.072 1.272 0.454) 2.473 4.700 ( -1.107 0.206 2.496) 2.738 4.928 ( -0.849 -3.168 -1.563) 3.633 5.116 ( 2.950 4.570 -6.826) 8.728 5.131 ( -0.315 1.462 2.903) 3.266 7.790 ( -4.563 -5.845 0.548) 7.436 8.132 ( -4.402 3.422 -2.835) 6.255 8.459 ( 7.311 -4.056 1.306) 8.462 9.072 ( -0.250 -8.394 1.548) 8.539 9.490 ( -0.769 -7.233 -1.024) 7.346 9.875 ( -3.136 4.675 -0.062) 5.630 10.076 ( -12.777 0.094 0.768) 12.801 10.570 ( 4.644 -7.702 0.650) 9.017 10.756 ( 2.767 -1.534 0.264) 3.174 11.991 ( 12.296 12.049 -1.808) 17.310 12.138 ( -1.051 -7.009 0.058) 7.088 12.851 ( -0.619 -3.461 0.435) 3.542 15.925 ( -0.613 16.602 -3.817) 17.046 17.402 ( -27.638 14.676 -0.185) 31.294 18.733 ( 1.681 -27.742 -2.630) 27.917 19.243 ( -0.421 -14.036 0.184) 14.044 20.934 ( -2.528 7.243 -1.432) 7.804 21.442 ( 0.342 3.208 8.378) 8.978 22.293 ( -2.530 7.724 -6.780) 10.584 23.057 ( 15.596 12.985 -3.021) 20.517 107.870 ( -0.093 -1.230 1.218) 1.734 107.883 ( 0.440 -1.660 -0.361) 1.755 108.441 ( 0.218 -0.182 -0.250) 0.378 108.463 ( -0.092 -0.663 -0.062) 0.672 ======================= Grid point 30 (19/259) ======================= q-point: ( 0.33 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.830 ( 8.814 16.314 0.591) 18.552 2.012 ( 6.408 16.239 5.030) 18.167 2.846 ( -4.569 2.935 -5.291) 7.581 3.274 ( -1.127 6.280 -1.854) 6.644 3.563 ( 6.628 8.354 -1.060) 10.717 3.846 ( -9.924 10.269 3.518) 14.707 4.338 ( -2.773 2.668 -1.151) 4.017 4.530 ( -1.667 2.755 1.559) 3.578 4.714 ( -0.047 0.746 2.844) 2.941 4.881 ( -1.222 -2.514 -4.601) 5.384 5.089 ( 0.517 8.033 -1.285) 8.151 5.201 ( 3.004 -0.285 0.788) 3.118 7.721 ( -3.624 -4.040 1.013) 5.521 8.093 ( 2.420 4.292 -3.145) 5.845 8.571 ( 2.900 -1.218 1.899) 3.675 9.062 ( -1.130 -11.522 0.884) 11.611 9.468 ( -0.773 -6.496 -1.510) 6.714 9.748 ( -15.760 -2.751 1.397) 16.060 9.848 ( -3.947 6.389 -0.183) 7.512 10.624 ( 1.538 -5.150 0.563) 5.404 10.941 ( 13.042 -5.753 -0.089) 14.255 12.053 ( -2.769 -11.601 -1.163) 11.984 12.222 ( 9.193 11.581 -0.151) 14.787 12.820 ( -2.956 -1.570 -0.032) 3.347 15.868 ( -1.741 18.618 -4.798) 19.305 17.012 ( -16.190 22.926 2.564) 28.183 18.754 ( 2.346 -30.662 -2.178) 30.829 19.229 ( -1.260 -12.153 0.653) 12.235 20.889 ( -1.792 4.481 -0.610) 4.865 21.521 ( 1.199 1.533 9.057) 9.264 22.178 ( -3.457 10.216 -8.582) 13.782 23.272 ( 10.266 12.617 -2.452) 16.450 107.874 ( -0.144 -1.238 0.635) 1.399 107.890 ( 0.357 -1.811 -0.002) 1.846 108.443 ( 0.173 -0.248 -0.192) 0.358 108.461 ( -0.084 -0.520 -0.056) 0.530 ======================= Grid point 31 (20/259) ======================= q-point: ( 0.44 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.997 ( 7.700 12.530 1.221) 14.757 2.105 ( -0.234 13.499 1.765) 13.616 2.754 ( -1.283 0.894 -2.864) 3.263 3.208 ( -3.163 7.230 -1.496) 8.032 3.651 ( 5.634 3.811 -2.980) 7.426 3.736 ( -6.832 6.676 5.135) 10.845 4.301 ( -0.310 6.830 -1.297) 6.959 4.516 ( -0.890 4.149 0.909) 4.340 4.733 ( -0.097 0.010 1.874) 1.876 4.837 ( -0.192 -1.238 -2.893) 3.153 5.099 ( 0.543 8.115 0.061) 8.133 5.241 ( 1.047 -0.126 0.254) 1.085 7.681 ( -1.377 -3.164 0.414) 3.475 8.136 ( 2.888 5.174 -1.424) 6.094 8.599 ( -0.223 0.948 1.038) 1.423 9.043 ( -1.397 -12.321 0.188) 12.401 9.425 ( -2.334 -4.329 -1.077) 5.035 9.569 ( -3.758 -7.901 1.013) 8.808 9.806 ( -1.353 5.568 0.018) 5.730 10.643 ( 0.354 -3.982 0.200) 4.003 11.131 ( 6.428 -3.845 -0.056) 7.491 11.987 ( -2.576 -17.841 -0.441) 18.031 12.361 ( 5.016 13.448 0.054) 14.353 12.759 ( -2.743 -0.923 -0.226) 2.903 15.811 ( -1.020 20.025 -2.182) 20.170 16.844 ( -4.839 24.928 1.556) 25.441 18.776 ( 1.109 -32.938 -0.882) 32.969 19.214 ( -0.656 -10.061 0.374) 10.090 20.862 ( -0.740 3.016 -0.213) 3.113 21.607 ( 1.259 -1.444 5.350) 5.683 22.064 ( -2.158 13.783 -5.255) 14.908 23.384 ( 3.545 12.908 -0.891) 13.416 107.875 ( -0.047 -1.222 0.178) 1.236 107.894 ( 0.115 -1.874 0.048) 1.878 108.444 ( 0.064 -0.283 -0.070) 0.299 108.460 ( -0.034 -0.430 -0.023) 0.432 ======================= Grid point 36 (21/259) ======================= q-point: ( 0.00 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.972 ( 0.000 19.856 0.000) 19.856 2.330 ( 0.000 25.410 0.000) 25.410 3.083 ( 0.000 -1.469 0.000) 1.469 3.335 ( 0.000 8.013 0.000) 8.013 3.766 ( 0.000 19.752 0.000) 19.752 4.355 ( 0.000 -10.453 0.000) 10.453 4.466 ( 0.000 3.054 0.000) 3.054 4.572 ( 0.000 11.086 0.000) 11.086 4.762 ( 0.000 -3.797 0.000) 3.797 4.938 ( 0.000 1.009 0.000) 1.009 5.034 ( 0.000 7.609 0.000) 7.609 5.261 ( 0.000 -0.371 0.000) 0.371 7.799 ( 0.000 -11.744 0.000) 11.744 7.879 ( 0.000 -7.132 0.000) 7.132 8.665 ( 0.000 3.558 0.000) 3.558 8.895 ( 0.000 4.633 0.000) 4.633 9.364 ( 0.000 -6.273 0.000) 6.273 9.835 ( 0.000 -8.128 0.000) 8.128 10.190 ( 0.000 2.212 0.000) 2.212 10.237 ( 0.000 -6.223 0.000) 6.223 11.463 ( 0.000 13.367 0.000) 13.367 11.630 ( 0.000 6.198 0.000) 6.198 12.148 ( 0.000 -1.558 0.000) 1.558 12.691 ( 0.000 -7.783 0.000) 7.783 16.255 ( 0.000 15.460 0.000) 15.460 17.818 ( 0.000 -18.797 0.000) 18.797 18.375 ( 0.000 -15.769 0.000) 15.769 18.970 ( 0.000 -13.113 0.000) 13.113 21.258 ( 0.000 7.964 0.000) 7.964 21.455 ( 0.000 6.542 0.000) 6.542 22.546 ( 0.000 8.627 0.000) 8.627 22.930 ( 0.000 11.045 0.000) 11.045 107.837 ( 0.000 -0.880 0.000) 0.880 107.849 ( 0.000 -1.424 0.000) 1.424 108.437 ( 0.000 -0.088 0.000) 0.088 108.451 ( 0.000 -0.643 0.000) 0.643 ======================= Grid point 37 (22/259) ======================= q-point: ( 0.11 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.001 ( 3.140 19.139 -0.277) 19.397 2.318 ( -1.432 25.023 1.128) 25.089 3.060 ( -1.954 -1.835 -1.586) 3.114 3.340 ( 0.707 7.124 -0.272) 7.164 3.771 ( 0.267 17.043 -0.082) 17.045 4.300 ( -7.806 -10.758 1.507) 13.376 4.416 ( -1.122 8.773 -2.094) 9.089 4.624 ( 3.287 7.212 0.679) 7.954 4.724 ( -3.178 -1.518 -0.254) 3.531 4.931 ( -0.502 0.492 -0.900) 1.142 5.074 ( 3.697 5.209 -0.096) 6.389 5.248 ( -0.579 1.187 -1.414) 1.934 7.731 ( -3.386 -7.348 -0.076) 8.091 8.007 ( 9.439 -9.596 0.266) 13.463 8.515 ( -9.922 5.775 -1.265) 11.550 8.956 ( 1.128 -0.956 1.313) 1.977 9.383 ( 2.144 -3.991 -1.363) 4.731 9.886 ( 4.438 -7.056 1.632) 8.494 10.103 ( -4.491 -0.302 -1.397) 4.713 10.342 ( 6.449 -5.074 1.028) 8.270 11.096 ( -23.499 9.638 -0.407) 25.402 11.942 ( 18.125 8.565 0.327) 20.049 12.085 ( -5.681 -3.742 -0.788) 6.848 12.730 ( 3.618 -5.761 -0.075) 6.803 16.261 ( 1.239 15.935 -1.509) 16.054 17.729 ( -9.694 -13.937 -0.214) 16.978 18.322 ( -4.264 -16.084 -0.759) 16.657 18.979 ( 0.319 -13.158 1.075) 13.206 21.193 ( -4.584 8.730 -2.792) 10.248 21.478 ( -0.238 5.053 4.827) 6.992 22.528 ( -0.372 9.480 -3.354) 10.063 23.038 ( 10.969 9.190 -0.693) 14.327 107.840 ( 0.091 -0.971 0.466) 1.081 107.850 ( 0.143 -1.427 -0.213) 1.449 108.437 ( 0.087 -0.109 -0.145) 0.201 108.451 ( 0.039 -0.597 -0.026) 0.599 ======================= Grid point 38 (23/259) ======================= q-point: ( 0.22 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.071 ( 5.146 17.639 -1.610) 18.445 2.317 ( 0.147 22.868 2.803) 23.040 2.986 ( -4.456 -1.338 -2.489) 5.276 3.354 ( 1.325 4.843 -1.444) 5.225 3.751 ( -2.870 8.944 -0.613) 9.413 4.124 ( -12.217 -5.316 3.041) 13.666 4.418 ( 2.163 9.154 -1.354) 9.503 4.641 ( -1.453 4.606 -1.802) 5.155 4.706 ( 1.622 1.654 0.904) 2.487 4.904 ( -1.137 0.487 -2.194) 2.518 5.141 ( 3.743 1.611 -0.794) 4.152 5.234 ( 0.043 4.641 -0.370) 4.656 7.696 ( -0.801 -3.181 0.179) 3.285 8.140 ( 3.326 -4.020 -0.812) 5.280 8.421 ( 2.748 1.451 -0.809) 3.211 8.923 ( -5.292 -6.427 2.512) 8.696 9.395 ( 0.224 -1.982 -1.624) 2.572 9.939 ( -3.607 2.299 -0.778) 4.348 10.020 ( -3.690 -6.664 0.084) 7.618 10.459 ( 5.059 -3.933 1.049) 6.494 10.766 ( -8.943 3.456 0.282) 9.592 11.939 ( -8.493 -10.690 -0.535) 13.663 12.238 ( 13.816 10.565 -0.385) 17.397 12.788 ( 2.466 -2.891 -0.568) 3.842 16.268 ( 1.368 17.357 -3.457) 17.750 17.496 ( -15.003 -3.393 1.402) 15.445 18.254 ( -2.173 -18.522 -0.971) 18.674 18.994 ( 0.241 -12.531 1.593) 12.634 21.087 ( -4.562 8.384 -2.233) 9.802 21.508 ( -1.026 2.861 6.298) 6.993 22.486 ( -0.459 11.463 -5.827) 12.867 23.257 ( 12.961 6.632 -1.305) 14.617 107.846 ( -0.011 -1.119 0.759) 1.352 107.851 ( 0.326 -1.469 -0.412) 1.560 108.437 ( 0.135 -0.146 -0.198) 0.280 108.451 ( 0.052 -0.496 -0.058) 0.502 ======================= Grid point 39 (24/259) ======================= q-point: ( 0.33 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.159 ( 6.558 15.944 -2.624) 17.439 2.366 ( 1.767 18.606 3.940) 19.101 2.876 ( -5.247 0.701 -2.247) 5.751 3.349 ( -0.366 2.334 -4.019) 4.662 3.669 ( -4.235 1.052 -0.033) 4.363 3.941 ( -10.885 -2.615 4.437) 12.042 4.458 ( 2.974 10.681 -1.190) 11.152 4.606 ( -0.675 3.901 -1.241) 4.149 4.738 ( 1.120 2.100 0.159) 2.385 4.864 ( -1.028 1.399 -2.847) 3.335 5.193 ( 3.016 -0.174 -1.183) 3.245 5.245 ( 0.480 6.264 1.347) 6.425 7.691 ( -0.388 1.004 0.509) 1.190 8.161 ( 2.813 1.719 -2.247) 3.990 8.542 ( 7.040 -1.631 0.666) 7.257 8.848 ( -4.007 -9.302 2.168) 10.358 9.371 ( -1.283 -2.903 -1.685) 3.593 9.699 ( -17.848 -2.436 -0.229) 18.015 9.980 ( -1.760 5.984 -0.080) 6.238 10.512 ( 1.095 -4.206 0.525) 4.378 10.831 ( 11.383 -5.973 0.686) 12.873 11.772 ( -9.460 -15.210 -0.464) 17.918 12.446 ( 9.694 9.759 -0.284) 13.758 12.799 ( -0.733 -0.710 -0.983) 1.417 16.254 ( 0.369 19.436 -4.340) 19.918 17.268 ( -11.167 3.853 3.084) 12.209 18.225 ( -0.480 -20.645 -0.812) 20.667 19.011 ( 0.377 -11.251 1.449) 11.350 21.003 ( -3.234 7.385 -1.322) 8.169 21.539 ( -0.741 0.058 5.972) 6.018 22.427 ( -0.816 14.455 -6.163) 15.735 23.454 ( 9.373 5.315 -1.180) 10.840 107.850 ( -0.050 -1.179 0.384) 1.241 107.855 ( 0.292 -1.565 -0.114) 1.596 108.439 ( 0.124 -0.161 -0.151) 0.254 108.452 ( 0.035 -0.401 -0.067) 0.408 ======================= Grid point 40 (25/259) ======================= q-point: ( 0.44 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.263 ( 5.856 13.684 -1.550) 14.965 2.398 ( -1.450 15.069 2.145) 15.290 2.794 ( -1.941 3.203 -0.665) 3.803 3.279 ( -2.677 1.059 -2.769) 3.994 3.655 ( 2.141 -2.918 -0.010) 3.620 3.801 ( -7.017 -1.097 2.553) 7.547 4.492 ( 1.298 10.923 -0.638) 11.018 4.597 ( 0.009 3.455 -0.247) 3.464 4.749 ( 0.229 1.816 -0.038) 1.830 4.834 ( -0.366 2.375 -1.340) 2.751 5.230 ( 1.567 -0.940 -0.654) 1.941 5.259 ( -0.093 6.495 0.969) 6.568 7.686 ( -0.372 3.532 0.280) 3.563 8.214 ( 3.261 1.920 -1.231) 3.979 8.626 ( 1.958 1.768 0.764) 2.746 8.819 ( -1.138 -9.653 0.616) 9.740 9.342 ( 0.522 -4.099 -1.840) 4.523 9.432 ( -9.993 -5.179 1.208) 11.320 9.955 ( -0.798 8.982 -0.053) 9.018 10.527 ( 0.350 -6.204 0.168) 6.216 11.040 ( 8.413 -6.036 0.331) 10.360 11.613 ( -6.470 -19.208 -0.259) 20.270 12.584 ( 5.287 8.793 0.126) 10.261 12.756 ( -2.546 0.609 -0.718) 2.715 16.228 ( -0.139 21.034 -2.030) 21.132 17.153 ( -3.756 6.525 1.654) 7.708 18.218 ( -0.016 -21.641 -0.312) 21.643 19.026 ( 0.217 -10.211 0.591) 10.230 20.955 ( -1.199 6.812 -0.446) 6.931 21.565 ( -0.195 -2.624 2.652) 3.736 22.377 ( -0.473 17.241 -2.811) 17.475 23.564 ( 3.362 4.870 -0.458) 5.935 107.851 ( -0.005 -1.189 0.087) 1.192 107.859 ( 0.093 -1.630 0.012) 1.632 108.439 ( 0.052 -0.159 -0.054) 0.176 108.452 ( 0.010 -0.349 -0.031) 0.351 ======================= Grid point 45 (26/259) ======================= q-point: ( 0.00 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.323 ( 0.000 15.320 0.000) 15.320 2.821 ( 0.000 23.587 0.000) 23.587 2.984 ( 0.000 -7.219 0.000) 7.219 3.513 ( 0.000 9.517 0.000) 9.517 3.938 ( 0.000 -1.729 0.000) 1.729 4.072 ( 0.000 -15.609 0.000) 15.609 4.684 ( 0.000 8.141 0.000) 8.141 4.712 ( 0.000 3.145 0.000) 3.145 4.750 ( 0.000 8.599 0.000) 8.599 4.971 ( 0.000 3.230 0.000) 3.230 5.183 ( 0.000 5.585 0.000) 5.585 5.238 ( 0.000 -1.956 0.000) 1.956 7.614 ( 0.000 -6.339 0.000) 6.339 7.727 ( 0.000 -7.458 0.000) 7.458 8.767 ( 0.000 6.189 0.000) 6.189 8.974 ( 0.000 2.543 0.000) 2.543 9.281 ( 0.000 -1.745 0.000) 1.745 9.635 ( 0.000 -11.015 0.000) 11.015 10.153 ( 0.000 -2.222 0.000) 2.222 10.204 ( 0.000 -0.614 0.000) 0.614 11.727 ( 0.000 12.146 0.000) 12.146 11.744 ( 0.000 5.236 0.000) 5.236 12.112 ( 0.000 -1.436 0.000) 1.436 12.523 ( 0.000 -8.951 0.000) 8.951 16.561 ( 0.000 14.933 0.000) 14.933 17.456 ( 0.000 -17.116 0.000) 17.116 18.169 ( 0.000 -4.657 0.000) 4.657 18.684 ( 0.000 -15.082 0.000) 15.082 21.406 ( 0.000 6.849 0.000) 6.849 21.556 ( 0.000 3.304 0.000) 3.304 22.735 ( 0.000 9.843 0.000) 9.843 23.066 ( 0.000 2.707 0.000) 2.707 107.821 ( 0.000 -0.696 0.000) 0.696 107.825 ( 0.000 -0.968 0.000) 0.968 108.435 ( 0.000 -0.072 0.000) 0.072 108.440 ( 0.000 -0.376 0.000) 0.376 ======================= Grid point 46 (27/259) ======================= q-point: ( 0.11 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.341 ( 2.321 14.917 -0.957) 15.127 2.800 ( -2.650 23.031 1.544) 23.234 2.971 ( -1.209 -6.363 -0.792) 6.525 3.498 ( -1.381 8.340 -0.597) 8.474 3.904 ( -3.646 -1.988 -0.631) 4.201 4.019 ( -6.196 -15.577 1.638) 16.844 4.673 ( 0.491 7.352 -2.454) 7.766 4.728 ( 0.867 2.337 -1.450) 2.883 4.748 ( 0.556 10.213 0.139) 10.229 4.968 ( -0.030 3.671 -0.889) 3.777 5.168 ( -0.130 2.418 -2.066) 3.183 5.265 ( 1.531 0.761 1.755) 2.450 7.617 ( 1.212 -3.626 0.207) 3.829 7.819 ( 8.695 -8.823 0.177) 12.388 8.642 ( -9.584 6.578 -1.187) 11.685 8.930 ( -6.022 -2.045 1.506) 6.536 9.358 ( 6.257 1.229 -1.554) 6.564 9.706 ( 7.227 -9.678 0.808) 12.106 10.100 ( -4.310 0.077 -1.845) 4.689 10.250 ( 3.747 -4.309 1.015) 5.800 11.308 ( -24.030 11.152 -0.377) 26.495 11.919 ( -8.154 -7.527 -0.045) 11.097 12.167 ( 14.620 8.733 -0.224) 17.032 12.613 ( 7.558 -6.028 -0.395) 9.676 16.574 ( 1.808 15.044 -1.093) 15.192 17.425 ( -3.284 -15.479 -0.337) 15.827 18.121 ( -4.706 -3.911 0.035) 6.119 18.691 ( 0.207 -15.411 1.174) 15.457 21.359 ( -4.269 7.684 -0.942) 8.840 21.555 ( -1.434 2.300 2.656) 3.795 22.736 ( 1.219 10.932 -2.553) 11.292 23.143 ( 8.004 1.368 -0.276) 8.125 107.823 ( 0.092 -0.750 0.132) 0.767 107.825 ( 0.096 -0.960 -0.095) 0.969 108.435 ( 0.070 -0.071 -0.148) 0.179 108.441 ( 0.100 -0.357 -0.008) 0.370 ======================= Grid point 47 (28/259) ======================= q-point: ( 0.22 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.388 ( 4.007 14.000 -2.044) 14.705 2.763 ( -2.904 21.489 2.616) 21.841 2.929 ( -2.507 -4.281 -0.929) 5.047 3.455 ( -2.370 4.953 -1.838) 5.790 3.792 ( -7.782 -2.552 -1.511) 8.328 3.899 ( -8.326 -14.162 3.334) 16.763 4.669 ( 1.174 5.337 -2.820) 6.149 4.712 ( -0.340 7.433 -2.142) 7.742 4.775 ( 2.056 5.872 -1.153) 6.328 4.957 ( -0.065 4.876 -1.543) 5.115 5.160 ( 0.634 0.063 -1.048) 1.227 5.305 ( 1.393 1.949 1.426) 2.788 7.670 ( 4.345 0.659 0.034) 4.394 8.000 ( 9.944 -8.422 0.373) 13.037 8.496 ( -3.799 4.954 -1.499) 6.421 8.806 ( -8.389 -5.494 2.309) 10.291 9.409 ( 0.522 3.090 -1.815) 3.621 9.841 ( 1.626 -9.877 -0.612) 10.028 9.990 ( -2.543 3.180 -1.477) 4.331 10.356 ( 7.239 -6.676 1.114) 9.910 10.913 ( -18.182 10.640 0.238) 21.068 11.701 ( -13.399 -12.849 -0.223) 18.566 12.427 ( 12.675 8.190 -0.442) 15.097 12.731 ( 5.477 -2.990 -1.066) 6.330 16.601 ( 2.499 15.459 -2.478) 15.855 17.336 ( -6.199 -10.944 0.285) 12.581 18.032 ( -4.634 -3.402 0.454) 5.766 18.710 ( 0.678 -15.900 1.772) 16.012 21.262 ( -5.257 8.626 -0.653) 10.122 21.542 ( -2.576 0.262 3.527) 4.376 22.741 ( 1.969 13.605 -4.030) 14.326 23.313 ( 10.316 -1.063 -0.617) 10.389 107.826 ( 0.127 -0.877 0.182) 0.905 107.827 ( 0.148 -0.934 -0.135) 0.955 108.435 ( 0.129 -0.053 -0.184) 0.231 108.443 ( 0.130 -0.322 -0.054) 0.351 ======================= Grid point 48 (29/259) ======================= q-point: ( 0.33 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.451 ( 5.107 13.045 -2.821) 14.290 2.732 ( -3.270 16.729 2.656) 17.251 2.883 ( -1.534 0.681 0.186) 1.689 3.381 ( -3.744 0.805 -3.622) 5.272 3.636 ( -7.115 -3.365 -0.570) 7.891 3.783 ( -7.162 -11.046 3.143) 13.535 4.667 ( 0.656 3.317 -2.268) 4.071 4.694 ( 0.112 8.625 -1.700) 8.792 4.795 ( 1.419 4.372 -1.713) 4.905 4.945 ( -0.032 6.200 -1.396) 6.355 5.172 ( 0.919 -1.638 0.082) 1.880 5.333 ( 0.806 1.884 0.874) 2.228 7.754 ( 4.183 4.981 0.077) 6.505 8.138 ( 5.241 -4.024 -0.498) 6.626 8.521 ( 6.871 -0.110 -0.681) 6.905 8.694 ( -5.339 -6.260 2.458) 8.586 9.361 ( -3.874 1.809 -1.717) 4.607 9.637 ( -16.270 -4.124 -1.743) 16.875 10.072 ( 6.063 3.829 -0.070) 7.171 10.480 ( 2.046 -1.637 0.737) 2.722 10.730 ( 0.532 -1.080 0.557) 1.327 11.458 ( -13.274 -15.927 -0.086) 20.733 12.608 ( 8.025 6.515 -0.534) 10.350 12.786 ( 1.717 -0.698 -1.308) 2.268 16.619 ( 1.753 16.266 -3.205) 16.671 17.228 ( -5.874 -6.253 1.433) 8.698 17.973 ( -2.331 -3.845 0.550) 4.530 18.740 ( 1.102 -16.075 1.614) 16.194 21.173 ( -4.002 8.958 -0.229) 9.814 21.520 ( -2.462 -2.043 2.944) 4.348 22.744 ( 1.619 16.790 -3.709) 17.271 23.478 ( 7.905 -2.945 -0.631) 8.459 107.828 ( 0.163 -0.919 -0.185) 0.952 107.829 ( 0.067 -0.990 0.217) 1.016 108.437 ( 0.131 -0.030 -0.136) 0.191 108.445 ( 0.097 -0.285 -0.071) 0.309 ======================= Grid point 49 (30/259) ======================= q-point: ( 0.44 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.526 ( 4.649 12.021 -2.048) 13.051 2.672 ( -4.310 10.939 1.451) 11.847 2.888 ( 0.742 6.790 1.067) 6.913 3.281 ( -3.286 -0.510 -2.429) 4.118 3.560 ( -1.443 -5.933 -0.045) 6.106 3.700 ( -3.411 -8.029 1.409) 8.837 4.662 ( 0.186 3.453 -0.911) 3.576 4.688 ( 0.095 7.521 -0.598) 7.545 4.802 ( 0.482 3.744 -0.787) 3.856 4.937 ( -0.002 6.946 -0.537) 6.967 5.186 ( 0.409 -2.823 0.192) 2.859 5.347 ( 0.242 1.536 0.291) 1.582 7.803 ( 1.195 7.594 0.099) 7.688 8.203 ( 2.409 -2.845 -0.572) 3.771 8.646 ( 4.137 -0.910 0.902) 4.331 8.668 ( 0.921 -4.940 0.283) 5.033 9.280 ( -2.231 -1.350 -1.179) 2.862 9.363 ( -10.562 -2.271 -0.276) 10.807 10.150 ( 2.418 10.028 0.024) 10.316 10.449 ( -2.266 -0.560 0.160) 2.339 10.879 ( 9.887 -9.661 0.359) 13.828 11.233 ( -10.437 -18.254 -0.094) 21.028 12.716 ( 4.359 4.589 -0.033) 6.329 12.778 ( -1.459 1.360 -0.810) 2.152 16.620 ( 0.513 17.046 -1.566) 17.125 17.162 ( -2.252 -3.963 0.921) 4.650 17.951 ( -0.612 -4.142 0.233) 4.194 18.765 ( 0.572 -16.036 0.658) 16.059 21.122 ( -1.485 9.021 -0.035) 9.143 21.503 ( -1.019 -3.674 1.147) 3.982 22.744 ( 0.601 18.999 -1.509) 19.068 23.574 ( 2.908 -3.894 -0.262) 4.867 107.830 ( 0.066 -0.895 -0.073) 0.900 107.831 ( 0.022 -1.069 0.084) 1.072 108.438 ( 0.056 -0.017 -0.048) 0.076 108.446 ( 0.033 -0.258 -0.033) 0.262 ======================= Grid point 54 (31/259) ======================= q-point: ( 0.00 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.594 ( 0.000 12.039 0.000) 12.039 2.812 ( 0.000 -9.796 0.000) 9.796 3.274 ( 0.000 21.656 0.000) 21.656 3.684 ( 0.000 -19.167 0.000) 19.167 3.703 ( 0.000 9.201 0.000) 9.201 3.871 ( 0.000 -7.371 0.000) 7.371 4.715 ( 0.000 0.813 0.000) 0.813 4.730 ( 0.000 -0.448 0.000) 0.448 5.020 ( 0.000 9.728 0.000) 9.728 5.050 ( 0.000 3.644 0.000) 3.644 5.194 ( 0.000 -1.406 0.000) 1.406 5.225 ( 0.000 -1.530 0.000) 1.530 7.550 ( 0.000 -0.139 0.000) 0.139 7.600 ( 0.000 -4.820 0.000) 4.820 8.893 ( 0.000 5.869 0.000) 5.869 8.979 ( 0.000 -2.189 0.000) 2.189 9.300 ( 0.000 3.723 0.000) 3.723 9.429 ( 0.000 -8.868 0.000) 8.868 10.142 ( 0.000 0.902 0.000) 0.902 10.175 ( 0.000 -1.956 0.000) 1.956 11.840 ( 0.000 4.129 0.000) 4.129 11.882 ( 0.000 1.626 0.000) 1.626 12.148 ( 0.000 6.715 0.000) 6.715 12.333 ( 0.000 -9.996 0.000) 9.996 16.850 ( 0.000 14.107 0.000) 14.107 17.137 ( 0.000 -14.884 0.000) 14.884 18.188 ( 0.000 6.229 0.000) 6.229 18.392 ( 0.000 -13.289 0.000) 13.289 21.524 ( 0.000 4.630 0.000) 4.630 21.581 ( 0.000 -0.891 0.000) 0.891 22.921 ( 0.000 8.279 0.000) 8.279 23.049 ( 0.000 -4.015 0.000) 4.015 107.811 ( 0.000 -0.267 0.000) 0.267 107.812 ( 0.000 -0.339 0.000) 0.339 108.434 ( 0.000 -0.003 0.000) 0.003 108.435 ( 0.000 -0.146 0.000) 0.146 ======================= Grid point 55 (32/259) ======================= q-point: ( 0.11 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.605 ( 1.427 11.640 -0.710) 11.748 2.812 ( 0.196 -9.154 -0.388) 9.164 3.243 ( -3.800 21.005 1.413) 21.392 3.618 ( -5.406 -9.300 -1.269) 10.832 3.701 ( -2.357 -1.245 2.171) 3.438 3.827 ( -4.514 -6.669 -0.497) 8.068 4.714 ( 0.851 1.281 -2.025) 2.543 4.737 ( 1.410 -0.771 -1.943) 2.521 4.998 ( -1.212 8.251 -1.524) 8.477 5.055 ( 0.382 2.964 -1.172) 3.210 5.182 ( -0.206 1.600 -0.380) 1.657 5.255 ( 1.732 -2.733 1.221) 3.459 7.594 ( 4.863 1.392 0.242) 5.064 7.669 ( 7.153 -5.858 0.188) 9.247 8.769 ( -10.231 5.886 -0.467) 11.812 8.870 ( -9.740 -4.048 0.684) 10.570 9.415 ( 8.854 4.291 -0.961) 9.886 9.531 ( 9.060 -7.376 -0.047) 11.682 10.116 ( -2.369 1.716 -1.212) 3.166 10.170 ( 0.099 -3.518 -0.090) 3.520 11.532 ( -21.207 11.007 -0.168) 23.894 11.742 ( -16.007 -9.868 -0.137) 18.805 12.337 ( 14.638 8.005 -0.256) 16.686 12.485 ( 11.559 -6.849 -0.429) 13.443 16.859 ( 1.133 13.569 -0.554) 13.628 17.130 ( -0.632 -13.927 -0.319) 13.945 18.160 ( -2.892 7.375 0.179) 7.924 18.386 ( -0.848 -14.227 0.635) 14.266 21.491 ( -3.473 5.313 0.282) 6.354 21.563 ( -2.496 -1.645 1.170) 3.211 22.947 ( 3.243 9.598 -1.351) 10.221 23.101 ( 5.547 -5.321 -0.474) 7.701 107.812 ( 0.097 -0.281 -0.063) 0.304 107.812 ( 0.072 -0.339 0.004) 0.347 108.434 ( 0.089 0.028 -0.111) 0.145 108.436 ( 0.110 -0.168 -0.041) 0.205 ======================= Grid point 56 (33/259) ======================= q-point: ( 0.22 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.633 ( 2.523 10.583 -1.313) 10.958 2.813 ( 0.247 -7.387 -0.609) 7.416 3.171 ( -5.342 19.100 2.289) 19.965 3.489 ( -7.563 -7.968 -0.929) 11.025 3.653 ( -4.483 -3.863 2.051) 6.263 3.710 ( -7.324 -4.805 -1.134) 8.832 4.717 ( 1.572 1.951 -2.976) 3.890 4.748 ( 2.008 -0.852 -3.522) 4.142 4.963 ( -1.391 7.333 -1.203) 7.560 5.043 ( -0.224 0.307 -1.821) 1.860 5.184 ( 0.237 4.725 0.314) 4.741 5.290 ( 1.203 -3.594 0.727) 3.859 7.721 ( 8.589 4.339 0.119) 9.623 7.839 ( 10.701 -7.245 0.350) 12.927 8.598 ( -7.200 5.062 -0.412) 8.811 8.700 ( -8.930 -5.161 1.118) 10.375 9.506 ( 1.105 6.268 -1.706) 6.589 9.654 ( 1.836 -8.514 -1.281) 8.803 10.076 ( 1.223 5.551 -1.043) 5.780 10.209 ( 5.063 -7.438 0.070) 8.998 11.159 ( -19.310 13.366 0.316) 23.487 11.433 ( -17.166 -13.750 0.113) 21.994 12.566 ( 10.759 5.794 -0.775) 12.244 12.663 ( 8.276 -3.967 -1.073) 9.240 16.876 ( 1.353 12.157 -1.189) 12.290 17.107 ( -1.619 -11.412 -0.347) 11.532 18.104 ( -3.136 9.823 0.624) 10.331 18.379 ( -0.489 -16.280 1.125) 16.326 21.416 ( -4.868 6.460 0.612) 8.112 21.513 ( -3.913 -3.166 1.605) 5.283 23.009 ( 4.744 12.559 -2.053) 13.581 23.220 ( 7.595 -8.023 -0.827) 11.078 107.813 ( 0.161 -0.302 -0.133) 0.367 107.814 ( 0.093 -0.350 0.039) 0.365 108.436 ( 0.150 0.072 -0.143) 0.219 108.438 ( 0.155 -0.193 -0.087) 0.262 ======================= Grid point 57 (34/259) ======================= q-point: ( 0.33 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.674 ( 3.218 9.058 -1.594) 9.744 2.808 ( -0.464 -4.211 -0.411) 4.257 3.102 ( -3.782 15.615 2.367) 16.240 3.348 ( -6.857 -6.565 -0.787) 9.526 3.564 ( -6.764 -2.985 -1.736) 7.594 3.584 ( -4.658 -5.841 1.713) 7.664 4.724 ( 1.533 2.470 -2.749) 4.001 4.755 ( 1.716 -0.309 -3.393) 3.815 4.933 ( -1.236 6.810 -0.420) 6.934 5.027 ( -0.281 -1.304 -1.027) 1.684 5.188 ( -0.160 5.487 0.269) 5.496 5.308 ( 0.349 -4.385 0.230) 4.405 7.877 ( 7.645 6.991 -0.023) 10.360 8.021 ( 8.151 -7.007 0.074) 10.749 8.538 ( 1.276 1.718 0.046) 2.141 8.592 ( -3.425 -3.861 1.489) 5.372 9.430 ( -6.866 4.748 -1.969) 8.577 9.536 ( -11.143 -5.522 -2.174) 12.625 10.178 ( 8.917 7.301 -0.172) 11.526 10.352 ( 9.736 -9.234 0.210) 13.420 10.863 ( -13.611 12.041 0.544) 18.180 11.144 ( -15.045 -15.285 0.330) 21.450 12.710 ( 6.056 3.760 -0.921) 7.187 12.763 ( 4.013 -1.751 -1.219) 4.545 16.885 ( 0.749 10.588 -1.479) 10.717 17.072 ( -1.964 -8.616 -0.002) 8.837 18.067 ( -1.583 12.068 0.817) 12.199 18.387 ( 0.390 -18.196 1.147) 18.237 21.338 ( -4.026 7.175 0.640) 8.252 21.455 ( -3.530 -4.497 1.298) 5.863 23.075 ( 3.921 15.559 -1.814) 16.147 23.341 ( 6.056 -10.489 -0.791) 12.138 107.815 ( 0.166 -0.320 -0.164) 0.396 107.816 ( 0.054 -0.365 0.078) 0.377 108.437 ( 0.140 0.094 -0.114) 0.204 108.440 ( 0.128 -0.192 -0.088) 0.247 ======================= Grid point 58 (35/259) ======================= q-point: ( 0.44 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.721 ( 2.846 6.914 -1.142) 7.563 2.786 ( -1.794 0.706 0.268) 1.947 3.078 ( -0.639 10.819 1.216) 10.906 3.247 ( -3.268 -4.462 -0.522) 5.555 3.461 ( -2.909 -1.778 -0.776) 3.497 3.531 ( -1.907 -7.484 0.576) 7.745 4.729 ( 0.634 2.823 -1.196) 3.130 4.759 ( 0.668 0.243 -1.334) 1.511 4.915 ( -0.513 6.569 -0.030) 6.589 5.019 ( -0.109 -2.055 -0.263) 2.075 5.185 ( -0.178 5.298 0.086) 5.302 5.310 ( -0.014 -4.966 0.019) 4.966 7.966 ( 2.179 8.118 -0.014) 8.405 8.111 ( 2.194 -6.121 -0.147) 6.504 8.599 ( 1.740 -0.923 0.960) 2.191 8.617 ( 4.744 -2.162 0.266) 5.220 9.288 ( -5.414 1.594 -1.077) 5.745 9.324 ( -8.090 -1.814 -1.028) 8.355 10.343 ( 8.379 9.359 -0.056) 12.562 10.484 ( 0.800 -0.696 0.118) 1.067 10.721 ( 0.668 -1.132 0.225) 1.334 10.900 ( -11.812 -14.551 0.204) 18.743 12.779 ( 2.392 1.908 -0.362) 3.081 12.796 ( 0.581 0.140 -0.598) 0.845 16.884 ( 0.164 9.718 -0.719) 9.746 17.045 ( -0.869 -7.023 0.117) 7.078 18.055 ( -0.350 13.341 0.376) 13.351 18.402 ( 0.356 -19.257 0.491) 19.267 21.290 ( -1.549 7.420 0.273) 7.584 21.415 ( -1.423 -5.199 0.489) 5.412 23.115 ( 1.487 17.387 -0.720) 17.465 23.414 ( 2.266 -11.889 -0.325) 12.108 107.817 ( 0.113 -0.342 -0.153) 0.391 107.817 ( -0.027 -0.361 0.118) 0.381 108.439 ( 0.057 0.097 -0.043) 0.120 108.441 ( 0.049 -0.180 -0.037) 0.190 ======================= Grid point 117 (36/259) ======================= q-point: ( 0.00 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.347 ( 8.294 0.000 16.357) 18.340 0.550 ( 2.181 0.000 26.780) 26.868 0.930 ( 2.085 0.000 44.786) 44.834 2.999 ( 6.454 0.000 -8.083) 10.343 3.352 ( 0.076 0.000 -5.762) 5.763 3.390 ( -1.535 0.000 1.819) 2.380 4.152 ( -0.823 0.000 0.881) 1.206 4.563 ( 0.789 0.000 -1.218) 1.451 4.580 ( 0.794 0.000 -2.300) 2.433 4.814 ( -1.298 0.000 3.494) 3.727 5.271 ( 2.612 0.000 -1.047) 2.814 6.756 ( -5.529 0.000 -6.257) 8.350 7.968 ( 0.265 0.000 0.011) 0.265 8.111 ( 0.103 0.000 -0.285) 0.303 8.347 ( -7.496 0.000 -0.223) 7.500 9.112 ( -0.551 0.000 1.152) 1.277 9.407 ( 0.225 0.000 0.035) 0.228 9.616 ( 33.699 0.000 1.433) 33.729 9.996 ( 0.109 0.000 -0.336) 0.353 10.660 ( -1.620 0.000 -0.431) 1.677 10.992 ( -0.045 0.000 -0.116) 0.125 11.581 ( -12.062 0.000 0.074) 12.062 12.147 ( 0.993 0.000 0.241) 1.021 13.657 ( -5.988 0.000 -0.442) 6.004 14.742 ( 0.176 0.000 1.666) 1.675 15.408 ( -0.917 0.000 -1.101) 1.433 19.805 ( -0.439 0.000 0.689) 0.817 20.273 ( 0.555 0.000 -0.761) 0.942 20.677 ( 16.358 0.000 2.263) 16.514 20.697 ( -0.338 0.000 0.517) 0.618 21.713 ( -16.858 0.000 1.379) 16.915 22.344 ( -0.188 0.000 -1.160) 1.175 107.937 ( 0.094 0.000 0.102) 0.139 107.978 ( 3.906 0.000 0.198) 3.911 108.513 ( -0.399 0.000 1.042) 1.116 108.737 ( -12.393 0.000 -0.682) 12.412 ======================= Grid point 118 (37/259) ======================= q-point: ( 0.11 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.924 ( 29.668 0.000 12.172) 32.068 0.962 ( 19.092 0.000 20.626) 28.106 1.346 ( 8.331 0.000 38.206) 39.104 3.076 ( 4.772 0.000 -12.297) 13.191 3.276 ( -3.010 0.000 -7.249) 7.849 3.391 ( 3.929 0.000 -7.436) 8.411 4.147 ( -0.203 0.000 0.242) 0.315 4.556 ( -0.543 0.000 -0.889) 1.042 4.580 ( 1.148 0.000 -1.949) 2.261 4.767 ( -6.343 0.000 4.354) 7.694 5.295 ( 0.161 0.000 0.906) 0.920 6.002 ( -40.071 0.000 17.315) 43.652 7.966 ( -0.777 0.000 0.538) 0.945 8.099 ( -1.029 0.000 -0.352) 1.087 8.720 ( 22.375 0.000 -8.674) 23.997 8.982 ( -11.290 0.000 1.114) 11.344 9.527 ( 9.480 0.000 0.207) 9.483 9.998 ( 0.283 0.000 -0.342) 0.444 10.239 ( 20.309 0.000 -22.058) 29.984 10.672 ( 10.878 0.000 -4.272) 11.687 10.916 ( -6.139 0.000 -0.085) 6.140 11.502 ( -0.269 0.000 4.204) 4.213 12.218 ( 6.885 0.000 -0.068) 6.886 13.390 ( -18.735 0.000 8.408) 20.535 14.779 ( 2.227 0.000 2.320) 3.216 15.366 ( -2.475 0.000 -1.972) 3.165 19.843 ( 3.497 0.000 0.729) 3.572 20.288 ( 1.650 0.000 -0.570) 1.745 20.681 ( -1.745 0.000 0.384) 1.787 21.192 ( 29.032 0.000 -16.440) 33.364 21.655 ( 3.515 0.000 1.379) 3.776 22.311 ( -1.610 0.000 -1.900) 2.490 107.934 ( -0.313 0.000 0.037) 0.315 108.009 ( 0.073 0.000 -0.079) 0.108 108.510 ( -0.998 0.000 1.229) 1.583 108.541 ( -8.123 0.000 5.498) 9.809 ======================= Grid point 119 (38/259) ======================= q-point: ( 0.22 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.443 ( 13.717 0.000 19.960) 24.219 1.471 ( 21.518 0.000 15.381) 26.450 1.773 ( 12.395 0.000 20.638) 24.074 3.027 ( 0.170 0.000 -6.363) 6.366 3.136 ( -6.260 0.000 -7.862) 10.050 3.394 ( 5.977 0.000 -14.884) 16.039 4.148 ( 0.518 0.000 -0.682) 0.856 4.532 ( -1.524 0.000 -0.435) 1.585 4.591 ( 1.272 0.000 -1.473) 1.946 4.689 ( -5.819 0.000 6.120) 8.445 5.293 ( -1.618 0.000 1.332) 2.096 5.609 ( -18.869 0.000 9.992) 21.352 7.957 ( -0.452 0.000 0.273) 0.528 8.072 ( -1.568 0.000 -0.499) 1.646 8.784 ( -10.955 0.000 1.289) 11.031 9.008 ( 16.319 0.000 -4.374) 16.895 9.694 ( 8.487 0.000 0.144) 8.488 10.000 ( 0.141 0.000 -0.313) 0.344 10.107 ( -11.324 0.000 -8.772) 14.324 10.714 ( -6.874 0.000 0.810) 6.922 11.029 ( 19.180 0.000 -9.489) 21.399 11.531 ( -0.865 0.000 3.434) 3.541 12.376 ( 10.728 0.000 -2.099) 10.931 13.158 ( -13.247 0.000 5.401) 14.306 14.855 ( 3.978 0.000 2.851) 4.894 15.292 ( -3.814 0.000 -2.400) 4.506 19.920 ( 3.852 0.000 1.192) 4.032 20.323 ( 2.558 0.000 -0.335) 2.580 20.641 ( -2.858 0.000 0.147) 2.862 21.432 ( 10.663 0.000 -6.971) 12.740 21.737 ( 4.591 0.000 -4.304) 6.294 22.286 ( 1.878 0.000 -3.739) 4.184 107.928 ( -0.346 0.000 -0.158) 0.380 108.002 ( -0.913 0.000 0.908) 1.288 108.482 ( -2.505 0.000 3.043) 3.942 108.507 ( -1.097 0.000 1.481) 1.843 ======================= Grid point 120 (39/259) ======================= q-point: ( 0.33 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.723 ( 1.039 0.000 17.641) 17.672 1.942 ( 18.699 0.000 11.573) 21.990 1.999 ( -0.406 0.000 9.148) 9.157 2.936 ( -9.040 0.000 -7.778) 11.926 3.071 ( 8.483 0.000 -0.777) 8.519 3.413 ( 8.702 0.000 -12.446) 15.186 4.158 ( 1.408 0.000 -1.310) 1.923 4.498 ( -1.904 0.000 -0.049) 1.905 4.593 ( -0.073 0.000 -1.468) 1.470 4.666 ( -2.039 0.000 6.353) 6.672 5.217 ( -7.721 0.000 -2.740) 8.193 5.424 ( -8.048 0.000 6.035) 10.060 7.954 ( 0.316 0.000 -0.772) 0.834 8.041 ( -1.236 0.000 -0.661) 1.402 8.622 ( -7.921 0.000 1.410) 8.046 9.246 ( 12.426 0.000 -2.101) 12.602 9.828 ( 6.154 0.000 0.048) 6.154 9.843 ( -10.706 0.000 -5.489) 12.032 9.995 ( -0.509 0.000 -0.253) 0.569 10.598 ( -6.571 0.000 2.876) 7.173 11.263 ( 11.235 0.000 -3.912) 11.897 11.531 ( -0.209 0.000 1.739) 1.751 12.542 ( 9.483 0.000 -3.411) 10.078 12.985 ( -9.237 0.000 2.291) 9.517 14.961 ( 5.129 0.000 3.097) 5.992 15.196 ( -4.835 0.000 -2.277) 5.344 19.984 ( 2.131 0.000 0.549) 2.201 20.373 ( 3.077 0.000 -0.072) 3.078 20.584 ( -3.379 0.000 -0.177) 3.384 21.529 ( 5.885 0.000 -6.697) 8.915 21.742 ( -1.849 0.000 2.233) 2.899 22.332 ( 6.409 0.000 -4.547) 7.859 107.920 ( -0.289 0.000 -0.428) 0.517 107.993 ( -0.894 0.000 1.008) 1.348 108.472 ( -0.906 0.000 1.887) 2.093 108.499 ( -0.998 0.000 1.384) 1.706 ======================= Grid point 121 (40/259) ======================= q-point: ( 0.44 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.672 ( -13.513 0.000 -0.267) 13.515 2.038 ( -1.603 0.000 11.890) 11.997 2.246 ( 2.889 0.000 5.892) 6.562 2.754 ( -1.199 0.000 -4.815) 4.962 3.234 ( 5.053 0.000 4.583) 6.822 3.560 ( 14.383 0.000 -3.107) 14.714 4.179 ( 1.853 0.000 -1.049) 2.130 4.467 ( -1.381 0.000 -0.110) 1.385 4.565 ( -2.029 0.000 -2.311) 3.075 4.660 ( -4.307 0.000 1.994) 4.746 5.031 ( -5.245 0.000 -5.974) 7.950 5.368 ( -3.632 0.000 3.169) 4.821 7.954 ( 0.479 0.000 -1.694) 1.761 8.022 ( -0.219 0.000 -0.744) 0.776 8.529 ( -3.375 0.000 1.375) 3.645 9.404 ( 5.736 0.000 -0.871) 5.802 9.665 ( -3.990 0.000 -5.299) 6.634 9.915 ( 3.463 0.000 -0.025) 3.463 9.975 ( -1.453 0.000 -0.181) 1.464 10.544 ( -2.526 0.000 5.634) 6.174 11.351 ( 1.219 0.000 0.145) 1.228 11.575 ( 3.184 0.000 0.197) 3.190 12.663 ( 7.122 0.000 -3.302) 7.850 12.863 ( -5.765 0.000 0.843) 5.827 15.067 ( 0.712 0.000 -0.847) 1.107 15.101 ( -0.629 0.000 2.127) 2.218 19.998 ( -0.354 0.000 -1.027) 1.086 20.424 ( 1.917 0.000 0.173) 1.925 20.527 ( -2.019 0.000 -0.512) 2.083 21.515 ( -0.739 0.000 -9.200) 9.229 21.775 ( 2.070 0.000 7.401) 7.685 22.428 ( 6.476 0.000 -1.724) 6.702 107.911 ( -0.158 0.000 -0.798) 0.813 107.985 ( -0.850 0.000 0.850) 1.202 108.473 ( -0.380 0.000 1.477) 1.525 108.493 ( -0.783 0.000 1.449) 1.647 ======================= Grid point 122 (41/259) ======================= q-point: (-0.44 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.341 ( -18.482 0.000 -6.411) 19.562 2.061 ( -19.812 0.000 -2.050) 19.918 2.072 ( -4.347 0.000 7.759) 8.894 2.891 ( 12.736 0.000 1.190) 12.791 3.303 ( -1.547 0.000 6.415) 6.599 3.820 ( 9.381 0.000 8.268) 12.505 4.202 ( 0.858 0.000 0.090) 0.863 4.402 ( -8.678 0.000 -9.689) 13.007 4.453 ( 0.388 0.000 -0.821) 0.908 4.608 ( -0.014 0.000 -0.838) 0.838 4.999 ( 4.695 0.000 -6.273) 7.836 5.321 ( -3.406 0.000 1.333) 3.658 7.941 ( -0.192 0.000 -2.256) 2.264 8.023 ( 0.950 0.000 -0.690) 1.174 8.525 ( 1.885 0.000 1.222) 2.246 9.417 ( -3.656 0.000 -0.554) 3.698 9.643 ( 6.351 0.000 -5.420) 8.350 9.914 ( -3.469 0.000 -0.070) 3.469 9.976 ( 1.635 0.000 -0.130) 1.641 10.593 ( 2.192 0.000 6.913) 7.252 11.372 ( 1.500 0.000 1.301) 1.986 11.596 ( -1.643 0.000 0.854) 1.852 12.741 ( -2.095 0.000 -0.360) 2.125 12.794 ( 3.287 0.000 -2.095) 3.898 14.971 ( -5.271 0.000 -1.634) 5.518 15.206 ( 4.905 0.000 3.253) 5.886 19.961 ( -2.139 0.000 -2.207) 3.074 20.412 ( -2.681 0.000 -0.340) 2.702 20.537 ( 2.886 0.000 -0.076) 2.887 21.403 ( -3.671 0.000 -8.074) 8.870 21.902 ( 5.962 0.000 5.652) 8.215 22.529 ( 4.196 0.000 2.547) 4.909 107.902 ( 0.002 0.000 -1.239) 1.239 107.975 ( -0.858 0.000 0.675) 1.092 108.480 ( -0.167 0.000 1.588) 1.596 108.494 ( -0.470 0.000 1.743) 1.805 ======================= Grid point 123 (42/259) ======================= q-point: (-0.33 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.950 ( -19.298 0.000 -4.977) 19.929 1.620 ( -26.274 0.000 -2.159) 26.363 1.938 ( -17.047 0.000 3.705) 17.445 3.119 ( 10.904 0.000 0.574) 10.919 3.295 ( -3.703 0.000 6.639) 7.602 3.877 ( -7.834 0.000 2.033) 8.093 4.205 ( -1.003 0.000 1.065) 1.463 4.348 ( 10.271 0.000 -4.428) 11.185 4.471 ( 2.451 0.000 -1.505) 2.876 4.616 ( 1.020 0.000 -1.022) 1.444 5.045 ( 5.373 0.000 -6.799) 8.666 5.275 ( -2.605 0.000 2.015) 3.293 7.919 ( -0.120 0.000 -2.167) 2.171 8.043 ( 1.750 0.000 -0.546) 1.834 8.613 ( 6.813 0.000 1.078) 6.898 9.297 ( -8.540 0.000 -0.001) 8.540 9.789 ( 14.098 0.000 -6.783) 15.645 9.826 ( -6.235 0.000 -0.035) 6.235 9.997 ( 0.705 0.000 -0.184) 0.728 10.698 ( 3.591 0.000 5.065) 6.209 11.420 ( 0.960 0.000 -0.500) 1.083 11.563 ( -1.823 0.000 5.755) 6.037 12.602 ( -9.242 0.000 -3.571) 9.908 12.904 ( 6.628 0.000 0.369) 6.639 14.871 ( -4.761 0.000 -0.730) 4.817 15.308 ( 3.923 0.000 2.414) 4.606 19.898 ( -2.733 0.000 -2.296) 3.570 20.356 ( -2.716 0.000 -0.726) 2.811 20.596 ( 3.195 0.000 0.279) 3.207 21.275 ( -3.508 0.000 -8.303) 9.014 22.060 ( 7.402 0.000 3.708) 8.279 22.612 ( 1.760 0.000 4.774) 5.088 107.892 ( 0.080 0.000 -1.627) 1.629 107.964 ( -0.858 0.000 0.600) 1.047 108.491 ( 0.108 0.000 1.446) 1.450 108.505 ( -0.175 0.000 3.368) 3.372 ======================= Grid point 124 (43/259) ======================= q-point: (-0.22 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.618 ( -17.076 0.000 9.002) 19.304 1.111 ( -29.240 0.000 1.539) 29.280 1.492 ( -34.152 0.000 2.465) 34.241 3.280 ( 7.188 0.000 -1.311) 7.307 3.311 ( 0.740 0.000 5.449) 5.499 3.697 ( -7.296 0.000 -13.143) 15.032 4.187 ( -1.791 0.000 1.227) 2.171 4.510 ( 2.959 0.000 -1.582) 3.355 4.539 ( 8.782 0.000 0.560) 8.800 4.621 ( 1.557 0.000 -1.047) 1.876 5.103 ( 5.237 0.000 -0.626) 5.275 5.281 ( -0.345 0.000 9.335) 9.342 7.916 ( 1.409 0.000 -1.186) 1.842 8.074 ( 1.879 0.000 -0.404) 1.922 8.778 ( 10.232 0.000 1.024) 10.283 9.136 ( -9.164 0.000 1.292) 9.255 9.691 ( -8.640 0.000 -0.005) 8.640 10.001 ( 0.074 0.000 -0.245) 0.256 10.006 ( 16.482 0.000 -13.493) 21.301 10.777 ( 1.949 0.000 1.600) 2.522 11.307 ( -9.322 0.000 -7.514) 11.973 11.690 ( 6.210 0.000 10.637) 12.317 12.375 ( -10.797 0.000 -6.856) 12.790 13.033 ( 6.118 0.000 6.135) 8.664 14.793 ( -3.568 0.000 0.136) 3.570 15.380 ( 2.448 0.000 1.305) 2.774 19.837 ( -2.262 0.000 -1.492) 2.710 20.309 ( -1.783 0.000 -0.875) 1.986 20.650 ( 2.374 0.000 0.461) 2.419 21.152 ( -3.106 0.000 -9.478) 9.974 22.212 ( 6.853 0.000 1.555) 7.027 22.643 ( -0.850 0.000 -2.479) 2.621 107.881 ( -0.024 0.000 -1.239) 1.239 107.954 ( -0.771 0.000 0.662) 1.016 108.502 ( 0.098 0.000 0.979) 0.984 108.552 ( 1.409 0.000 7.363) 7.496 ======================= Grid point 125 (44/259) ======================= q-point: (-0.11 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.543 ( -10.468 0.000 26.583) 28.570 0.641 ( -26.161 0.000 12.919) 29.177 0.846 ( -36.587 0.000 14.350) 39.301 3.321 ( -15.566 0.000 -23.507) 28.193 3.357 ( 3.443 0.000 -3.586) 4.972 3.385 ( -1.649 0.000 0.823) 1.844 4.165 ( -1.482 0.000 1.125) 1.860 4.546 ( 2.133 0.000 -1.429) 2.568 4.581 ( 0.837 0.000 -2.050) 2.214 4.740 ( 6.294 0.000 3.564) 7.233 5.213 ( 5.614 0.000 -2.009) 5.962 5.624 ( 30.377 0.000 45.717) 54.888 7.947 ( 2.088 0.000 -0.220) 2.100 8.100 ( 1.251 0.000 -0.309) 1.289 8.980 ( 10.649 0.000 1.051) 10.701 9.004 ( -7.370 0.000 -1.736) 7.572 9.523 ( -9.541 0.000 0.026) 9.541 9.955 ( -15.757 0.000 -40.516) 43.472 9.999 ( -0.064 0.000 -0.299) 0.306 10.739 ( -7.425 0.000 -2.678) 7.893 11.029 ( -8.182 0.000 -5.422) 9.816 11.796 ( -2.752 0.000 -4.063) 4.908 12.175 ( -4.819 0.000 -2.239) 5.314 13.326 ( 19.595 0.000 18.212) 26.752 14.748 ( -1.851 0.000 0.937) 2.075 15.414 ( 0.768 0.000 0.062) 0.770 19.804 ( -0.564 0.000 0.324) 0.651 20.280 ( -0.626 0.000 -0.875) 1.076 20.685 ( 1.115 0.000 0.541) 1.239 20.958 ( -12.479 0.000 -15.040) 19.543 22.306 ( -0.128 0.000 -5.972) 5.973 22.382 ( -19.001 0.000 -26.257) 32.411 107.889 ( 1.614 0.000 1.911) 2.501 107.947 ( -0.531 0.000 0.797) 0.958 108.510 ( -0.099 0.000 0.973) 0.978 108.699 ( 7.872 0.000 9.684) 12.480 ======================= Grid point 126 (45/259) ======================= q-point: ( 0.00 0.08 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.705 ( -2.365 27.091 7.551) 28.223 0.775 ( 4.938 16.225 20.625) 26.702 1.367 ( 2.470 37.274 26.490) 45.795 2.995 ( 1.315 0.775 -7.222) 7.382 3.384 ( -2.155 -0.206 1.064) 2.413 3.519 ( 0.779 13.835 -4.197) 14.479 4.423 ( 1.219 10.462 -11.730) 15.765 4.588 ( 1.061 2.801 -1.998) 3.601 4.628 ( 0.129 7.536 -4.878) 8.978 4.790 ( -0.994 -2.375 3.312) 4.194 5.230 ( 2.377 -4.184 -0.855) 4.887 5.764 ( -4.588 -36.258 22.809) 43.081 7.982 ( -0.347 1.324 -0.234) 1.388 8.328 ( -1.059 -1.880 0.002) 2.158 8.766 ( -8.678 7.956 -8.541) 14.545 9.126 ( 5.699 -15.986 0.867) 16.993 9.497 ( -3.955 25.534 -16.127) 30.458 9.780 ( 14.806 5.809 0.065) 15.905 9.960 ( 6.735 -1.796 0.398) 6.982 10.636 ( -1.619 -2.623 -0.338) 3.101 10.974 ( 3.688 -0.515 -0.670) 3.784 11.345 ( -11.782 -6.663 9.404) 16.482 12.151 ( 1.145 0.504 0.086) 1.254 13.132 ( 0.067 -11.998 7.194) 13.989 15.449 ( -0.684 7.579 -4.756) 8.974 17.046 ( 0.075 94.324 -84.206) 126.443 19.583 ( 0.866 -16.346 -0.200) 16.370 19.979 ( -2.387 -31.387 -3.078) 31.628 20.544 ( 1.841 12.023 2.893) 12.502 21.144 ( 20.805 13.675 2.933) 25.069 21.764 ( -20.750 11.446 5.766) 24.389 22.339 ( -0.082 -0.197 -0.875) 0.901 107.926 ( 1.035 -1.295 0.538) 1.743 107.943 ( 0.970 -2.009 1.984) 2.986 108.505 ( -0.400 -0.746 0.968) 1.286 108.575 ( -6.189 -7.620 6.824) 11.956 ======================= Grid point 127 (46/259) ======================= q-point: ( 0.11 0.08 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.914 ( 16.008 9.641 13.440) 23.018 1.136 ( 13.110 10.421 21.986) 27.638 1.730 ( 14.004 31.465 22.533) 41.157 3.015 ( 4.827 -1.845 -9.531) 10.841 3.337 ( -1.263 -3.095 -3.464) 4.814 3.461 ( -2.880 14.630 -5.717) 15.969 4.338 ( -1.816 11.694 -6.604) 13.552 4.587 ( 0.811 3.901 -3.150) 5.079 4.616 ( 0.955 3.826 -2.063) 4.450 4.751 ( -5.652 -1.570 4.085) 7.148 5.255 ( 0.398 -4.134 0.793) 4.229 5.646 ( -17.809 -23.864 14.673) 33.196 7.951 ( -1.651 0.238 -0.699) 1.808 8.194 ( -9.098 3.431 -0.178) 9.725 8.648 ( 2.763 -5.837 -1.855) 6.719 9.222 ( -3.647 9.907 -0.268) 10.561 9.479 ( 11.804 2.265 -4.579) 12.862 9.885 ( 0.886 -8.536 -1.601) 8.730 10.262 ( 10.459 -0.426 -9.550) 14.169 10.664 ( 12.562 -1.783 -3.348) 13.122 10.901 ( -8.478 -1.370 0.693) 8.616 11.357 ( 4.342 -3.583 6.206) 8.379 12.213 ( 5.298 -0.366 0.213) 5.315 13.147 ( -4.317 -10.545 6.292) 13.016 15.365 ( -3.328 10.809 -8.600) 14.208 16.144 ( -30.984 79.222 -24.543) 88.536 19.615 ( 2.436 -17.881 0.663) 18.058 20.067 ( 8.916 -28.807 -8.278) 31.271 20.593 ( 0.429 8.654 4.722) 9.868 21.586 ( 8.565 -4.860 2.594) 10.184 21.616 ( 11.649 26.345 -8.931) 30.158 22.322 ( 0.170 1.848 -1.012) 2.114 107.927 ( -0.282 -0.721 0.020) 0.775 107.976 ( 0.390 -2.632 1.387) 3.001 108.499 ( -2.337 -1.364 2.416) 3.628 108.512 ( -3.165 -1.604 3.342) 4.874 ======================= Grid point 128 (47/259) ======================= q-point: ( 0.22 0.08 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.364 ( 19.837 -1.953 13.988) 24.351 1.511 ( 9.142 5.875 22.289) 24.797 2.121 ( 12.497 25.669 12.544) 31.183 2.988 ( -0.135 0.763 -6.270) 6.318 3.312 ( 4.486 -5.654 -10.032) 12.359 3.343 ( -4.602 15.301 -6.065) 17.090 4.269 ( -1.949 8.725 -2.914) 9.403 4.563 ( -0.965 3.524 -3.319) 4.936 4.624 ( 1.071 3.101 -0.459) 3.313 4.685 ( -4.710 -0.304 5.199) 7.022 5.254 ( -1.596 -4.108 0.688) 4.460 5.460 ( -11.980 -12.279 8.497) 19.144 7.932 ( 0.344 -0.942 -1.144) 1.522 8.065 ( -5.521 -1.818 0.354) 5.824 8.682 ( -0.958 -6.127 0.649) 6.235 9.184 ( 2.498 10.294 -1.399) 10.685 9.659 ( 9.360 -1.874 -1.606) 9.680 9.871 ( -1.229 -9.742 -1.584) 9.946 10.119 ( -12.374 -0.569 -3.765) 12.947 10.724 ( -6.589 0.716 0.862) 6.684 11.010 ( 18.914 -5.201 -6.705) 20.730 11.490 ( 5.680 2.165 3.127) 6.835 12.332 ( 7.721 -3.321 -0.909) 8.454 13.076 ( -7.481 -5.805 3.908) 10.244 15.224 ( -3.631 15.607 -8.058) 17.936 15.690 ( -13.034 47.394 -1.253) 49.170 19.675 ( 3.200 -18.828 1.081) 19.129 20.126 ( 4.628 -27.076 -7.080) 28.366 20.631 ( -0.225 9.263 4.642) 10.363 21.594 ( -1.346 4.783 6.871) 8.479 21.787 ( 6.766 8.115 -13.456) 17.109 22.374 ( 7.767 9.661 -3.677) 12.930 107.921 ( -0.315 -0.675 -0.162) 0.762 107.983 ( -0.539 -1.746 1.264) 2.221 108.474 ( -1.872 -0.669 2.575) 3.253 108.501 ( -0.933 -0.608 1.269) 1.688 ======================= Grid point 129 (48/259) ======================= q-point: ( 0.33 0.08 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.759 ( 6.270 -2.722 20.478) 21.589 1.775 ( 6.747 2.040 8.340) 10.920 2.323 ( 5.457 18.277 3.897) 19.468 2.943 ( -3.611 3.980 -2.040) 5.748 3.240 ( -0.278 12.408 -3.498) 12.895 3.374 ( 11.229 -1.552 -9.855) 15.021 4.223 ( -1.352 4.792 -1.386) 5.168 4.507 ( -2.753 1.400 -1.911) 3.632 4.637 ( -0.157 3.620 0.114) 3.625 4.680 ( 0.280 1.648 4.293) 4.607 5.166 ( -7.742 -5.055 -2.669) 9.623 5.364 ( -4.481 -4.961 5.290) 8.525 7.941 ( 1.549 -0.564 -1.780) 2.426 7.993 ( -2.759 -4.766 0.334) 5.517 8.621 ( -5.236 -0.134 0.990) 5.331 9.280 ( 7.650 2.070 -1.338) 8.037 9.753 ( -3.220 -5.746 -3.355) 7.392 9.805 ( 0.366 -4.752 -0.182) 4.770 9.927 ( -4.969 -4.780 -0.418) 6.908 10.629 ( -4.845 2.729 2.172) 5.970 11.231 ( 8.992 -5.333 -2.461) 10.740 11.614 ( 6.815 9.977 0.613) 12.098 12.459 ( 7.343 -6.973 -2.103) 10.342 12.954 ( -7.932 -2.858 1.867) 8.636 15.150 ( 0.151 11.990 -3.353) 12.451 15.528 ( -6.504 34.821 0.929) 35.435 19.737 ( 2.574 -18.424 0.835) 18.621 20.143 ( 2.585 -27.744 -4.814) 28.277 20.649 ( -1.141 10.379 2.880) 10.831 21.630 ( 1.185 6.754 -1.725) 7.070 21.738 ( -2.535 -0.116 -0.520) 2.590 22.510 ( 9.786 16.108 -4.572) 19.394 107.914 ( -0.260 -0.621 -0.429) 0.798 107.980 ( -0.719 -1.246 1.110) 1.817 108.467 ( -0.743 -0.392 1.643) 1.845 108.494 ( -0.876 -0.503 1.236) 1.596 ======================= Grid point 130 (49/259) ======================= q-point: ( 0.44 0.08 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( -12.138 5.940 0.068) 13.514 1.942 ( -0.373 -3.306 11.878) 12.335 2.502 ( 6.989 17.217 4.563) 19.133 2.802 ( -5.258 4.756 -1.501) 7.247 3.268 ( 2.808 3.558 -0.258) 4.540 3.577 ( 14.195 2.516 -0.559) 14.428 4.198 ( -0.581 0.926 -1.042) 1.511 4.441 ( -3.280 -0.155 -1.383) 3.563 4.635 ( 0.006 3.640 0.497) 3.674 4.701 ( -1.945 4.744 -0.580) 5.160 5.000 ( -4.475 -2.582 -4.775) 7.035 5.337 ( -2.647 -2.796 2.583) 4.637 7.939 ( -0.214 -3.973 -1.942) 4.427 7.981 ( 0.871 -0.882 0.046) 1.241 8.547 ( -2.910 1.493 0.474) 3.305 9.388 ( 4.393 -2.218 -0.775) 4.982 9.615 ( -4.246 -4.520 -3.326) 7.037 9.854 ( 2.028 -6.083 0.108) 6.413 9.877 ( -1.580 -7.158 -0.248) 7.335 10.591 ( -1.801 4.093 3.985) 5.990 11.313 ( 1.974 -3.678 0.266) 4.182 11.726 ( 4.292 13.528 -0.030) 14.193 12.561 ( 5.812 -9.444 -2.020) 11.272 12.837 ( -5.605 -2.037 0.591) 5.993 15.163 ( 2.171 9.236 -0.042) 9.488 15.447 ( -3.020 31.338 0.098) 31.483 19.768 ( 0.344 -16.916 -0.183) 16.920 20.161 ( 2.683 -28.975 -2.319) 29.192 20.631 ( -2.188 10.923 0.409) 11.148 21.542 ( -3.594 2.349 -9.349) 10.288 21.794 ( 3.024 2.051 8.829) 9.555 22.638 ( 6.935 17.912 -1.954) 19.307 107.905 ( -0.145 -0.574 -0.779) 0.979 107.974 ( -0.773 -1.012 0.904) 1.562 108.469 ( -0.335 -0.380 1.314) 1.409 108.489 ( -0.686 -0.417 1.303) 1.531 ======================= Grid point 131 (50/259) ======================= q-point: (-0.44 0.08 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.438 ( -16.889 9.350 -4.330) 19.784 1.906 ( -11.686 -2.949 3.841) 12.650 2.425 ( -11.106 21.351 1.359) 24.106 2.944 ( 12.997 3.804 4.611) 14.306 3.305 ( 0.576 1.455 1.487) 2.159 3.793 ( 3.092 -2.340 8.254) 9.119 4.184 ( 1.523 -0.954 -2.672) 3.220 4.367 ( -1.861 1.059 -4.250) 4.759 4.594 ( -3.203 4.724 -4.270) 7.128 4.659 ( 1.313 8.056 0.621) 8.186 4.979 ( 4.157 -1.658 -4.983) 6.698 5.300 ( -2.878 -1.903 1.142) 3.635 7.922 ( 0.016 -4.225 -2.037) 4.690 7.998 ( 0.883 0.268 -0.065) 0.925 8.536 ( 1.481 0.852 0.154) 1.716 9.406 ( -2.575 -1.953 -0.205) 3.238 9.592 ( 5.589 -4.369 -3.840) 8.067 9.846 ( -1.930 -6.101 -0.189) 6.402 9.881 ( 1.089 -7.623 -0.089) 7.701 10.622 ( 1.205 2.626 4.820) 5.619 11.332 ( -0.267 -3.869 1.216) 4.064 11.744 ( -2.303 13.274 0.542) 13.484 12.614 ( -1.321 -11.186 0.245) 11.266 12.787 ( 2.123 -0.568 -1.749) 2.809 15.220 ( 3.377 14.035 2.563) 14.662 15.422 ( 0.757 28.073 -1.302) 28.113 19.746 ( -1.995 -15.950 -1.091) 16.111 20.207 ( 3.406 -29.250 -0.359) 29.450 20.581 ( -2.608 11.327 -1.408) 11.708 21.410 ( -3.656 0.711 -7.887) 8.722 21.933 ( 5.567 3.178 6.555) 9.168 22.727 ( 2.839 16.725 1.817) 17.062 107.897 ( -0.016 -0.542 -1.169) 1.288 107.966 ( -0.823 -0.891 0.724) 1.413 108.475 ( -0.187 -0.463 1.433) 1.518 108.490 ( -0.418 -0.406 1.531) 1.638 ======================= Grid point 132 (51/259) ======================= q-point: (-0.33 0.08 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.099 ( -16.911 13.795 -2.704) 21.991 1.588 ( -23.192 0.928 0.162) 23.211 2.218 ( -15.203 22.580 1.404) 27.257 3.183 ( 7.585 3.559 6.291) 10.477 3.326 ( 2.427 5.188 -0.073) 5.728 3.716 ( -12.898 -9.724 1.626) 16.234 4.262 ( 5.045 2.138 0.728) 5.527 4.376 ( 7.918 2.356 -3.702) 9.052 4.559 ( 1.269 4.832 -1.862) 5.332 4.703 ( 2.963 9.691 -0.003) 10.134 5.020 ( 4.490 -2.304 -5.707) 7.618 5.260 ( -2.590 -1.397 2.135) 3.636 7.910 ( 0.663 -2.105 -2.128) 3.066 8.019 ( 1.716 -0.829 0.320) 1.932 8.596 ( 4.676 -1.538 0.252) 4.929 9.310 ( -6.708 0.406 -0.243) 6.724 9.748 ( 13.292 -3.630 -4.359) 14.452 9.791 ( -3.635 -3.383 -0.240) 4.971 9.901 ( 1.634 -7.615 -0.736) 7.823 10.691 ( 2.381 -0.402 3.790) 4.494 11.308 ( -4.160 -9.501 0.394) 10.380 11.682 ( -5.144 11.029 3.376) 12.629 12.505 ( -8.866 -7.842 -1.291) 11.907 12.871 ( 6.357 -2.236 -1.092) 6.827 15.346 ( 7.722 21.382 5.360) 23.356 15.454 ( 5.521 31.241 -3.664) 31.936 19.690 ( -2.957 -15.776 -1.229) 16.097 20.269 ( 3.313 -28.966 0.243) 29.156 20.525 ( -2.098 11.902 -1.665) 12.199 21.292 ( -2.963 1.378 -7.863) 8.515 22.084 ( 6.588 2.541 3.930) 8.081 22.761 ( -1.865 12.840 4.120) 13.613 107.887 ( 0.034 -0.505 -1.448) 1.534 107.956 ( -0.837 -0.813 0.641) 1.331 108.484 ( -0.009 -0.647 1.582) 1.709 108.498 ( -0.266 -0.632 2.529) 2.621 ======================= Grid point 133 (52/259) ======================= q-point: (-0.22 0.08 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.823 ( -14.009 17.672 5.754) 23.273 1.147 ( -25.086 8.021 2.649) 26.470 1.850 ( -26.208 29.034 1.783) 39.154 3.302 ( 2.094 0.405 6.333) 6.683 3.399 ( 1.563 3.639 -3.531) 5.306 3.477 ( -7.686 -3.822 -5.082) 9.975 4.339 ( 5.238 3.970 -1.611) 6.767 4.534 ( 7.034 0.965 0.368) 7.110 4.593 ( 4.404 2.372 -0.611) 5.039 4.745 ( 3.083 13.313 -5.825) 14.856 5.076 ( 5.412 -2.525 -0.415) 5.986 5.258 ( -1.270 -1.953 9.128) 9.421 7.921 ( 2.008 -0.017 -1.175) 2.326 8.077 ( 4.831 0.409 0.518) 4.876 8.680 ( 3.072 -7.442 0.809) 8.091 9.210 ( -2.598 4.046 -0.083) 4.809 9.681 ( -7.099 -0.079 -0.431) 7.112 9.902 ( 1.691 -8.697 -0.005) 8.860 10.009 ( 15.442 0.365 -9.771) 18.278 10.749 ( 1.516 -2.586 1.249) 3.248 11.138 ( -14.046 -15.932 -3.628) 21.547 11.624 ( -6.690 3.262 7.902) 10.855 12.317 ( -9.118 -3.036 -2.751) 9.996 12.969 ( 4.501 -3.763 0.982) 5.949 15.454 ( 2.019 7.597 0.153) 7.862 15.759 ( 33.478 67.343 -2.220) 75.238 19.630 ( -2.603 -15.814 -0.958) 16.055 20.318 ( 2.108 -29.201 -1.457) 29.314 20.489 ( -0.942 12.662 -0.163) 12.699 21.177 ( -3.229 2.385 -8.611) 9.501 22.221 ( 5.943 1.094 1.663) 6.267 22.688 ( -10.027 5.528 0.429) 11.458 107.877 ( -0.015 -0.388 -0.989) 1.062 107.946 ( -0.752 -0.761 0.662) 1.258 108.495 ( 0.075 -0.681 1.035) 1.241 108.524 ( -0.016 -2.069 5.421) 5.802 ======================= Grid point 134 (53/259) ======================= q-point: (-0.11 0.08 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.683 ( -10.810 15.631 14.010) 23.611 0.825 ( -13.480 21.376 10.066) 27.203 1.405 ( -23.179 39.435 10.436) 46.918 3.160 ( -11.671 -5.709 -8.726) 15.651 3.376 ( 1.116 0.051 3.900) 4.057 3.501 ( 3.904 13.407 -3.109) 14.306 4.423 ( 6.518 4.836 -7.027) 10.735 4.582 ( 1.325 1.985 -1.600) 2.874 4.688 ( 1.641 10.158 -8.225) 13.173 4.732 ( 3.793 1.515 0.064) 4.085 5.179 ( 5.067 -3.253 -2.394) 6.479 5.450 ( 8.797 -10.753 28.164) 31.404 7.959 ( 2.407 1.033 -0.223) 2.629 8.216 ( 9.767 5.291 0.650) 11.127 8.716 ( 2.688 -11.565 0.860) 11.905 9.234 ( 1.528 -0.189 0.742) 1.709 9.543 ( -4.236 7.629 -4.164) 9.669 9.916 ( -0.117 -5.858 -0.826) 5.917 10.022 ( -8.749 3.510 -21.323) 23.314 10.698 ( -7.439 -3.888 -1.329) 8.499 10.904 ( -1.631 -8.181 1.167) 8.423 11.521 ( -12.427 -4.578 9.015) 16.020 12.179 ( -3.960 0.389 -1.322) 4.192 13.055 ( 2.836 -7.518 4.742) 9.329 15.472 ( 0.925 7.312 -2.265) 7.710 16.628 ( 72.646 89.630 -32.924) 119.979 19.589 ( -1.183 -15.932 -0.550) 15.985 20.266 ( -7.337 -32.998 -9.437) 35.097 20.494 ( 1.071 14.095 1.595) 14.225 21.041 ( -4.910 5.617 -4.683) 8.808 22.287 ( -16.347 1.651 -3.789) 16.862 22.334 ( -10.536 0.277 -3.699) 11.169 107.882 ( 0.970 -0.545 1.346) 1.747 107.939 ( -0.573 -0.766 0.701) 1.185 108.503 ( -0.096 -0.696 0.909) 1.149 108.576 ( -0.608 -6.602 8.101) 10.468 ======================= Grid point 135 (54/259) ======================= q-point: ( 0.00 0.15 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.146 ( 2.268 20.453 10.772) 23.227 1.274 ( -1.733 28.586 3.954) 28.910 2.183 ( 1.485 41.133 12.106) 42.903 3.039 ( 0.527 3.654 -6.197) 7.213 3.382 ( -2.864 0.273 1.283) 3.150 3.858 ( 0.218 18.864 -3.808) 19.246 4.466 ( 2.032 -1.179 -2.240) 3.246 4.671 ( 1.715 4.202 -2.252) 5.066 4.725 ( -0.318 -3.200 2.885) 4.320 4.832 ( 0.183 8.591 -8.471) 12.066 5.105 ( 0.491 -7.859 0.378) 7.883 5.335 ( -3.701 -11.499 6.840) 13.882 8.004 ( -0.676 0.318 -0.806) 1.099 8.255 ( -0.529 -6.184 0.247) 6.211 8.786 ( -21.355 -4.424 -1.369) 21.852 8.821 ( 21.244 -9.235 0.231) 23.166 9.704 ( 1.218 -8.251 -0.794) 8.378 9.864 ( -6.412 10.249 -4.805) 13.010 10.015 ( 10.486 4.982 2.447) 11.864 10.545 ( -1.167 -6.436 -0.129) 6.542 11.027 ( 5.974 6.053 -2.303) 8.811 11.358 ( -7.890 5.091 2.480) 9.712 12.162 ( 0.665 0.460 -0.094) 0.815 12.969 ( 0.875 -6.708 1.332) 6.894 15.646 ( -0.357 11.830 -3.849) 12.445 18.067 ( 0.815 19.347 -38.320) 42.935 19.268 ( -5.496 -15.860 -7.064) 18.211 19.353 ( 4.742 -27.273 -0.535) 27.687 20.786 ( 0.260 10.871 -2.262) 11.107 21.296 ( 10.437 5.831 8.302) 14.555 22.149 ( -11.152 20.744 -1.328) 23.589 22.361 ( 1.198 3.971 0.877) 4.240 107.893 ( 1.046 -1.594 1.399) 2.365 107.914 ( -0.428 -1.370 0.707) 1.600 108.480 ( -1.435 -1.758 2.452) 3.341 108.494 ( -1.034 -1.557 1.743) 2.556 ======================= Grid point 136 (55/259) ======================= q-point: ( 0.11 0.15 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.245 ( 3.277 19.874 8.204) 21.750 1.422 ( 8.804 18.742 13.166) 24.538 2.409 ( 10.778 33.586 11.336) 37.050 3.039 ( 4.757 3.912 -7.210) 9.482 3.304 ( -5.143 0.307 -1.140) 5.277 3.798 ( -3.240 17.888 -4.397) 18.703 4.460 ( -1.627 2.154 -0.826) 2.823 4.668 ( -0.798 1.208 0.014) 1.448 4.714 ( -2.648 0.011 2.239) 3.468 4.774 ( 1.166 9.774 -10.354) 14.286 5.117 ( -0.203 -9.580 1.497) 9.698 5.285 ( -5.493 -11.119 5.373) 13.515 7.948 ( -2.975 -1.645 -1.188) 3.601 8.221 ( -8.544 0.160 -0.470) 8.558 8.509 ( -2.839 -7.263 0.337) 7.805 9.138 ( 11.592 -8.610 0.314) 14.443 9.687 ( -1.911 -7.532 -0.171) 7.772 9.745 ( -2.322 11.756 -3.293) 12.427 10.220 ( 4.307 -2.888 0.229) 5.191 10.586 ( 8.596 -5.521 -0.579) 10.233 10.886 ( -13.166 0.479 0.643) 13.190 11.459 ( 12.248 10.781 -0.980) 16.346 12.199 ( 2.974 -1.248 0.094) 3.226 12.985 ( -0.810 -6.927 1.939) 7.238 15.591 ( -1.669 12.742 -6.146) 14.245 17.385 ( -35.406 41.427 -23.441) 59.323 19.199 ( 1.087 -24.068 -1.754) 24.156 19.495 ( 8.794 -23.661 -5.850) 25.911 20.788 ( 0.463 8.441 1.171) 8.534 21.512 ( 3.997 -0.835 8.889) 9.782 22.060 ( 1.594 15.177 -9.278) 17.859 22.442 ( 9.061 11.874 0.144) 14.936 107.906 ( -0.121 -1.344 -0.072) 1.352 107.925 ( 0.413 -2.247 1.933) 2.993 108.468 ( -1.677 -1.238 2.388) 3.169 108.489 ( -0.591 -1.066 0.890) 1.509 ======================= Grid point 137 (56/259) ======================= q-point: ( 0.22 0.15 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.453 ( 11.216 10.212 10.359) 18.368 1.695 ( 8.469 12.488 15.231) 21.440 2.620 ( 3.935 20.533 2.422) 21.047 3.107 ( 5.881 12.169 -1.024) 13.554 3.223 ( 1.250 -2.196 -5.734) 6.266 3.687 ( -5.369 17.631 -3.585) 18.776 4.392 ( -5.209 3.347 -0.334) 6.201 4.636 ( -4.986 -1.019 2.736) 5.778 4.692 ( 1.871 5.455 -2.209) 6.175 4.728 ( 0.768 5.609 -5.826) 8.124 5.104 ( -2.347 -9.767 0.620) 10.064 5.256 ( -1.725 -6.387 4.363) 7.925 7.910 ( -0.624 -3.591 -0.502) 3.679 8.024 ( -8.983 0.380 -0.984) 9.044 8.574 ( 4.549 -4.847 0.872) 6.704 9.237 ( 0.888 -4.948 0.244) 5.033 9.658 ( -1.693 -10.286 -0.626) 10.444 9.725 ( 2.229 7.608 -2.154) 8.215 10.098 ( -14.217 -0.802 -0.101) 14.240 10.723 ( -4.906 -2.148 1.070) 5.461 10.833 ( 15.623 -8.864 -1.061) 17.994 11.677 ( 12.558 13.617 -1.235) 18.565 12.255 ( 3.023 -4.591 -0.260) 5.504 12.960 ( -3.549 -5.641 1.614) 6.857 15.500 ( -2.423 14.420 -7.157) 16.280 16.714 ( -25.339 46.089 -6.020) 52.939 19.235 ( 3.810 -25.840 -1.340) 26.153 19.560 ( 3.328 -24.352 -4.913) 25.065 20.807 ( 0.126 6.328 1.734) 6.563 21.612 ( 0.454 0.510 10.667) 10.689 21.968 ( -3.211 8.015 -11.108) 14.069 22.663 ( 14.944 17.354 -3.695) 23.198 107.902 ( -0.209 -1.228 -0.216) 1.264 107.942 ( -0.067 -2.191 1.517) 2.665 108.460 ( -0.940 -0.699 1.598) 1.982 108.485 ( -0.602 -0.912 0.837) 1.377 ======================= Grid point 138 (57/259) ======================= q-point: ( 0.33 0.15 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.745 ( 10.255 3.540 11.245) 15.625 1.917 ( 3.149 9.822 12.027) 15.844 2.613 ( 0.311 9.817 -3.883) 10.561 3.118 ( -4.613 9.930 2.949) 11.339 3.333 ( 10.582 5.175 -7.330) 13.874 3.591 ( -0.843 16.900 -0.586) 16.931 4.286 ( -5.511 1.372 -0.797) 5.735 4.553 ( -4.779 2.060 0.273) 5.211 4.704 ( 0.672 2.775 -3.960) 4.882 4.744 ( 3.228 4.075 1.558) 5.427 5.045 ( -3.661 -4.946 -1.294) 6.288 5.270 ( -0.258 -3.855 2.666) 4.694 7.863 ( -4.851 -7.063 0.736) 8.600 7.962 ( 3.068 2.516 -2.044) 4.463 8.615 ( -0.913 -0.530 0.576) 1.203 9.250 ( 1.821 -6.237 -0.909) 6.561 9.600 ( -4.204 -9.068 -1.472) 10.103 9.749 ( 0.132 1.685 -0.552) 1.778 9.849 ( -10.372 -3.334 1.051) 10.945 10.679 ( -1.670 1.189 1.186) 2.368 11.077 ( 11.383 -8.350 -0.494) 14.126 11.886 ( 11.159 15.084 -0.794) 18.780 12.296 ( 1.795 -9.136 -0.482) 9.324 12.884 ( -5.636 -3.744 0.841) 6.819 15.422 ( -0.666 15.555 -4.586) 16.230 16.354 ( -13.411 41.919 -0.377) 44.014 19.309 ( 5.414 -26.485 -1.239) 27.061 19.554 ( -0.393 -24.877 -3.092) 25.072 20.811 ( -0.831 4.750 0.740) 4.878 21.709 ( 0.249 -0.038 9.371) 9.375 21.808 ( -3.973 8.975 -8.500) 12.984 22.881 ( 11.955 18.885 -3.908) 22.690 107.896 ( -0.163 -1.126 -0.452) 1.225 107.947 ( -0.407 -1.922 1.208) 2.306 108.458 ( -0.434 -0.542 1.098) 1.299 108.481 ( -0.579 -0.758 0.878) 1.296 ======================= Grid point 139 (58/259) ======================= q-point: ( 0.44 0.15 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.892 ( -5.563 8.673 1.212) 10.375 1.963 ( -1.942 6.167 10.832) 12.615 2.714 ( 11.738 3.250 2.321) 12.399 3.002 ( -9.856 13.399 2.508) 16.821 3.379 ( 3.756 7.876 -7.885) 11.760 3.689 ( 5.905 8.230 4.730) 11.179 4.199 ( -2.162 0.121 -2.533) 3.333 4.477 ( -4.108 2.952 0.823) 5.125 4.681 ( -0.119 1.075 -3.901) 4.048 4.813 ( 2.586 4.666 1.203) 5.469 4.972 ( -1.844 1.326 -2.701) 3.529 5.276 ( -0.792 -2.719 1.131) 3.050 7.802 ( -1.983 -7.435 -0.238) 7.699 8.021 ( 3.527 3.783 -0.549) 5.201 8.576 ( -2.189 1.199 -0.869) 2.643 9.273 ( 0.685 -9.712 -0.476) 9.747 9.510 ( -2.630 -5.585 -1.277) 6.304 9.723 ( -0.659 -6.028 -0.120) 6.065 9.770 ( -2.211 -2.257 0.553) 3.207 10.668 ( -0.825 2.361 1.614) 2.976 11.221 ( 4.345 -4.907 0.509) 6.574 12.041 ( 5.477 16.254 -0.333) 17.155 12.320 ( 1.424 -13.972 -0.087) 14.044 12.794 ( -3.877 -2.144 0.179) 4.434 15.420 ( 2.520 15.932 -0.244) 16.132 16.185 ( -5.326 38.364 -1.205) 38.751 19.404 ( 5.716 -24.101 -1.162) 24.797 19.508 ( -2.380 -27.794 -1.519) 27.937 20.792 ( -1.155 4.707 -0.568) 4.880 21.593 ( -6.213 2.010 -8.723) 10.896 21.880 ( 4.338 7.385 10.061) 13.213 23.027 ( 6.634 19.026 -1.969) 20.245 107.889 ( -0.086 -1.024 -0.737) 1.264 107.946 ( -0.602 -1.715 0.971) 2.061 108.459 ( -0.225 -0.548 0.926) 1.100 108.478 ( -0.454 -0.634 0.951) 1.230 ======================= Grid point 140 (59/259) ======================= q-point: (-0.44 0.15 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.691 ( -13.463 15.130 -0.483) 20.258 1.935 ( -9.308 5.525 3.660) 11.427 2.823 ( -8.098 12.258 4.311) 15.311 3.010 ( 11.283 7.002 5.576) 14.402 3.410 ( 6.296 8.476 -6.293) 12.292 3.747 ( -5.933 -1.845 6.413) 8.929 4.201 ( 5.040 3.204 -2.766) 6.582 4.418 ( -1.796 3.364 -1.292) 4.026 4.645 ( -0.207 1.866 -3.804) 4.243 4.853 ( 1.787 8.133 0.863) 8.372 4.956 ( 1.897 0.407 -3.154) 3.703 5.260 ( -1.661 -1.669 0.740) 2.468 7.786 ( 0.557 -7.425 -0.817) 7.491 8.057 ( 0.310 4.756 0.542) 4.797 8.550 ( 0.576 0.433 -1.701) 1.848 9.283 ( 0.510 -10.580 -0.064) 10.593 9.509 ( 4.022 -3.680 -1.259) 5.595 9.720 ( -0.063 -8.332 -0.504) 8.347 9.754 ( 0.602 -0.908 0.166) 1.102 10.671 ( -0.238 1.333 1.690) 2.166 11.235 ( -3.551 -5.252 1.100) 6.435 12.054 ( -3.549 16.176 0.008) 16.561 12.343 ( 0.120 -15.321 1.061) 15.358 12.774 ( 2.077 -0.662 -0.810) 2.326 15.503 ( 4.889 16.034 3.390) 17.102 16.146 ( 3.583 37.726 -3.189) 38.029 19.422 ( -3.562 -17.227 -0.428) 17.597 19.521 ( 5.345 -34.844 -1.113) 35.269 20.764 ( -0.881 6.406 -1.727) 6.693 21.435 ( -4.257 1.802 -7.368) 8.699 22.035 ( 4.876 7.196 8.079) 11.867 23.087 ( 0.497 17.575 0.666) 17.594 107.882 ( -0.018 -0.927 -1.005) 1.367 107.941 ( -0.724 -1.569 0.794) 1.902 108.463 ( -0.180 -0.634 1.031) 1.224 108.479 ( -0.296 -0.616 1.087) 1.284 ======================= Grid point 141 (60/259) ======================= q-point: (-0.33 0.15 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.446 ( -13.147 19.577 0.379) 23.585 1.704 ( -16.604 10.376 1.533) 19.639 2.704 ( -8.766 22.853 1.588) 24.528 3.193 ( 3.894 -0.275 5.830) 7.016 3.512 ( 2.028 7.909 -1.706) 8.342 3.612 ( -4.418 2.417 1.033) 5.141 4.296 ( 4.905 1.977 -0.237) 5.293 4.429 ( 5.356 2.853 -2.230) 6.466 4.627 ( 0.641 2.598 -2.101) 3.402 4.908 ( 3.948 7.692 -0.980) 8.702 4.971 ( 2.521 -1.257 -2.972) 4.095 5.233 ( -2.488 -0.892 2.567) 3.685 7.812 ( 3.251 -6.374 -1.199) 7.255 8.058 ( -0.071 4.031 1.296) 4.235 8.560 ( 1.008 -1.959 -1.261) 2.538 9.253 ( -3.076 -7.397 -0.840) 8.055 9.627 ( 5.863 -7.549 -0.429) 9.568 9.759 ( 3.054 1.396 -0.410) 3.383 9.781 ( 7.531 -3.466 -1.372) 8.403 10.681 ( -0.101 -1.168 1.233) 1.701 11.109 ( -11.124 -9.460 0.792) 14.624 11.946 ( -8.228 14.128 1.366) 16.406 12.323 ( -3.024 -10.375 0.521) 10.819 12.834 ( 4.551 -1.362 -1.339) 4.936 15.612 ( 3.438 14.601 3.200) 15.338 16.321 ( 20.196 40.634 -2.541) 45.448 19.347 ( -4.266 -19.544 0.395) 20.008 19.605 ( 4.720 -32.551 -1.634) 32.933 20.739 ( -0.103 8.846 -2.154) 9.105 21.327 ( -2.494 2.286 -5.686) 6.616 22.169 ( 4.524 6.115 4.746) 8.965 23.048 ( -6.541 14.500 2.487) 16.100 107.873 ( -0.001 -0.817 -1.102) 1.372 107.933 ( -0.763 -1.456 0.693) 1.784 108.469 ( -0.208 -0.833 1.342) 1.593 108.484 ( -0.233 -0.769 1.374) 1.592 ======================= Grid point 142 (61/259) ======================= q-point: (-0.22 0.15 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.232 ( -11.223 21.990 1.538) 24.736 1.440 ( -13.135 19.532 4.189) 23.908 2.492 ( -15.647 32.494 1.428) 36.094 3.260 ( -0.915 -3.989 -2.928) 5.032 3.353 ( -7.263 2.146 5.089) 9.125 3.738 ( 8.787 17.116 -1.473) 19.296 4.365 ( 4.382 0.031 -2.046) 4.836 4.550 ( 6.905 0.463 1.402) 7.061 4.632 ( 1.462 1.837 -1.803) 2.960 4.932 ( 1.483 2.560 -5.880) 6.582 5.036 ( 5.906 0.176 -2.004) 6.239 5.224 ( -2.171 -0.799 7.940) 8.270 7.883 ( 5.149 -4.176 -0.879) 6.688 8.111 ( 5.736 3.292 1.716) 6.832 8.536 ( -3.410 -6.475 -0.348) 7.326 9.200 ( -1.595 -5.413 -1.318) 5.795 9.662 ( -0.116 -7.106 -0.348) 7.116 9.775 ( 1.357 2.355 0.143) 2.722 10.028 ( 15.264 1.665 -3.740) 15.803 10.682 ( -0.500 -4.308 -0.199) 4.342 10.868 ( -13.948 -9.784 0.345) 17.041 11.788 ( -11.088 10.838 2.649) 15.730 12.253 ( -4.212 -4.015 -0.658) 5.856 12.897 ( 3.289 -3.376 -0.945) 4.807 15.662 ( 1.119 12.959 0.094) 13.008 16.870 ( 42.687 40.178 -3.270) 58.712 19.283 ( -3.166 -19.416 0.768) 19.687 19.650 ( 1.741 -32.587 -3.514) 32.822 20.737 ( 1.616 11.157 -1.559) 11.381 21.245 ( -2.703 4.352 -4.484) 6.808 22.268 ( 3.643 3.992 1.996) 5.762 22.867 ( -15.957 11.448 1.692) 19.711 107.866 ( 0.030 -0.664 -0.654) 0.932 107.925 ( -0.691 -1.375 0.643) 1.668 108.476 ( -0.287 -1.158 1.608) 2.002 108.491 ( -0.424 -1.212 2.013) 2.388 ======================= Grid point 143 (62/259) ======================= q-point: (-0.11 0.15 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.098 ( -4.892 23.382 4.815) 24.369 1.315 ( -5.949 25.957 5.685) 27.230 2.231 ( -13.575 40.920 5.893) 43.514 3.124 ( -4.947 0.953 -5.570) 7.510 3.381 ( 0.548 0.597 3.976) 4.057 3.842 ( 4.290 19.333 -2.427) 19.952 4.427 ( 4.293 -1.767 -2.899) 5.473 4.646 ( 2.433 4.112 -1.484) 5.003 4.672 ( 3.732 -3.353 2.188) 5.473 4.893 ( -0.043 5.032 -7.243) 8.820 5.092 ( 2.216 -4.911 -2.564) 5.966 5.291 ( 0.718 -4.969 10.252) 11.416 7.966 ( 4.231 -1.270 -0.296) 4.427 8.268 ( 4.653 0.170 1.294) 4.833 8.500 ( 6.507 -9.119 0.036) 11.202 9.113 ( -10.437 -7.562 -0.680) 12.907 9.665 ( 2.384 -2.904 -1.337) 3.988 9.828 ( 4.647 2.457 0.403) 5.272 10.093 ( -5.951 2.911 -5.737) 8.764 10.598 ( -5.374 -6.043 0.210) 8.090 10.833 ( 10.053 0.968 -0.690) 10.123 11.580 ( -14.414 7.056 2.966) 16.320 12.183 ( -2.527 -0.232 -0.698) 2.632 12.939 ( 1.860 -5.282 0.109) 5.601 15.667 ( 0.391 11.951 -2.013) 12.126 17.704 ( 52.034 25.671 -17.656) 60.649 19.255 ( 0.150 -17.952 0.345) 17.956 19.568 ( -7.729 -31.656 -8.169) 33.595 20.774 ( 3.471 12.519 -2.304) 13.194 21.175 ( -1.726 7.850 0.924) 8.090 22.330 ( 2.120 2.062 0.350) 2.978 22.500 ( -23.785 14.617 0.289) 27.918 107.869 ( 0.484 -0.749 0.614) 1.082 107.918 ( -0.551 -1.341 0.587) 1.564 108.481 ( -0.544 -1.452 1.724) 2.319 108.496 ( -0.992 -1.891 2.651) 3.404 ======================= Grid point 144 (63/259) ======================= q-point: ( 0.00 0.23 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.568 ( 0.906 21.052 3.679) 21.391 1.833 ( -0.782 27.086 2.916) 27.254 2.895 ( -0.290 24.994 2.748) 25.147 3.139 ( 1.255 6.341 -4.955) 8.145 3.444 ( -2.429 9.441 3.424) 10.333 4.216 ( -1.204 14.803 -5.692) 15.906 4.451 ( 2.777 1.110 1.978) 3.586 4.596 ( 0.081 -7.406 1.130) 7.492 4.810 ( 3.494 6.427 -1.426) 7.453 4.887 ( -3.274 -3.561 0.449) 4.858 4.992 ( 0.560 -1.612 -0.747) 1.863 5.209 ( -1.778 -1.893 -3.789) 4.594 7.971 ( -2.096 -3.998 -1.696) 4.822 8.060 ( 2.325 -12.636 0.311) 12.851 8.647 ( -2.040 -2.686 0.015) 3.373 8.818 ( 1.195 2.680 -0.079) 2.936 9.524 ( -0.961 -8.733 0.253) 8.789 9.945 ( 2.450 -1.158 0.527) 2.761 10.126 ( -0.367 5.153 1.195) 5.302 10.390 ( 0.002 -8.453 -0.044) 8.453 11.205 ( 2.244 11.328 -1.200) 11.610 11.485 ( -2.352 6.824 -0.660) 7.248 12.164 ( -0.058 -0.455 -0.291) 0.543 12.834 ( 0.681 -7.037 -0.141) 7.071 15.909 ( 0.113 14.078 -4.333) 14.730 18.113 ( 0.695 -9.765 -7.408) 12.276 18.771 ( -3.431 -24.693 -1.860) 25.000 19.105 ( 4.298 -7.521 -7.626) 11.541 20.985 ( -0.213 9.600 -5.897) 11.269 21.429 ( 3.734 6.969 8.544) 11.641 22.371 ( -3.689 5.982 -3.170) 7.710 22.631 ( -0.885 17.762 0.474) 17.790 107.864 ( 0.556 -1.348 0.640) 1.592 107.884 ( -0.349 -1.588 0.493) 1.699 108.454 ( -0.810 -0.841 1.375) 1.804 108.469 ( -0.216 -1.060 0.385) 1.148 ======================= Grid point 145 (64/259) ======================= q-point: ( 0.11 0.23 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.631 ( 2.420 18.553 3.713) 19.075 1.872 ( 2.359 24.834 6.040) 25.667 2.928 ( 0.626 13.759 -0.377) 13.778 3.157 ( 5.344 6.998 -5.007) 10.129 3.426 ( -1.837 15.498 4.247) 16.174 4.125 ( -4.158 13.581 -4.652) 14.946 4.486 ( -1.350 -0.107 2.326) 2.691 4.594 ( -1.088 -4.582 0.860) 4.787 4.779 ( -3.857 1.930 1.488) 4.562 4.873 ( 1.044 -0.941 -5.686) 5.857 5.005 ( 1.727 1.514 -1.759) 2.893 5.156 ( -0.670 -2.108 -1.117) 2.478 7.862 ( -4.791 -6.619 -1.445) 8.298 8.179 ( 3.830 -5.940 -0.010) 7.068 8.421 ( -9.085 0.172 -0.470) 9.099 9.012 ( 9.548 -3.390 0.623) 10.151 9.500 ( -1.476 -8.574 -0.286) 8.705 9.940 ( -3.842 4.973 -0.073) 6.285 10.154 ( 2.620 -3.786 1.863) 4.966 10.465 ( 6.509 -5.987 0.371) 8.851 10.937 ( -18.593 4.909 -0.401) 19.234 11.703 ( 16.446 12.541 -1.783) 20.759 12.155 ( -0.652 -3.217 -0.165) 3.286 12.851 ( 0.893 -6.567 0.142) 6.629 15.870 ( -0.175 14.849 -6.099) 16.053 17.839 ( -21.696 5.860 -6.069) 23.278 18.693 ( -1.414 -24.071 -2.820) 24.277 19.164 ( 5.564 -11.160 -5.023) 13.443 20.934 ( -1.022 7.364 -3.314) 8.140 21.552 ( 1.641 3.724 9.740) 10.556 22.261 ( -3.844 7.970 -6.344) 10.888 22.753 ( 12.438 16.061 -1.234) 20.351 107.875 ( 0.170 -1.682 -0.103) 1.694 107.887 ( 0.087 -1.707 1.301) 2.148 108.450 ( -0.679 -0.685 1.081) 1.449 108.468 ( -0.228 -0.978 0.371) 1.070 ======================= Grid point 146 (65/259) ======================= q-point: ( 0.22 0.23 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.723 ( 5.401 15.462 3.805) 16.815 2.007 ( 5.297 18.460 9.305) 21.340 2.872 ( -4.303 6.210 -4.283) 8.685 3.214 ( 3.764 2.218 -5.414) 6.957 3.477 ( 3.478 19.854 4.669) 20.690 4.007 ( -5.922 13.876 -1.530) 15.164 4.427 ( -6.364 -0.829 0.812) 6.469 4.573 ( -1.382 -3.073 0.876) 3.481 4.756 ( -1.050 -0.549 2.245) 2.538 4.811 ( -0.313 2.149 -8.266) 8.547 5.026 ( 2.183 3.364 -1.919) 4.445 5.177 ( 2.035 -1.354 1.362) 2.798 7.792 ( -2.604 -6.440 -0.382) 6.957 8.088 ( -6.666 4.368 -1.229) 8.064 8.474 ( 8.492 -5.262 0.165) 9.992 9.098 ( -0.251 -7.110 0.862) 7.166 9.470 ( -1.377 -7.674 -0.822) 7.840 9.869 ( -2.759 4.885 -0.531) 5.635 10.098 ( -13.424 0.259 1.345) 13.493 10.585 ( 4.885 -8.149 0.756) 9.531 10.758 ( 2.764 -1.129 -0.061) 2.986 11.954 ( 12.158 12.439 -1.601) 17.468 12.141 ( -0.474 -6.319 0.209) 6.340 12.855 ( -0.778 -4.771 -0.044) 4.834 15.813 ( -0.436 16.686 -6.877) 18.053 17.390 ( -22.640 20.232 -0.676) 30.370 18.679 ( 1.790 -27.045 -2.736) 27.242 19.205 ( 2.543 -12.569 -3.257) 13.231 20.898 ( -0.984 4.332 -1.853) 4.814 21.641 ( 0.033 1.704 10.404) 10.543 22.138 ( -3.760 9.815 -7.643) 12.996 22.995 ( 14.955 14.661 -2.974) 21.153 107.873 ( -0.028 -1.538 -0.333) 1.573 107.899 ( 0.071 -2.007 1.266) 2.374 108.447 ( -0.384 -0.550 0.750) 1.006 108.467 ( -0.262 -0.851 0.422) 0.985 ======================= Grid point 147 (66/259) ======================= q-point: ( 0.33 0.23 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.888 ( 8.460 10.187 5.306) 14.266 2.160 ( 2.530 14.323 9.159) 17.188 2.755 ( -3.599 5.318 -3.667) 7.395 3.208 ( 0.209 1.932 -4.750) 5.133 3.560 ( 2.193 11.455 0.656) 11.681 3.910 ( -5.239 13.621 2.756) 14.851 4.308 ( -4.857 1.692 -1.893) 5.480 4.558 ( -1.496 -1.147 1.065) 2.166 4.718 ( -0.300 -0.469 -5.544) 5.571 4.811 ( 1.608 2.462 2.033) 3.575 5.052 ( 2.225 5.041 -2.155) 5.917 5.222 ( 1.758 -0.765 0.482) 1.977 7.741 ( -3.514 -4.438 0.862) 5.726 8.039 ( 2.654 4.730 -1.919) 5.753 8.594 ( 3.278 -1.817 0.204) 3.753 9.068 ( -1.748 -10.228 -0.350) 10.382 9.437 ( -1.491 -6.823 -1.423) 7.128 9.782 ( -14.946 -3.368 1.798) 15.426 9.846 ( -3.773 6.741 0.034) 7.725 10.637 ( 1.214 -5.384 0.630) 5.555 10.942 ( 13.003 -5.018 0.186) 13.939 12.038 ( -1.782 -9.445 -0.162) 9.613 12.219 ( 8.929 10.368 -0.134) 13.684 12.817 ( -3.118 -2.676 -0.246) 4.116 15.767 ( 0.790 18.677 -4.799) 19.300 17.051 ( -15.314 25.214 1.248) 29.526 18.706 ( 3.220 -29.857 -2.509) 30.135 19.211 ( 0.511 -11.985 -2.113) 12.181 20.868 ( -0.940 2.615 -1.295) 3.066 21.689 ( -2.569 -1.677 4.974) 5.844 22.043 ( -0.928 13.979 -2.128) 14.171 23.216 ( 11.595 13.953 -2.931) 18.377 107.870 ( -0.001 -1.399 -0.502) 1.487 107.907 ( -0.197 -2.042 1.069) 2.313 108.447 ( -0.168 -0.490 0.554) 0.759 108.465 ( -0.256 -0.715 0.486) 0.902 ======================= Grid point 148 (67/259) ======================= q-point: ( 0.44 0.23 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.055 ( 4.002 9.008 4.004) 10.639 2.184 ( -6.185 13.654 5.965) 16.133 2.750 ( 3.608 1.869 2.664) 4.859 3.175 ( 0.562 3.964 -2.239) 4.587 3.577 ( 2.174 9.418 -4.121) 10.508 3.826 ( -7.601 3.435 4.025) 9.261 4.268 ( 2.229 8.024 -2.062) 8.579 4.530 ( -2.203 1.887 0.293) 2.916 4.689 ( 0.713 0.754 -3.728) 3.870 4.861 ( 1.363 0.821 3.276) 3.642 5.066 ( 1.373 6.743 -3.122) 7.556 5.244 ( 0.673 -0.470 -0.323) 0.882 7.691 ( -2.271 -2.872 0.636) 3.716 8.115 ( 5.225 5.114 -0.524) 7.330 8.595 ( -1.481 0.876 -1.416) 2.229 9.042 ( -1.173 -11.977 -0.325) 12.039 9.402 ( -0.401 -5.068 -1.028) 5.187 9.590 ( -5.863 -6.933 0.889) 9.123 9.814 ( -1.440 5.547 0.746) 5.780 10.650 ( -0.117 -4.293 0.421) 4.315 11.135 ( 6.391 -3.761 0.429) 7.428 11.992 ( -2.115 -17.374 0.912) 17.526 12.357 ( 4.985 13.489 -0.398) 14.386 12.759 ( -2.328 -1.179 0.170) 2.616 15.782 ( 3.222 19.840 -0.626) 20.109 16.850 ( -7.166 25.704 -0.955) 26.701 18.749 ( 3.075 -32.344 -1.730) 32.536 19.197 ( -0.215 -10.893 -1.882) 11.056 20.850 ( -0.004 2.465 -0.971) 2.649 21.606 ( -5.416 -0.574 -4.623) 7.144 22.095 ( 3.205 13.552 7.487) 15.811 23.357 ( 5.730 13.336 -1.757) 14.621 107.866 ( 0.034 -1.252 -0.685) 1.427 107.908 ( -0.424 -1.975 0.894) 2.209 108.449 ( -0.089 -0.483 0.511) 0.709 108.465 ( -0.209 -0.621 0.560) 0.862 ======================= Grid point 149 (68/259) ======================= q-point: (-0.44 0.23 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.011 ( -9.423 16.073 2.354) 18.779 2.113 ( -6.049 11.885 2.577) 13.582 2.855 ( 2.947 -1.942 6.678) 7.553 3.244 ( 5.747 8.897 2.291) 10.836 3.597 ( 5.703 9.282 -7.418) 13.180 3.718 ( -6.187 -1.381 2.582) 6.845 4.320 ( 2.901 8.344 0.578) 8.853 4.492 ( -0.833 4.050 -1.584) 4.428 4.680 ( 0.465 2.114 -1.777) 2.801 4.902 ( 0.757 -0.529 2.144) 2.335 5.059 ( 1.086 7.354 -3.676) 8.293 5.243 ( -0.655 -0.191 0.299) 0.745 7.676 ( 0.357 -2.727 0.017) 2.750 8.167 ( -0.419 5.527 1.419) 5.722 8.558 ( -0.401 0.686 -2.838) 2.947 9.036 ( 0.809 -12.806 -0.506) 12.842 9.442 ( 4.755 -2.961 0.617) 5.636 9.552 ( 1.711 -8.301 -0.746) 8.508 9.813 ( 0.905 5.934 0.725) 6.046 10.643 ( -0.895 -4.368 0.184) 4.463 11.137 ( -6.550 -4.563 0.502) 7.999 12.008 ( 2.712 -18.003 1.514) 18.269 12.355 ( -4.526 13.343 -0.458) 14.098 12.766 ( 2.539 0.000 0.387) 2.568 15.864 ( 4.247 19.695 2.881) 20.352 16.790 ( 3.300 24.711 -3.613) 25.191 18.783 ( 1.315 -33.354 -0.276) 33.381 19.182 ( 0.555 -10.957 -2.694) 11.297 20.855 ( 1.371 3.681 -1.035) 4.062 21.474 ( -4.043 1.811 -5.874) 7.357 22.223 ( 3.455 11.495 8.517) 14.717 23.391 ( -1.181 12.257 -0.224) 12.316 107.861 ( 0.047 -1.104 -0.825) 1.379 107.906 ( -0.576 -1.878 0.754) 2.104 108.451 ( -0.106 -0.525 0.592) 0.799 108.466 ( -0.170 -0.614 0.645) 0.907 ======================= Grid point 150 (69/259) ======================= q-point: (-0.33 0.23 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.844 ( -10.261 19.557 1.652) 22.147 1.980 ( -9.021 16.458 1.985) 18.873 2.956 ( 2.857 1.569 5.214) 6.149 3.293 ( -1.894 8.886 0.044) 9.086 3.595 ( -6.457 5.622 2.018) 8.796 3.778 ( 14.695 7.792 -2.886) 16.882 4.351 ( 0.519 3.392 -0.066) 3.432 4.504 ( 3.106 5.502 -0.671) 6.354 4.671 ( -0.264 2.124 -1.300) 2.504 4.919 ( 0.475 -1.113 -0.156) 1.220 5.059 ( 1.982 5.424 -3.956) 7.000 5.231 ( -1.636 0.440 2.638) 3.135 7.705 ( 3.055 -3.550 -0.530) 4.713 8.152 ( -1.407 4.618 2.356) 5.372 8.526 ( -1.967 -1.261 -2.358) 3.320 9.037 ( 0.254 -12.542 -1.516) 12.636 9.490 ( 0.558 -5.964 0.543) 6.015 9.733 ( 16.538 -1.092 -0.092) 16.574 9.853 ( 3.458 6.515 0.307) 7.382 10.618 ( -2.072 -5.324 -0.049) 5.713 10.945 ( -13.477 -6.920 0.300) 15.153 12.080 ( 3.090 -12.920 1.378) 13.356 12.224 ( -9.135 12.188 -0.001) 15.231 12.817 ( 2.375 -0.332 -0.347) 2.423 15.943 ( 1.643 18.023 2.273) 18.239 16.954 ( 18.321 21.981 -2.837) 28.755 18.790 ( -0.768 -31.722 1.300) 31.758 19.179 ( 1.966 -13.115 -4.165) 13.901 20.882 ( 2.690 5.989 -1.557) 6.747 21.385 ( -1.833 3.358 -3.686) 5.312 22.330 ( 2.149 9.891 5.943) 11.738 23.308 ( -8.413 10.884 0.847) 13.783 107.855 ( 0.036 -0.959 -0.814) 1.259 107.900 ( -0.632 -1.776 0.648) 1.993 108.454 ( -0.182 -0.615 0.776) 1.007 108.468 ( -0.186 -0.721 0.719) 1.035 ======================= Grid point 151 (70/259) ======================= q-point: (-0.22 0.23 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.677 ( -8.412 21.901 0.104) 23.461 1.867 ( -5.444 22.197 3.687) 23.150 3.000 ( -2.228 12.197 2.790) 12.709 3.236 ( -1.982 3.345 -3.505) 5.235 3.488 ( -6.302 13.423 3.902) 15.333 4.040 ( 13.510 10.591 0.041) 17.166 4.364 ( 2.078 0.051 -2.296) 3.098 4.557 ( 1.831 1.661 0.287) 2.489 4.667 ( 1.557 1.740 -0.351) 2.361 4.925 ( 0.714 -0.556 -0.758) 1.181 5.053 ( 0.378 1.062 -4.237) 4.384 5.234 ( -0.535 1.108 3.226) 3.452 7.776 ( 5.285 -5.621 -0.662) 7.744 8.188 ( 3.591 3.145 2.409) 5.347 8.428 ( -6.500 -3.839 -1.482) 7.694 9.041 ( 0.985 -8.987 -1.465) 9.158 9.507 ( 0.903 -6.340 0.576) 6.430 9.873 ( 2.430 4.876 -0.227) 5.452 10.069 ( 12.467 1.674 0.145) 12.580 10.561 ( -4.457 -7.153 -0.157) 8.430 10.749 ( -3.584 -2.656 -0.386) 4.478 12.017 ( -12.845 11.461 0.639) 17.227 12.140 ( 1.460 -7.431 0.226) 7.576 12.838 ( 0.490 -2.546 -0.837) 2.725 15.956 ( -0.324 15.985 -0.785) 16.007 17.389 ( 29.921 13.555 -1.502) 32.883 18.782 ( -1.272 -28.803 2.105) 28.908 19.181 ( 2.021 -15.112 -5.922) 16.356 20.930 ( 4.353 8.463 -2.301) 9.791 21.344 ( -1.135 5.344 -0.634) 5.500 22.389 ( 0.835 8.062 2.784) 8.570 23.100 ( -15.093 10.804 0.700) 18.574 107.851 ( 0.075 -0.842 -0.490) 0.977 107.893 ( -0.583 -1.691 0.558) 1.874 108.456 ( -0.336 -0.742 1.043) 1.323 108.470 ( -0.247 -0.909 0.721) 1.186 ======================= Grid point 152 (71/259) ======================= q-point: (-0.11 0.23 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( -3.626 23.068 1.324) 23.389 1.832 ( -1.868 25.398 3.287) 25.678 2.934 ( -5.477 24.159 2.234) 24.873 3.175 ( -1.125 4.114 -4.571) 6.251 3.451 ( -2.013 10.104 4.250) 11.145 4.217 ( 5.789 16.115 -2.033) 17.243 4.390 ( 2.851 -1.319 -1.469) 3.468 4.577 ( 0.923 -5.537 0.435) 5.630 4.729 ( 4.511 3.147 0.440) 5.518 4.929 ( -0.416 0.374 -0.307) 0.638 5.012 ( -1.674 -2.381 -2.040) 3.554 5.244 ( -0.072 -0.387 -0.686) 0.791 7.881 ( 6.772 -7.066 -0.578) 9.804 8.182 ( -8.378 -8.247 0.067) 11.756 8.439 ( 11.674 2.803 0.335) 12.010 8.991 ( -7.615 -4.241 -0.254) 8.720 9.526 ( 0.387 -7.340 0.678) 7.381 9.907 ( 2.102 1.792 -1.303) 3.054 10.129 ( -1.837 0.853 0.912) 2.221 10.460 ( -5.951 -7.378 0.075) 9.479 10.920 ( 19.189 7.185 -1.105) 20.519 11.748 ( -16.960 9.140 0.074) 19.266 12.160 ( 0.661 -2.206 -0.068) 2.304 12.832 ( -0.102 -5.380 -0.671) 5.423 15.936 ( -0.217 14.530 -2.805) 14.800 17.901 ( 25.546 -1.819 -4.260) 25.963 18.786 ( 0.176 -26.583 1.610) 26.633 19.147 ( 0.044 -12.723 -8.231) 15.153 20.992 ( 4.408 9.631 -4.781) 11.621 21.340 ( -0.076 8.051 4.276) 9.116 22.408 ( -0.002 6.008 0.234) 6.012 22.806 ( -16.041 14.417 0.068) 21.568 107.853 ( 0.297 -0.912 0.161) 0.972 107.888 ( -0.469 -1.636 0.470) 1.766 108.457 ( -0.601 -0.855 1.329) 1.691 108.470 ( -0.265 -1.055 0.563) 1.225 ======================= Grid point 153 (72/259) ======================= q-point: ( 0.00 0.31 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.967 ( 0.040 18.422 -0.378) 18.426 2.356 ( 0.196 25.236 2.504) 25.361 3.068 ( -1.260 -1.868 -1.615) 2.772 3.297 ( 1.311 8.844 -3.452) 9.583 3.796 ( -1.139 17.608 2.712) 17.852 4.341 ( 2.009 -5.656 -2.135) 6.370 4.449 ( -3.082 0.991 -0.805) 3.336 4.581 ( 1.999 8.455 0.754) 8.721 4.775 ( -0.846 -3.852 1.209) 4.125 4.935 ( -1.137 1.060 -0.260) 1.576 5.013 ( 1.063 6.456 -1.942) 6.825 5.219 ( 0.006 1.515 -3.956) 4.236 7.801 ( -0.845 -11.679 0.156) 11.711 7.856 ( 1.883 -7.400 -2.199) 7.946 8.665 ( -1.905 3.575 0.059) 4.051 8.899 ( 1.216 4.730 0.375) 4.898 9.374 ( -1.791 -5.908 0.938) 6.245 9.852 ( 1.969 -7.775 1.581) 8.175 10.185 ( -5.200 -0.215 -0.474) 5.226 10.244 ( 4.417 -4.540 0.609) 6.363 11.460 ( -2.716 13.559 -0.274) 13.831 11.616 ( 3.108 6.191 -1.345) 7.056 12.142 ( -0.648 -1.681 -0.525) 1.877 12.685 ( 0.310 -7.825 -0.483) 7.846 16.203 ( 0.614 15.172 -5.042) 15.999 17.823 ( -0.827 -17.102 0.608) 17.132 18.359 ( -0.382 -15.918 -1.632) 16.006 18.928 ( 2.998 -10.972 -3.714) 11.966 21.182 ( -0.114 10.054 -5.103) 11.275 21.551 ( 1.411 4.812 7.159) 8.741 22.519 ( -2.650 8.983 -2.494) 9.692 22.923 ( -0.222 10.818 -0.693) 10.843 107.838 ( 0.305 -1.191 0.038) 1.230 107.852 ( -0.195 -1.486 0.330) 1.534 108.442 ( -0.391 -0.459 0.469) 0.764 108.451 ( -0.030 -0.740 0.067) 0.744 ======================= Grid point 154 (73/259) ======================= q-point: ( 0.11 0.31 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.987 ( 2.398 16.798 -0.823) 16.988 2.373 ( -0.645 24.767 4.137) 25.119 3.016 ( -2.613 -1.271 -2.926) 4.123 3.298 ( 1.643 7.667 -3.610) 8.632 3.795 ( -1.489 14.027 2.161) 14.271 4.340 ( -6.857 -10.232 2.382) 12.545 4.354 ( 0.642 9.878 -4.141) 10.731 4.626 ( 1.366 4.816 -0.302) 5.015 4.738 ( -3.096 -2.681 1.527) 4.371 4.899 ( -1.611 1.523 -2.096) 3.051 5.047 ( 3.650 3.387 -2.179) 5.435 5.201 ( 1.370 4.369 -2.970) 5.458 7.718 ( -3.040 -6.916 -1.236) 7.655 8.005 ( 10.344 -10.006 -0.462) 14.399 8.493 ( -10.903 5.704 -0.786) 12.330 8.987 ( 2.701 -0.181 1.571) 3.130 9.368 ( 0.446 -4.210 -0.109) 4.235 9.921 ( 3.050 -6.662 1.545) 7.488 10.087 ( -3.891 -2.200 -0.090) 4.470 10.359 ( 6.629 -4.831 0.606) 8.225 11.083 ( -22.950 9.444 -0.810) 24.831 11.937 ( 18.757 10.092 -0.837) 21.316 12.070 ( -6.149 -4.764 -0.577) 7.800 12.722 ( 3.446 -6.247 -0.663) 7.166 16.180 ( 1.501 16.046 -6.273) 17.294 17.737 ( -9.065 -12.613 1.038) 15.567 18.297 ( -3.877 -14.856 -1.691) 15.447 18.959 ( 2.836 -11.122 -2.655) 11.781 21.114 ( -2.978 10.499 -4.005) 11.625 21.620 ( -0.334 2.489 8.012) 8.396 22.443 ( -2.403 10.599 -4.624) 11.810 23.017 ( 10.242 9.675 -1.389) 14.158 107.843 ( 0.193 -1.466 -0.229) 1.496 107.855 ( 0.061 -1.487 0.656) 1.626 108.439 ( -0.251 -0.435 0.291) 0.581 108.452 ( -0.013 -0.682 0.104) 0.690 ======================= Grid point 155 (74/259) ======================= q-point: ( 0.22 0.31 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.036 ( 4.096 15.416 -1.167) 15.993 2.412 ( 0.804 21.349 6.149) 22.232 2.931 ( -4.104 0.476 -3.017) 5.116 3.291 ( 0.703 5.038 -4.520) 6.805 3.756 ( -4.318 6.337 0.968) 7.729 4.194 ( -10.445 -3.627 3.742) 11.673 4.375 ( 3.464 7.261 -2.983) 8.580 4.599 ( -1.988 3.371 -2.349) 4.565 4.730 ( 0.145 -0.430 1.208) 1.290 4.859 ( -0.889 2.728 -1.257) 3.133 5.097 ( 3.954 2.300 -2.929) 5.432 5.222 ( 2.326 4.812 -1.240) 5.487 7.688 ( 0.431 -3.525 -0.962) 3.679 8.131 ( 1.159 -2.247 0.058) 2.529 8.400 ( 4.297 -0.067 -1.168) 4.453 8.972 ( -5.030 -5.741 2.101) 7.917 9.369 ( -0.380 -2.120 -0.871) 2.323 9.923 ( -4.524 1.405 -0.641) 4.780 10.040 ( -4.042 -7.118 1.663) 8.352 10.476 ( 5.029 -3.661 0.549) 6.245 10.766 ( -7.739 3.258 -0.260) 8.401 11.934 ( -8.403 -10.219 0.051) 13.230 12.226 ( 14.104 10.580 -0.766) 17.648 12.772 ( 2.232 -3.591 -1.002) 4.346 16.161 ( 1.918 17.929 -6.636) 19.214 17.539 ( -13.364 -3.348 2.695) 14.038 18.230 ( -1.957 -16.685 -1.445) 16.861 18.986 ( 2.092 -11.210 -2.229) 11.619 21.032 ( -3.051 9.253 -2.806) 10.139 21.656 ( -2.176 -0.387 7.243) 7.573 22.374 ( -1.061 13.744 -4.338) 14.451 23.222 ( 12.940 7.664 -2.070) 15.181 107.843 ( 0.139 -1.433 -0.407) 1.496 107.862 ( 0.091 -1.690 0.748) 1.851 108.438 ( -0.070 -0.376 0.185) 0.425 108.452 ( -0.019 -0.608 0.134) 0.623 ======================= Grid point 156 (75/259) ======================= q-point: ( 0.33 0.31 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.128 ( 6.698 13.110 -0.028) 14.722 2.477 ( -0.163 16.844 6.740) 18.143 2.841 ( -3.405 3.295 -1.229) 4.895 3.249 ( -0.869 2.205 -5.928) 6.384 3.679 ( -3.787 0.857 1.001) 4.010 4.020 ( -11.760 -4.326 3.169) 12.925 4.427 ( 4.022 11.087 -1.918) 11.949 4.561 ( 0.332 2.049 -3.063) 3.700 4.735 ( 0.232 2.148 -0.278) 2.178 4.858 ( -0.108 2.826 2.699) 3.909 5.145 ( 3.919 2.272 -3.359) 5.639 5.251 ( 1.510 3.715 -1.141) 4.170 7.700 ( 0.484 0.432 0.327) 0.727 8.127 ( 1.848 3.237 -0.895) 3.833 8.541 ( 8.186 -3.009 -0.702) 8.749 8.882 ( -5.056 -8.069 1.052) 9.581 9.338 ( -1.838 -2.798 -1.424) 3.638 9.710 ( -16.899 -3.975 1.212) 17.403 9.985 ( -2.026 6.286 0.558) 6.628 10.521 ( 0.780 -4.282 0.320) 4.364 10.841 ( 11.552 -5.830 0.293) 12.943 11.773 ( -9.562 -14.922 0.565) 17.732 12.439 ( 10.209 9.734 -0.302) 14.109 12.780 ( -0.563 -1.173 -0.809) 1.532 16.158 ( 2.762 19.959 -4.771) 20.706 17.329 ( -11.726 3.435 2.714) 12.517 18.203 ( 0.025 -19.143 -1.380) 19.193 19.000 ( 1.416 -10.777 -2.461) 11.144 20.967 ( -1.952 7.738 -1.966) 8.219 21.643 ( -3.768 -2.848 3.293) 5.758 22.353 ( 0.900 16.807 -0.142) 16.831 23.421 ( 10.236 6.225 -1.989) 12.144 107.842 ( 0.164 -1.315 -0.515) 1.422 107.868 ( -0.070 -1.808 0.703) 1.941 108.439 ( 0.040 -0.321 0.160) 0.361 108.453 ( -0.025 -0.534 0.181) 0.564 ======================= Grid point 157 (76/259) ======================= q-point: ( 0.44 0.31 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.261 ( 6.398 11.294 1.447) 13.061 2.466 ( -5.705 13.993 4.391) 15.736 2.811 ( -0.906 4.281 2.455) 5.018 3.214 ( 3.177 0.855 -3.834) 5.052 3.662 ( 1.105 -1.238 0.728) 1.812 3.828 ( -10.460 -2.716 0.128) 10.808 4.481 ( 2.638 11.106 -0.419) 11.423 4.559 ( 1.756 2.059 -2.906) 3.971 4.742 ( 0.479 4.371 0.363) 4.412 4.882 ( -0.465 2.004 4.602) 5.041 5.180 ( 2.806 2.396 -3.855) 5.336 5.256 ( 0.274 2.642 -1.585) 3.093 7.699 ( -0.980 3.528 0.997) 3.795 8.197 ( 5.022 2.306 -0.406) 5.541 8.619 ( 1.395 1.556 -1.424) 2.529 8.827 ( -2.038 -9.114 0.051) 9.339 9.310 ( 1.282 -3.970 -1.224) 4.347 9.460 ( -10.060 -5.666 1.528) 11.646 9.965 ( -0.971 9.128 0.975) 9.231 10.530 ( 0.049 -6.321 0.081) 6.322 11.045 ( 7.913 -5.978 0.160) 9.918 11.621 ( -6.458 -19.275 1.008) 20.353 12.583 ( 5.197 8.968 -0.233) 10.368 12.752 ( -1.399 0.483 0.359) 1.523 16.196 ( 3.956 21.031 -0.994) 21.423 17.170 ( -6.715 6.728 0.065) 9.506 18.203 ( 0.898 -21.064 -1.114) 21.112 18.997 ( 0.627 -10.456 -3.234) 10.962 20.937 ( 0.046 6.706 -1.357) 6.842 21.576 ( -4.024 -2.300 -1.400) 4.842 22.403 ( 2.194 16.930 5.087) 17.814 23.545 ( 4.683 5.296 -1.356) 7.199 107.841 ( 0.168 -1.177 -0.604) 1.333 107.870 ( -0.255 -1.819 0.634) 1.943 108.441 ( 0.041 -0.292 0.195) 0.354 108.454 ( -0.033 -0.486 0.246) 0.546 ======================= Grid point 158 (77/259) ======================= q-point: (-0.44 0.31 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.313 ( -4.234 13.931 3.008) 14.867 2.388 ( -3.713 14.653 1.252) 15.168 2.834 ( 1.951 0.373 3.206) 3.771 3.330 ( 8.344 1.141 2.308) 8.732 3.654 ( -4.840 -3.320 -0.904) 5.938 3.737 ( 5.410 1.284 -2.835) 6.241 4.499 ( -0.506 8.697 -0.186) 8.714 4.585 ( 2.497 5.358 -0.413) 5.926 4.751 ( -0.162 5.099 0.643) 5.142 4.905 ( -0.705 1.434 3.899) 4.213 5.185 ( 1.122 3.159 -4.234) 5.401 5.243 ( -0.296 1.423 -1.140) 1.847 7.689 ( -0.687 3.873 0.601) 3.979 8.242 ( -1.091 1.241 1.358) 2.139 8.592 ( -2.000 2.622 -2.463) 4.116 8.804 ( -0.403 -9.831 -0.863) 9.877 9.377 ( -0.768 -4.793 1.334) 5.034 9.417 ( 11.508 -3.474 -0.087) 12.021 9.967 ( 0.345 9.036 1.049) 9.103 10.524 ( -0.685 -6.257 -0.124) 6.295 11.033 ( -8.948 -6.414 -0.289) 11.013 11.630 ( 6.232 -19.488 1.320) 20.503 12.579 ( -4.716 8.995 -0.370) 10.163 12.777 ( 2.639 1.052 1.286) 3.119 16.272 ( 3.207 20.497 2.200) 20.863 17.108 ( 1.668 7.546 -2.650) 8.170 18.216 ( 1.103 -22.221 -0.572) 22.256 18.975 ( 0.126 -10.818 -4.159) 11.590 20.950 ( 2.451 6.363 -1.082) 6.904 21.497 ( -2.453 0.249 -3.184) 4.027 22.490 ( 1.728 15.000 7.264) 16.755 23.563 ( -2.005 4.675 -0.605) 5.123 107.839 ( 0.136 -1.038 -0.654) 1.234 107.868 ( -0.398 -1.764 0.560) 1.893 108.443 ( -0.022 -0.304 0.270) 0.407 108.455 ( -0.073 -0.488 0.303) 0.579 ======================= Grid point 159 (78/259) ======================= q-point: (-0.33 0.31 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.208 ( -7.739 16.406 1.830) 18.232 2.336 ( -3.125 18.536 1.196) 18.835 2.929 ( 5.077 -2.313 2.917) 6.296 3.404 ( -2.679 2.908 1.005) 4.080 3.682 ( 7.091 0.772 1.377) 7.265 3.858 ( 10.864 -1.139 -3.294) 11.410 4.469 ( -2.299 9.857 -0.179) 10.123 4.634 ( 2.088 5.689 2.088) 6.410 4.736 ( -1.829 5.089 -0.163) 5.411 4.916 ( -0.157 1.076 1.450) 1.813 5.159 ( -0.425 3.823 -4.104) 5.625 5.237 ( 0.081 0.515 0.187) 0.554 7.683 ( -0.175 1.409 -0.194) 1.433 8.207 ( -2.936 0.112 2.181) 3.660 8.516 ( -5.247 0.419 -1.702) 5.532 8.804 ( 2.913 -9.940 -2.009) 10.551 9.400 ( 1.538 -2.677 1.055) 3.263 9.719 ( 18.939 -0.704 1.669) 19.025 9.988 ( 1.044 6.118 0.661) 6.242 10.502 ( -1.627 -4.592 -0.380) 4.886 10.816 ( -11.739 -6.391 -0.691) 13.384 11.789 ( 9.082 -15.575 1.125) 18.064 12.448 ( -9.370 9.877 -0.052) 13.614 12.816 ( 0.279 0.010 0.640) 0.698 16.314 ( -0.411 18.494 1.273) 18.542 17.217 ( 12.334 5.389 -1.620) 13.557 18.235 ( 1.309 -22.221 0.045) 22.260 18.945 ( 0.458 -11.754 -4.870) 12.731 21.006 ( 4.623 6.887 -1.336) 8.402 21.450 ( -0.442 2.712 -2.086) 3.450 22.560 ( 0.066 12.854 6.250) 14.293 23.465 ( -8.382 4.533 -0.144) 9.531 107.836 ( 0.091 -0.918 -0.615) 1.109 107.864 ( -0.462 -1.685 0.479) 1.811 108.444 ( -0.094 -0.350 0.369) 0.517 108.456 ( -0.155 -0.551 0.313) 0.652 ======================= Grid point 160 (79/259) ======================= q-point: (-0.22 0.31 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.086 ( -6.233 18.450 0.132) 19.475 2.310 ( -0.866 21.872 1.835) 21.966 3.032 ( 3.735 -3.295 1.895) 5.329 3.346 ( -2.026 5.785 -2.178) 6.505 3.782 ( 1.707 9.521 2.379) 9.961 4.079 ( 13.890 -6.978 -1.325) 15.600 4.432 ( -1.239 10.430 0.154) 10.505 4.669 ( -2.046 7.691 -0.295) 7.963 4.701 ( 0.564 1.669 1.655) 2.417 4.926 ( 0.691 0.816 0.006) 1.069 5.110 ( -1.834 4.518 -3.267) 5.870 5.245 ( 0.474 -0.132 -0.060) 0.496 7.684 ( 1.066 -3.140 -0.879) 3.430 8.157 ( -6.087 -6.512 0.802) 8.950 8.430 ( -0.151 3.917 0.075) 3.920 8.882 ( 5.920 -6.570 -1.412) 8.956 9.428 ( 0.233 -1.341 1.487) 2.015 9.947 ( -0.718 2.266 0.024) 2.377 10.043 ( 6.251 -4.666 2.333) 8.142 10.437 ( -5.484 -5.223 -1.027) 7.642 10.755 ( 9.898 3.846 -0.719) 10.643 11.952 ( 7.976 -10.925 0.699) 13.545 12.239 ( -13.769 10.402 -0.282) 17.259 12.792 ( -2.886 -2.143 -0.179) 3.599 16.286 ( -1.885 16.560 -1.793) 16.763 17.489 ( 16.344 -1.893 0.828) 16.474 18.268 ( 2.369 -20.597 0.287) 20.735 18.923 ( 1.334 -12.470 -5.192) 13.573 21.091 ( 6.117 7.941 -2.259) 10.275 21.447 ( 0.575 4.551 0.729) 4.645 22.583 ( -1.455 11.037 3.536) 11.681 23.270 ( -12.640 5.645 -0.236) 13.846 107.834 ( 0.094 -0.852 -0.431) 0.960 107.859 ( -0.435 -1.611 0.385) 1.712 108.445 ( -0.180 -0.400 0.485) 0.654 108.454 ( -0.215 -0.658 0.237) 0.732 ======================= Grid point 161 (80/259) ======================= q-point: (-0.11 0.31 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.998 ( -3.260 19.289 -0.317) 19.566 2.327 ( 0.912 24.046 1.834) 24.133 3.081 ( 0.729 -2.836 0.274) 2.941 3.308 ( 0.073 8.066 -3.213) 8.682 3.799 ( -1.156 16.066 2.473) 16.296 4.276 ( 7.801 -10.051 -1.135) 12.773 4.441 ( 2.006 7.692 0.396) 7.959 4.600 ( -3.171 8.265 -1.457) 8.972 4.748 ( 1.778 -0.554 2.081) 2.793 4.938 ( 0.538 0.410 -0.007) 0.676 5.048 ( -2.378 6.136 -2.381) 6.998 5.243 ( 0.156 -0.203 -2.192) 2.206 7.722 ( 4.141 -7.714 -1.027) 8.816 7.996 ( -9.898 -9.827 -0.745) 13.967 8.537 ( 9.522 6.099 0.813) 11.337 8.940 ( -0.239 -1.351 -0.158) 1.381 9.416 ( -3.071 -3.234 1.672) 4.763 9.863 ( -4.098 -5.847 -0.575) 7.163 10.139 ( 3.571 0.204 2.128) 4.162 10.320 ( -6.333 -6.152 -1.034) 8.890 11.097 ( 24.171 10.038 -0.332) 26.175 11.926 ( -17.784 7.604 -1.107) 19.373 12.097 ( 4.625 -3.184 0.377) 5.628 12.725 ( -3.592 -5.400 -0.591) 6.512 16.238 ( -0.863 15.416 -3.754) 15.891 17.743 ( 9.326 -12.358 1.157) 15.525 18.327 ( 3.811 -17.744 -0.373) 18.153 18.915 ( 2.099 -12.002 -4.882) 13.125 21.174 ( 4.950 8.796 -4.177) 10.924 21.480 ( 1.041 5.738 4.515) 7.375 22.567 ( -1.945 9.516 0.494) 9.725 23.041 ( -11.052 8.546 -0.575) 13.982 107.834 ( 0.194 -0.922 -0.134) 0.951 107.855 ( -0.340 -1.552 0.299) 1.617 108.445 ( -0.331 -0.430 0.580) 0.794 108.452 ( -0.138 -0.751 0.087) 0.768 ======================= Grid point 162 (81/259) ======================= q-point: ( 0.00 0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.298 ( 0.009 14.729 -2.369) 14.919 2.842 ( 0.998 23.011 2.007) 23.120 2.966 ( -0.334 -7.130 -1.784) 7.357 3.486 ( 0.582 9.894 -2.475) 10.216 3.939 ( -0.555 -2.103 0.067) 2.176 4.084 ( 1.100 -15.334 1.100) 15.413 4.644 ( -1.367 7.328 -3.739) 8.339 4.703 ( -0.319 2.435 -0.745) 2.567 4.758 ( -0.754 8.136 0.851) 8.215 4.971 ( -0.946 3.590 0.071) 3.713 5.139 ( -0.647 4.131 -3.293) 5.322 5.242 ( 1.569 0.715 -0.473) 1.788 7.614 ( 0.659 -6.550 0.010) 6.583 7.704 ( 0.701 -7.265 -2.180) 7.618 8.767 ( -1.646 6.229 0.079) 6.443 8.978 ( 1.701 2.527 0.418) 3.075 9.298 ( -2.417 -1.457 1.607) 3.248 9.657 ( 0.285 -10.885 2.018) 11.075 10.135 ( -2.017 -1.995 -1.455) 3.189 10.209 ( 1.581 -1.497 0.174) 2.184 11.716 ( -21.050 9.445 -1.041) 23.096 11.739 ( 21.737 7.877 -0.449) 23.125 12.105 ( -0.808 -1.442 -0.676) 1.786 12.518 ( 0.057 -8.908 -0.479) 8.921 16.510 ( 0.936 15.462 -4.712) 16.191 17.471 ( -1.122 -17.530 1.411) 17.623 18.152 ( 0.535 -4.533 -1.609) 4.840 18.668 ( 1.968 -14.437 -1.414) 14.639 21.375 ( 0.208 8.889 -2.053) 9.125 21.615 ( 0.535 1.485 4.646) 4.907 22.718 ( -2.110 10.381 -1.646) 10.721 23.059 ( 0.088 2.808 -0.672) 2.889 107.818 ( 0.154 -0.820 -0.272) 0.877 107.826 ( -0.036 -1.084 0.081) 1.087 108.435 ( -0.175 -0.252 -0.037) 0.309 108.440 ( 0.031 -0.411 -0.032) 0.413 ======================= Grid point 163 (82/259) ======================= q-point: ( 0.11 0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.299 ( 2.240 14.357 -3.047) 14.846 2.852 ( -1.961 22.916 3.478) 23.261 2.938 ( -0.876 -6.098 -2.388) 6.608 3.462 ( -1.178 8.336 -2.824) 8.880 3.892 ( -4.631 -2.261 -0.492) 5.177 4.061 ( -4.683 -15.177 2.306) 16.050 4.608 ( 0.789 8.102 -4.127) 9.127 4.684 ( -0.750 0.174 -2.253) 2.381 4.757 ( 0.053 8.354 0.979) 8.412 4.950 ( -0.934 4.055 -0.710) 4.222 5.119 ( 0.958 2.739 -2.648) 3.928 5.270 ( 2.198 1.880 -1.292) 3.168 7.611 ( 1.108 -3.410 -0.847) 3.684 7.811 ( 10.191 -8.938 -0.864) 13.583 8.624 ( -10.373 7.108 -0.418) 12.582 8.966 ( -4.917 -2.347 1.863) 5.759 9.343 ( 4.355 1.607 0.164) 4.645 9.737 ( 6.387 -10.173 2.114) 12.197 10.064 ( -4.843 -0.197 -1.634) 5.115 10.259 ( 4.179 -5.267 -0.160) 6.725 11.296 ( -23.226 11.356 -0.724) 25.864 11.915 ( -8.410 -7.859 -0.335) 11.515 12.155 ( 15.104 9.055 -0.860) 17.631 12.599 ( 7.059 -6.177 -0.951) 9.428 16.504 ( 2.523 16.146 -5.400) 17.212 17.437 ( -3.762 -15.966 1.343) 16.459 18.109 ( -3.537 -3.699 -1.150) 5.246 18.693 ( 1.661 -15.132 -0.855) 15.247 21.328 ( -3.562 10.131 -1.561) 10.852 21.641 ( -1.760 -0.391 5.032) 5.345 22.678 ( -0.137 12.478 -2.842) 12.799 23.130 ( 7.844 1.652 -0.970) 8.075 107.818 ( 0.171 -0.921 -0.354) 1.002 107.828 ( 0.124 -1.133 0.168) 1.152 108.432 ( -0.022 -0.200 -0.113) 0.231 108.441 ( 0.086 -0.425 -0.047) 0.436 ======================= Grid point 164 (83/259) ======================= q-point: ( 0.22 0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.330 ( 3.899 13.808 -3.342) 14.732 2.837 ( -2.995 20.188 4.433) 20.885 2.900 ( -1.110 -3.174 -1.828) 3.828 3.399 ( -3.155 5.300 -3.679) 7.182 3.770 ( -7.890 -3.161 -0.595) 8.520 3.966 ( -7.705 -13.892 2.997) 16.166 4.611 ( 2.496 7.921 -3.278) 8.928 4.647 ( -0.763 1.676 -3.120) 3.623 4.775 ( 0.950 6.744 1.307) 6.935 4.935 ( -0.169 4.790 -0.479) 4.817 5.130 ( 2.023 1.179 -2.005) 3.083 5.298 ( 2.146 1.743 -2.031) 3.431 7.660 ( 4.952 0.720 -1.058) 5.115 8.005 ( 10.232 -8.413 0.071) 13.247 8.475 ( -4.159 5.904 -0.460) 7.236 8.855 ( -8.116 -6.059 2.310) 10.389 9.383 ( -0.326 3.225 -0.677) 3.312 9.844 ( -3.661 -10.400 0.851) 11.058 9.966 ( 1.375 2.696 -0.831) 3.138 10.367 ( 7.854 -7.473 -0.067) 10.842 10.915 ( -17.372 10.886 -0.047) 20.501 11.701 ( -13.164 -12.641 0.231) 18.252 12.414 ( 12.764 7.999 -0.796) 15.085 12.706 ( 5.256 -3.134 -1.280) 6.251 16.516 ( 3.298 17.111 -5.445) 18.257 17.360 ( -5.853 -12.210 1.865) 13.668 18.032 ( -3.839 -3.035 -0.474) 4.917 18.716 ( 1.695 -15.762 -1.135) 15.893 21.240 ( -4.553 10.586 -1.227) 11.588 21.626 ( -3.727 -2.575 4.114) 6.119 22.674 ( 1.753 15.677 -2.133) 15.918 23.294 ( 10.398 -0.558 -1.225) 10.485 107.819 ( 0.221 -0.906 -0.421) 1.023 107.832 ( 0.144 -1.256 0.229) 1.285 108.432 ( 0.120 -0.142 -0.113) 0.218 108.442 ( 0.117 -0.408 -0.052) 0.427 ======================= Grid point 165 (84/259) ======================= q-point: ( 0.33 0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.392 ( 5.616 12.831 -2.722) 14.268 2.790 ( -5.057 10.176 2.372) 11.608 2.902 ( 1.005 6.228 2.161) 6.668 3.297 ( -4.125 2.609 -4.763) 6.819 3.635 ( -6.110 -4.341 0.651) 7.523 3.839 ( -8.241 -11.451 2.100) 14.264 4.618 ( 0.397 3.254 -2.725) 4.263 4.643 ( 2.890 7.711 -2.154) 8.512 4.806 ( 0.927 5.430 2.165) 5.919 4.937 ( 0.214 5.010 0.914) 5.097 5.152 ( 1.910 -0.674 -2.094) 2.913 5.314 ( 1.606 1.296 -2.638) 3.350 7.754 ( 5.140 4.685 -0.126) 6.956 8.132 ( 4.107 -3.134 0.001) 5.166 8.508 ( 7.463 0.358 -0.573) 7.494 8.740 ( -5.786 -6.338 1.896) 8.789 9.329 ( -4.207 1.804 -1.275) 4.752 9.618 ( -15.942 -5.259 0.015) 16.787 10.078 ( 6.125 3.608 0.708) 7.144 10.488 ( 1.914 -1.839 0.050) 2.655 10.740 ( 0.773 -1.081 0.324) 1.368 11.464 ( -13.424 -15.699 0.610) 20.665 12.599 ( 8.464 6.259 -0.329) 10.532 12.763 ( 2.061 -0.676 -0.854) 2.331 16.543 ( 3.703 17.810 -3.967) 18.618 17.264 ( -6.197 -7.839 1.893) 10.170 17.974 ( -2.177 -3.386 -0.507) 4.057 18.735 ( 1.621 -15.967 -2.075) 16.183 21.157 ( -3.432 10.189 -1.243) 10.823 21.575 ( -4.266 -4.001 2.123) 6.222 22.707 ( 2.523 18.144 0.323) 18.322 23.460 ( 8.399 -2.398 -1.099) 8.804 107.820 ( 0.256 -0.843 -0.459) 0.993 107.836 ( 0.054 -1.335 0.262) 1.362 108.435 ( 0.179 -0.102 -0.064) 0.216 108.444 ( 0.113 -0.370 -0.018) 0.387 ======================= Grid point 166 (85/259) ======================= q-point: ( 0.44 0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.490 ( 6.579 11.085 -1.216) 12.948 2.708 ( -5.445 8.711 1.792) 10.428 2.926 ( -1.809 7.586 2.647) 8.235 3.229 ( 1.713 0.895 -2.667) 3.293 3.575 ( -1.760 -6.173 1.550) 6.603 3.716 ( -5.719 -7.972 0.069) 9.812 4.620 ( 1.978 4.734 -2.338) 5.638 4.680 ( 1.933 7.254 -0.026) 7.507 4.838 ( 0.307 4.637 2.905) 5.480 4.954 ( 0.069 5.023 2.498) 5.610 5.162 ( 1.106 -2.349 -2.535) 3.629 5.316 ( 1.067 1.316 -3.195) 3.616 7.815 ( 1.028 7.429 0.978) 7.563 8.195 ( 3.046 -2.359 -0.160) 3.856 8.641 ( 5.080 -0.068 -1.032) 5.184 8.685 ( -1.771 -4.926 0.914) 5.314 9.257 ( -0.935 -0.929 -0.878) 1.584 9.369 ( -9.757 -3.532 0.854) 10.412 10.161 ( 2.096 9.930 1.022) 10.200 10.450 ( -2.515 -0.528 -0.016) 2.570 10.885 ( 9.443 -9.663 0.186) 13.513 11.239 ( -10.693 -18.298 0.656) 21.203 12.718 ( 4.672 4.663 0.159) 6.603 12.773 ( -0.430 1.346 0.343) 1.454 16.592 ( 3.804 17.558 -1.033) 17.995 17.177 ( -4.086 -4.359 0.478) 5.994 17.943 ( -0.644 -4.169 -0.968) 4.328 18.737 ( 0.794 -15.867 -3.339) 16.234 21.106 ( -0.928 9.412 -1.415) 9.563 21.515 ( -2.986 -3.805 0.089) 4.838 22.762 ( 1.908 18.562 3.201) 18.932 23.564 ( 3.640 -3.437 -0.709) 5.056 107.821 ( 0.240 -0.766 -0.476) 0.933 107.838 ( -0.080 -1.341 0.278) 1.372 108.437 ( 0.131 -0.084 0.006) 0.156 108.446 ( 0.075 -0.339 0.042) 0.350 ======================= Grid point 167 (86/259) ======================= q-point: (-0.44 0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.560 ( -1.503 10.479 1.190) 10.653 2.659 ( 1.288 11.047 0.249) 11.125 2.883 ( -2.517 5.142 0.511) 5.748 3.326 ( 7.508 -1.265 2.144) 7.910 3.569 ( -0.083 -4.568 0.429) 4.589 3.669 ( 1.760 -7.005 -1.276) 7.335 4.652 ( 2.841 6.557 -1.128) 7.235 4.709 ( 0.581 6.437 1.584) 6.655 4.855 ( -0.897 4.364 2.826) 5.275 4.973 ( -0.364 5.412 3.035) 6.215 5.157 ( 0.665 -3.178 -2.413) 4.046 5.306 ( 0.601 1.897 -3.594) 4.109 7.812 ( -2.055 7.729 0.889) 8.047 8.216 ( -1.469 -3.430 0.620) 3.782 8.618 ( -2.590 -1.672 -1.453) 3.408 8.665 ( -3.897 -3.254 -0.354) 5.090 9.300 ( 3.770 -1.554 0.862) 4.168 9.380 ( 11.587 -1.328 1.335) 11.739 10.161 ( -2.958 9.880 0.988) 10.360 10.444 ( 1.870 -0.627 -0.272) 1.990 10.872 ( -10.407 -9.369 -0.328) 14.007 11.243 ( 10.097 -18.737 0.757) 21.298 12.719 ( -3.696 5.142 0.195) 6.336 12.802 ( 1.656 1.195 1.457) 2.509 16.650 ( 1.801 16.261 1.363) 16.417 17.142 ( 1.131 -2.708 -0.981) 3.094 17.935 ( 0.696 -4.868 -1.325) 5.093 18.713 ( -0.146 -15.693 -4.306) 16.274 21.106 ( 2.198 8.688 -1.516) 9.089 21.478 ( -0.644 -2.230 -1.017) 2.534 22.814 ( 0.169 17.014 4.975) 17.727 23.573 ( -2.204 -3.600 -0.348) 4.236 107.821 ( 0.176 -0.693 -0.476) 0.859 107.837 ( -0.204 -1.295 0.270) 1.339 108.439 ( 0.029 -0.092 0.078) 0.124 108.447 ( -0.008 -0.337 0.088) 0.349 ======================= Grid point 168 (87/259) ======================= q-point: (-0.33 0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.491 ( -5.258 11.762 0.906) 12.915 2.703 ( 1.943 17.385 -0.080) 17.493 2.885 ( 2.272 -1.796 0.283) 2.910 3.442 ( 1.887 0.951 2.294) 3.119 3.639 ( 9.349 -4.509 -0.994) 10.427 3.738 ( 5.666 -8.716 -0.518) 10.408 4.699 ( 2.527 9.367 0.135) 9.702 4.723 ( -0.676 5.024 2.494) 5.650 4.842 ( -2.600 4.355 1.629) 5.327 4.982 ( -0.548 5.875 1.594) 6.112 5.159 ( 0.936 -2.581 -0.669) 2.826 5.283 ( -0.024 2.377 -3.755) 4.444 7.753 ( -4.752 5.179 -0.044) 7.029 8.149 ( -6.410 -5.411 0.517) 8.405 8.533 ( -5.245 0.806 0.379) 5.320 8.650 ( 4.951 -5.507 -1.613) 7.579 9.394 ( 4.428 2.118 1.512) 5.136 9.683 ( 17.158 -3.406 2.646) 17.691 10.080 ( -6.438 3.771 0.742) 7.498 10.460 ( -3.078 -1.859 -1.134) 3.770 10.719 ( -0.389 -0.596 -0.491) 0.864 11.467 ( 13.019 -16.442 0.672) 20.983 12.617 ( -8.001 6.935 0.250) 10.591 12.812 ( -1.931 -0.551 1.115) 2.297 16.656 ( -1.845 14.958 0.176) 15.072 17.215 ( 6.825 -4.593 0.379) 8.235 17.953 ( 2.655 -4.866 -1.348) 5.705 18.675 ( -0.102 -15.445 -4.524) 16.094 21.160 ( 4.957 8.282 -1.519) 9.771 21.478 ( 1.376 -0.189 -0.792) 1.599 22.836 ( -1.970 14.479 4.901) 15.413 23.482 ( -7.448 -2.840 -0.239) 7.975 107.820 ( 0.102 -0.637 -0.448) 0.785 107.835 ( -0.275 -1.228 0.227) 1.279 108.440 ( -0.056 -0.131 0.137) 0.198 108.447 ( -0.121 -0.358 0.081) 0.387 ======================= Grid point 169 (88/259) ======================= q-point: (-0.22 0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.404 ( -4.355 13.402 -0.367) 14.097 2.738 ( 2.408 20.812 0.197) 20.952 2.938 ( 2.765 -5.772 -0.051) 6.400 3.468 ( 1.248 6.452 -0.681) 6.607 3.825 ( 8.199 -3.703 1.580) 9.134 3.847 ( 8.083 -13.607 -1.503) 15.898 4.719 ( -0.986 8.733 1.505) 8.917 4.741 ( 0.890 6.635 1.786) 6.928 4.787 ( -3.597 4.988 -0.710) 6.190 4.983 ( -0.228 5.128 0.598) 5.168 5.177 ( 0.824 0.169 0.620) 1.045 5.249 ( -0.577 1.523 -3.579) 3.932 7.659 ( -4.387 0.687 -1.003) 4.552 7.991 ( -10.472 -8.920 -0.494) 13.765 8.527 ( 4.107 4.917 1.331) 6.543 8.773 ( 8.623 -4.595 -0.828) 9.805 9.451 ( -0.237 3.337 2.133) 3.968 9.867 ( -6.383 -8.793 1.840) 11.020 10.021 ( 5.747 2.551 1.510) 6.466 10.324 ( -7.056 -6.287 -1.924) 9.645 10.906 ( 18.702 10.615 -0.444) 21.509 11.709 ( 13.155 -13.214 0.482) 18.652 12.429 ( -12.914 8.441 -0.253) 15.429 12.745 ( -5.985 -2.722 0.306) 6.582 16.603 ( -2.572 14.785 -2.312) 15.184 17.355 ( 6.421 -10.582 2.049) 12.547 18.015 ( 5.235 -4.032 -1.139) 6.705 18.649 ( 0.907 -14.957 -3.958) 15.499 21.253 ( 6.286 8.103 -1.621) 10.383 21.511 ( 2.166 1.501 0.709) 2.730 22.817 ( -3.382 12.027 3.222) 12.902 23.316 ( -10.164 -1.058 -0.410) 10.227 107.818 ( 0.071 -0.619 -0.380) 0.730 107.831 ( -0.270 -1.167 0.153) 1.207 108.439 ( -0.101 -0.191 0.173) 0.277 108.444 ( -0.197 -0.383 0.006) 0.431 ======================= Grid point 170 (89/259) ======================= q-point: (-0.11 0.38 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.335 ( -2.443 14.483 -1.477) 14.762 2.793 ( 2.932 22.110 0.760) 22.316 2.970 ( 1.067 -7.002 -0.797) 7.127 3.483 ( 1.477 9.322 -1.998) 9.648 3.916 ( 2.835 -3.080 0.501) 4.216 4.003 ( 7.198 -14.967 0.083) 16.608 4.704 ( -2.285 8.704 -0.518) 9.014 4.718 ( -1.587 2.880 -1.290) 3.532 4.760 ( -0.170 8.474 1.278) 8.571 4.981 ( -0.441 4.003 0.468) 4.055 5.178 ( -0.730 5.217 -2.063) 5.657 5.225 ( 0.549 -1.629 -0.986) 1.982 7.603 ( -0.551 -3.715 -1.181) 3.937 7.805 ( -8.566 -8.912 -1.067) 12.407 8.665 ( 8.802 6.399 0.992) 10.928 8.913 ( 6.316 -1.681 -0.079) 6.536 9.399 ( -7.376 1.209 2.257) 7.808 9.709 ( -7.509 -8.578 1.024) 11.446 10.132 ( 3.135 -0.722 1.246) 3.450 10.221 ( -2.863 -3.834 -1.686) 5.073 11.309 ( 24.642 10.946 -0.257) 26.965 11.917 ( 6.773 -7.115 -0.326) 9.829 12.164 ( -13.836 8.360 -0.494) 16.173 12.613 ( -7.858 -5.852 -0.378) 9.805 16.544 ( -1.114 15.069 -3.823) 15.586 17.450 ( 2.283 -15.960 1.970) 16.242 18.108 ( 5.156 -4.099 -1.223) 6.699 18.649 ( 1.802 -14.400 -2.752) 14.771 21.344 ( 4.758 8.082 -2.011) 9.592 21.562 ( 1.821 2.253 2.969) 4.148 22.771 ( -3.257 10.411 0.748) 10.934 23.140 ( -7.921 1.416 -0.612) 8.070 107.817 ( 0.106 -0.678 -0.291) 0.745 107.828 ( -0.190 -1.118 0.079) 1.137 108.438 ( -0.202 -0.235 0.164) 0.351 108.440 ( -0.085 -0.409 -0.097) 0.429 ======================= Grid point 171 (90/259) ======================= q-point: ( 0.00 0.46 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.564 ( 0.471 12.050 -2.870) 12.396 2.785 ( 0.643 -10.084 -2.501) 10.409 3.291 ( 0.870 21.256 1.677) 21.339 3.652 ( -0.694 -2.804 -2.111) 3.578 3.736 ( 1.713 -6.365 2.058) 6.906 3.866 ( -0.194 -7.681 -0.436) 7.695 4.687 ( -0.946 0.690 -2.847) 3.078 4.701 ( -0.812 -0.642 -2.213) 2.443 5.006 ( -1.819 9.113 -1.153) 9.364 5.052 ( -1.011 3.230 -0.092) 3.386 5.172 ( -0.266 0.873 -1.675) 1.908 5.230 ( 1.601 -2.650 -0.086) 3.097 7.543 ( 0.758 -0.597 -0.602) 1.137 7.583 ( 0.704 -4.350 -1.503) 4.656 8.895 ( -0.785 5.965 0.171) 6.019 8.982 ( 0.816 -2.255 0.335) 2.421 9.321 ( -1.857 3.869 2.010) 4.739 9.452 ( -0.823 -8.905 2.134) 9.194 10.128 ( -0.661 1.114 -1.321) 1.850 10.167 ( 0.007 -2.414 -0.850) 2.560 11.827 ( -1.598 4.312 -1.183) 4.748 11.874 ( 1.610 1.199 -0.748) 2.142 12.144 ( -0.042 6.881 -0.396) 6.893 12.329 ( 0.045 -9.939 -0.378) 9.947 16.819 ( 0.695 15.385 -2.932) 15.677 17.133 ( -0.200 -16.210 -0.410) 16.216 18.175 ( 0.586 6.449 -1.183) 6.583 18.382 ( 1.069 -13.282 -0.928) 13.358 21.526 ( 0.222 5.935 0.389) 5.951 21.608 ( 0.213 -2.206 2.304) 3.197 22.913 ( -1.152 8.621 -0.781) 8.733 23.044 ( -0.260 -4.013 -0.491) 4.051 107.807 ( 0.089 -0.201 -0.318) 0.387 107.810 ( 0.053 -0.489 -0.178) 0.523 108.432 ( -0.047 -0.015 -0.186) 0.192 108.434 ( 0.014 -0.195 -0.130) 0.235 ======================= Grid point 172 (91/259) ======================= q-point: ( 0.11 0.46 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.563 ( 1.955 12.082 -3.236) 12.659 2.780 ( 0.960 -9.528 -2.611) 9.926 3.286 ( -3.196 20.203 2.667) 20.628 3.587 ( -4.711 -1.424 -1.753) 5.224 3.745 ( -2.401 -7.673 1.952) 8.273 3.818 ( -4.725 -7.253 -0.239) 8.659 4.662 ( 0.675 0.847 -2.979) 3.170 4.676 ( 0.433 -0.622 -3.181) 3.270 4.967 ( -1.214 7.718 -1.504) 7.957 5.028 ( -0.752 1.694 -1.540) 2.410 5.167 ( 0.736 3.673 -1.126) 3.912 5.257 ( 1.805 -3.329 -1.110) 3.946 7.589 ( 5.146 1.323 -0.695) 5.359 7.661 ( 8.217 -5.730 -0.815) 10.051 8.767 ( -10.380 6.925 0.297) 12.481 8.890 ( -9.289 -5.153 1.243) 10.695 9.415 ( 6.952 5.220 0.895) 8.740 9.549 ( 7.583 -8.213 1.739) 11.313 10.084 ( -2.686 2.346 -1.838) 4.012 10.156 ( 0.481 -4.659 -1.219) 4.840 11.524 ( -20.354 11.136 -0.584) 23.209 11.735 ( -15.401 -9.906 -0.483) 18.318 12.325 ( 14.336 7.847 -0.833) 16.364 12.471 ( 11.039 -6.755 -0.946) 12.976 16.819 ( 1.810 15.261 -3.185) 15.695 17.122 ( -0.602 -15.314 -0.480) 15.333 18.152 ( -1.992 7.652 -0.910) 7.959 18.385 ( 0.076 -14.621 -0.635) 14.635 21.500 ( -3.325 6.914 0.658) 7.700 21.603 ( -2.726 -3.463 2.518) 5.075 22.918 ( 2.539 10.805 -1.340) 11.180 23.088 ( 5.295 -5.675 -0.746) 7.798 107.807 ( 0.170 -0.188 -0.348) 0.430 107.811 ( 0.162 -0.551 -0.176) 0.600 108.431 ( 0.090 0.051 -0.223) 0.246 108.434 ( 0.117 -0.249 -0.171) 0.324 ======================= Grid point 173 (92/259) ======================= q-point: ( 0.22 0.46 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.584 ( 3.125 11.460 -3.287) 12.325 2.781 ( 1.201 -7.995 -2.388) 8.430 3.227 ( -5.296 17.634 3.188) 18.686 3.466 ( -7.048 -1.868 -1.346) 7.414 3.674 ( -6.382 -5.064 -0.317) 8.153 3.714 ( -6.337 -8.270 1.746) 10.564 4.665 ( 1.288 0.986 -1.956) 2.541 4.674 ( 2.322 0.219 -3.056) 3.844 4.943 ( -0.552 6.718 -0.726) 6.779 5.010 ( 0.144 0.624 -1.477) 1.610 5.173 ( 0.770 4.526 -1.379) 4.794 5.276 ( 1.564 -3.896 -2.156) 4.719 7.715 ( 8.961 4.673 -0.691) 10.129 7.840 ( 11.175 -7.556 -0.236) 13.492 8.601 ( -7.300 6.466 0.751) 9.781 8.730 ( -8.753 -6.382 1.751) 10.973 9.485 ( -0.566 6.662 -0.290) 6.693 9.644 ( -1.101 -9.139 0.298) 9.210 10.053 ( 2.930 6.016 -1.150) 6.790 10.201 ( 6.036 -8.397 -0.803) 10.372 11.164 ( -18.595 13.411 0.179) 22.927 11.437 ( -16.661 -13.593 0.254) 21.504 12.547 ( 10.687 5.489 -0.989) 12.054 12.639 ( 8.114 -3.787 -1.194) 9.034 16.832 ( 2.093 14.356 -2.974) 14.810 17.103 ( -1.315 -13.124 -0.154) 13.190 18.104 ( -2.337 9.769 -0.633) 10.064 18.381 ( 0.244 -16.582 -0.835) 16.605 21.427 ( -4.893 7.807 0.482) 9.226 21.553 ( -4.564 -4.838 1.990) 6.942 22.976 ( 4.623 13.855 -0.953) 14.638 23.203 ( 7.570 -8.297 -0.720) 11.255 107.808 ( 0.238 -0.149 -0.352) 0.451 107.813 ( 0.206 -0.625 -0.146) 0.675 108.432 ( 0.199 0.088 -0.207) 0.300 108.435 ( 0.189 -0.260 -0.171) 0.364 ======================= Grid point 174 (93/259) ======================= q-point: ( 0.33 0.46 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.626 ( 4.077 10.191 -2.951) 11.367 2.785 ( 0.883 -5.401 -1.800) 5.761 3.159 ( -4.645 13.461 3.189) 14.593 3.330 ( -6.572 -1.565 -1.139) 6.852 3.546 ( -6.451 -2.525 -0.031) 6.928 3.620 ( -5.649 -9.007 1.644) 10.758 4.680 ( 2.006 2.653 -1.510) 3.653 4.710 ( 2.916 0.108 -0.842) 3.037 4.934 ( -0.505 5.908 0.621) 5.962 5.009 ( 0.507 -0.374 -0.686) 0.931 5.172 ( 0.407 4.492 -1.731) 4.831 5.282 ( 1.183 -4.447 -2.700) 5.335 7.875 ( 8.166 7.079 -0.179) 10.808 8.021 ( 7.995 -7.064 -0.011) 10.669 8.548 ( 1.178 3.159 0.882) 3.485 8.628 ( -3.637 -4.824 1.816) 6.309 9.398 ( -7.298 4.681 -1.138) 8.745 9.505 ( -11.551 -5.780 -0.805) 12.941 10.178 ( 9.386 7.023 0.161) 11.724 10.353 ( 10.119 -9.557 -0.158) 13.920 10.875 ( -13.567 12.102 0.579) 18.190 11.154 ( -15.073 -15.083 0.630) 21.333 12.695 ( 6.469 3.472 -0.492) 7.359 12.743 ( 4.426 -1.541 -0.686) 4.736 16.849 ( 1.905 12.761 -1.984) 13.054 17.075 ( -1.746 -10.361 0.255) 10.510 18.065 ( -1.298 11.718 -0.958) 11.829 18.382 ( 0.762 -18.207 -1.623) 18.295 21.344 ( -4.222 8.125 -0.074) 9.157 21.480 ( -4.408 -5.627 1.041) 7.223 23.057 ( 4.324 16.182 0.184) 16.751 23.329 ( 6.345 -10.439 -0.327) 12.220 107.810 ( 0.254 -0.116 -0.331) 0.433 107.816 ( 0.176 -0.665 -0.099) 0.695 108.435 ( 0.227 0.093 -0.148) 0.287 108.438 ( 0.197 -0.239 -0.127) 0.335 ======================= Grid point 175 (94/259) ======================= q-point: ( 0.44 0.46 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.684 ( 4.406 7.787 -2.237) 9.222 2.779 ( -0.459 -1.177 -0.920) 1.563 3.108 ( -3.436 9.385 1.710) 10.139 3.237 ( -2.135 -1.896 -0.406) 2.884 3.471 ( -2.125 -1.877 1.640) 3.276 3.547 ( -3.139 -7.765 0.919) 8.425 4.714 ( 2.480 4.059 -0.144) 4.758 4.758 ( 2.210 0.361 0.824) 2.386 4.932 ( -0.694 5.020 1.805) 5.379 5.015 ( 0.406 -1.750 0.080) 1.799 5.165 ( 0.477 4.912 -1.917) 5.294 5.281 ( 1.138 -4.659 -2.728) 5.517 7.973 ( 2.246 7.860 0.681) 8.203 8.112 ( 2.345 -5.736 0.224) 6.201 8.616 ( 0.872 -0.891 0.511) 1.348 8.628 ( 3.231 -1.691 0.831) 3.740 9.270 ( -3.771 1.739 -0.601) 4.195 9.312 ( -6.648 -2.368 -0.089) 7.058 10.347 ( 8.277 8.971 0.471) 12.215 10.486 ( 0.840 -0.819 0.099) 1.178 10.729 ( 0.021 -0.888 0.445) 0.993 10.907 ( -12.287 -14.405 0.503) 18.940 12.780 ( 3.129 1.720 0.404) 3.594 12.793 ( 1.302 0.348 0.295) 1.379 16.872 ( 1.724 10.617 -0.414) 10.764 17.049 ( -1.149 -7.671 0.268) 7.761 18.041 ( -0.336 12.823 -1.760) 12.947 18.379 ( 0.559 -18.933 -2.706) 19.134 21.285 ( -1.775 8.019 -0.722) 8.244 21.421 ( -2.319 -5.681 0.102) 6.137 23.124 ( 2.109 16.903 1.562) 17.106 23.413 ( 2.726 -11.406 0.249) 11.730 107.812 ( 0.209 -0.100 -0.297) 0.377 107.818 ( 0.089 -0.658 -0.050) 0.666 108.437 ( 0.161 0.083 -0.073) 0.196 108.440 ( 0.139 -0.213 -0.061) 0.261 ======================= Grid point 176 (95/259) ======================= q-point: (-0.44 0.46 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.722 ( -0.269 5.561 -0.985) 5.654 2.774 ( 1.775 0.808 -0.844) 2.125 3.062 ( -1.554 11.291 -0.397) 11.404 3.258 ( 3.783 -6.746 0.622) 7.759 3.496 ( 2.931 -1.744 2.352) 4.143 3.529 ( 0.675 -5.072 0.535) 5.145 4.761 ( 1.647 4.032 1.763) 4.699 4.795 ( 0.892 1.200 1.438) 2.074 4.936 ( -0.506 4.537 2.126) 5.035 5.027 ( 0.703 -3.208 0.780) 3.376 5.162 ( 0.820 6.050 -1.987) 6.421 5.282 ( 1.070 -4.247 -2.557) 5.072 7.974 ( -2.741 7.999 0.759) 8.490 8.118 ( -2.274 -6.164 0.468) 6.587 8.583 ( -3.109 -0.090 -0.563) 3.161 8.615 ( -5.049 -2.626 0.049) 5.692 9.310 ( 7.214 1.833 1.102) 7.524 9.350 ( 9.877 -1.796 1.440) 10.142 10.349 ( -8.770 9.080 0.506) 12.634 10.481 ( -0.946 -0.221 -0.167) 0.986 10.720 ( -1.381 -1.123 0.119) 1.784 10.900 ( 11.396 -14.866 0.208) 18.733 12.792 ( -1.919 2.285 0.824) 3.095 12.815 ( -0.089 -0.109 1.201) 1.210 16.899 ( 0.780 8.938 0.648) 8.996 17.045 ( 0.735 -6.253 0.102) 6.296 18.027 ( 0.620 12.765 -2.340) 12.992 18.361 ( 0.130 -18.596 -3.426) 18.909 21.275 ( 1.500 7.719 -1.108) 7.941 21.405 ( 0.660 -5.122 -0.483) 5.187 23.150 ( -1.088 15.875 2.532) 16.113 23.424 ( -1.898 -11.015 0.673) 11.197 107.813 ( 0.123 -0.101 -0.271) 0.315 107.818 ( -0.016 -0.617 -0.024) 0.617 108.439 ( 0.043 0.071 -0.011) 0.084 108.442 ( 0.030 -0.203 -0.010) 0.205 ======================= Grid point 177 (96/259) ======================= q-point: (-0.33 0.46 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.683 ( -2.507 7.633 -0.715) 8.066 2.801 ( 1.262 -4.161 -1.065) 4.477 3.068 ( 2.920 16.264 -0.919) 16.550 3.362 ( 6.921 -11.526 0.617) 13.459 3.558 ( 3.351 0.122 -0.691) 3.424 3.609 ( 5.984 -4.073 2.472) 7.649 4.782 ( -1.220 2.761 2.494) 3.916 4.812 ( -0.550 0.386 1.366) 1.522 4.951 ( 0.994 6.364 1.490) 6.612 5.056 ( 1.222 -3.200 2.147) 4.043 5.162 ( 0.801 6.505 -2.137) 6.894 5.277 ( 0.339 -3.397 -2.530) 4.249 7.876 ( -8.219 6.890 -0.091) 10.725 8.019 ( -8.921 -7.098 -0.145) 11.401 8.545 ( -0.749 0.686 0.710) 1.239 8.573 ( 3.410 -2.422 -0.334) 4.196 9.472 ( 7.369 5.202 2.022) 9.244 9.586 ( 11.561 -5.763 2.548) 13.166 10.183 ( -8.887 6.869 0.224) 11.234 10.343 ( -9.935 -8.383 -0.682) 13.017 10.855 ( 13.307 12.155 -0.216) 18.024 11.141 ( 14.855 -15.740 0.124) 21.643 12.727 ( -6.143 4.187 0.720) 7.469 12.788 ( -4.104 -1.976 1.086) 4.682 16.900 ( -0.815 9.832 -0.110) 9.867 17.077 ( 2.224 -8.210 0.539) 8.523 18.035 ( 2.381 11.544 -2.178) 11.986 18.340 ( 0.630 -17.241 -3.329) 17.571 21.320 ( 4.263 7.230 -1.049) 8.458 21.436 ( 3.036 -4.079 -0.471) 5.107 23.122 ( -4.071 13.555 2.631) 14.395 23.357 ( -5.972 -9.412 0.701) 11.168 107.812 ( 0.038 -0.113 -0.263) 0.289 107.817 ( -0.097 -0.564 -0.036) 0.573 108.439 ( -0.062 0.042 0.019) 0.077 108.441 ( -0.087 -0.193 -0.006) 0.212 ======================= Grid point 178 (97/259) ======================= q-point: (-0.22 0.46 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.632 ( -2.154 9.691 -1.384) 10.023 2.803 ( 0.269 -7.562 -1.523) 7.718 3.141 ( 5.315 19.291 -0.507) 20.017 3.503 ( 7.859 -15.347 0.535) 17.250 3.618 ( 3.779 4.536 -1.224) 6.030 3.737 ( 6.097 -5.722 1.267) 8.457 4.765 ( -2.061 1.592 1.272) 2.898 4.788 ( -2.425 -0.507 0.032) 2.478 4.993 ( 1.790 8.159 1.794) 8.543 5.087 ( -0.393 0.649 2.406) 2.522 5.163 ( 1.314 3.029 -1.580) 3.660 5.253 ( -0.731 -2.463 -2.649) 3.691 7.710 ( -8.704 4.283 -0.944) 9.746 7.826 ( -10.787 -7.202 -0.825) 12.996 8.615 ( 7.039 3.933 1.180) 8.150 8.690 ( 8.856 -3.767 0.230) 9.626 9.549 ( -1.687 6.189 2.444) 6.864 9.693 ( -3.946 -8.107 2.445) 9.342 10.090 ( -0.023 4.350 0.191) 4.354 10.196 ( -4.588 -6.144 -1.216) 7.764 11.153 ( 19.586 13.524 -0.300) 23.804 11.433 ( 17.200 -14.150 0.057) 22.273 12.575 ( -11.143 6.179 0.073) 12.742 12.678 ( -8.752 -4.144 0.355) 9.690 16.873 ( -1.322 12.434 -1.463) 12.590 17.117 ( 1.465 -12.233 0.541) 12.332 18.081 ( 4.128 9.386 -1.530) 10.368 18.340 ( 1.820 -15.216 -2.560) 15.537 21.403 ( 5.298 6.486 -0.636) 8.400 21.499 ( 3.789 -2.817 0.225) 4.726 23.050 ( -5.486 10.800 1.831) 12.251 23.232 ( -7.792 -7.015 0.349) 10.490 107.811 ( -0.000 -0.135 -0.270) 0.302 107.814 ( -0.118 -0.517 -0.083) 0.536 108.437 ( -0.110 -0.019 0.005) 0.111 108.439 ( -0.155 -0.161 -0.055) 0.230 ======================= Grid point 179 (98/259) ======================= q-point: (-0.11 0.46 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.589 ( -1.055 11.225 -2.213) 11.489 2.794 ( 0.335 -9.394 -2.101) 9.632 3.233 ( 4.397 20.856 0.462) 21.319 3.631 ( 5.150 -18.288 -0.548) 19.007 3.671 ( 3.139 8.427 -0.080) 8.993 3.833 ( 3.765 -7.087 0.093) 8.026 4.731 ( -1.980 0.444 -0.609) 2.119 4.738 ( -1.961 -0.064 -1.586) 2.523 5.026 ( 0.237 9.477 1.159) 9.551 5.073 ( -1.778 4.034 0.497) 4.437 5.185 ( 1.024 -1.488 -0.287) 1.829 5.218 ( -0.519 -1.520 -2.006) 2.570 7.580 ( -4.344 1.378 -1.173) 4.706 7.654 ( -6.812 -5.860 -1.169) 9.061 8.783 ( 9.598 5.175 0.853) 10.938 8.866 ( 9.493 -3.142 0.383) 10.007 9.449 ( -10.107 3.707 2.244) 10.997 9.551 ( -9.967 -6.625 1.887) 12.116 10.128 ( 1.661 0.610 -0.160) 1.777 10.159 ( 0.791 -2.422 -1.051) 2.756 11.530 ( 21.507 10.921 -0.376) 24.124 11.740 ( 15.831 -9.945 -0.305) 18.698 12.334 ( -14.766 8.210 -0.464) 16.901 12.486 ( -11.888 -6.934 -0.331) 13.766 16.839 ( -0.663 14.500 -2.402) 14.712 17.134 ( 0.302 -15.248 0.018) 15.251 18.145 ( 3.558 7.169 -1.190) 8.091 18.361 ( 2.110 -13.507 -1.634) 13.768 21.486 ( 3.840 5.797 -0.110) 6.954 21.566 ( 2.722 -1.950 1.366) 3.616 22.966 ( -4.380 8.727 0.498) 9.777 23.104 ( -5.832 -4.695 -0.125) 7.488 107.809 ( 0.025 -0.171 -0.288) 0.336 107.812 ( -0.063 -0.484 -0.142) 0.509 108.435 ( -0.141 -0.079 -0.071) 0.177 108.435 ( -0.078 -0.124 -0.109) 0.183 ======================= Grid point 234 (99/259) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.641 ( 6.705 0.000 12.534) 14.215 1.064 ( 1.787 0.000 23.812) 23.879 1.771 ( 2.799 0.000 37.863) 37.966 2.814 ( 2.029 0.000 -9.372) 9.590 3.191 ( 0.037 0.000 -9.772) 9.772 3.412 ( -4.451 0.000 0.066) 4.451 4.174 ( -1.348 0.000 1.220) 1.819 4.524 ( 1.460 0.000 -2.913) 3.258 4.530 ( 1.305 0.000 -1.834) 2.251 4.903 ( -2.169 0.000 4.999) 5.450 5.246 ( 4.732 0.000 -1.402) 4.935 6.583 ( -5.198 0.000 -10.297) 11.534 7.975 ( 0.116 0.000 0.817) 0.826 8.103 ( 0.133 0.000 -0.410) 0.431 8.337 ( -2.400 0.000 -0.856) 2.548 9.142 ( -0.791 0.000 1.652) 1.832 9.408 ( 0.336 0.000 0.045) 0.339 9.652 ( 15.659 0.000 1.960) 15.782 9.988 ( 0.162 0.000 -0.501) 0.526 10.648 ( -2.304 0.000 -0.687) 2.405 10.989 ( -0.110 0.000 -0.130) 0.171 11.583 ( -5.603 0.000 0.118) 5.604 12.154 ( 1.358 0.000 0.376) 1.409 13.645 ( -1.593 0.000 -0.729) 1.752 14.787 ( 0.344 0.000 2.592) 2.614 15.378 ( -1.393 0.000 -1.789) 2.268 19.824 ( -0.570 0.000 1.112) 1.249 20.254 ( 0.745 0.000 -1.013) 1.257 20.709 ( -0.438 0.000 0.665) 0.796 20.734 ( 6.916 0.000 3.045) 7.556 21.750 ( -5.340 0.000 2.141) 5.753 22.312 ( -0.316 0.000 -1.918) 1.944 107.940 ( 0.101 0.000 0.173) 0.200 107.983 ( 1.352 0.000 0.285) 1.382 108.542 ( -0.526 0.000 1.779) 1.855 108.716 ( -5.185 0.000 -1.303) 5.346 ======================= Grid point 235 (100/259) ======================= q-point: ( 0.11 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.123 ( 30.121 0.000 7.887) 31.137 1.375 ( 13.021 0.000 19.301) 23.282 2.079 ( 0.956 0.000 32.317) 32.331 2.844 ( 7.793 0.000 -10.142) 12.790 3.095 ( -2.307 0.000 -10.153) 10.412 3.285 ( -7.107 0.000 -3.788) 8.054 4.158 ( -1.319 0.000 0.777) 1.531 4.531 ( 0.194 0.000 -1.568) 1.580 4.537 ( 2.032 0.000 -2.133) 2.946 4.862 ( -5.663 0.000 4.696) 7.356 5.304 ( 2.043 0.000 -0.219) 2.054 6.124 ( -27.876 0.000 -0.974) 27.893 7.975 ( -0.865 0.000 0.364) 0.939 8.091 ( -1.110 0.000 -0.473) 1.207 8.590 ( 21.907 0.000 -4.309) 22.326 9.009 ( -11.383 0.000 1.517) 11.483 9.531 ( 9.497 0.000 0.193) 9.499 9.942 ( 13.215 0.000 -9.379) 16.205 9.989 ( 0.372 0.000 -0.480) 0.607 10.650 ( 5.513 0.000 0.326) 5.523 10.915 ( -7.022 0.000 -0.073) 7.022 11.564 ( 1.150 0.000 2.417) 2.676 12.216 ( 5.469 0.000 -0.223) 5.473 13.486 ( -14.125 0.000 2.366) 14.322 14.832 ( 2.425 0.000 2.676) 3.611 15.327 ( -2.790 0.000 -1.719) 3.277 19.857 ( 3.274 0.000 0.693) 3.347 20.272 ( 1.996 0.000 -0.979) 2.223 20.692 ( -2.023 0.000 0.608) 2.112 20.991 ( 18.216 0.000 -4.947) 18.876 21.742 ( 0.343 0.000 4.614) 4.627 22.269 ( -2.365 0.000 -2.204) 3.233 107.936 ( -0.526 0.000 0.100) 0.536 108.003 ( 0.779 0.000 -0.268) 0.824 108.542 ( -1.056 0.000 1.964) 2.230 108.612 ( -5.610 0.000 1.850) 5.907 ======================= Grid point 236 (101/259) ======================= q-point: ( 0.22 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.681 ( 22.224 0.000 7.088) 23.327 1.778 ( 16.959 0.000 13.904) 21.930 2.258 ( -4.212 0.000 21.273) 21.686 2.913 ( 6.955 0.000 -5.355) 8.778 2.955 ( -5.203 0.000 -9.403) 10.747 3.168 ( 0.499 0.000 -5.620) 5.643 4.141 ( -0.708 0.000 0.131) 0.720 4.515 ( -0.717 0.000 -1.209) 1.406 4.558 ( 1.651 0.000 -1.754) 2.408 4.796 ( -4.966 0.000 4.172) 6.486 5.293 ( -3.454 0.000 -2.067) 4.025 5.720 ( -17.593 0.000 2.954) 17.839 7.953 ( -1.246 0.000 -0.544) 1.360 8.060 ( -1.715 0.000 -0.605) 1.818 8.815 ( -10.921 0.000 1.586) 11.036 8.933 ( 18.678 0.000 -2.631) 18.862 9.697 ( 8.379 0.000 0.122) 8.380 9.909 ( -5.622 0.000 -9.696) 11.208 9.992 ( 0.259 0.000 -0.417) 0.491 10.759 ( -5.893 0.000 3.028) 6.626 10.914 ( 17.238 0.000 -3.024) 17.501 11.593 ( -1.123 0.000 2.795) 3.012 12.339 ( 8.526 0.000 -1.735) 8.701 13.236 ( -14.713 0.000 2.342) 14.899 14.911 ( 4.130 0.000 2.309) 4.732 15.255 ( -3.926 0.000 -0.967) 4.043 19.929 ( 3.866 0.000 -0.214) 3.872 20.310 ( 3.030 0.000 -0.846) 3.146 20.647 ( -3.289 0.000 0.418) 3.316 21.233 ( 13.557 0.000 -8.378) 15.937 21.808 ( 1.880 0.000 5.991) 6.279 22.216 ( -0.238 0.000 -3.369) 3.377 107.925 ( -0.651 0.000 -0.126) 0.663 108.009 ( 0.003 0.000 0.005) 0.006 108.530 ( -1.984 0.000 1.926) 2.765 108.555 ( -2.646 0.000 2.704) 3.783 ======================= Grid point 237 (102/259) ======================= q-point: ( 0.33 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.890 ( -5.051 0.000 2.231) 5.522 2.170 ( 15.705 0.000 10.005) 18.621 2.286 ( -5.140 0.000 14.722) 15.594 2.764 ( -8.195 0.000 -8.528) 11.827 3.105 ( 17.375 0.000 1.665) 17.455 3.230 ( 8.688 0.000 -3.433) 9.342 4.141 ( 0.778 0.000 -0.110) 0.785 4.488 ( -1.339 0.000 -1.048) 1.700 4.561 ( -0.085 0.000 -1.611) 1.613 4.753 ( -2.938 0.000 2.481) 3.845 5.117 ( -11.411 0.000 -7.305) 13.549 5.525 ( -8.559 0.000 4.626) 9.729 7.928 ( -0.522 0.000 -1.624) 1.705 8.026 ( -1.360 0.000 -0.749) 1.553 8.654 ( -7.967 0.000 1.650) 8.136 9.212 ( 13.426 0.000 -0.979) 13.461 9.706 ( -8.077 0.000 -7.284) 10.876 9.828 ( 6.059 0.000 0.022) 6.059 9.989 ( -0.378 0.000 -0.324) 0.498 10.681 ( -4.579 0.000 4.464) 6.395 11.211 ( 14.561 0.000 -1.328) 14.622 11.572 ( -2.269 0.000 2.271) 3.211 12.476 ( 8.369 0.000 -3.114) 8.929 13.016 ( -10.617 0.000 0.696) 10.640 15.005 ( 4.504 0.000 0.678) 4.555 15.178 ( -4.118 0.000 1.093) 4.260 19.975 ( 1.585 0.000 -1.213) 1.996 20.366 ( 3.659 0.000 -0.595) 3.707 20.583 ( -3.941 0.000 0.103) 3.943 21.352 ( 6.623 0.000 -7.844) 10.266 21.865 ( -1.326 0.000 6.821) 6.949 22.250 ( 7.438 0.000 -3.758) 8.334 107.911 ( -0.650 0.000 -0.396) 0.761 108.006 ( -0.427 0.000 0.348) 0.551 108.511 ( -1.434 0.000 1.831) 2.325 108.540 ( -1.575 0.000 2.504) 2.958 ======================= Grid point 238 (103/259) ======================= q-point: (-0.56 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.651 ( -17.787 0.000 -1.299) 17.835 2.298 ( -5.824 0.000 13.193) 14.421 2.364 ( -9.603 0.000 5.655) 11.144 2.647 ( 9.877 0.000 -5.808) 11.458 3.344 ( 4.503 0.000 3.956) 5.994 3.537 ( 24.840 0.000 1.428) 24.881 4.169 ( 2.149 0.000 0.395) 2.185 4.453 ( -1.388 0.000 -1.348) 1.935 4.515 ( -5.957 0.000 -2.473) 6.450 4.653 ( -9.442 0.000 -2.747) 9.834 4.896 ( -2.310 0.000 -6.367) 6.773 5.429 ( -5.858 0.000 3.036) 6.599 7.909 ( -0.000 0.000 -2.474) 2.474 8.005 ( -0.218 0.000 -0.842) 0.870 8.562 ( -3.558 0.000 1.675) 3.933 9.388 ( 6.287 0.000 -0.572) 6.312 9.546 ( -3.408 0.000 -5.852) 6.772 9.914 ( 3.406 0.000 -0.065) 3.407 9.971 ( -1.349 0.000 -0.226) 1.367 10.673 ( -0.897 0.000 6.202) 6.267 11.361 ( 2.881 0.000 0.886) 3.014 11.585 ( 2.104 0.000 0.639) 2.199 12.600 ( 8.445 0.000 -2.740) 8.878 12.860 ( -7.107 0.000 -1.127) 7.196 15.028 ( -2.189 0.000 -1.893) 2.894 15.175 ( 2.293 0.000 3.938) 4.556 19.968 ( -0.974 0.000 -1.683) 1.944 20.425 ( 2.466 0.000 -0.113) 2.469 20.517 ( -2.553 0.000 -0.419) 2.587 21.358 ( 0.004 0.000 -6.186) 6.186 21.889 ( 0.703 0.000 3.785) 3.850 22.398 ( 9.792 0.000 -1.376) 9.888 107.896 ( -0.560 0.000 -0.586) 0.811 107.999 ( -0.697 0.000 0.576) 0.905 108.506 ( -0.675 0.000 1.600) 1.737 108.535 ( -0.975 0.000 2.478) 2.663 ======================= Grid point 239 (104/259) ======================= q-point: (-0.44 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.314 ( -18.810 0.000 2.680) 18.999 2.062 ( -22.131 0.000 2.224) 22.243 2.264 ( -9.181 0.000 11.711) 14.880 2.879 ( 14.384 0.000 -2.502) 14.600 3.401 ( -0.731 0.000 1.740) 1.887 3.973 ( 16.289 0.000 6.804) 17.653 4.191 ( -15.684 0.000 -10.847) 19.069 4.214 ( 1.613 0.000 1.301) 2.073 4.425 ( -0.053 0.000 -2.092) 2.093 4.581 ( 0.632 0.000 -1.312) 1.457 4.894 ( 3.898 0.000 -3.771) 5.423 5.364 ( -3.362 0.000 3.151) 4.608 7.889 ( -0.029 0.000 -2.669) 2.669 8.006 ( 1.119 0.000 -0.834) 1.396 8.556 ( 1.585 0.000 1.676) 2.307 9.395 ( -3.464 0.000 -1.534) 3.788 9.539 ( 6.042 0.000 -4.355) 7.449 9.913 ( -3.415 0.000 -0.071) 3.416 9.973 ( 1.611 0.000 -0.222) 1.626 10.725 ( 1.152 0.000 5.451) 5.572 11.404 ( 1.574 0.000 1.648) 2.279 11.609 ( 0.314 0.000 0.339) 0.462 12.701 ( -6.665 0.000 -3.735) 7.640 12.759 ( 7.885 0.000 -0.947) 7.942 14.952 ( -4.507 0.000 -0.338) 4.520 15.264 ( 4.004 0.000 2.380) 4.658 19.924 ( -2.386 0.000 -1.251) 2.694 20.406 ( -3.384 0.000 -0.163) 3.387 20.532 ( 3.616 0.000 -0.368) 3.635 21.271 ( -4.390 0.000 -4.790) 6.498 21.965 ( 5.489 0.000 1.136) 5.606 22.540 ( 6.537 0.000 -1.919) 6.813 107.883 ( -0.394 0.000 -0.519) 0.652 107.990 ( -0.862 0.000 0.724) 1.126 108.509 ( -0.247 0.000 1.415) 1.437 108.546 ( 0.082 0.000 2.910) 2.911 ======================= Grid point 240 (105/259) ======================= q-point: (-0.33 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.065 ( -14.051 0.000 13.298) 19.346 1.655 ( -25.549 0.000 5.590) 26.153 2.089 ( -21.669 0.000 11.474) 24.520 3.084 ( 10.837 0.000 -3.974) 11.543 3.364 ( -2.274 0.000 -1.003) 2.485 3.748 ( -16.030 0.000 -11.062) 19.476 4.231 ( -0.957 0.000 1.490) 1.771 4.365 ( 14.684 0.000 4.655) 15.404 4.431 ( 2.636 0.000 -2.348) 3.530 4.587 ( 0.489 0.000 -1.336) 1.423 4.958 ( 6.143 0.000 -3.359) 7.001 5.392 ( 2.397 0.000 9.312) 9.615 7.877 ( 0.870 0.000 -1.721) 1.928 8.030 ( 2.008 0.000 -0.722) 2.134 8.642 ( 6.480 0.000 1.644) 6.685 9.290 ( -7.088 0.000 -0.522) 7.107 9.644 ( 9.546 0.000 -7.153) 11.928 9.825 ( -6.184 0.000 0.014) 6.184 9.991 ( 0.667 0.000 -0.319) 0.739 10.779 ( 1.175 0.000 2.860) 3.092 11.380 ( -5.699 0.000 -3.027) 6.454 11.669 ( 5.408 0.000 3.713) 6.560 12.487 ( -11.119 0.000 -6.351) 12.805 12.931 ( 9.786 0.000 1.647) 9.923 14.873 ( -4.358 0.000 0.831) 4.437 15.343 ( 3.205 0.000 0.934) 3.338 19.871 ( -2.663 0.000 -0.287) 2.679 20.342 ( -3.113 0.000 -0.552) 3.161 20.599 ( 3.644 0.000 0.062) 3.645 21.148 ( -5.299 0.000 -3.933) 6.599 22.089 ( 7.387 0.000 -0.092) 7.388 22.571 ( 0.035 0.000 -8.073) 8.073 107.876 ( -0.071 0.000 0.026) 0.075 107.980 ( -0.895 0.000 0.837) 1.226 108.517 ( -0.058 0.000 1.319) 1.321 108.587 ( 1.853 0.000 3.753) 4.186 ======================= Grid point 241 (106/259) ======================= q-point: (-0.22 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.024 ( -7.758 0.000 22.739) 24.026 1.259 ( -24.701 0.000 12.304) 27.595 1.664 ( -33.038 0.000 15.097) 36.324 3.204 ( 6.668 0.000 -6.029) 8.989 3.298 ( -6.549 0.000 -12.235) 13.877 3.440 ( -6.148 0.000 -2.921) 6.807 4.212 ( -1.847 0.000 1.133) 2.167 4.472 ( 3.322 0.000 -2.017) 3.886 4.545 ( 0.400 0.000 -0.935) 1.017 4.652 ( 9.400 0.000 5.047) 10.669 5.057 ( 7.346 0.000 -3.431) 8.108 5.631 ( 13.909 0.000 18.203) 22.909 7.900 ( 2.428 0.000 -0.385) 2.459 8.063 ( 2.112 0.000 -0.568) 2.187 8.805 ( 9.939 0.000 1.569) 10.062 9.140 ( -9.114 0.000 -1.142) 9.185 9.692 ( -8.610 0.000 0.113) 8.610 9.714 ( 3.796 0.000 -13.090) 13.629 9.994 ( 0.062 0.000 -0.410) 0.415 10.802 ( -0.851 0.000 0.927) 1.259 11.153 ( -13.611 0.000 -7.091) 15.348 11.778 ( 2.366 0.000 -0.149) 2.370 12.259 ( -8.258 0.000 -3.034) 8.798 13.161 ( 14.174 0.000 4.801) 14.966 14.812 ( -3.333 0.000 1.666) 3.726 15.390 ( 1.778 0.000 -0.330) 1.809 19.832 ( -1.686 0.000 0.946) 1.933 20.291 ( -1.974 0.000 -0.804) 2.131 20.659 ( 2.645 0.000 0.377) 2.672 21.015 ( -7.069 0.000 -3.733) 7.994 22.209 ( 5.570 0.000 -1.594) 5.793 22.382 ( -10.855 0.000 -16.259) 19.550 107.885 ( 0.773 0.000 0.963) 1.235 107.971 ( -0.787 0.000 0.928) 1.217 108.527 ( -0.032 0.000 1.355) 1.356 108.672 ( 4.273 0.000 3.479) 5.510 ======================= Grid point 242 (107/259) ======================= q-point: (-0.11 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.842 ( -28.415 0.000 10.634) 30.340 1.010 ( -15.203 0.000 21.106) 26.011 1.475 ( -5.066 0.000 36.510) 36.860 2.977 ( -11.313 0.000 -12.198) 16.636 3.235 ( 2.875 0.000 -8.204) 8.694 3.439 ( 0.209 0.000 1.848) 1.859 4.190 ( -1.522 0.000 1.208) 1.944 4.510 ( 2.484 0.000 -1.917) 3.138 4.529 ( 0.425 0.000 -2.919) 2.950 4.840 ( 5.026 0.000 5.972) 7.805 5.160 ( 6.488 0.000 -2.669) 7.015 6.196 ( 33.505 0.000 11.972) 35.579 7.948 ( 2.430 0.000 0.405) 2.463 8.092 ( 1.397 0.000 -0.447) 1.467 8.827 ( -26.812 0.000 -11.934) 29.348 9.007 ( 10.509 0.000 1.502) 10.616 9.525 ( -9.602 0.000 0.186) 9.604 9.551 ( -6.734 0.000 -3.685) 7.676 9.990 ( -0.046 0.000 -0.475) 0.477 10.720 ( -6.270 0.000 -0.313) 6.278 10.973 ( -0.420 0.000 -1.629) 1.682 11.720 ( -6.225 0.000 -2.661) 6.770 12.162 ( -2.469 0.000 0.137) 2.473 13.493 ( 16.363 0.000 2.453) 16.546 14.781 ( -1.687 0.000 2.243) 2.807 15.401 ( 0.169 0.000 -1.289) 1.300 19.827 ( -0.274 0.000 1.506) 1.531 20.261 ( -0.620 0.000 -0.955) 1.138 20.697 ( 1.203 0.000 0.585) 1.338 20.807 ( -12.574 0.000 -1.476) 12.660 21.966 ( -16.399 0.000 -9.474) 18.939 22.301 ( 3.062 0.000 -1.672) 3.489 107.918 ( 1.769 0.000 0.861) 1.967 107.967 ( -0.320 0.000 0.997) 1.047 108.536 ( -0.186 0.000 1.524) 1.535 108.758 ( 2.488 0.000 -0.847) 2.628 ======================= Grid point 243 (108/259) ======================= q-point: ( 0.00 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.886 ( 1.380 21.158 9.140) 23.089 1.228 ( 3.307 11.718 23.053) 26.071 1.947 ( 2.532 18.472 28.118) 33.738 2.828 ( 0.683 1.944 -8.458) 8.705 3.316 ( -0.917 7.599 -8.854) 11.704 3.450 ( -2.652 6.993 -0.967) 7.541 4.297 ( -0.806 9.710 -2.065) 9.959 4.534 ( 0.823 1.657 -2.847) 3.396 4.571 ( 1.587 3.935 -2.201) 4.780 4.875 ( -1.772 -2.735 4.820) 5.818 5.206 ( 4.467 -3.965 -1.465) 6.150 5.994 ( -4.784 -36.276 2.713) 36.691 7.982 ( -0.852 0.748 0.294) 1.171 8.322 ( -1.952 -1.548 -0.589) 2.560 8.586 ( -3.920 21.062 -7.691) 22.763 9.146 ( 6.850 -16.039 0.905) 17.463 9.312 ( -0.681 17.379 -3.974) 17.841 9.792 ( 5.764 4.004 0.744) 7.057 9.965 ( 5.314 0.663 0.274) 5.362 10.626 ( -2.327 -2.328 -0.573) 3.341 10.967 ( 1.724 -1.547 -0.153) 2.322 11.470 ( -7.617 -6.914 3.799) 10.966 12.155 ( 1.488 0.255 0.303) 1.540 13.266 ( 0.436 -18.098 5.597) 18.949 15.271 ( -0.676 13.575 -12.044) 18.160 16.102 ( -0.415 70.768 -19.192) 73.325 19.604 ( 0.329 -18.153 1.858) 18.250 19.904 ( -1.120 -28.710 -4.036) 29.014 20.640 ( 1.230 7.474 5.520) 9.373 21.179 ( 11.057 19.120 1.157) 22.117 21.823 ( -10.613 8.773 1.203) 13.823 22.317 ( 0.063 0.781 -1.249) 1.474 107.931 ( 0.199 -0.873 0.201) 0.918 107.968 ( 0.925 -1.314 0.754) 1.775 108.531 ( -0.480 -0.999 1.580) 1.930 108.648 ( -4.046 -5.405 1.219) 6.861 ======================= Grid point 244 (109/259) ======================= q-point: ( 0.11 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.165 ( 18.499 7.895 10.359) 22.624 1.558 ( 13.432 11.008 19.771) 26.316 2.203 ( 3.490 13.854 21.086) 25.470 2.832 ( 5.790 0.899 -7.991) 9.909 3.209 ( -3.312 4.704 -7.875) 9.752 3.356 ( -5.107 11.299 -4.109) 13.063 4.264 ( -1.370 9.255 -1.360) 9.454 4.527 ( 0.362 0.732 -2.556) 2.684 4.586 ( 1.735 3.805 -1.549) 4.459 4.842 ( -5.146 -2.038 4.519) 7.146 5.258 ( 1.819 -4.625 -0.710) 5.020 5.796 ( -15.279 -24.868 2.174) 29.267 7.942 ( -2.536 -0.496 -0.097) 2.586 8.191 ( -7.878 3.533 -0.124) 8.635 8.613 ( 6.850 -1.492 -1.581) 7.187 9.210 ( -5.448 16.850 -0.994) 17.737 9.396 ( 15.706 -7.818 -3.138) 17.823 9.854 ( 1.140 -6.938 -1.426) 7.175 10.111 ( 6.475 7.280 -5.364) 11.122 10.638 ( 7.225 -1.443 -0.022) 7.368 10.901 ( -7.299 -1.152 -0.265) 7.394 11.471 ( 2.669 -5.385 4.827) 7.709 12.213 ( 4.635 -0.354 -0.212) 4.654 13.255 ( -5.690 -14.001 4.227) 15.693 15.159 ( -1.696 14.684 -9.873) 17.776 15.881 ( -10.684 54.925 -4.924) 56.171 19.641 ( 2.158 -18.403 1.868) 18.623 19.929 ( 5.888 -28.220 -5.690) 29.384 20.692 ( 0.122 6.876 4.612) 8.281 21.402 ( 13.282 23.837 -6.470) 28.044 21.737 ( -2.179 0.901 5.345) 5.842 22.298 ( -0.435 3.386 -1.384) 3.684 107.928 ( -0.482 -0.767 0.084) 0.910 107.988 ( 0.687 -1.407 0.193) 1.577 108.531 ( -0.987 -1.042 1.749) 2.263 108.580 ( -4.250 -2.717 2.246) 5.522 ======================= Grid point 245 (110/259) ======================= q-point: ( 0.22 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.606 ( 19.693 -0.580 9.998) 22.093 1.936 ( 10.476 6.326 18.500) 22.181 2.340 ( -0.457 9.920 6.190) 11.702 2.901 ( 6.371 4.410 -2.928) 8.283 3.125 ( 1.062 2.782 -5.601) 6.343 3.227 ( -4.388 14.048 -5.160) 15.596 4.229 ( -1.424 7.785 -0.869) 7.962 4.503 ( -0.918 -0.344 -2.476) 2.663 4.611 ( 1.993 4.414 -0.961) 4.937 4.782 ( -4.563 -1.405 3.940) 6.190 5.236 ( -3.672 -5.681 -3.026) 7.410 5.571 ( -11.059 -12.469 3.887) 17.114 7.912 ( -0.469 -1.539 -0.602) 1.718 8.070 ( -5.582 -1.232 0.007) 5.717 8.694 ( 0.417 -6.238 0.561) 6.277 9.156 ( 2.189 13.018 -1.154) 13.251 9.616 ( 10.477 -4.621 -2.608) 11.744 9.835 ( -1.961 -7.549 -1.854) 8.017 10.032 ( -7.238 2.985 -4.138) 8.855 10.758 ( -5.563 -0.158 2.216) 5.990 10.912 ( 18.010 -1.656 -3.099) 18.350 11.564 ( 3.082 0.131 3.862) 4.943 12.310 ( 6.488 -2.442 -1.215) 7.038 13.138 ( -9.310 -7.483 2.124) 12.132 15.091 ( 0.649 12.069 -4.867) 13.030 15.686 ( -9.296 41.296 0.554) 42.333 19.702 ( 2.798 -18.887 1.649) 19.165 19.991 ( 5.687 -27.723 -6.072) 28.944 20.711 ( -1.320 7.709 2.941) 8.356 21.498 ( 4.448 16.789 -9.072) 19.595 21.804 ( 2.274 0.027 7.591) 7.924 22.312 ( 4.694 9.972 -2.935) 11.406 107.918 ( -0.608 -0.697 -0.131) 0.934 107.996 ( 0.033 -1.218 0.251) 1.244 108.519 ( -1.832 -1.042 1.797) 2.770 108.541 ( -2.040 -1.275 2.429) 3.419 ======================= Grid point 246 (111/259) ======================= q-point: ( 0.33 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.893 ( 0.532 1.060 4.052) 4.222 2.165 ( -0.548 -0.743 17.818) 17.842 2.369 ( 7.719 8.047 0.116) 11.152 2.916 ( -6.546 13.772 -2.051) 15.386 3.188 ( 6.159 -3.312 -2.206) 7.332 3.241 ( 14.573 12.735 -1.352) 19.400 4.204 ( -0.964 5.115 -0.135) 5.207 4.461 ( -1.637 -0.766 -2.013) 2.706 4.636 ( 1.103 5.842 -0.557) 5.971 4.742 ( -2.733 -1.311 1.762) 3.506 5.069 ( -9.673 -4.350 -6.877) 12.640 5.457 ( -6.070 -6.097 4.233) 9.588 7.910 ( 0.655 -0.885 -1.009) 1.493 7.992 ( -2.702 -3.599 -0.487) 4.527 8.638 ( -5.492 -1.336 0.621) 5.686 9.258 ( 7.888 2.729 -0.683) 8.375 9.663 ( -4.415 -3.402 -5.101) 7.556 9.803 ( 2.751 -3.739 -0.100) 4.643 9.913 ( -3.296 -4.920 -0.789) 5.974 10.694 ( -3.490 1.122 3.687) 5.200 11.191 ( 12.574 -3.471 -1.357) 13.114 11.644 ( 3.879 8.310 2.152) 9.420 12.417 ( 6.566 -5.204 -2.065) 8.628 12.978 ( -8.944 -3.481 0.436) 9.607 15.105 ( 3.145 9.277 -1.102) 9.858 15.546 ( -6.991 33.569 0.807) 34.299 19.753 ( 1.541 -17.809 0.769) 17.892 20.046 ( 5.008 -28.526 -4.450) 29.302 20.688 ( -2.798 8.569 0.920) 9.061 21.468 ( 0.004 7.657 -7.980) 11.059 21.880 ( -0.265 1.684 8.095) 8.272 22.430 ( 10.484 16.386 -3.420) 19.751 107.905 ( -0.606 -0.615 -0.383) 0.944 107.995 ( -0.384 -1.043 0.453) 1.200 108.503 ( -1.247 -0.783 1.675) 2.230 108.530 ( -1.351 -0.931 2.230) 2.769 ======================= Grid point 247 (112/259) ======================= q-point: (-0.56 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.726 ( -15.195 7.266 -0.540) 16.852 2.185 ( -8.950 -3.251 11.644) 15.042 2.609 ( 5.091 14.043 5.873) 16.050 2.755 ( 0.063 11.307 -3.553) 11.853 3.283 ( 4.223 -5.139 1.298) 6.777 3.600 ( 21.456 6.386 2.282) 22.502 4.183 ( -1.854 -0.296 -0.029) 1.877 4.413 ( -3.353 0.931 -0.877) 3.588 4.637 ( -5.201 -0.499 -1.874) 5.550 4.647 ( -3.324 7.775 -3.407) 9.116 4.888 ( -1.640 -0.535 -5.545) 5.807 5.388 ( -4.633 -3.852 2.503) 6.524 7.905 ( -0.411 -2.102 -1.220) 2.465 7.969 ( 0.618 -1.301 -1.190) 1.869 8.557 ( -3.143 -0.429 0.511) 3.213 9.375 ( 4.771 -2.014 -0.479) 5.201 9.533 ( -3.636 -1.492 -4.338) 5.853 9.855 ( 2.015 -5.990 -0.004) 6.320 9.872 ( -1.380 -7.124 -0.209) 7.260 10.687 ( -1.044 1.284 4.795) 5.073 11.326 ( 3.423 -3.386 1.029) 4.924 11.729 ( 3.436 13.000 0.234) 13.449 12.524 ( 7.149 -7.294 -1.549) 10.330 12.834 ( -6.827 -2.173 -0.975) 7.230 15.175 ( 4.298 10.572 1.203) 11.476 15.445 ( -4.319 28.037 -0.290) 28.369 19.762 ( -0.730 -16.131 -0.338) 16.151 20.110 ( 5.002 -29.327 -2.481) 29.854 20.630 ( -3.600 9.111 -0.397) 9.805 21.390 ( -2.702 2.473 -5.752) 6.819 21.936 ( 1.402 4.299 4.958) 6.710 22.602 ( 9.795 17.634 -1.548) 20.231 107.891 ( -0.519 -0.520 -0.554) 0.921 107.990 ( -0.660 -0.930 0.611) 1.294 108.499 ( -0.595 -0.676 1.462) 1.717 108.526 ( -0.867 -0.831 2.218) 2.522 ======================= Grid point 248 (113/259) ======================= q-point: (-0.44 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.436 ( -16.807 11.472 3.091) 20.582 2.009 ( -18.410 -1.283 6.641) 19.613 2.499 ( -10.952 18.540 6.328) 22.443 2.983 ( 15.356 9.492 -1.443) 18.111 3.336 ( 0.451 -5.702 0.904) 5.791 3.947 ( 1.838 -3.342 6.222) 7.298 4.098 ( 1.942 -2.153 -5.149) 5.909 4.301 ( -3.373 4.772 -1.904) 6.146 4.516 ( -0.160 4.833 -3.206) 5.802 4.651 ( 1.379 7.910 -1.316) 8.137 4.886 ( 3.490 -0.641 -3.887) 5.263 5.337 ( -2.593 -2.484 2.641) 4.457 7.884 ( -0.523 -2.381 -1.498) 2.861 7.982 ( 1.750 -0.048 -1.313) 2.189 8.545 ( 1.375 -0.995 0.774) 1.866 9.394 ( -2.679 -1.191 -1.018) 3.104 9.514 ( 5.609 -2.210 -3.510) 6.976 9.844 ( -1.962 -6.055 -0.028) 6.365 9.878 ( 0.800 -7.726 -0.202) 7.770 10.719 ( 0.541 -0.276 4.317) 4.359 11.360 ( -0.620 -4.040 1.469) 4.343 11.750 ( -0.595 12.704 0.021) 12.718 12.606 ( -2.025 -9.312 -1.219) 9.607 12.749 ( 2.707 -0.117 -1.764) 3.233 15.273 ( 5.032 21.831 2.311) 22.522 15.391 ( -0.680 18.830 -1.554) 18.906 19.728 ( -2.388 -15.288 -0.541) 15.483 20.181 ( 4.507 -29.214 -2.168) 29.639 20.564 ( -3.114 9.386 -0.213) 9.891 21.290 ( -4.220 1.739 -3.929) 6.023 22.014 ( 4.464 4.675 1.790) 6.708 22.732 ( 5.221 16.243 -1.638) 17.140 107.879 ( -0.359 -0.426 -0.483) 0.737 107.981 ( -0.832 -0.861 0.722) 1.398 108.502 ( -0.217 -0.683 1.300) 1.484 108.535 ( -0.046 -1.004 2.581) 2.770 ======================= Grid point 249 (114/259) ======================= q-point: (-0.33 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.207 ( -13.607 13.092 11.254) 21.983 1.662 ( -24.353 2.646 7.083) 25.500 2.319 ( -17.448 19.925 8.720) 27.883 3.204 ( 11.272 10.970 -4.448) 16.346 3.325 ( -0.733 -3.418 -0.928) 3.617 3.656 ( -17.303 -5.466 -5.854) 19.067 4.273 ( 2.352 1.420 0.415) 2.779 4.378 ( 12.946 1.750 3.852) 13.620 4.518 ( 1.960 5.414 -2.392) 6.235 4.659 ( 0.764 8.168 -3.144) 8.785 4.940 ( 5.592 -1.620 -3.358) 6.721 5.363 ( 1.974 -2.701 7.632) 8.333 7.875 ( 0.965 -1.216 -1.144) 1.929 8.014 ( 2.739 -0.355 -0.753) 2.863 8.611 ( 4.707 -2.815 1.051) 5.584 9.298 ( -6.173 -0.070 -0.804) 6.226 9.644 ( 11.065 0.014 -5.395) 12.311 9.789 ( -4.081 -3.257 0.016) 5.221 9.891 ( 0.881 -8.286 -0.343) 8.340 10.760 ( 0.677 -1.826 2.790) 3.402 11.294 ( -7.767 -7.862 -1.648) 11.174 11.743 ( -0.738 8.175 2.285) 8.520 12.446 ( -9.823 -4.000 -3.979) 11.328 12.871 ( 7.779 -4.021 0.922) 8.805 15.355 ( 3.844 32.068 -5.541) 32.770 15.446 ( 7.817 18.142 4.136) 20.183 19.675 ( -3.029 -15.241 -0.098) 15.539 20.226 ( 2.854 -27.714 -4.304) 28.191 20.527 ( -1.417 8.348 1.750) 8.646 21.183 ( -4.670 3.359 -2.640) 6.329 22.119 ( 6.161 3.111 0.190) 6.904 22.738 ( -2.178 14.023 -6.045) 15.424 107.873 ( -0.052 -0.360 0.018) 0.364 107.971 ( -0.874 -0.823 0.813) 1.450 108.509 ( -0.050 -0.736 1.202) 1.410 108.567 ( 1.131 -1.823 3.309) 3.944 ======================= Grid point 250 (115/259) ======================= q-point: (-0.22 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.127 ( -9.522 8.813 20.156) 23.970 1.286 ( -23.226 7.849 10.167) 26.541 1.995 ( -24.715 26.940 12.241) 38.554 3.215 ( -7.534 -5.331 -11.004) 14.362 3.345 ( 5.748 12.218 -6.396) 14.941 3.424 ( -2.509 0.189 1.966) 3.193 4.306 ( 1.851 4.006 -0.861) 4.496 4.531 ( 2.044 4.128 -1.745) 4.926 4.597 ( 2.712 5.573 -1.433) 6.361 4.655 ( 5.962 1.873 1.635) 6.460 5.030 ( 6.871 -2.472 -3.342) 8.031 5.542 ( 8.921 -7.786 13.941) 18.291 7.906 ( 2.802 0.202 -0.183) 2.815 8.080 ( 5.570 1.405 -0.243) 5.750 8.701 ( 3.074 -8.160 1.080) 8.786 9.205 ( -1.886 3.118 -0.405) 3.666 9.644 ( -7.824 -0.114 -4.338) 8.947 9.812 ( 7.155 5.036 -6.635) 10.981 9.904 ( 0.785 -7.247 -0.149) 7.291 10.774 ( -1.390 -2.843 1.196) 3.383 11.054 ( -14.198 -9.076 -4.220) 17.372 11.730 ( -3.915 0.002 2.518) 4.655 12.258 ( -7.258 -0.341 -2.349) 7.636 13.018 ( 6.980 -8.170 3.230) 11.221 15.367 ( 3.438 17.316 -8.358) 19.532 15.706 ( 19.340 49.869 -1.281) 53.503 19.625 ( -2.578 -15.873 0.587) 16.092 20.204 ( -0.690 -26.026 -8.100) 27.266 20.538 ( -0.087 6.201 4.070) 7.418 21.089 ( -4.232 5.824 -0.333) 7.207 22.226 ( 5.463 1.576 -0.647) 5.723 22.532 ( -13.413 12.731 -12.090) 22.094 107.881 ( 0.668 -0.444 0.862) 1.177 107.963 ( -0.788 -0.820 0.893) 1.447 108.518 ( -0.031 -0.822 1.219) 1.470 108.624 ( 2.169 -3.894 3.504) 5.670 ======================= Grid point 251 (116/259) ======================= q-point: (-0.11 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.980 ( -17.248 13.633 11.567) 24.843 1.132 ( -9.513 10.927 20.719) 25.282 1.784 ( -10.005 27.565 24.056) 37.929 2.963 ( -8.120 -0.356 -9.717) 12.668 3.365 ( 2.458 9.442 -7.717) 12.439 3.459 ( 1.324 4.467 1.291) 4.835 4.318 ( 0.583 7.813 -2.325) 8.173 4.545 ( 0.640 2.338 -1.951) 3.112 4.567 ( 0.840 6.096 -4.315) 7.515 4.814 ( 4.508 -2.504 5.513) 7.548 5.126 ( 6.119 -3.300 -2.693) 7.455 5.854 ( 12.220 -23.981 11.085) 29.108 7.958 ( 2.574 0.839 0.206) 2.715 8.222 ( 9.593 6.296 -0.217) 11.476 8.707 ( -1.694 -9.161 -1.984) 9.525 9.251 ( 4.397 2.986 0.418) 5.332 9.354 ( -16.992 7.792 -10.183) 21.287 9.780 ( -3.983 11.330 -2.529) 12.273 9.922 ( 1.189 -5.919 -0.083) 6.038 10.691 ( -5.641 -2.819 0.004) 6.306 10.912 ( 1.112 -5.324 -0.059) 5.439 11.624 ( -9.443 -4.599 2.136) 10.718 12.162 ( -2.503 0.308 -0.196) 2.530 13.167 ( 5.361 -15.007 5.358) 16.812 15.346 ( 1.867 13.037 -10.438) 16.805 16.048 ( 22.078 70.323 -17.315) 75.713 19.598 ( -1.109 -17.376 1.400) 17.468 20.058 ( -7.842 -28.188 -8.741) 30.537 20.578 ( 0.641 7.453 5.491) 9.280 21.054 ( 0.395 11.204 3.258) 11.675 22.123 ( -19.238 13.874 -7.682) 24.932 22.301 ( 2.739 0.203 -1.291) 3.035 107.909 ( 1.497 -0.831 0.943) 1.955 107.958 ( -0.458 -0.895 0.995) 1.415 108.526 ( -0.172 -0.919 1.359) 1.650 108.675 ( 0.306 -6.414 1.804) 6.670 ======================= Grid point 252 (117/259) ======================= q-point: ( 0.00 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.377 ( -2.607 26.094 5.970) 26.895 1.449 ( 3.989 11.282 18.255) 21.828 2.452 ( 1.627 28.436 11.983) 30.901 2.900 ( 0.387 5.156 -6.948) 8.661 3.386 ( -4.062 2.786 -0.913) 5.010 3.741 ( 1.001 17.927 -6.854) 19.219 4.443 ( 1.802 3.929 0.369) 4.338 4.604 ( 0.524 4.491 -4.015) 6.047 4.703 ( -0.265 9.249 -4.507) 10.292 4.801 ( -1.102 -4.128 4.272) 6.041 5.093 ( 3.039 -7.072 -1.247) 7.798 5.430 ( -4.070 -20.317 2.280) 20.845 7.987 ( -1.187 -0.846 -0.830) 1.677 8.257 ( -0.768 -5.824 -0.036) 5.874 8.756 ( -14.463 1.178 -1.547) 14.593 8.823 ( 14.723 -12.518 0.053) 19.325 9.683 ( 2.313 -2.087 -1.204) 3.340 9.770 ( -3.567 12.149 -4.098) 13.309 10.062 ( 8.418 5.552 2.234) 10.328 10.544 ( -1.994 -6.092 -0.026) 6.410 10.987 ( 5.109 4.990 -1.507) 7.299 11.410 ( -8.029 0.801 2.477) 8.441 12.161 ( 1.017 0.167 -0.022) 1.031 13.006 ( 1.221 -9.739 2.217) 10.062 15.516 ( -0.444 12.535 -8.926) 15.395 17.360 ( 0.470 48.067 -26.253) 54.771 19.182 ( -2.025 -23.536 -2.422) 23.747 19.343 ( 1.699 -24.430 -0.484) 24.494 20.783 ( 1.473 5.660 1.155) 5.962 21.442 ( 9.889 9.219 6.657) 15.070 22.096 ( -11.995 14.638 -3.861) 19.314 22.376 ( 1.395 6.965 0.607) 7.129 107.906 ( 0.345 -1.569 0.285) 1.632 107.937 ( 0.225 -1.768 1.108) 2.099 108.506 ( -0.368 -1.476 1.135) 1.898 108.549 ( -2.232 -4.055 2.185) 5.118 ======================= Grid point 253 (118/259) ======================= q-point: ( 0.11 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.439 ( 4.654 17.459 9.858) 20.583 1.731 ( 10.076 8.517 17.139) 21.628 2.587 ( 3.953 20.257 3.429) 20.922 2.903 ( 6.031 5.970 -5.848) 10.306 3.290 ( -5.747 6.652 1.260) 8.881 3.685 ( -1.640 18.200 -6.394) 19.360 4.449 ( -1.490 7.080 -0.149) 7.237 4.572 ( 0.257 4.178 -5.889) 7.226 4.682 ( 0.509 5.383 -1.554) 5.626 4.784 ( -3.728 -3.254 3.858) 6.274 5.119 ( 0.447 -8.964 -1.272) 9.065 5.363 ( -4.239 -16.117 2.503) 16.852 7.927 ( -3.110 -2.243 -0.730) 3.904 8.219 ( -8.580 0.333 0.248) 8.590 8.512 ( -1.884 -7.122 -0.079) 7.367 9.139 ( 12.881 -9.016 -0.204) 15.724 9.674 ( -2.430 16.563 -3.098) 17.025 9.682 ( -1.117 -7.637 -0.711) 7.751 10.207 ( 2.255 1.873 -1.440) 3.266 10.581 ( 8.123 -4.370 0.162) 9.225 10.883 ( -10.677 -0.096 -0.705) 10.700 11.475 ( 9.521 6.306 2.338) 11.657 12.197 ( 2.798 -1.360 -0.227) 3.119 13.025 ( -1.170 -9.603 1.867) 9.852 15.430 ( -1.189 13.790 -8.994) 16.507 17.012 ( -18.012 50.220 -12.262) 54.744 19.170 ( 1.655 -27.669 -1.046) 27.738 19.408 ( 5.578 -21.310 -2.999) 22.231 20.815 ( 0.938 4.008 1.159) 4.277 21.665 ( 8.080 4.477 6.351) 11.210 21.911 ( -5.613 13.754 -5.375) 15.797 22.440 ( 6.268 11.596 -0.406) 13.188 107.906 ( -0.346 -1.436 0.029) 1.478 107.952 ( 0.477 -2.063 0.819) 2.270 108.504 ( -0.880 -1.533 1.324) 2.209 108.523 ( -2.032 -2.643 1.938) 3.856 ======================= Grid point 254 (119/259) ======================= q-point: ( 0.22 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.681 ( 11.919 7.265 11.269) 17.940 2.018 ( 6.869 4.667 15.879) 17.919 2.588 ( -2.008 11.791 -5.181) 13.035 3.023 ( 10.723 4.042 -7.319) 13.597 3.242 ( -2.229 14.029 7.110) 15.885 3.594 ( -2.894 19.464 -5.530) 20.440 4.386 ( -5.228 5.610 -0.104) 7.669 4.531 ( 0.292 4.364 -5.585) 7.094 4.697 ( 1.247 0.457 0.376) 1.380 4.746 ( -2.602 0.590 2.584) 3.714 5.080 ( -2.856 -8.464 -3.009) 9.426 5.331 ( -2.057 -9.941 3.147) 10.629 7.896 ( 0.406 -2.525 -0.441) 2.595 8.022 ( -10.466 -0.737 0.477) 10.503 8.583 ( 4.984 -5.297 -0.023) 7.273 9.233 ( -0.371 -5.201 -0.639) 5.253 9.643 ( -2.579 -9.093 -0.757) 9.482 9.682 ( 4.599 8.976 -1.939) 10.270 10.082 ( -12.209 2.046 -1.482) 12.468 10.740 ( -3.905 -3.022 0.554) 4.969 10.816 ( 15.089 -6.096 -0.489) 16.282 11.682 ( 11.042 11.030 1.640) 15.693 12.248 ( 2.849 -4.007 -0.543) 4.947 12.986 ( -4.243 -7.410 0.791) 8.575 15.358 ( 0.074 14.734 -6.103) 15.948 16.628 ( -17.620 46.706 -2.553) 49.984 19.213 ( 3.698 -29.557 -0.674) 29.795 19.470 ( 3.890 -21.062 -3.866) 21.765 20.827 ( -0.280 2.892 0.095) 2.907 21.756 ( -3.137 7.475 -8.037) 11.416 21.837 ( 1.267 5.520 9.929) 11.431 22.601 ( 12.272 17.321 -2.782) 21.410 107.898 ( -0.471 -1.301 -0.159) 1.393 107.963 ( 0.085 -1.997 0.640) 2.098 108.493 ( -1.347 -1.442 1.449) 2.448 108.511 ( -1.018 -1.653 1.636) 2.539 ======================= Grid point 255 (120/259) ======================= q-point: ( 0.33 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.940 ( 5.100 3.336 7.327) 9.530 2.193 ( -0.790 4.628 13.894) 14.665 2.543 ( 5.156 8.514 -2.516) 10.267 3.121 ( 4.859 -2.690 -4.428) 7.103 3.256 ( -3.754 18.562 1.315) 18.983 3.577 ( 6.974 19.246 -0.749) 20.485 4.271 ( -6.954 0.558 -0.571) 7.000 4.510 ( 0.661 5.855 -2.186) 6.285 4.680 ( -3.352 -4.941 -0.043) 5.971 4.767 ( 2.926 6.204 0.354) 6.868 4.984 ( -4.065 -2.652 -4.594) 6.684 5.318 ( -1.824 -6.867 2.058) 7.397 7.872 ( -5.706 -5.868 0.267) 8.189 7.940 ( 3.516 2.133 -0.211) 4.118 8.612 ( -1.729 -1.186 -0.793) 2.242 9.227 ( 1.977 -6.651 -1.307) 7.060 9.571 ( -4.801 -7.356 -1.313) 8.882 9.738 ( 1.354 1.875 -0.499) 2.366 9.858 ( -9.207 -1.786 -0.210) 9.381 10.709 ( -1.123 -0.333 1.683) 2.051 11.073 ( 12.445 -7.090 0.088) 14.323 11.886 ( 10.249 14.155 0.764) 17.492 12.287 ( 1.978 -7.656 -0.442) 7.920 12.892 ( -6.006 -4.611 -0.078) 7.573 15.354 ( 2.990 15.084 -1.797) 15.482 16.341 ( -13.002 41.532 -0.951) 43.530 19.289 ( 5.117 -30.607 -0.620) 31.038 19.489 ( 1.218 -21.347 -3.200) 21.620 20.807 ( -1.391 2.835 -1.026) 3.320 21.602 ( -5.865 5.451 -7.818) 11.190 21.952 ( 2.072 6.200 10.463) 12.337 22.810 ( 12.611 19.467 -3.025) 23.392 107.887 ( -0.465 -1.138 -0.363) 1.282 107.966 ( -0.278 -1.838 0.626) 1.962 108.483 ( -0.830 -1.123 1.262) 1.882 108.506 ( -0.843 -1.352 1.573) 2.239 ======================= Grid point 256 (121/259) ======================= q-point: (-0.56 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.919 ( -8.619 11.125 0.964) 14.106 2.190 ( -8.931 3.720 11.491) 15.022 2.802 ( 18.698 5.698 4.859) 20.142 3.059 ( -10.939 10.918 2.837) 15.714 3.218 ( 4.465 4.799 -6.914) 9.527 3.787 ( 11.292 11.261 4.555) 16.585 4.137 ( -5.789 -2.742 -3.292) 7.202 4.498 ( -3.792 5.275 1.637) 6.699 4.602 ( -1.756 -1.198 -3.860) 4.406 4.818 ( 2.391 7.312 -0.700) 7.725 4.894 ( -1.059 1.941 -4.754) 5.243 5.295 ( -1.695 -4.758 0.741) 5.104 7.799 ( -2.549 -6.298 0.094) 6.795 8.012 ( 3.887 4.352 -0.466) 5.853 8.548 ( -2.798 -0.333 -1.640) 3.260 9.262 ( 1.639 -9.704 -0.504) 9.854 9.479 ( -2.442 -3.802 -1.563) 4.781 9.720 ( -1.296 -6.045 -0.227) 6.187 9.778 ( -1.842 -1.392 0.232) 2.321 10.708 ( -0.791 0.038 2.104) 2.248 11.239 ( 4.996 -4.825 1.217) 7.052 12.035 ( 5.025 16.080 -0.252) 16.849 12.323 ( 2.484 -12.434 0.429) 12.687 12.790 ( -4.343 -1.955 -0.630) 4.804 15.437 ( 5.870 15.629 1.954) 16.809 16.143 ( -7.187 37.431 -2.825) 38.219 19.380 ( 5.299 -28.824 -1.070) 29.326 19.471 ( -0.719 -23.949 -2.066) 24.049 20.768 ( -1.705 4.177 -1.726) 4.831 21.448 ( -5.385 3.253 -5.227) 8.180 22.062 ( 2.563 8.426 7.248) 11.406 22.988 ( 8.715 18.988 -1.717) 20.962 107.876 ( -0.389 -0.957 -0.490) 1.143 107.963 ( -0.556 -1.697 0.659) 1.903 108.481 ( -0.405 -1.001 1.107) 1.546 108.505 ( -0.585 -1.218 1.591) 2.087 ======================= Grid point 257 (122/259) ======================= q-point: (-0.44 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.731 ( -12.900 16.914 3.597) 21.574 2.048 ( -14.944 5.199 7.777) 17.631 2.894 ( -8.879 17.478 3.506) 19.915 3.173 ( 13.285 3.887 8.729) 16.365 3.252 ( 7.370 3.872 -8.879) 12.171 3.851 ( -11.429 -5.176 2.850) 12.866 4.141 ( 11.165 6.003 -2.049) 12.841 4.393 ( -4.423 3.975 -1.433) 6.117 4.594 ( 1.030 3.888 -0.896) 4.121 4.838 ( 1.609 8.763 -1.959) 9.122 4.880 ( 2.389 0.430 -4.124) 4.785 5.279 ( -0.576 -2.902 0.927) 3.100 7.776 ( -0.094 -6.404 0.006) 6.405 8.052 ( 1.224 5.875 -1.074) 6.096 8.520 ( 0.872 -1.434 -1.059) 1.984 9.277 ( 0.110 -10.708 -0.495) 10.720 9.480 ( 4.163 -1.252 -1.521) 4.606 9.709 ( 0.222 -8.656 -0.539) 8.675 9.761 ( -0.220 -0.348 0.490) 0.640 10.711 ( -0.629 -1.112 2.030) 2.398 11.260 ( -3.847 -5.536 1.298) 6.865 12.048 ( -2.527 15.722 -0.481) 15.931 12.365 ( 0.086 -14.308 0.869) 14.334 12.754 ( 1.563 0.560 -1.125) 2.005 15.572 ( 5.615 15.334 3.174) 16.636 16.068 ( 3.404 37.072 -4.185) 37.462 19.408 ( -2.105 -15.813 -0.864) 15.976 19.484 ( 4.670 -37.373 -2.372) 37.738 20.726 ( -1.250 6.144 -1.843) 6.535 21.337 ( -3.693 2.967 -2.402) 5.312 22.151 ( 2.881 9.056 3.583) 10.156 23.081 ( 2.484 16.980 -1.380) 17.216 107.867 ( -0.252 -0.789 -0.417) 0.927 107.956 ( -0.738 -1.587 0.699) 1.885 108.484 ( -0.155 -1.023 1.006) 1.443 108.510 ( -0.192 -1.368 1.807) 2.274 ======================= Grid point 258 (123/259) ======================= q-point: (-0.33 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.534 ( -13.348 18.276 7.544) 23.856 1.796 ( -17.858 10.674 7.330) 22.058 2.772 ( -9.852 22.595 5.332) 25.220 3.227 ( 0.027 -3.749 -3.873) 5.390 3.498 ( 13.329 15.157 0.230) 20.186 3.594 ( -13.675 -0.545 -1.697) 13.791 4.283 ( 3.297 0.441 -1.271) 3.561 4.429 ( 8.640 3.096 2.415) 9.491 4.600 ( 0.293 3.470 -0.521) 3.522 4.846 ( 1.097 7.826 -3.871) 8.800 4.910 ( 4.372 -0.512 -3.362) 5.539 5.298 ( 1.185 -3.310 3.208) 4.760 7.799 ( 2.786 -5.445 0.100) 6.117 8.062 ( 1.510 4.849 -0.766) 5.136 8.546 ( 1.661 -3.318 -0.106) 3.712 9.230 ( -3.781 -7.923 -1.396) 8.889 9.608 ( 8.168 -5.201 -1.442) 9.790 9.742 ( 3.695 0.012 -0.891) 3.801 9.772 ( 3.158 -0.937 0.242) 3.303 10.712 ( -1.037 -3.087 1.684) 3.666 11.119 ( -12.160 -8.832 0.141) 15.029 11.965 ( -6.423 12.729 0.442) 14.265 12.322 ( -4.175 -8.572 -0.719) 9.562 12.814 ( 4.736 -1.438 -0.439) 4.969 15.635 ( 0.733 13.786 -1.316) 13.868 16.265 ( 21.246 40.497 -2.392) 45.795 19.351 ( -3.401 -16.856 0.031) 17.195 19.539 ( 3.690 -36.334 -4.641) 36.815 20.702 ( 0.088 7.623 -1.199) 7.718 21.272 ( -2.803 5.106 -0.031) 5.825 22.223 ( 3.171 7.413 1.109) 8.139 23.039 ( -5.702 14.655 -3.446) 16.099 107.862 ( -0.002 -0.692 -0.030) 0.693 107.948 ( -0.803 -1.512 0.744) 1.867 108.490 ( -0.041 -1.120 0.923) 1.452 108.526 ( 0.171 -2.051 2.250) 3.050 ======================= Grid point 259 (124/259) ======================= q-point: (-0.22 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.368 ( -12.607 15.592 11.388) 23.059 1.574 ( -12.394 18.447 8.196) 23.687 2.592 ( -14.907 30.118 7.855) 34.511 3.136 ( -5.289 -1.999 -7.733) 9.580 3.437 ( -2.806 2.154 1.410) 3.808 3.679 ( 8.246 18.702 -4.004) 20.828 4.329 ( 3.488 -0.685 -0.978) 3.686 4.599 ( 2.629 0.251 -0.704) 2.733 4.617 ( 5.571 2.105 4.380) 7.393 4.816 ( -0.292 8.398 -5.810) 10.216 4.975 ( 5.187 -2.294 -3.305) 6.565 5.368 ( 2.526 -8.580 5.480) 10.490 7.875 ( 5.003 -3.848 0.189) 6.315 8.127 ( 7.063 3.760 -0.029) 8.001 8.538 ( -3.466 -7.534 0.422) 8.304 9.176 ( -0.634 -5.892 -0.902) 5.994 9.653 ( -1.368 -5.646 -0.481) 5.829 9.761 ( 2.368 2.244 -1.876) 3.763 9.956 ( 11.605 6.689 -2.525) 13.631 10.692 ( -2.796 -5.288 0.991) 6.063 10.868 ( -12.508 -8.266 -0.358) 14.997 11.825 ( -9.818 8.221 0.950) 12.840 12.233 ( -4.231 -2.499 -1.147) 5.046 12.893 ( 3.738 -4.732 0.531) 6.053 15.615 ( 0.280 12.665 -4.982) 13.613 16.744 ( 33.924 43.224 -7.466) 55.452 19.293 ( -3.006 -16.703 0.228) 16.973 19.528 ( -0.398 -35.632 -7.356) 36.385 20.713 ( 1.631 8.223 -0.364) 8.392 21.236 ( -2.073 8.438 2.897) 9.159 22.283 ( 2.974 4.514 -0.077) 5.406 22.813 ( -15.160 14.187 -6.213) 21.672 107.868 ( 0.474 -0.807 0.591) 1.107 107.939 ( -0.753 -1.479 0.792) 1.839 108.496 ( -0.036 -1.250 0.903) 1.542 108.548 ( 0.095 -3.352 2.610) 4.250 ======================= Grid point 260 (125/259) ======================= q-point: (-0.11 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.298 ( -4.227 16.747 13.505) 21.925 1.458 ( -8.583 21.120 8.764) 24.424 2.426 ( -9.581 33.446 11.697) 36.705 2.986 ( -3.896 2.704 -7.338) 8.737 3.430 ( -0.652 1.541 0.309) 1.701 3.747 ( 4.104 18.895 -6.453) 20.384 4.391 ( 3.508 0.747 0.020) 3.587 4.611 ( 0.904 3.495 -1.537) 3.924 4.745 ( 3.001 0.600 1.869) 3.586 4.759 ( -0.391 6.505 -3.716) 7.502 5.039 ( 4.379 -4.902 -2.602) 7.069 5.441 ( 0.396 -16.655 4.372) 17.224 7.958 ( 3.914 -1.784 -0.416) 4.321 8.285 ( 3.854 0.318 0.279) 3.877 8.501 ( 6.778 -9.591 -0.019) 11.745 9.103 ( -11.396 -7.491 -0.272) 13.640 9.631 ( 2.438 3.447 -1.971) 4.660 9.800 ( 3.261 0.450 -3.214) 4.601 10.015 ( -2.235 10.122 -0.908) 10.406 10.607 ( -5.049 -5.778 0.561) 7.694 10.829 ( 7.443 -1.129 0.179) 7.531 11.622 ( -13.399 3.784 1.227) 13.978 12.170 ( -1.873 0.124 -0.468) 1.934 12.957 ( 2.535 -7.742 1.580) 8.298 15.576 ( 0.423 12.056 -7.199) 14.048 17.255 ( 30.361 44.026 -21.465) 57.626 19.246 ( -2.075 -16.433 -1.371) 16.620 19.411 ( -5.845 -33.191 -5.603) 34.164 20.747 ( 1.970 7.507 0.228) 7.764 21.269 ( 2.761 10.767 6.573) 12.913 22.316 ( -0.357 2.096 -1.746) 2.751 22.451 ( -16.803 17.144 -3.825) 24.308 107.888 ( 0.967 -1.266 0.850) 1.806 107.933 ( -0.565 -1.500 0.890) 1.833 108.502 ( -0.140 -1.383 0.979) 1.700 108.561 ( -0.960 -4.482 2.497) 5.220 ======================= Grid point 261 (126/259) ======================= q-point: ( 0.00 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.690 ( 0.239 13.327 8.590) 15.857 1.911 ( 0.006 26.300 4.418) 26.669 2.920 ( -1.254 13.964 -1.697) 14.123 3.030 ( 1.347 7.931 -5.336) 9.653 3.532 ( -2.416 14.090 5.475) 15.308 4.070 ( 0.757 13.312 -8.071) 15.586 4.507 ( 2.607 3.707 3.367) 5.646 4.607 ( 0.022 -5.750 -0.267) 5.756 4.794 ( -0.442 4.811 -0.004) 4.831 4.877 ( -2.769 4.339 -1.965) 5.510 4.961 ( 1.733 -3.095 -1.736) 3.949 5.140 ( -0.800 -9.115 -2.409) 9.461 7.929 ( -1.807 -5.048 -2.305) 5.836 8.064 ( 2.032 -12.827 0.075) 12.987 8.651 ( -3.145 -2.541 0.332) 4.057 8.817 ( 1.865 3.646 0.015) 4.095 9.529 ( -1.229 -7.929 0.212) 8.026 9.954 ( 3.440 1.857 0.159) 3.913 10.155 ( -0.596 3.809 1.600) 4.174 10.393 ( 0.060 -8.348 0.328) 8.354 11.174 ( 3.434 12.745 -1.734) 13.313 11.473 ( -3.877 4.819 -0.387) 6.197 12.156 ( 0.043 -0.776 -0.414) 0.881 12.833 ( 0.956 -8.033 0.175) 8.091 15.778 ( 0.164 13.651 -8.224) 15.937 17.939 ( 0.556 9.365 -8.246) 12.490 18.703 ( -3.692 -22.731 -4.525) 23.469 18.992 ( 5.011 -10.395 -2.944) 11.909 20.897 ( 0.657 7.130 -2.841) 7.703 21.603 ( 4.791 6.822 8.526) 11.924 22.293 ( -6.580 7.086 -4.448) 10.644 22.631 ( -0.070 15.518 -0.470) 15.525 107.872 ( 0.292 -1.790 0.195) 1.824 107.899 ( -0.053 -1.922 0.880) 2.115 108.477 ( -0.220 -1.312 0.678) 1.493 108.486 ( -1.066 -2.321 1.214) 2.828 ======================= Grid point 262 (127/259) ======================= q-point: ( 0.11 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.751 ( -0.039 12.320 8.262) 14.834 2.012 ( 6.099 20.345 7.062) 22.383 2.872 ( -1.967 7.754 -5.288) 9.590 3.048 ( 4.896 7.666 -5.679) 10.723 3.543 ( -1.272 17.612 6.966) 18.982 4.016 ( -0.719 14.021 -6.038) 15.283 4.535 ( -2.590 1.435 2.517) 3.886 4.589 ( -0.913 -4.262 -1.842) 4.732 4.752 ( -2.801 4.416 -3.234) 6.148 4.808 ( -2.394 2.100 0.278) 3.196 4.979 ( 1.295 -1.649 -1.130) 2.381 5.145 ( 2.145 -6.485 -0.365) 6.840 7.829 ( -4.198 -7.014 -1.631) 8.336 8.180 ( 4.588 -6.380 0.139) 7.860 8.414 ( -10.013 -0.074 -0.160) 10.014 9.024 ( 10.223 -2.446 0.465) 10.522 9.500 ( -2.073 -8.073 0.193) 8.337 9.926 ( -4.685 6.191 -1.282) 7.869 10.193 ( 2.390 -2.961 1.778) 4.200 10.475 ( 6.869 -5.703 0.566) 8.946 10.922 ( -17.854 4.507 -1.011) 18.442 11.675 ( 16.099 12.129 -0.697) 20.169 12.152 ( -0.305 -3.350 -0.209) 3.370 12.852 ( 0.749 -7.845 0.042) 7.881 15.717 ( 0.199 14.934 -8.235) 17.055 17.727 ( -16.057 18.782 -4.200) 25.065 18.634 ( -0.687 -23.909 -2.816) 24.084 19.074 ( 5.843 -12.099 -3.571) 13.902 20.883 ( -0.160 4.611 -1.864) 4.976 21.743 ( 2.835 3.086 8.759) 9.710 22.138 ( -5.619 10.217 -5.181) 12.759 22.727 ( 10.197 15.048 -1.402) 18.231 107.873 ( -0.158 -1.785 -0.072) 1.793 107.909 ( 0.288 -2.180 0.860) 2.361 108.473 ( -0.957 -1.562 1.049) 2.111 108.480 ( -0.363 -1.611 0.761) 1.818 ======================= Grid point 263 (128/259) ======================= q-point: ( 0.22 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.852 ( 4.657 8.984 8.577) 13.266 2.197 ( 7.000 13.749 8.491) 17.611 2.775 ( -3.914 6.931 -4.980) 9.390 3.087 ( 4.023 3.762 -6.517) 8.533 3.585 ( -0.182 16.042 5.497) 16.959 3.961 ( -0.933 17.025 -3.205) 17.349 4.436 ( -8.924 -0.533 0.113) 8.940 4.566 ( 0.228 -6.084 -1.957) 6.395 4.672 ( -2.584 5.017 -2.334) 6.107 4.817 ( 1.391 2.953 2.222) 3.948 4.992 ( 1.401 0.669 -1.950) 2.492 5.186 ( 2.229 -4.327 -0.418) 4.885 7.777 ( -0.810 -7.149 -0.901) 7.251 8.087 ( -8.584 5.239 1.048) 10.111 8.466 ( 9.237 -6.415 -0.871) 11.280 9.103 ( -1.205 -6.010 -0.392) 6.142 9.461 ( -2.249 -7.526 -0.052) 7.856 9.855 ( -1.454 5.672 -0.787) 5.908 10.123 ( -13.814 1.676 1.009) 13.951 10.597 ( 4.795 -8.245 0.416) 9.547 10.755 ( 3.623 -1.570 -0.185) 3.953 11.936 ( 12.411 12.464 -0.023) 17.589 12.144 ( -0.123 -6.054 0.012) 6.055 12.850 ( -0.986 -5.934 -0.375) 6.027 15.674 ( 1.473 16.784 -6.086) 17.914 17.382 ( -19.139 25.557 -0.120) 31.929 18.627 ( 1.754 -26.839 -2.312) 26.995 19.134 ( 3.757 -13.097 -3.527) 14.074 20.862 ( -0.629 2.495 -1.696) 3.082 21.794 ( -3.451 -0.629 1.897) 3.988 22.056 ( -0.439 13.460 2.308) 13.663 22.938 ( 13.932 15.158 -2.703) 20.764 107.868 ( -0.253 -1.630 -0.223) 1.665 107.919 ( 0.127 -2.282 0.710) 2.394 108.465 ( -0.721 -1.278 0.893) 1.718 108.480 ( -0.349 -1.371 0.821) 1.636 ======================= Grid point 264 (129/259) ======================= q-point: ( 0.33 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.025 ( 6.392 5.381 7.237) 11.054 2.357 ( 1.282 11.333 9.749) 15.004 2.702 ( 1.250 7.254 -1.379) 7.489 3.092 ( 2.059 -0.117 -6.303) 6.632 3.581 ( -3.460 12.103 1.351) 12.660 3.957 ( 0.371 16.902 1.886) 17.011 4.258 ( -7.755 -0.633 -3.144) 8.392 4.555 ( -0.484 -5.844 -1.594) 6.077 4.642 ( 0.176 6.175 -0.081) 6.178 4.869 ( 1.985 3.971 2.450) 5.070 4.997 ( 1.232 3.323 -3.382) 4.898 5.211 ( 1.400 -3.296 -1.496) 3.881 7.754 ( -2.441 -4.758 0.372) 5.361 8.024 ( 1.702 5.484 0.574) 5.770 8.580 ( 2.727 -2.354 -1.405) 3.867 9.047 ( -1.783 -9.513 -1.632) 9.815 9.418 ( -2.298 -6.747 -0.399) 7.138 9.814 ( -14.718 -2.676 1.167) 15.005 9.849 ( -2.770 7.379 0.236) 7.886 10.648 ( 1.288 -5.887 0.367) 6.037 10.949 ( 13.304 -5.110 0.475) 14.259 12.047 ( -0.963 -7.912 1.001) 8.033 12.216 ( 8.606 9.537 -0.212) 12.848 12.811 ( -2.802 -3.155 -0.338) 4.233 15.692 ( 4.196 18.341 -2.305) 18.955 17.060 ( -16.150 27.379 -0.335) 31.789 18.657 ( 3.374 -29.519 -2.207) 29.793 19.157 ( 1.601 -13.297 -3.018) 13.729 20.838 ( -0.548 1.767 -1.703) 2.515 21.668 ( -7.290 1.148 -4.556) 8.673 22.142 ( 3.260 12.374 9.121) 15.714 23.159 ( 12.195 14.680 -2.611) 19.263 107.861 ( -0.237 -1.422 -0.364) 1.487 107.924 ( -0.144 -2.238 0.631) 2.330 108.461 ( -0.394 -1.023 0.752) 1.329 108.480 ( -0.349 -1.222 0.873) 1.542 ======================= Grid point 265 (130/259) ======================= q-point: (-0.56 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.132 ( 0.146 9.708 3.194) 10.221 2.336 ( -9.506 10.490 8.870) 16.705 2.861 ( 9.737 1.145 8.098) 12.716 3.093 ( 5.840 0.304 -6.430) 8.692 3.507 ( -3.604 14.647 -2.182) 15.241 3.903 ( -9.234 -2.265 3.398) 10.096 4.214 ( 5.957 12.286 -3.127) 14.008 4.516 ( -2.537 -1.846 -1.528) 3.489 4.662 ( 0.862 5.415 1.363) 5.650 4.910 ( 0.779 3.287 0.872) 3.489 4.985 ( 0.942 5.554 -4.251) 7.057 5.221 ( 1.419 -2.362 -1.995) 3.402 7.707 ( -2.646 -2.182 0.874) 3.539 8.116 ( 5.980 5.438 0.551) 8.102 8.549 ( -2.623 0.542 -2.920) 3.962 9.030 ( -0.169 -12.087 -0.843) 12.118 9.390 ( 0.399 -4.842 -0.086) 4.859 9.601 ( -7.343 -5.843 0.120) 9.385 9.833 ( -1.178 5.959 1.025) 6.160 10.659 ( -0.217 -5.077 0.478) 5.104 11.148 ( 6.404 -4.362 0.756) 7.785 12.019 ( -1.614 -16.903 1.672) 17.062 12.346 ( 4.548 13.496 -0.702) 14.259 12.764 ( -1.653 -0.542 0.285) 1.762 15.790 ( 6.652 19.268 1.436) 20.434 16.810 ( -9.669 26.672 -2.937) 28.522 18.708 ( 3.986 -31.884 -2.162) 32.205 19.149 ( -0.032 -13.078 -2.678) 13.349 20.821 ( 0.247 2.334 -1.828) 2.975 21.509 ( -6.176 2.488 -3.932) 7.733 22.270 ( 3.127 12.199 8.383) 15.128 23.319 ( 7.071 13.506 -1.788) 15.349 107.854 ( -0.181 -1.196 -0.443) 1.289 107.924 ( -0.398 -2.135 0.607) 2.255 108.462 ( -0.180 -0.912 0.676) 1.149 108.481 ( -0.268 -1.134 0.912) 1.480 ======================= Grid point 266 (131/259) ======================= q-point: (-0.44 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.074 ( -8.676 16.612 3.441) 19.055 2.209 ( -10.846 10.482 6.886) 16.581 2.982 ( 0.843 -4.111 4.348) 6.043 3.310 ( 10.581 7.117 4.435) 13.501 3.444 ( 5.102 11.771 -6.851) 14.544 3.759 ( -7.428 -3.682 1.154) 8.371 4.325 ( 4.925 11.237 -0.043) 12.268 4.458 ( -1.149 3.188 -1.399) 3.666 4.675 ( -0.545 4.084 0.910) 4.220 4.909 ( 0.008 2.200 -1.650) 2.750 4.976 ( 1.235 5.514 -3.402) 6.595 5.235 ( 1.533 -1.446 -1.545) 2.613 7.684 ( -0.457 -1.968 0.821) 2.181 8.185 ( 0.688 6.536 0.239) 6.576 8.499 ( 0.010 -0.195 -2.653) 2.660 9.023 ( 0.034 -13.262 -0.723) 13.282 9.452 ( 5.334 -1.472 0.401) 5.548 9.539 ( 1.619 -8.032 -0.488) 8.208 9.832 ( 0.415 6.447 1.043) 6.544 10.650 ( -1.150 -5.157 0.554) 5.313 11.150 ( -6.724 -5.476 0.741) 8.704 12.041 ( 2.431 -17.839 1.650) 18.080 12.343 ( -3.884 13.242 -0.693) 13.818 12.772 ( 1.916 1.260 0.142) 2.298 15.918 ( 4.504 18.888 2.224) 19.544 16.712 ( 3.397 25.444 -3.782) 25.947 18.761 ( 3.355 -33.356 -1.926) 33.580 19.120 ( -0.670 -12.996 -3.018) 13.358 20.819 ( 1.217 3.881 -2.318) 4.681 21.403 ( -3.168 3.396 -1.202) 4.797 22.368 ( 1.684 12.265 5.520) 13.555 23.374 ( 0.149 11.813 -1.423) 11.900 107.848 ( -0.092 -1.004 -0.387) 1.080 107.920 ( -0.585 -2.023 0.604) 2.191 108.464 ( -0.077 -0.925 0.635) 1.125 108.484 ( -0.170 -1.214 1.002) 1.583 ======================= Grid point 267 (132/259) ======================= q-point: (-0.33 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.903 ( -12.638 18.078 4.289) 22.471 2.069 ( -9.563 15.742 6.203) 19.436 3.035 ( 2.017 0.570 1.898) 2.828 3.265 ( -5.884 8.023 -2.873) 10.356 3.650 ( -6.235 6.674 2.739) 9.535 3.741 ( 18.842 7.298 0.116) 20.206 4.325 ( -1.125 4.244 -2.683) 5.145 4.509 ( 4.311 5.782 0.798) 7.256 4.665 ( -0.513 3.085 0.856) 3.243 4.903 ( 0.642 1.024 -1.136) 1.659 4.974 ( 1.439 4.217 -3.581) 5.716 5.246 ( 0.817 -1.726 -1.586) 2.482 7.704 ( 2.138 -3.267 0.491) 3.935 8.177 ( -0.156 5.766 0.110) 5.770 8.489 ( -0.957 -2.151 -1.118) 2.606 9.005 ( -0.452 -12.798 -1.482) 12.892 9.489 ( 1.112 -5.450 -0.591) 5.593 9.745 ( 16.927 0.738 1.225) 16.987 9.859 ( 2.256 7.030 0.277) 7.388 10.623 ( -2.493 -5.903 0.552) 6.431 10.953 ( -14.072 -7.730 0.456) 16.062 12.103 ( 2.644 -12.846 0.845) 13.143 12.220 ( -8.874 12.090 -0.321) 15.000 12.808 ( 1.728 0.492 -0.559) 1.882 15.947 ( -0.926 16.965 -2.052) 17.114 16.913 ( 20.157 23.554 -0.839) 31.013 18.795 ( 1.712 -33.051 -1.266) 33.120 19.083 ( -0.260 -13.431 -4.475) 14.159 20.831 ( 2.421 5.767 -2.893) 6.891 21.374 ( -0.678 4.847 1.942) 5.265 22.413 ( 0.108 11.300 2.485) 11.570 23.295 ( -7.590 10.497 -2.218) 13.142 107.846 ( 0.063 -0.916 -0.140) 0.928 107.913 ( -0.672 -1.930 0.609) 2.132 108.468 ( -0.036 -1.018 0.590) 1.177 108.489 ( -0.174 -1.547 1.175) 1.950 ======================= Grid point 268 (133/259) ======================= q-point: (-0.22 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.726 ( -9.843 19.148 4.981) 22.099 1.967 ( -6.616 20.186 5.704) 21.995 3.051 ( -2.460 9.499 1.411) 9.914 3.145 ( -3.484 4.744 -5.078) 7.774 3.569 ( -4.851 13.311 3.882) 14.690 4.022 ( 11.578 12.691 -2.230) 17.323 4.315 ( 2.917 0.439 -2.061) 3.599 4.559 ( 1.428 -1.313 -0.004) 1.940 4.700 ( 2.304 4.160 3.397) 5.844 4.912 ( 0.886 1.668 -0.707) 2.016 4.971 ( 1.096 1.608 -3.755) 4.229 5.235 ( -0.391 -3.916 -2.675) 4.759 7.766 ( 4.592 -6.118 -0.306) 7.656 8.219 ( 4.614 4.027 0.590) 6.153 8.407 ( -6.847 -4.989 -0.535) 8.488 9.019 ( 2.249 -8.517 -0.610) 8.830 9.512 ( 1.551 -5.691 -0.097) 5.900 9.866 ( 0.879 5.216 -0.580) 5.321 10.080 ( 12.868 4.822 0.919) 13.772 10.564 ( -4.605 -7.265 0.431) 8.612 10.743 ( -4.755 -3.778 -0.094) 6.074 12.019 ( -13.048 10.496 -0.322) 16.749 12.143 ( 1.188 -6.719 0.011) 6.824 12.821 ( 0.444 -2.545 -0.676) 2.670 15.893 ( -1.185 14.927 -5.379) 15.911 17.354 ( 27.456 18.377 -1.427) 33.070 18.804 ( 0.180 -31.127 -0.803) 31.138 19.039 ( -0.237 -13.148 -6.459) 14.651 20.862 ( 3.514 7.279 -3.456) 8.791 21.399 ( 0.454 7.226 4.917) 8.752 22.416 ( -0.689 8.834 0.270) 8.865 23.072 ( -14.271 11.198 -3.394) 18.455 107.849 ( 0.321 -1.029 0.236) 1.104 107.905 ( -0.651 -1.872 0.619) 2.076 108.472 ( -0.039 -1.144 0.551) 1.270 108.494 ( -0.391 -2.060 1.345) 2.491 ======================= Grid point 269 (134/259) ======================= q-point: (-0.11 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.649 ( -3.354 18.094 6.735) 19.596 1.915 ( -3.618 23.530 4.625) 24.252 2.979 ( -5.053 16.929 0.974) 17.694 3.068 ( -0.802 5.478 -5.594) 7.870 3.539 ( -2.505 12.511 4.496) 13.528 4.101 ( 3.243 14.255 -8.300) 16.811 4.407 ( 5.508 2.050 2.667) 6.454 4.589 ( 1.539 -5.357 0.699) 5.617 4.766 ( 1.871 4.200 2.931) 5.452 4.915 ( 0.051 4.460 -1.571) 4.729 4.958 ( 0.636 -2.216 -3.154) 3.907 5.192 ( -1.626 -7.456 -3.588) 8.433 7.860 ( 6.418 -7.751 -1.404) 10.161 8.183 ( -9.763 -9.360 0.032) 13.525 8.443 ( 12.679 3.284 0.101) 13.098 8.992 ( -7.586 -3.546 0.390) 8.383 9.535 ( 0.588 -6.489 0.154) 6.518 9.882 ( 2.834 2.412 -1.144) 3.893 10.159 ( -1.406 3.715 1.894) 4.401 10.464 ( -6.256 -8.093 0.366) 10.236 10.897 ( 18.397 7.414 -1.093) 19.865 11.742 ( -16.993 7.607 -0.521) 18.625 12.155 ( 0.445 -1.801 -0.369) 1.891 12.822 ( 0.285 -6.016 -0.236) 6.027 15.834 ( -0.107 13.655 -7.089) 15.386 17.788 ( 21.066 10.606 -5.893) 24.310 18.786 ( -1.191 -28.489 -2.849) 28.656 18.980 ( -0.290 -9.836 -5.607) 11.326 20.894 ( 2.669 8.024 -3.821) 9.280 21.470 ( 2.597 8.694 7.499) 11.772 22.392 ( -1.853 5.903 -1.606) 6.392 22.777 ( -13.733 14.576 -2.707) 20.209 107.861 ( 0.557 -1.404 0.454) 1.577 107.899 ( -0.507 -1.847 0.676) 2.032 108.475 ( -0.087 -1.259 0.567) 1.383 108.494 ( -0.801 -2.422 1.372) 2.896 ======================= Grid point 270 (135/259) ======================= q-point: ( 0.00 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.966 ( -0.396 13.856 0.506) 13.871 2.423 ( 0.743 24.808 3.849) 25.116 3.009 ( -1.828 -1.829 -4.415) 5.116 3.214 ( 1.648 9.983 -4.373) 11.023 3.861 ( -1.566 12.769 3.452) 13.319 4.254 ( 2.018 4.532 -5.871) 7.686 4.461 ( -2.249 -5.167 1.810) 5.918 4.602 ( 1.728 4.861 1.392) 5.344 4.805 ( -1.562 -3.965 1.538) 4.531 4.924 ( -3.419 3.717 -1.470) 5.260 4.968 ( 2.409 2.044 -1.642) 3.561 5.121 ( 1.253 5.103 -5.151) 7.358 7.797 ( -4.719 -7.722 -2.735) 9.454 7.805 ( 6.124 -11.722 -0.413) 13.232 8.670 ( -2.749 3.607 0.524) 4.565 8.909 ( 1.613 4.970 0.631) 5.263 9.397 ( -2.277 -4.915 1.250) 5.559 9.890 ( 3.042 -7.056 1.959) 7.930 10.175 ( -6.111 -2.846 -0.410) 6.753 10.257 ( 4.627 -3.739 0.496) 5.969 11.452 ( -3.752 14.177 -0.473) 14.673 11.583 ( 4.225 5.913 -1.723) 7.469 12.128 ( -0.848 -1.966 -0.771) 2.276 12.674 ( 0.427 -8.033 -0.539) 8.062 16.066 ( 0.815 15.270 -7.879) 17.202 17.847 ( -1.433 -13.756 1.818) 13.950 18.310 ( -0.258 -15.674 -3.144) 15.988 18.847 ( 4.150 -7.532 -3.760) 9.386 21.095 ( 0.113 12.213 -3.284) 12.648 21.699 ( 2.206 2.638 7.141) 7.925 22.457 ( -4.448 9.846 -3.328) 11.305 22.901 ( 0.034 10.591 -1.385) 10.681 107.838 ( 0.180 -1.574 -0.089) 1.587 107.861 ( -0.036 -1.862 0.459) 1.918 108.451 ( -0.408 -1.284 0.270) 1.374 108.455 ( -0.153 -0.914 0.350) 0.990 ======================= Grid point 271 (136/259) ======================= q-point: ( 0.11 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.984 ( 1.689 11.795 0.844) 11.945 2.467 ( 0.945 23.627 4.598) 24.089 2.940 ( -2.073 -0.167 -4.537) 4.990 3.210 ( 1.514 8.752 -4.726) 10.061 3.846 ( -3.076 9.022 2.720) 9.913 4.253 ( 3.209 8.795 -5.440) 10.828 4.396 ( -6.654 -7.451 3.123) 10.467 4.621 ( -1.303 2.707 -0.029) 3.005 4.772 ( -2.588 -1.816 1.499) 3.499 4.860 ( -1.312 4.398 -1.513) 4.833 5.003 ( 2.615 1.563 -1.872) 3.576 5.136 ( 3.581 4.696 -3.422) 6.826 7.683 ( -3.012 -6.720 -2.060) 7.647 7.992 ( 11.753 -10.650 -0.790) 15.881 8.490 ( -11.917 6.073 0.547) 13.386 9.014 ( 3.853 0.336 1.003) 3.996 9.377 ( -1.006 -3.705 0.961) 3.958 9.936 ( 0.166 -4.506 -0.102) 4.510 10.105 ( -1.319 -4.753 1.933) 5.298 10.363 ( 6.648 -5.642 -0.284) 8.724 11.067 ( -22.772 9.530 -0.789) 24.699 11.914 ( 19.118 10.830 -1.185) 22.004 12.062 ( -5.506 -5.226 -0.193) 7.594 12.707 ( 3.076 -6.731 -0.764) 7.440 16.032 ( 1.962 16.597 -7.649) 18.380 17.772 ( -8.290 -10.401 2.429) 13.520 18.255 ( -2.807 -13.915 -2.460) 14.407 18.890 ( 3.590 -8.697 -3.823) 10.156 21.049 ( -2.470 11.769 -2.367) 12.256 21.770 ( -0.476 -0.425 6.227) 6.259 22.364 ( -2.643 12.644 -2.569) 13.170 22.984 ( 9.504 9.898 -1.730) 13.831 107.838 ( 0.001 -1.627 -0.223) 1.642 107.867 ( 0.218 -2.030 0.485) 2.099 108.446 ( -0.375 -1.094 0.345) 1.207 108.455 ( -0.051 -0.941 0.269) 0.980 ======================= Grid point 272 (137/259) ======================= q-point: ( 0.22 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.043 ( 3.999 10.365 1.952) 11.280 2.540 ( 2.808 19.394 5.787) 20.432 2.866 ( -2.690 2.105 -3.155) 4.650 3.184 ( -0.334 5.791 -5.708) 8.138 3.785 ( -5.301 3.642 1.872) 6.699 4.266 ( -10.246 -4.574 3.202) 11.669 4.298 ( 5.304 7.800 -4.313) 10.372 4.562 ( -3.448 2.948 -0.996) 4.644 4.746 ( -1.157 2.701 0.946) 3.087 4.876 ( 2.084 3.366 2.360) 4.608 5.034 ( 2.972 2.022 -3.139) 4.772 5.177 ( 3.310 2.893 -3.229) 5.455 7.661 ( 1.835 -3.946 -1.599) 4.636 8.142 ( 1.438 -2.658 0.959) 3.171 8.380 ( 3.328 0.731 -0.681) 3.474 8.999 ( -5.338 -4.987 0.375) 7.315 9.363 ( -1.635 -1.870 0.339) 2.507 9.915 ( -2.561 1.365 -0.082) 2.903 10.081 ( -6.167 -6.986 2.310) 9.600 10.478 ( 5.516 -4.443 -0.391) 7.093 10.757 ( -6.921 3.320 -0.556) 7.696 11.942 ( -7.865 -9.942 0.665) 12.694 12.211 ( 14.616 10.562 -0.640) 18.044 12.752 ( 2.236 -3.963 -0.834) 4.626 16.028 ( 3.538 18.494 -5.893) 19.730 17.598 ( -12.867 -2.633 2.989) 13.470 18.195 ( -1.602 -15.413 -1.917) 15.614 18.916 ( 2.745 -10.233 -4.294) 11.432 20.983 ( -2.741 9.820 -1.942) 10.379 21.759 ( -4.472 -2.733 2.329) 5.735 22.347 ( 1.163 15.467 2.036) 15.643 23.178 ( 12.695 8.502 -2.152) 15.430 107.836 ( -0.015 -1.506 -0.312) 1.538 107.874 ( 0.181 -2.167 0.441) 2.219 108.443 ( -0.182 -0.864 0.327) 0.942 108.457 ( -0.040 -0.924 0.309) 0.975 ======================= Grid point 273 (138/259) ======================= q-point: ( 0.33 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.163 ( 6.945 8.437 3.348) 11.429 2.622 ( -1.505 14.201 7.260) 16.020 2.826 ( 1.633 5.135 -0.159) 5.390 3.116 ( -1.258 2.476 -6.941) 7.476 3.709 ( -4.029 1.115 1.993) 4.631 4.060 ( -13.530 -6.948 0.552) 15.220 4.384 ( 6.314 12.982 -1.905) 14.561 4.513 ( -0.933 1.746 -1.248) 2.340 4.751 ( 0.188 5.136 2.083) 5.546 4.937 ( 1.224 2.954 4.320) 5.374 5.064 ( 3.537 2.380 -4.500) 6.199 5.198 ( 1.994 1.707 -4.043) 4.821 7.703 ( 2.524 -0.101 -0.006) 2.526 8.129 ( 0.304 4.019 1.151) 4.192 8.517 ( 8.104 -3.261 -1.545) 8.871 8.884 ( -5.544 -6.809 -0.970) 8.834 9.321 ( -2.711 -2.626 -0.138) 3.777 9.743 ( -16.595 -4.351 1.970) 17.269 10.001 ( -1.772 6.834 0.882) 7.114 10.524 ( 0.884 -4.712 -0.079) 4.795 10.842 ( 12.021 -6.073 -0.145) 13.469 11.792 ( -9.330 -14.912 1.214) 17.632 12.434 ( 10.538 9.849 -0.202) 14.426 12.770 ( 0.169 -1.144 -0.110) 1.161 16.079 ( 5.799 19.997 -2.725) 20.998 17.373 ( -13.547 4.125 1.558) 14.246 18.170 ( 0.280 -18.132 -1.848) 18.229 18.924 ( 1.811 -11.183 -4.716) 12.271 20.928 ( -1.605 7.750 -1.842) 8.126 21.659 ( -6.387 -1.879 -1.247) 6.774 22.426 ( 3.424 15.645 6.466) 17.271 23.379 ( 10.679 7.103 -1.999) 12.980 107.833 ( 0.017 -1.317 -0.385) 1.372 107.879 ( 0.006 -2.188 0.414) 2.227 108.444 ( -0.027 -0.686 0.309) 0.753 108.459 ( -0.037 -0.872 0.361) 0.944 ======================= Grid point 274 (139/259) ======================= q-point: (-0.56 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.315 ( 5.791 8.722 3.429) 11.017 2.565 ( -8.368 11.208 5.321) 14.965 2.892 ( -0.889 2.730 5.341) 6.064 3.121 ( 10.693 2.320 -5.263) 12.142 3.684 ( -0.240 1.873 1.467) 2.392 3.810 ( -12.897 -5.072 -1.830) 13.979 4.480 ( 3.107 10.097 0.413) 10.572 4.511 ( 3.088 4.245 -1.346) 5.419 4.770 ( -0.183 5.566 2.062) 5.938 4.970 ( -1.014 2.862 3.326) 4.504 5.089 ( 2.860 3.931 -4.573) 6.674 5.196 ( 1.668 -0.065 -4.168) 4.490 7.724 ( -0.757 3.766 1.357) 4.074 8.201 ( 5.334 2.296 0.775) 5.859 8.576 ( 0.521 2.126 -2.644) 3.433 8.817 ( -1.658 -8.683 -1.057) 8.903 9.299 ( 1.747 -3.810 0.255) 4.200 9.489 ( -10.849 -5.205 1.231) 12.096 9.990 ( -0.780 9.329 1.406) 9.467 10.531 ( -0.014 -6.541 0.033) 6.541 11.046 ( 7.701 -6.327 -0.035) 9.967 11.648 ( -6.227 -19.644 1.591) 20.669 12.575 ( 4.582 9.287 -0.568) 10.372 12.769 ( 0.007 0.916 1.229) 1.533 16.192 ( 7.235 20.489 0.675) 21.740 17.157 ( -9.612 8.099 -1.326) 12.639 18.173 ( 1.492 -20.618 -1.811) 20.751 18.910 ( 0.692 -11.709 -4.978) 12.742 20.903 ( 0.378 6.348 -1.934) 6.647 21.537 ( -5.164 0.193 -1.862) 5.493 22.542 ( 3.011 14.834 7.647) 16.958 23.514 ( 5.440 5.793 -1.601) 8.107 107.830 ( 0.044 -1.116 -0.425) 1.195 107.880 ( -0.204 -2.126 0.408) 2.174 108.446 ( 0.026 -0.595 0.304) 0.669 108.461 ( -0.037 -0.836 0.396) 0.926 ======================= Grid point 275 (140/259) ======================= q-point: (-0.44 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.371 ( -3.845 12.670 2.479) 13.470 2.449 ( -6.938 12.817 4.782) 15.339 2.905 ( 1.101 -2.646 3.052) 4.187 3.375 ( 14.563 0.993 2.465) 14.804 3.582 ( -6.567 0.140 -5.475) 8.551 3.731 ( 2.863 0.264 1.519) 3.252 4.487 ( -0.513 5.866 -0.534) 5.912 4.602 ( 4.654 9.845 1.958) 11.064 4.765 ( -1.497 5.301 0.198) 5.512 4.951 ( -2.280 2.134 0.327) 3.140 5.092 ( 1.234 5.919 -4.144) 7.331 5.205 ( 2.013 -1.786 -2.553) 3.709 7.710 ( -1.728 4.322 1.362) 4.850 8.265 ( 0.194 0.630 0.822) 1.054 8.537 ( -1.576 4.024 -2.637) 5.063 8.784 ( -1.355 -10.004 -1.062) 10.151 9.389 ( -0.467 -5.570 -0.018) 5.589 9.434 ( 12.150 -1.350 1.544) 12.322 9.993 ( -0.083 9.213 1.413) 9.322 10.524 ( -0.873 -6.501 0.088) 6.560 11.030 ( -9.223 -6.939 -0.021) 11.542 11.660 ( 5.881 -19.954 1.521) 20.858 12.570 ( -4.094 9.386 -0.521) 10.254 12.802 ( 1.907 1.673 1.111) 2.769 16.309 ( 3.197 19.544 1.218) 19.842 17.058 ( 1.790 9.459 -1.976) 9.827 18.193 ( 2.098 -22.416 -1.634) 22.573 18.876 ( -0.069 -12.042 -5.107) 13.080 20.913 ( 2.536 6.092 -2.365) 7.010 21.461 ( -2.139 1.987 -0.334) 2.939 22.632 ( 0.817 14.004 6.268) 15.364 23.541 ( -1.271 4.712 -1.437) 5.087 107.828 ( 0.066 -0.958 -0.397) 1.039 107.878 ( -0.385 -2.029 0.402) 2.104 108.449 ( 0.010 -0.594 0.298) 0.665 108.463 ( -0.082 -0.876 0.420) 0.974 ======================= Grid point 276 (141/259) ======================= q-point: (-0.33 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.240 ( -9.533 15.094 1.685) 17.932 2.397 ( -4.044 16.713 4.403) 17.750 2.979 ( 4.233 -4.136 1.579) 6.125 3.375 ( -5.583 3.638 -3.855) 7.698 3.729 ( 12.370 -1.777 3.357) 12.940 3.821 ( 8.517 0.937 -0.464) 8.581 4.461 ( -1.909 10.186 -0.311) 10.368 4.680 ( 1.114 9.744 0.308) 9.813 4.727 ( -1.186 3.294 0.739) 3.578 4.916 ( -0.714 0.613 -1.163) 1.496 5.076 ( 0.045 6.084 -3.261) 6.903 5.218 ( 1.206 -1.518 -2.470) 3.141 7.685 ( -1.689 1.373 0.299) 2.197 8.241 ( -2.453 -0.728 1.024) 2.756 8.481 ( -3.969 1.866 -1.605) 4.670 8.772 ( 2.745 -9.579 -0.984) 10.013 9.410 ( 2.298 -2.046 -0.032) 3.077 9.760 ( 19.691 0.290 2.143) 19.810 10.004 ( 0.297 6.575 0.888) 6.642 10.498 ( -2.201 -5.304 -0.025) 5.743 10.806 ( -12.436 -6.924 -0.160) 14.235 11.813 ( 8.646 -15.802 1.081) 18.046 12.443 ( -9.351 9.981 -0.402) 13.683 12.822 ( -0.554 0.684 -0.053) 0.882 16.296 ( -2.950 17.458 -2.993) 17.957 17.216 ( 14.604 7.554 1.661) 16.525 18.223 ( 2.381 -23.036 -1.376) 23.200 18.836 ( 0.160 -12.025 -5.236) 13.117 20.956 ( 4.436 7.117 -3.043) 8.921 21.457 ( 0.754 3.160 2.194) 3.920 22.660 ( -1.854 13.029 3.554) 13.632 23.446 ( -7.876 4.407 -1.749) 9.193 107.827 ( 0.115 -0.904 -0.279) 0.953 107.873 ( -0.489 -1.938 0.384) 2.035 108.451 ( -0.017 -0.664 0.263) 0.715 108.464 ( -0.201 -1.012 0.452) 1.127 ======================= Grid point 277 (142/259) ======================= q-point: (-0.22 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.094 ( -7.366 16.767 0.895) 18.335 2.370 ( -2.120 20.006 3.806) 20.475 3.052 ( 2.681 -4.308 -0.229) 5.079 3.273 ( -2.049 6.556 -4.810) 8.386 3.838 ( 1.187 7.628 2.821) 8.219 4.071 ( 13.750 -7.134 0.488) 15.498 4.426 ( -0.934 12.372 -0.841) 12.435 4.627 ( -2.546 6.964 -2.995) 7.997 4.766 ( 0.854 2.159 4.017) 4.639 4.914 ( 1.229 -0.004 -1.069) 1.629 5.044 ( -1.139 5.861 -2.549) 6.491 5.205 ( 0.034 -0.224 -4.074) 4.080 7.663 ( 0.171 -3.643 -1.168) 3.829 8.170 ( -8.078 -8.224 0.428) 11.536 8.425 ( 2.093 5.698 -0.485) 6.090 8.871 ( 6.763 -5.938 0.414) 9.009 9.449 ( 1.317 -0.529 0.402) 1.475 9.944 ( -3.029 2.326 -0.261) 3.828 10.102 ( 7.620 -3.040 3.117) 8.776 10.420 ( -6.166 -6.887 -0.657) 9.267 10.740 ( 9.787 4.055 -0.634) 10.613 11.965 ( 7.180 -10.847 0.492) 13.017 12.229 ( -13.896 10.197 -0.679) 17.249 12.782 ( -3.278 -1.718 -0.842) 3.796 16.204 ( -2.736 15.921 -5.960) 17.219 17.530 ( 16.098 0.591 3.107) 16.406 18.259 ( 2.820 -21.877 -1.387) 22.101 18.809 ( 1.365 -11.066 -5.276) 12.335 21.022 ( 5.499 8.887 -3.651) 11.070 21.512 ( 2.228 3.999 4.698) 6.559 22.625 ( -3.524 11.583 0.731) 12.130 23.244 ( -12.186 5.761 -2.224) 13.662 107.829 ( 0.216 -1.009 -0.103) 1.036 107.867 ( -0.489 -1.872 0.359) 1.968 108.452 ( -0.028 -0.778 0.196) 0.803 108.462 ( -0.374 -1.186 0.496) 1.339 ======================= Grid point 278 (143/259) ======================= q-point: (-0.11 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.998 ( -3.757 16.182 0.506) 16.620 2.383 ( 0.349 23.015 3.466) 23.277 3.061 ( -0.518 -3.453 -2.515) 4.303 3.226 ( 0.540 9.089 -4.622) 10.211 3.859 ( -0.950 12.168 3.190) 12.615 4.238 ( 5.129 -2.989 -3.123) 6.708 4.440 ( 2.827 4.035 -0.063) 4.927 4.582 ( -0.823 6.261 0.012) 6.315 4.800 ( 0.031 -1.315 2.806) 3.099 4.935 ( 1.616 -0.138 -0.490) 1.694 4.996 ( -2.228 6.122 -2.253) 6.893 5.161 ( -0.497 2.161 -5.677) 6.094 7.691 ( 4.546 -8.003 -1.942) 9.407 7.982 ( -11.016 -10.325 -0.616) 15.111 8.548 ( 9.743 6.336 0.302) 11.626 8.951 ( -0.421 -1.132 1.120) 1.647 9.442 ( -2.776 -2.352 0.813) 3.728 9.863 ( -2.556 -4.034 0.477) 4.799 10.184 ( 1.966 -0.566 2.118) 2.944 10.302 ( -6.390 -7.518 -0.732) 9.894 11.084 ( 24.472 10.410 -0.940) 26.611 11.904 ( -18.166 7.408 -0.999) 19.644 12.098 ( 3.865 -3.174 -0.284) 5.009 12.709 ( -3.345 -5.406 -0.854) 6.414 16.122 ( -0.737 15.096 -7.256) 16.766 17.778 ( 7.984 -9.045 2.287) 12.279 18.301 ( 3.073 -18.830 -2.278) 19.215 18.811 ( 3.072 -8.827 -4.642) 10.436 21.084 ( 4.040 10.815 -3.899) 12.185 21.600 ( 2.714 4.189 6.493) 8.190 22.553 ( -3.976 9.868 -1.634) 10.763 23.013 ( -10.192 8.729 -2.021) 13.570 107.833 ( 0.303 -1.282 0.004) 1.317 107.862 ( -0.359 -1.835 0.368) 1.905 108.453 ( -0.031 -0.938 0.108) 0.944 108.458 ( -0.515 -1.239 0.546) 1.449 ======================= Grid point 279 (144/259) ======================= q-point: ( 0.00 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( -0.074 13.036 -3.610) 13.527 2.884 ( 2.282 9.978 0.411) 10.244 2.926 ( -1.147 5.368 -0.370) 5.502 3.423 ( 0.815 10.671 -3.500) 11.259 3.939 ( -0.799 -3.148 -0.114) 3.250 4.111 ( 1.615 -13.954 1.430) 14.119 4.551 ( -1.074 5.784 -4.923) 7.671 4.687 ( -1.414 1.550 -0.753) 2.230 4.786 ( -1.005 6.389 1.919) 6.747 4.975 ( -1.822 3.598 0.166) 4.036 5.068 ( 0.131 4.422 -3.675) 5.751 5.209 ( 1.505 2.700 -2.667) 4.083 7.613 ( 2.492 -6.959 -0.173) 7.394 7.650 ( -0.577 -6.639 -2.846) 7.246 8.772 ( -2.278 6.176 0.434) 6.597 8.989 ( 2.109 2.454 0.692) 3.309 9.340 ( -3.144 -0.662 2.363) 3.988 9.705 ( 0.432 -10.527 2.461) 10.820 10.107 ( -2.148 -2.286 -1.100) 3.324 10.203 ( 1.466 -2.858 -0.878) 3.330 11.689 ( -15.606 6.720 -1.541) 17.061 11.728 ( 16.618 10.390 -0.593) 19.608 12.088 ( -1.148 -1.405 -0.933) 2.040 12.506 ( 0.068 -8.837 -0.644) 8.861 16.390 ( 1.201 17.055 -6.586) 18.322 17.506 ( -1.603 -18.980 1.853) 19.137 18.110 ( 0.890 -3.941 -2.385) 4.692 18.636 ( 2.760 -13.134 -1.605) 13.517 21.344 ( 0.301 11.688 -0.944) 11.730 21.712 ( 0.895 -1.106 4.634) 4.848 22.678 ( -3.144 11.595 -2.060) 12.189 23.040 ( 0.185 3.200 -1.068) 3.378 107.811 ( 0.120 -0.996 -0.335) 1.058 107.827 ( 0.043 -1.450 0.022) 1.451 108.433 ( -0.158 -0.554 -0.142) 0.594 108.440 ( -0.037 -0.595 0.014) 0.597 ======================= Grid point 280 (145/259) ======================= q-point: ( 0.11 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.230 ( 2.388 12.728 -3.429) 13.397 2.879 ( -0.359 -5.426 -3.258) 6.339 2.930 ( -0.979 21.904 3.895) 22.269 3.392 ( -1.377 9.131 -3.847) 10.003 3.885 ( -5.023 -3.333 -0.134) 6.030 4.103 ( -3.623 -13.983 1.615) 14.535 4.519 ( 1.514 7.454 -4.103) 8.642 4.653 ( -1.816 0.293 -0.754) 1.988 4.792 ( -0.098 5.570 2.564) 6.133 4.941 ( -1.105 3.844 -0.297) 4.011 5.064 ( 1.715 3.713 -2.679) 4.889 5.219 ( 2.191 2.340 -3.506) 4.750 7.583 ( 0.686 -2.998 -1.822) 3.575 7.790 ( 11.673 -9.011 -0.993) 14.780 8.628 ( -10.632 7.470 0.824) 13.020 8.998 ( -3.733 -2.459 1.096) 4.602 9.363 ( 2.398 2.198 1.698) 3.669 9.782 ( 5.918 -9.545 2.073) 11.420 10.042 ( -5.061 -1.453 -0.351) 5.277 10.243 ( 4.503 -6.264 -1.370) 7.835 11.281 ( -22.632 11.428 -0.709) 25.363 11.907 ( -7.383 -8.023 -0.422) 10.911 12.136 ( 15.063 9.212 -0.912) 17.681 12.579 ( 6.577 -6.239 -0.946) 9.114 16.380 ( 3.033 18.018 -6.297) 19.326 17.472 ( -3.694 -17.463 2.000) 17.961 18.078 ( -2.301 -3.341 -1.803) 4.439 18.662 ( 1.688 -14.031 -2.073) 14.283 21.305 ( -3.656 12.420 -0.734) 12.968 21.734 ( -2.231 -3.020 3.721) 5.287 22.636 ( 0.096 14.012 -1.082) 14.054 23.108 ( 7.628 2.253 -1.181) 8.041 107.811 ( 0.118 -1.014 -0.368) 1.085 107.830 ( 0.227 -1.572 0.040) 1.589 108.430 ( -0.018 -0.466 -0.086) 0.474 108.440 ( 0.060 -0.620 -0.012) 0.623 ======================= Grid point 281 (146/259) ======================= q-point: ( 0.22 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.269 ( 4.409 12.066 -2.368) 13.063 2.853 ( -0.444 -3.548 -2.269) 4.235 2.936 ( -1.215 19.459 4.572) 20.025 3.312 ( -3.947 6.755 -4.663) 9.108 3.770 ( -7.239 -3.980 0.615) 8.284 4.010 ( -7.585 -13.674 1.214) 15.683 4.545 ( 3.951 8.699 -2.580) 9.897 4.613 ( -1.918 2.106 -0.478) 2.889 4.820 ( 0.733 5.318 2.894) 6.099 4.944 ( 0.997 3.284 1.446) 3.725 5.079 ( 2.105 2.475 -2.958) 4.394 5.232 ( 2.359 1.325 -4.180) 4.979 7.631 ( 5.873 0.980 -1.700) 6.192 8.003 ( 11.140 -8.840 -0.223) 14.223 8.480 ( -5.118 7.030 0.912) 8.743 8.889 ( -7.915 -5.955 0.926) 9.948 9.384 ( -1.910 3.630 0.789) 4.176 9.876 ( -8.258 -10.146 2.288) 13.280 9.958 ( 5.526 1.524 -0.047) 5.733 10.354 ( 8.664 -8.102 -1.219) 11.924 10.911 ( -16.684 11.166 -0.318) 20.078 11.709 ( -12.577 -12.743 0.537) 17.912 12.399 ( 13.177 7.948 -0.610) 15.400 12.684 ( 5.406 -3.061 -0.751) 6.258 16.406 ( 4.620 18.876 -4.995) 20.065 17.403 ( -5.751 -13.910 2.239) 15.218 18.014 ( -3.198 -2.844 -1.230) 4.453 18.669 ( 1.421 -14.819 -3.322) 15.253 21.217 ( -4.859 12.168 -1.054) 13.144 21.688 ( -4.921 -4.305 1.864) 6.799 22.667 ( 3.027 16.245 1.515) 16.594 23.268 ( 10.404 0.362 -1.234) 10.484 107.811 ( 0.173 -0.925 -0.385) 1.017 107.835 ( 0.252 -1.682 0.062) 1.702 108.431 ( 0.134 -0.366 -0.028) 0.391 108.442 ( 0.122 -0.604 0.012) 0.616 ======================= Grid point 282 (147/259) ======================= q-point: ( 0.33 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.356 ( 6.494 10.489 -0.617) 12.352 2.812 ( -3.349 1.148 0.150) 3.544 2.979 ( 1.718 12.705 4.986) 13.756 3.192 ( -4.182 5.095 -5.485) 8.575 3.663 ( -5.215 -4.804 1.995) 7.366 3.860 ( -9.106 -11.293 -0.123) 14.507 4.582 ( -0.306 4.610 -0.465) 4.643 4.616 ( 4.316 8.536 -0.645) 9.587 4.857 ( 0.877 5.446 2.650) 6.119 4.988 ( 1.272 2.095 3.820) 4.538 5.090 ( 1.940 0.860 -3.860) 4.405 5.237 ( 1.875 0.960 -4.696) 5.146 7.749 ( 7.126 4.485 -0.306) 8.426 8.139 ( 3.776 -3.519 0.599) 5.195 8.499 ( 6.415 1.956 -0.341) 6.715 8.762 ( -5.958 -5.599 0.155) 8.177 9.316 ( -5.151 2.047 0.159) 5.545 9.638 ( -16.223 -6.085 1.934) 17.434 10.097 ( 6.464 3.248 1.018) 7.305 10.481 ( 2.714 -2.228 -0.667) 3.574 10.742 ( 0.942 -0.670 -0.081) 1.159 11.480 ( -13.374 -15.918 0.887) 20.810 12.595 ( 9.022 6.310 -0.013) 11.010 12.756 ( 2.788 -0.499 0.202) 2.840 16.474 ( 6.132 18.865 -2.624) 20.010 17.300 ( -7.207 -8.941 1.666) 11.604 17.954 ( -2.243 -3.345 -1.397) 4.263 18.664 ( 1.303 -15.286 -4.671) 16.036 21.128 ( -3.693 11.069 -1.582) 11.776 21.598 ( -5.488 -4.110 0.230) 6.861 22.756 ( 3.965 16.912 4.156) 17.860 23.437 ( 8.691 -1.356 -1.072) 8.862 107.811 ( 0.212 -0.795 -0.393) 0.912 107.840 ( 0.157 -1.714 0.096) 1.724 108.434 ( 0.204 -0.289 0.023) 0.354 108.444 ( 0.139 -0.564 0.057) 0.583 ======================= Grid point 283 (148/259) ======================= q-point: (-0.56 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.484 ( 7.198 8.259 0.698) 10.978 2.740 ( -5.090 5.076 1.420) 7.328 2.984 ( -5.785 6.542 2.533) 9.093 3.183 ( 7.916 3.691 -1.412) 8.848 3.619 ( -2.105 -5.804 2.594) 6.697 3.700 ( -6.969 -6.797 -1.679) 9.879 4.590 ( 1.794 6.424 -0.462) 6.686 4.691 ( 3.436 7.366 1.184) 8.214 4.885 ( 0.276 5.605 1.655) 5.851 5.030 ( -0.554 3.080 3.722) 4.863 5.094 ( 2.056 -2.132 -3.290) 4.427 5.230 ( 1.496 1.785 -4.852) 5.382 7.840 ( 1.798 7.247 1.413) 7.599 8.199 ( 2.894 -2.297 0.501) 3.729 8.614 ( 4.300 1.013 -1.423) 4.641 8.691 ( -1.954 -3.927 -0.479) 4.413 9.252 ( -0.349 -0.636 0.491) 0.876 9.396 ( -9.957 -4.114 1.693) 10.906 10.186 ( 2.200 9.582 1.296) 9.916 10.448 ( -2.504 -0.544 -0.159) 2.567 10.886 ( 9.296 -9.423 -0.144) 13.237 11.257 ( -10.692 -18.860 0.944) 21.701 12.719 ( 4.125 5.237 -0.062) 6.667 12.793 ( 1.105 1.260 1.548) 2.281 16.582 ( 6.497 17.545 0.056) 18.709 17.182 ( -5.981 -3.926 0.008) 7.155 17.915 ( -0.743 -4.638 -1.791) 5.027 18.643 ( 0.706 -15.381 -5.500) 16.350 21.070 ( -0.970 9.775 -1.949) 10.015 21.511 ( -3.722 -2.891 -0.373) 4.727 22.856 ( 2.680 16.169 5.520) 17.294 23.547 ( 4.025 -2.459 -0.905) 4.803 107.812 ( 0.202 -0.667 -0.398) 0.803 107.842 ( -0.002 -1.675 0.126) 1.680 108.438 ( 0.165 -0.250 0.058) 0.305 108.447 ( 0.102 -0.534 0.086) 0.550 ======================= Grid point 284 (149/259) ======================= q-point: (-0.44 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.573 ( -0.668 7.599 0.131) 7.630 2.685 ( -0.162 9.138 2.354) 9.437 2.900 ( -3.558 3.130 0.843) 4.813 3.371 ( 11.021 -1.750 2.359) 11.406 3.547 ( -4.171 -1.888 -2.811) 5.372 3.672 ( 2.618 -5.938 1.545) 6.671 4.637 ( 3.441 8.498 -0.093) 9.169 4.749 ( 1.426 4.870 2.406) 5.616 4.888 ( -0.905 6.056 0.287) 6.130 5.009 ( -1.929 4.020 -1.679) 4.765 5.126 ( 1.997 -2.853 0.816) 3.576 5.220 ( 1.115 2.954 -4.174) 5.233 7.837 ( -3.174 7.707 1.472) 8.464 8.227 ( -0.926 -3.738 0.460) 3.879 8.595 ( -2.324 -0.561 -0.738) 2.502 8.650 ( -4.093 -2.346 -1.093) 4.843 9.315 ( 4.453 -1.237 0.618) 4.662 9.412 ( 12.274 -1.189 1.719) 12.451 10.185 ( -3.329 9.494 1.310) 10.146 10.439 ( 1.481 -0.798 -0.206) 1.695 10.867 ( -10.685 -9.053 -0.159) 14.005 11.260 ( 9.874 -19.435 0.899) 21.818 12.721 ( -3.239 5.849 0.024) 6.686 12.832 ( 1.080 1.122 1.400) 2.094 16.669 ( 1.399 15.475 0.314) 15.541 17.129 ( 1.758 -1.216 -0.215) 2.148 17.902 ( 0.889 -5.779 -1.847) 6.132 18.609 ( 0.194 -15.118 -5.533) 16.100 21.067 ( 2.344 9.001 -2.088) 9.533 21.469 ( -0.697 -1.431 0.143) 1.599 22.922 ( -0.150 14.664 5.159) 15.546 23.560 ( -1.891 -2.788 -0.931) 3.495 107.812 ( 0.158 -0.583 -0.393) 0.721 107.841 ( -0.167 -1.597 0.129) 1.611 108.441 ( 0.068 -0.259 0.064) 0.275 108.449 ( -0.002 -0.539 0.084) 0.546 ======================= Grid point 285 (150/259) ======================= q-point: (-0.33 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.490 ( -5.857 9.860 -0.797) 11.496 2.729 ( 0.964 15.949 2.661) 16.198 2.888 ( 1.692 -4.431 -0.135) 4.745 3.453 ( -1.661 4.499 -1.951) 5.177 3.619 ( 12.436 -9.133 0.509) 15.438 3.756 ( 4.896 -5.369 1.441) 7.407 4.699 ( 2.976 10.812 0.155) 11.215 4.776 ( -0.365 2.177 2.596) 3.408 4.842 ( -3.861 5.763 -1.701) 7.142 4.973 ( 0.360 5.832 -2.532) 6.368 5.164 ( 1.259 -1.126 0.930) 1.929 5.204 ( 0.245 2.915 -3.546) 4.597 7.752 ( -6.458 5.044 -0.052) 8.194 8.157 ( -7.200 -6.463 0.319) 9.680 8.534 ( -3.648 2.350 -0.234) 4.346 8.634 ( 5.212 -4.413 0.098) 6.830 9.417 ( 5.349 2.651 0.578) 5.997 9.734 ( 18.387 -3.344 2.201) 18.818 10.098 ( -7.096 3.325 0.952) 7.893 10.438 ( -4.608 -2.491 -0.911) 5.317 10.713 ( -0.440 0.029 -0.114) 0.456 11.482 ( 12.819 -16.927 0.802) 21.249 12.617 ( -8.302 7.310 -0.216) 11.063 12.827 ( -2.633 -0.339 0.318) 2.673 16.624 ( -3.941 14.801 -3.122) 15.632 17.245 ( 8.554 -4.197 2.398) 9.826 17.923 ( 3.035 -5.658 -1.542) 6.604 18.575 ( 0.677 -14.430 -4.905) 15.256 21.121 ( 5.166 9.104 -2.074) 10.671 21.488 ( 2.002 -0.302 1.510) 2.526 22.923 ( -3.260 12.995 3.378) 13.817 23.468 ( -7.256 -2.180 -1.155) 7.664 107.812 ( 0.119 -0.576 -0.367) 0.693 107.838 ( -0.283 -1.515 0.098) 1.545 108.441 ( -0.017 -0.318 0.022) 0.320 108.448 ( -0.150 -0.575 0.068) 0.598 ======================= Grid point 286 (151/259) ======================= q-point: (-0.22 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( -5.034 11.816 -1.978) 12.995 2.765 ( 1.510 19.129 2.281) 19.323 2.927 ( 2.294 -7.308 -0.979) 7.722 3.426 ( 0.847 8.531 -3.381) 9.216 3.837 ( 9.412 -14.162 0.726) 17.020 3.859 ( 6.184 -3.728 1.321) 7.340 4.726 ( -0.787 4.764 -1.751) 5.137 4.741 ( -3.784 9.846 -2.384) 10.815 4.788 ( -0.330 4.368 2.448) 5.018 4.977 ( 1.151 5.741 -1.016) 5.943 5.164 ( -1.208 4.850 -2.246) 5.479 5.194 ( 1.224 -1.240 -1.502) 2.301 7.632 ( -5.163 0.636 -1.568) 5.434 7.983 ( -11.287 -9.487 -0.242) 14.746 8.546 ( 4.730 5.607 0.502) 7.353 8.776 ( 8.785 -3.882 1.078) 9.665 9.486 ( 0.923 3.973 1.108) 4.227 9.910 ( -9.847 -6.835 2.182) 12.184 10.046 ( 8.624 0.143 0.777) 8.660 10.285 ( -7.656 -6.623 -1.808) 10.283 10.897 ( 18.545 10.840 -0.405) 21.485 11.719 ( 12.599 -13.505 0.449) 18.475 12.418 ( -13.280 8.597 -0.710) 15.836 12.742 ( -6.515 -2.488 -0.655) 7.004 16.521 ( -3.301 15.608 -5.323) 16.817 17.409 ( 6.157 -11.916 2.947) 13.732 17.989 ( 5.368 -4.211 -1.316) 6.948 18.566 ( 2.129 -13.398 -3.795) 14.087 21.213 ( 6.390 9.799 -1.883) 11.849 21.556 ( 3.254 0.268 3.153) 4.539 22.861 ( -5.135 11.582 1.012) 12.709 23.297 ( -9.970 -0.447 -1.365) 10.073 107.811 ( 0.122 -0.667 -0.326) 0.753 107.833 ( -0.302 -1.451 0.048) 1.483 108.440 ( -0.064 -0.427 -0.089) 0.441 108.445 ( -0.262 -0.599 0.085) 0.659 ======================= Grid point 287 (152/259) ======================= q-point: (-0.11 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.287 ( -2.857 12.839 -3.062) 13.505 2.823 ( 2.941 18.530 1.814) 18.849 2.943 ( 0.489 -5.142 -1.489) 5.375 3.425 ( 1.681 10.534 -3.537) 11.238 3.921 ( 2.642 -4.173 -0.016) 4.939 4.020 ( 7.038 -14.040 1.550) 15.782 4.628 ( -3.211 5.140 -5.093) 7.917 4.716 ( -1.230 5.101 -0.330) 5.258 4.793 ( -1.067 6.917 1.952) 7.265 4.987 ( 0.151 4.567 0.075) 4.570 5.113 ( -1.648 4.244 -3.504) 5.745 5.203 ( 1.162 1.402 -1.915) 2.643 7.571 ( 0.271 -3.617 -1.919) 4.104 7.784 ( -9.619 -9.124 -0.879) 13.287 8.680 ( 8.504 6.550 0.483) 10.745 8.927 ( 5.792 -1.530 1.306) 6.132 9.440 ( -7.148 1.761 1.642) 7.542 9.742 ( -7.031 -7.280 2.082) 10.332 10.146 ( 0.075 -2.899 0.082) 2.901 10.187 ( -0.305 -3.697 -1.565) 4.026 11.298 ( 24.681 10.898 -0.813) 26.992 11.908 ( 5.042 -6.824 -0.506) 8.499 12.150 ( -13.162 8.060 -0.800) 15.455 12.599 ( -7.766 -5.758 -0.945) 9.714 16.437 ( -1.044 16.338 -6.257) 17.526 17.495 ( 1.420 -17.611 2.237) 17.809 18.075 ( 4.671 -3.815 -1.897) 6.322 18.593 ( 3.268 -12.738 -2.379) 13.364 21.306 ( 4.746 10.667 -1.470) 11.767 21.642 ( 2.847 0.101 4.365) 5.212 22.766 ( -4.994 10.828 -1.082) 11.974 23.120 ( -7.556 1.955 -1.262) 7.906 107.811 ( 0.145 -0.841 -0.306) 0.906 107.829 ( -0.192 -1.417 0.014) 1.430 108.437 ( -0.162 -0.564 -0.191) 0.617 108.441 ( -0.178 -0.564 0.101) 0.600 ======================= Grid point 288 (153/259) ======================= q-point: ( 0.00 0.46 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.488 ( 0.747 12.273 -4.281) 13.020 2.721 ( 0.952 -10.753 -3.523) 11.355 3.336 ( 1.340 20.166 2.595) 20.376 3.606 ( -0.366 3.346 -2.413) 4.142 3.777 ( 1.581 -9.854 1.832) 10.147 3.857 ( 0.016 -9.089 -0.327) 9.095 4.616 ( -0.763 2.275 -3.631) 4.352 4.660 ( -1.433 -2.183 -1.677) 3.103 4.980 ( -2.356 7.689 -1.331) 8.151 5.038 ( -2.327 1.357 -1.366) 3.021 5.136 ( 0.781 3.438 -1.837) 3.976 5.211 ( 1.161 -2.555 -1.790) 3.329 7.529 ( 1.684 -1.526 -0.776) 2.402 7.548 ( 0.424 -3.257 -1.824) 3.757 8.900 ( -1.069 6.061 0.329) 6.163 8.991 ( 0.980 -2.465 0.482) 2.696 9.374 ( -2.546 4.150 3.021) 5.730 9.505 ( -1.182 -8.722 2.922) 9.274 10.096 ( -0.751 1.086 -1.667) 2.127 10.141 ( -0.096 -3.043 -1.736) 3.505 11.797 ( -1.667 4.612 -1.616) 5.164 11.854 ( 1.756 0.361 -1.175) 2.143 12.134 ( -0.093 7.221 -0.516) 7.240 12.319 ( 0.046 -9.802 -0.527) 9.816 16.744 ( 0.912 18.248 -4.045) 18.714 17.120 ( -0.186 -19.201 -0.859) 19.221 18.146 ( 0.814 7.045 -1.526) 7.254 18.360 ( 1.493 -13.318 -1.109) 13.447 21.541 ( 0.290 7.817 1.002) 7.886 21.660 ( 0.338 -4.183 2.555) 4.913 22.894 ( -1.626 9.370 -0.958) 9.558 23.031 ( -0.362 -3.930 -0.654) 4.000 107.800 ( 0.106 -0.167 -0.419) 0.464 107.805 ( 0.093 -0.720 -0.297) 0.785 108.427 ( -0.039 -0.027 -0.262) 0.266 108.431 ( -0.005 -0.326 -0.191) 0.378 ======================= Grid point 289 (154/259) ======================= q-point: ( 0.11 0.46 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.486 ( 2.420 12.554 -4.075) 13.419 2.718 ( 1.503 -10.204 -3.305) 10.831 3.343 ( -2.717 18.615 2.807) 19.021 3.547 ( -4.136 3.643 -2.203) 5.936 3.767 ( -3.596 -7.054 0.220) 7.921 3.825 ( -3.577 -11.225 0.871) 11.813 4.601 ( 1.759 2.299 -2.490) 3.818 4.637 ( -0.049 -1.435 -0.845) 1.666 4.942 ( -0.794 6.288 -0.751) 6.383 4.996 ( -0.819 0.750 -1.440) 1.818 5.137 ( 0.784 3.991 -1.748) 4.426 5.214 ( 1.223 -2.686 -2.909) 4.144 7.568 ( 5.158 1.529 -1.323) 5.540 7.642 ( 9.137 -5.686 -1.025) 10.810 8.780 ( -9.923 7.418 0.905) 12.422 8.914 ( -8.404 -5.696 1.002) 10.202 9.449 ( 5.143 5.991 2.350) 8.238 9.595 ( 6.533 -8.570 2.695) 11.108 10.048 ( -2.884 2.144 -1.557) 3.916 10.124 ( 0.815 -5.213 -1.845) 5.589 11.510 ( -19.407 11.235 -0.687) 22.435 11.724 ( -14.323 -10.044 -0.558) 17.503 12.307 ( 14.034 7.800 -0.879) 16.080 12.451 ( 10.598 -6.680 -0.907) 12.560 16.745 ( 2.347 18.283 -3.799) 18.820 17.111 ( -0.205 -18.294 -0.644) 18.307 18.127 ( -1.468 7.940 -1.371) 8.190 18.364 ( 0.092 -14.566 -1.369) 14.630 21.516 ( -3.639 8.530 0.785) 9.307 21.651 ( -3.129 -5.260 2.034) 6.449 22.899 ( 2.672 11.548 -0.429) 11.861 23.074 ( 5.261 -5.491 -0.533) 7.623 107.799 ( 0.199 -0.128 -0.411) 0.474 107.806 ( 0.234 -0.805 -0.281) 0.885 108.426 ( 0.116 0.024 -0.227) 0.256 108.430 ( 0.125 -0.360 -0.185) 0.424 ======================= Grid point 290 (155/259) ======================= q-point: ( 0.22 0.46 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.513 ( 3.732 11.906 -3.455) 12.947 2.726 ( 1.963 -8.887 -2.815) 9.527 3.293 ( -4.868 15.267 3.157) 16.332 3.432 ( -6.527 3.301 -2.094) 7.608 3.669 ( -6.562 -4.378 0.061) 7.889 3.746 ( -5.831 -11.518 0.957) 12.945 4.635 ( 2.592 1.789 -0.549) 3.197 4.647 ( 1.961 0.773 -0.146) 2.113 4.940 ( 0.446 5.163 0.586) 5.215 4.990 ( 0.715 0.367 -0.322) 0.866 5.136 ( 0.620 3.631 -2.091) 4.236 5.213 ( 1.428 -3.079 -3.698) 5.019 7.695 ( 9.576 5.262 -1.200) 10.993 7.831 ( 11.772 -7.987 -0.628) 14.239 8.624 ( -7.256 7.136 1.380) 10.270 8.763 ( -8.366 -6.657 1.299) 10.770 9.496 ( -2.624 7.250 1.375) 7.832 9.667 ( -3.762 -9.754 2.006) 10.646 10.033 ( 4.744 5.687 -0.792) 7.448 10.179 ( 7.185 -8.577 -1.282) 11.262 11.166 ( -17.835 13.637 -0.070) 22.452 11.442 ( -15.969 -13.773 0.239) 21.089 12.531 ( 10.992 5.375 -0.588) 12.250 12.619 ( 8.349 -3.651 -0.610) 9.133 16.769 ( 3.148 17.288 -2.900) 17.810 17.100 ( -0.738 -15.902 -0.093) 15.919 18.082 ( -2.197 9.299 -1.438) 9.663 18.349 ( -0.124 -16.016 -2.258) 16.175 21.434 ( -5.455 9.137 0.108) 10.642 21.585 ( -5.253 -6.167 1.092) 8.174 22.974 ( 5.187 13.773 0.751) 14.737 23.194 ( 7.740 -7.654 -0.192) 10.887 107.800 ( 0.279 -0.051 -0.378) 0.473 107.809 ( 0.299 -0.891 -0.235) 0.968 108.428 ( 0.245 0.050 -0.166) 0.300 108.432 ( 0.223 -0.351 -0.143) 0.440 ======================= Grid point 291 (156/259) ======================= q-point: ( 0.33 0.46 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.567 ( 4.784 10.208 -2.525) 11.552 2.743 ( 1.871 -6.778 -2.163) 7.357 3.227 ( -5.244 10.051 3.529) 11.873 3.298 ( -5.794 3.707 -2.112) 7.195 3.562 ( -5.223 -3.075 1.534) 6.252 3.643 ( -5.757 -9.561 0.588) 11.176 4.670 ( 1.971 3.800 0.464) 4.306 4.709 ( 3.802 0.730 0.359) 3.888 4.959 ( 0.486 4.221 1.682) 4.569 5.009 ( 0.940 -0.591 0.878) 1.415 5.129 ( 0.448 3.616 -2.117) 4.214 5.211 ( 1.617 -3.433 -3.775) 5.352 7.870 ( 9.455 7.210 -0.310) 11.895 8.020 ( 8.549 -7.343 -0.096) 11.270 8.568 ( 0.445 4.203 0.957) 4.333 8.658 ( -3.811 -4.811 0.975) 6.214 9.391 ( -8.401 5.110 0.634) 9.853 9.509 ( -12.503 -6.459 1.325) 14.135 10.183 ( 9.991 6.265 0.299) 11.797 10.346 ( 10.870 -9.213 -0.483) 14.257 10.883 ( -13.236 12.302 0.246) 18.072 11.166 ( -14.935 -15.246 0.509) 21.348 12.692 ( 7.139 3.448 0.191) 7.930 12.739 ( 5.095 -1.431 0.303) 5.301 16.813 ( 3.441 14.897 -1.416) 15.355 17.081 ( -1.500 -12.244 0.371) 12.341 18.033 ( -1.704 10.636 -2.089) 10.972 18.328 ( 0.230 -17.219 -3.508) 17.574 21.336 ( -4.778 9.280 -0.661) 10.459 21.493 ( -5.070 -6.468 0.224) 8.222 23.081 ( 5.023 14.940 2.029) 15.892 23.328 ( 6.667 -9.270 0.256) 11.422 107.803 ( 0.298 0.023 -0.339) 0.452 107.813 ( 0.270 -0.932 -0.177) 0.986 108.432 ( 0.283 0.050 -0.102) 0.305 108.436 ( 0.247 -0.315 -0.089) 0.410 ======================= Grid point 292 (157/259) ======================= q-point: (-0.56 0.46 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.642 ( 4.942 7.200 -1.773) 8.911 2.753 ( 0.606 -3.210 -1.530) 3.607 3.138 ( -5.961 7.833 0.862) 9.881 3.236 ( -0.400 -0.280 0.509) 0.705 3.519 ( -1.326 -2.427 2.857) 3.976 3.563 ( -3.275 -5.755 0.554) 6.644 4.718 ( 3.024 5.444 0.330) 6.236 4.774 ( 2.810 0.567 0.538) 2.917 4.977 ( -0.141 3.321 1.961) 3.860 5.030 ( 0.450 -2.443 1.135) 2.731 5.123 ( 0.567 4.904 -1.442) 5.143 5.216 ( 1.812 -3.283 -3.104) 4.868 7.991 ( 3.038 7.370 1.026) 8.037 8.120 ( 2.655 -5.327 0.561) 5.979 8.618 ( 1.069 0.306 -0.230) 1.135 8.641 ( 1.374 -1.748 0.272) 2.239 9.271 ( -3.205 2.134 0.793) 3.931 9.324 ( -6.440 -3.078 1.319) 7.259 10.358 ( 8.442 8.217 0.532) 11.793 10.487 ( 1.038 -0.615 -0.048) 1.208 10.737 ( -0.192 -0.540 0.306) 0.649 10.917 ( -12.522 -14.522 0.421) 19.180 12.791 ( 3.303 2.104 0.651) 3.970 12.809 ( 2.186 0.127 1.258) 2.525 16.869 ( 3.105 11.199 0.086) 11.622 17.055 ( -1.448 -7.936 0.313) 8.073 17.992 ( -0.673 11.464 -2.858) 11.834 18.303 ( 0.367 -17.738 -4.434) 18.287 21.265 ( -2.081 9.077 -1.130) 9.380 21.420 ( -2.750 -6.232 -0.234) 6.816 23.171 ( 2.566 14.721 2.838) 15.210 23.422 ( 3.005 -9.815 0.551) 10.279 107.806 ( 0.243 0.069 -0.313) 0.402 107.815 ( 0.164 -0.921 -0.136) 0.946 108.436 ( 0.213 0.038 -0.059) 0.224 108.439 ( 0.184 -0.280 -0.054) 0.340 ======================= Grid point 293 (158/259) ======================= q-point: (-0.44 0.46 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.690 ( 0.727 4.513 -1.934) 4.963 2.753 ( 1.427 -1.166 -1.189) 2.193 3.062 ( -2.445 11.198 0.389) 11.469 3.273 ( 3.719 -8.529 0.872) 9.345 3.530 ( -0.081 0.234 0.865) 0.900 3.563 ( 2.730 -3.561 2.475) 5.124 4.779 ( 3.271 4.647 -0.209) 5.687 4.811 ( 0.788 1.133 0.228) 1.398 4.979 ( -1.000 3.486 1.533) 3.937 5.048 ( 1.426 -3.301 0.155) 3.599 5.128 ( 0.482 5.972 -0.224) 5.996 5.226 ( 1.388 -2.730 -2.281) 3.819 7.994 ( -3.644 7.553 1.092) 8.457 8.129 ( -2.624 -5.886 0.606) 6.473 8.577 ( -3.216 0.689 -0.027) 3.289 8.616 ( -4.662 -2.400 0.049) 5.243 9.332 ( 8.058 2.215 0.961) 8.412 9.379 ( 10.877 -2.140 1.384) 11.172 10.360 ( -9.180 8.265 0.480) 12.362 10.477 ( -1.348 0.205 -0.195) 1.378 10.725 ( -1.621 -0.822 0.295) 1.842 10.907 ( 11.279 -15.167 0.405) 18.906 12.808 ( -1.819 2.872 0.677) 3.467 12.840 ( -0.285 -0.478 1.185) 1.309 16.907 ( 0.353 8.728 0.140) 8.736 17.049 ( 1.050 -5.876 0.332) 5.978 17.971 ( 0.954 11.442 -2.943) 11.853 18.277 ( 0.631 -17.265 -4.462) 17.844 21.251 ( 1.553 8.749 -1.113) 8.955 21.398 ( 0.591 -5.631 -0.117) 5.663 23.206 ( -1.165 13.351 2.793) 13.690 23.437 ( -1.831 -9.241 0.489) 9.433 107.807 ( 0.143 0.076 -0.313) 0.352 107.816 ( 0.024 -0.873 -0.131) 0.884 108.438 ( 0.081 0.015 -0.056) 0.099 108.441 ( 0.054 -0.261 -0.057) 0.273 ======================= Grid point 294 (159/259) ======================= q-point: (-0.33 0.46 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.649 ( -2.440 6.583 -2.435) 7.431 2.769 ( 0.912 -5.531 -2.000) 5.952 3.068 ( 2.538 15.891 0.951) 16.120 3.374 ( 6.683 -14.343 0.581) 15.834 3.554 ( 2.254 5.138 0.118) 5.612 3.654 ( 5.033 -4.896 1.757) 7.238 4.803 ( -0.797 1.257 -1.114) 1.860 4.808 ( -0.749 0.802 -0.716) 1.310 4.985 ( 1.044 7.171 1.442) 7.389 5.088 ( 3.220 -1.215 -1.410) 3.720 5.130 ( -0.617 4.297 0.933) 4.440 5.225 ( 0.113 -2.150 -2.039) 2.965 7.873 ( -9.602 6.786 -0.241) 11.760 8.015 ( -9.927 -7.298 -0.143) 12.322 8.562 ( 0.232 0.723 0.878) 1.161 8.580 ( 3.635 -1.437 0.970) 4.027 9.505 ( 8.431 5.782 1.100) 10.282 9.631 ( 12.717 -6.317 1.708) 14.302 10.185 ( -9.462 5.925 0.043) 11.164 10.327 ( -10.763 -7.533 -0.834) 13.164 10.855 ( 12.860 12.351 0.214) 17.832 11.148 ( 14.652 -16.160 0.452) 21.818 12.736 ( -6.617 4.605 0.091) 8.062 12.803 ( -4.673 -2.180 0.340) 5.167 16.882 ( -2.031 11.214 -1.627) 11.512 17.090 ( 2.322 -9.790 0.674) 10.084 17.988 ( 3.248 10.451 -2.180) 11.159 18.266 ( 1.699 -15.763 -3.623) 16.263 21.301 ( 4.606 8.395 -0.669) 9.599 21.437 ( 3.375 -4.828 0.566) 5.918 23.170 ( -4.703 11.398 1.909) 12.476 23.365 ( -6.123 -7.778 0.102) 9.900 107.806 ( 0.051 0.040 -0.336) 0.342 107.814 ( -0.091 -0.808 -0.167) 0.830 108.438 ( -0.046 -0.029 -0.099) 0.113 108.440 ( -0.091 -0.245 -0.090) 0.277 ======================= Grid point 295 (160/259) ======================= q-point: (-0.22 0.46 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.583 ( -2.331 9.051 -3.297) 9.911 2.757 ( 0.049 -8.501 -2.871) 8.973 3.152 ( 5.221 18.541 1.601) 19.329 3.508 ( 7.296 -15.810 -0.305) 17.415 3.608 ( 3.587 7.007 0.350) 7.880 3.755 ( 4.944 -6.542 0.421) 8.211 4.755 ( -2.955 0.641 -2.824) 4.137 4.764 ( -2.407 -0.295 -1.065) 2.648 5.029 ( 1.763 9.422 1.459) 9.695 5.102 ( -0.739 6.454 -1.803) 6.742 5.147 ( 2.083 -3.559 0.197) 4.128 5.200 ( -0.929 -1.832 -2.140) 2.966 7.686 ( -9.307 4.588 -1.307) 10.458 7.809 ( -11.351 -7.583 -0.726) 13.671 8.640 ( 6.942 3.859 1.180) 8.029 8.707 ( 8.659 -3.133 1.360) 9.308 9.595 ( -0.887 6.676 1.873) 6.990 9.746 ( -4.399 -8.269 2.627) 9.727 10.081 ( 0.465 2.946 -1.060) 3.165 10.163 ( -5.058 -5.246 -1.869) 7.523 11.148 ( 19.241 13.811 -0.112) 23.685 11.435 ( 16.761 -14.540 0.191) 22.190 12.569 ( -11.596 6.428 -0.630) 13.273 12.676 ( -9.277 -4.234 -0.569) 10.213 16.825 ( -1.978 14.883 -3.032) 15.317 17.124 ( 0.956 -15.067 0.079) 15.098 18.050 ( 4.684 8.668 -1.438) 9.957 18.286 ( 2.978 -13.872 -2.453) 14.398 21.396 ( 5.742 7.987 0.008) 9.837 21.518 ( 4.413 -4.063 1.543) 6.194 23.076 ( -6.428 9.556 0.607) 11.533 23.232 ( -8.008 -5.819 -0.354) 9.906 107.804 ( 0.013 -0.036 -0.369) 0.371 107.811 ( -0.127 -0.742 -0.226) 0.786 108.435 ( -0.122 -0.084 -0.190) 0.241 108.437 ( -0.167 -0.230 -0.118) 0.308 ======================= Grid point 296 (161/259) ======================= q-point: (-0.11 0.46 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.523 ( -1.057 11.041 -4.018) 11.797 2.736 ( 0.374 -10.161 -3.396) 10.720 3.260 ( 4.669 19.994 2.184) 20.647 3.597 ( 3.380 -2.665 -2.277) 4.869 3.697 ( 4.897 -5.390 2.064) 7.569 3.830 ( 3.170 -7.789 -0.447) 8.421 4.676 ( -2.658 1.650 -3.625) 4.788 4.709 ( -2.377 -1.579 -1.686) 3.315 5.033 ( -2.092 9.859 -0.551) 10.093 5.078 ( -1.021 3.677 -0.003) 3.816 5.147 ( -0.285 -0.123 -2.996) 3.012 5.196 ( 1.551 -2.722 -0.803) 3.234 7.551 ( -3.946 1.598 -1.530) 4.524 7.629 ( -7.287 -6.036 -1.107) 9.527 8.800 ( 8.926 5.215 0.760) 10.365 8.883 ( 8.792 -3.039 1.120) 9.370 9.498 ( -10.172 3.939 2.409) 11.171 9.600 ( -10.059 -6.323 2.739) 12.193 10.108 ( 0.457 -0.305 -1.626) 1.716 10.131 ( 2.519 -2.208 -1.765) 3.786 11.518 ( 21.063 10.975 -0.729) 23.762 11.731 ( 14.964 -10.091 -0.578) 18.058 12.320 ( -14.636 8.290 -0.859) 16.842 12.473 ( -11.830 -6.941 -0.900) 13.745 16.773 ( -0.771 17.233 -3.791) 17.662 17.128 ( -0.065 -18.281 -0.597) 18.291 18.117 ( 3.568 7.195 -1.411) 8.154 18.328 ( 2.983 -12.880 -1.498) 13.306 21.492 ( 4.181 7.648 0.665) 8.741 21.606 ( 3.294 -3.720 2.348) 5.495 22.966 ( -5.299 8.621 -0.532) 10.133 23.096 ( -5.955 -4.134 -0.609) 7.275 107.801 ( 0.040 -0.125 -0.401) 0.422 107.807 ( -0.059 -0.699 -0.277) 0.755 108.431 ( -0.137 -0.082 -0.257) 0.303 108.433 ( -0.117 -0.263 -0.155) 0.327 ======================= Grid point 351 (162/259) ======================= q-point: ( 0.00 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.838 ( 3.967 0.000 6.744) 7.824 1.480 ( 1.097 0.000 16.472) 16.508 2.411 ( 3.346 0.000 24.415) 24.644 2.653 ( 0.540 0.000 -6.012) 6.036 2.987 ( -0.073 0.000 -9.446) 9.447 3.386 ( -5.348 0.000 -2.519) 5.912 4.197 ( -1.146 0.000 0.924) 1.471 4.478 ( 1.361 0.000 -1.440) 1.982 4.496 ( 1.117 0.000 -1.422) 1.808 5.007 ( -3.347 0.000 5.274) 6.246 5.209 ( 5.898 0.000 -2.593) 6.443 6.381 ( -3.801 0.000 -8.596) 9.399 7.997 ( -0.177 0.000 1.095) 1.109 8.096 ( 0.086 0.000 -0.294) 0.307 8.316 ( -0.612 0.000 -0.990) 1.164 9.172 ( -0.573 0.000 1.186) 1.318 9.409 ( 0.253 0.000 0.028) 0.255 9.687 ( 7.276 0.000 1.344) 7.399 9.978 ( 0.121 0.000 -0.375) 0.394 10.635 ( -1.646 0.000 -0.539) 1.732 10.987 ( -0.113 0.000 -0.068) 0.131 11.585 ( -2.557 0.000 0.091) 2.559 12.161 ( 0.928 0.000 0.287) 0.971 13.631 ( -0.242 0.000 -0.599) 0.646 14.837 ( 0.344 0.000 2.084) 2.112 15.343 ( -1.086 0.000 -1.514) 1.863 19.846 ( -0.368 0.000 0.879) 0.953 20.236 ( 0.504 0.000 -0.680) 0.846 20.721 ( -0.286 0.000 0.432) 0.518 20.787 ( 2.970 0.000 2.059) 3.613 21.792 ( -1.585 0.000 1.728) 2.345 22.274 ( -0.265 0.000 -1.640) 1.661 107.944 ( 0.053 0.000 0.141) 0.150 107.988 ( 0.462 0.000 0.204) 0.505 108.581 ( -0.240 0.000 1.943) 1.958 108.686 ( -2.295 0.000 -1.629) 2.814 ======================= Grid point 352 (163/259) ======================= q-point: ( 0.11 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.226 ( 29.545 0.000 1.928) 29.608 1.687 ( 9.986 0.000 10.033) 14.156 2.560 ( -3.709 0.000 12.796) 13.323 2.691 ( 7.444 0.000 -4.580) 8.741 2.907 ( -1.856 0.000 -6.951) 7.194 3.252 ( -7.277 0.000 1.716) 7.477 4.178 ( -1.784 0.000 1.162) 2.129 4.498 ( 0.376 0.000 -1.564) 1.609 4.499 ( 2.053 0.000 -1.670) 2.646 4.949 ( -6.296 0.000 3.993) 7.455 5.265 ( 2.177 0.000 -4.222) 4.750 6.088 ( -19.314 0.000 -0.484) 19.320 7.981 ( -1.859 0.000 0.216) 1.872 8.082 ( -1.259 0.000 -0.299) 1.294 8.538 ( 20.604 0.000 -1.026) 20.629 9.036 ( -11.243 0.000 1.021) 11.289 9.534 ( 9.547 0.000 0.064) 9.548 9.795 ( 4.551 0.000 -6.175) 7.671 9.980 ( 0.368 0.000 -0.335) 0.498 10.666 ( 6.357 0.000 1.104) 6.452 10.917 ( -6.545 0.000 0.332) 6.554 11.607 ( 2.562 0.000 1.952) 3.221 12.207 ( 4.372 0.000 -0.687) 4.426 13.510 ( -11.869 0.000 0.377) 11.875 14.874 ( 2.332 0.000 1.160) 2.605 15.306 ( -2.263 0.000 -0.156) 2.269 19.869 ( 2.271 0.000 0.403) 2.307 20.253 ( 1.919 0.000 -0.804) 2.081 20.703 ( -2.040 0.000 0.466) 2.093 20.928 ( 11.175 0.000 -2.232) 11.396 21.818 ( 2.433 0.000 2.770) 3.687 22.231 ( -3.106 0.000 -1.256) 3.350 107.937 ( -0.689 0.000 0.021) 0.690 107.999 ( 0.639 0.000 -0.188) 0.666 108.583 ( -1.267 0.000 1.672) 2.098 108.634 ( -2.673 0.000 0.875) 2.813 ======================= Grid point 353 (164/259) ======================= q-point: ( 0.22 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( 23.188 0.000 -0.441) 23.192 1.967 ( 15.194 0.000 2.841) 15.458 2.493 ( -5.837 0.000 1.752) 6.094 2.811 ( -5.023 0.000 -2.972) 5.837 2.826 ( 9.966 0.000 -2.022) 10.169 3.203 ( -1.456 0.000 7.245) 7.390 4.157 ( -1.350 0.000 1.399) 1.944 4.485 ( -0.437 0.000 -1.690) 1.746 4.523 ( 1.894 0.000 -1.595) 2.476 4.861 ( -5.843 0.000 2.673) 6.425 5.187 ( -6.316 0.000 -8.190) 10.342 5.793 ( -14.437 0.000 4.806) 15.216 7.939 ( -2.293 0.000 -0.798) 2.428 8.050 ( -1.938 0.000 -0.337) 1.968 8.842 ( -10.635 0.000 0.948) 10.677 8.913 ( 19.415 0.000 0.788) 19.431 9.699 ( 8.331 0.000 0.023) 8.331 9.731 ( -4.542 0.000 -7.906) 9.118 9.984 ( 0.287 0.000 -0.274) 0.396 10.808 ( -5.110 0.000 1.207) 5.251 10.896 ( 16.506 0.000 1.373) 16.563 11.646 ( -0.888 0.000 2.551) 2.701 12.303 ( 7.010 0.000 -1.827) 7.244 13.259 ( -14.952 0.000 0.155) 14.953 14.933 ( 3.649 0.000 -0.310) 3.662 15.263 ( -3.009 0.000 1.753) 3.482 19.917 ( 2.813 0.000 -0.858) 2.941 20.293 ( 3.148 0.000 -0.833) 3.256 20.656 ( -3.486 0.000 0.418) 3.511 21.108 ( 10.736 0.000 -4.603) 11.682 21.920 ( 5.295 0.000 4.820) 7.160 22.157 ( -2.927 0.000 -2.122) 3.616 107.922 ( -0.892 0.000 -0.197) 0.914 108.007 ( 0.350 0.000 -0.186) 0.396 108.561 ( -1.826 0.000 0.995) 2.080 108.607 ( -2.052 0.000 2.602) 3.313 ======================= Grid point 354 (165/259) ======================= q-point: ( 0.33 0.00 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.852 ( -7.432 0.000 -6.142) 9.641 2.262 ( 17.522 0.000 -3.422) 17.853 2.529 ( 1.574 0.000 9.407) 9.538 2.669 ( -10.414 0.000 1.785) 10.566 3.057 ( 19.435 0.000 -3.154) 19.689 3.308 ( 7.295 0.000 6.455) 9.741 4.159 ( 0.394 0.000 1.956) 1.995 4.456 ( -1.226 0.000 -2.048) 2.386 4.537 ( 0.316 0.000 -0.561) 0.644 4.785 ( -5.146 0.000 1.225) 5.290 4.930 ( -12.207 0.000 -10.674) 16.215 5.617 ( -9.939 0.000 4.139) 10.766 7.895 ( -1.497 0.000 -1.597) 2.189 8.014 ( -1.618 0.000 -0.395) 1.665 8.682 ( -7.630 0.000 0.935) 7.687 9.215 ( 12.770 0.000 1.273) 12.833 9.569 ( -6.337 0.000 -5.918) 8.670 9.828 ( 5.993 0.000 -0.022) 5.993 9.983 ( -0.325 0.000 -0.202) 0.383 10.759 ( -2.037 0.000 3.093) 3.704 11.207 ( 14.753 0.000 0.882) 14.779 11.621 ( -3.243 0.000 2.520) 4.107 12.419 ( 7.684 0.000 -2.498) 8.080 13.013 ( -11.514 0.000 -0.828) 11.544 14.988 ( 2.908 0.000 -1.907) 3.477 15.233 ( -2.207 0.000 3.587) 4.211 19.945 ( 1.201 0.000 -1.585) 1.989 20.352 ( 4.014 0.000 -0.734) 4.080 20.587 ( -4.347 0.000 0.289) 4.357 21.228 ( 6.340 0.000 -4.732) 7.911 21.982 ( -4.237 0.000 4.439) 6.136 22.193 ( 9.887 0.000 -1.275) 9.969 107.904 ( -0.844 0.000 -0.347) 0.912 108.009 ( 0.015 0.000 0.000) 0.015 108.541 ( -1.205 0.000 1.040) 1.592 108.591 ( -1.827 0.000 2.461) 3.065 ======================= Grid point 355 (166/259) ======================= q-point: (-0.56 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.604 ( -12.807 0.000 -3.616) 13.308 2.430 ( -10.340 0.000 -2.461) 10.629 2.564 ( 11.214 0.000 1.089) 11.267 2.564 ( -5.816 0.000 12.590) 13.869 3.324 ( 9.106 0.000 -4.853) 10.318 3.632 ( 23.204 0.000 6.775) 24.173 4.200 ( 2.012 0.000 2.587) 3.277 4.412 ( -1.564 0.000 -2.671) 3.095 4.444 ( -17.647 0.000 -6.134) 18.683 4.578 ( -3.836 0.000 -2.548) 4.605 4.811 ( 1.273 0.000 -1.948) 2.327 5.487 ( -6.778 0.000 2.279) 7.151 7.863 ( -0.613 0.000 -1.967) 2.060 7.991 ( -0.441 0.000 -0.468) 0.643 8.590 ( -3.200 0.000 1.021) 3.359 9.381 ( 4.470 0.000 -0.317) 4.481 9.450 ( -1.748 0.000 -3.130) 3.585 9.913 ( 3.342 0.000 -0.071) 3.343 9.967 ( -1.312 0.000 -0.136) 1.319 10.773 ( 0.283 0.000 3.527) 3.538 11.387 ( 4.394 0.000 1.564) 4.664 11.597 ( -0.466 0.000 0.521) 0.699 12.560 ( 9.815 0.000 -1.137) 9.881 12.823 ( -9.080 0.000 -2.313) 9.370 14.995 ( -0.659 0.000 -1.391) 1.539 15.247 ( 0.899 0.000 3.002) 3.133 19.939 ( -0.584 0.000 -1.102) 1.248 20.420 ( 3.428 0.000 -0.380) 3.449 20.512 ( -3.543 0.000 -0.033) 3.543 21.263 ( 0.854 0.000 -3.407) 3.513 21.936 ( -1.507 0.000 1.236) 1.949 22.376 ( 9.024 0.000 -0.590) 9.044 107.888 ( -0.601 0.000 -0.265) 0.656 108.007 ( -0.306 0.000 0.242) 0.390 108.533 ( -0.581 0.000 1.016) 1.170 108.583 ( -0.882 0.000 2.022) 2.206 ======================= Grid point 356 (167/259) ======================= q-point: (-0.44 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.401 ( -9.285 0.000 5.242) 10.662 2.149 ( -20.091 0.000 6.210) 21.029 2.534 ( -9.284 0.000 13.829) 16.656 2.794 ( 14.033 0.000 -5.642) 15.125 3.349 ( -0.831 0.000 -6.131) 6.187 3.976 ( -22.294 0.000 -10.198) 24.516 4.110 ( 21.361 0.000 7.171) 22.533 4.254 ( 1.045 0.000 2.333) 2.556 4.371 ( 0.087 0.000 -2.849) 2.851 4.569 ( 0.607 0.000 -0.023) 0.607 4.838 ( 2.809 0.000 -2.155) 3.541 5.443 ( 0.446 0.000 4.156) 4.180 7.846 ( 0.281 0.000 -1.401) 1.429 7.992 ( 1.010 0.000 -0.522) 1.137 8.586 ( 1.877 0.000 1.174) 2.214 9.366 ( -2.305 0.000 -1.017) 2.519 9.472 ( 3.205 0.000 -2.493) 4.061 9.912 ( -3.350 0.000 -0.026) 3.350 9.968 ( 1.501 0.000 -0.186) 1.512 10.801 ( 0.185 0.000 2.134) 2.142 11.427 ( -1.244 0.000 0.387) 1.303 11.610 ( 2.765 0.000 -0.138) 2.768 12.616 ( -10.220 0.000 -3.964) 10.962 12.755 ( 10.372 0.000 0.518) 10.385 14.955 ( -3.127 0.000 0.547) 3.175 15.296 ( 2.605 0.000 0.724) 2.703 19.913 ( -1.722 0.000 0.088) 1.725 20.406 ( -3.906 0.000 0.135) 3.908 20.524 ( 4.123 0.000 -0.471) 4.150 21.212 ( -4.075 0.000 -1.202) 4.249 21.968 ( 4.594 0.000 -0.491) 4.620 22.464 ( 2.301 0.000 -4.696) 5.230 107.880 ( -0.179 0.000 0.106) 0.208 108.002 ( -0.557 0.000 0.484) 0.738 108.534 ( -0.163 0.000 0.940) 0.954 108.595 ( 0.788 0.000 1.691) 1.865 ======================= Grid point 357 (168/259) ======================= q-point: (-0.33 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.370 ( -3.320 0.000 15.438) 15.791 1.830 ( -21.907 0.000 11.182) 24.596 2.372 ( -22.446 0.000 15.025) 27.011 2.966 ( 10.315 0.000 -7.440) 12.718 3.244 ( -3.314 0.000 -9.614) 10.169 3.554 ( -14.493 0.000 -7.560) 16.346 4.250 ( -1.588 0.000 -0.258) 1.609 4.392 ( 3.058 0.000 -0.757) 3.150 4.501 ( 14.694 0.000 8.656) 17.054 4.564 ( -0.615 0.000 -1.084) 1.246 4.887 ( 5.627 0.000 -3.523) 6.638 5.581 ( 9.415 0.000 7.649) 12.131 7.857 ( 1.728 0.000 -0.205) 1.740 8.017 ( 2.030 0.000 -0.510) 2.093 8.673 ( 6.624 0.000 1.268) 6.744 9.281 ( -7.138 0.000 -0.515) 7.157 9.519 ( 4.920 0.000 -4.637) 6.761 9.826 ( -6.089 0.000 0.061) 6.090 9.985 ( 0.539 0.000 -0.272) 0.604 10.813 ( 0.213 0.000 0.538) 0.579 11.309 ( -10.540 0.000 -3.686) 11.166 11.700 ( 5.548 0.000 -0.366) 5.560 12.393 ( -10.305 0.000 -2.511) 10.606 12.961 ( 11.882 0.000 1.392) 11.963 14.901 ( -3.701 0.000 1.869) 4.146 15.342 ( 2.459 0.000 -1.052) 2.674 19.883 ( -2.065 0.000 1.263) 2.420 20.336 ( -3.614 0.000 -0.081) 3.615 20.598 ( 4.124 0.000 -0.167) 4.128 21.116 ( -6.064 0.000 0.454) 6.081 22.072 ( 7.067 0.000 -1.375) 7.199 22.372 ( -6.536 0.000 -9.730) 11.722 107.885 ( 0.425 0.000 0.600) 0.735 107.995 ( -0.682 0.000 0.674) 0.959 108.541 ( 0.125 0.000 0.938) 0.946 108.637 ( 2.607 0.000 1.035) 2.805 ======================= Grid point 358 (169/259) ======================= q-point: (-0.22 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.405 ( -12.948 0.000 15.296) 20.041 1.558 ( -18.836 0.000 16.191) 24.839 2.048 ( -19.464 0.000 20.207) 28.057 3.035 ( -10.791 0.000 -11.263) 15.598 3.049 ( 5.759 0.000 -8.996) 10.682 3.415 ( 1.333 0.000 -1.890) 2.313 4.221 ( -1.033 0.000 -0.500) 1.148 4.442 ( 2.734 0.000 -0.553) 2.790 4.516 ( -2.112 0.000 -1.419) 2.544 4.794 ( 9.608 0.000 8.285) 12.686 4.990 ( 8.116 0.000 -2.921) 8.626 5.876 ( 17.312 0.000 5.686) 18.222 7.903 ( 2.968 0.000 0.661) 3.041 8.053 ( 2.193 0.000 -0.432) 2.235 8.835 ( 9.966 0.000 1.213) 10.040 9.075 ( -14.909 0.000 -5.253) 15.808 9.556 ( 1.621 0.000 -2.088) 2.643 9.695 ( -8.506 0.000 0.172) 8.508 9.986 ( -0.047 0.000 -0.342) 0.345 10.814 ( -1.422 0.000 0.284) 1.450 11.033 ( -12.685 0.000 -4.861) 13.584 11.745 ( 0.073 0.000 -2.318) 2.319 12.242 ( -5.856 0.000 0.627) 5.890 13.223 ( 15.850 0.000 1.849) 15.957 14.855 ( -3.079 0.000 2.477) 3.952 15.366 ( 1.486 0.000 -2.024) 2.511 19.863 ( -1.396 0.000 1.781) 2.263 20.279 ( -2.427 0.000 -0.293) 2.445 20.664 ( 3.056 0.000 0.103) 3.058 20.992 ( -8.775 0.000 0.885) 8.819 22.099 ( -11.130 0.000 -7.721) 13.546 22.196 ( 4.826 0.000 -3.040) 5.704 107.904 ( 1.067 0.000 0.780) 1.322 107.988 ( -0.663 0.000 0.758) 1.007 108.552 ( 0.285 0.000 1.115) 1.151 108.694 ( 3.152 0.000 -0.737) 3.237 ======================= Grid point 359 (170/259) ======================= q-point: (-0.11 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.048 ( -28.311 0.000 9.347) 29.814 1.425 ( -10.158 0.000 18.920) 21.474 2.136 ( 3.033 0.000 27.714) 27.880 2.775 ( -8.236 0.000 -7.877) 11.397 3.045 ( 2.102 0.000 -9.986) 10.205 3.443 ( 0.939 0.000 -1.798) 2.028 4.207 ( -0.622 0.000 0.302) 0.691 4.478 ( 1.893 0.000 -1.043) 2.162 4.480 ( -0.458 0.000 -1.576) 1.641 4.967 ( 3.337 0.000 6.275) 7.107 5.111 ( 6.906 0.000 -2.003) 7.191 6.249 ( 20.346 0.000 -3.703) 20.680 7.963 ( 2.652 0.000 0.992) 2.832 8.084 ( 1.443 0.000 -0.342) 1.483 8.637 ( -25.609 0.000 -6.686) 26.467 9.035 ( 10.647 0.000 1.084) 10.702 9.529 ( -9.638 0.000 0.244) 9.641 9.579 ( 1.566 0.000 4.065) 4.357 9.981 ( -0.124 0.000 -0.379) 0.399 10.710 ( -6.461 0.000 -0.762) 6.505 10.947 ( 2.851 0.000 -1.079) 3.048 11.678 ( -5.101 0.000 -1.747) 5.392 12.172 ( -2.659 0.000 0.777) 2.770 13.511 ( 13.072 0.000 0.131) 13.073 14.831 ( -1.618 0.000 2.520) 2.995 15.365 ( 0.217 0.000 -2.168) 2.178 19.855 ( -0.978 0.000 1.118) 1.485 20.245 ( -0.988 0.000 -0.499) 1.107 20.707 ( 1.503 0.000 0.309) 1.534 20.828 ( -8.846 0.000 2.466) 9.183 21.869 ( -7.822 0.000 -1.775) 8.021 22.262 ( 3.236 0.000 -2.082) 3.847 107.930 ( 1.131 0.000 0.417) 1.206 107.984 ( -0.366 0.000 0.665) 0.759 108.567 ( 0.214 0.000 1.507) 1.522 108.720 ( 0.718 0.000 -2.478) 2.580 ======================= Grid point 360 (171/259) ======================= q-point: ( 0.00 0.08 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.039 ( 1.851 18.076 5.495) 18.983 1.661 ( 1.733 14.069 18.656) 23.430 2.389 ( 2.188 0.661 13.010) 13.210 2.684 ( 0.183 3.296 -5.256) 6.207 3.144 ( 0.271 12.902 -5.285) 13.945 3.423 ( -4.213 4.474 -2.313) 6.567 4.287 ( -1.231 8.256 0.344) 8.354 4.488 ( 0.776 1.168 -1.511) 2.062 4.532 ( 1.548 3.454 -1.587) 4.105 4.976 ( -2.920 -3.098 5.134) 6.669 5.166 ( 5.515 -4.213 -2.850) 7.502 5.971 ( -3.549 -29.759 -3.063) 30.126 7.993 ( -0.882 -0.069 0.652) 1.100 8.307 ( -1.825 -1.007 -0.736) 2.211 8.475 ( -0.060 22.888 -3.540) 23.160 9.159 ( 4.277 -17.233 0.393) 17.760 9.276 ( -1.389 12.332 -0.519) 12.421 9.803 ( 2.107 1.386 0.318) 2.543 9.973 ( 3.434 3.286 0.421) 4.772 10.615 ( -1.699 -2.094 -0.487) 2.740 10.965 ( 0.689 -1.704 -0.060) 1.839 11.521 ( -3.750 -4.870 1.508) 6.329 12.162 ( 0.993 0.076 0.250) 1.027 13.353 ( 0.459 -18.031 3.003) 18.285 15.056 ( -0.261 13.265 -7.843) 15.413 15.928 ( -0.443 51.950 -2.865) 52.031 19.651 ( 0.179 -17.973 2.612) 18.163 19.824 ( -0.516 -28.499 -3.767) 28.751 20.739 ( 0.633 4.785 3.782) 6.132 21.198 ( 5.210 23.392 0.727) 23.976 21.834 ( -4.786 4.938 0.159) 6.878 22.293 ( 0.130 2.161 -0.950) 2.364 107.935 ( 0.064 -0.843 0.147) 0.859 107.979 ( 0.373 -0.916 0.322) 1.041 108.566 ( -0.223 -1.435 1.676) 2.218 108.649 ( -1.975 -3.323 -0.711) 3.930 ======================= Grid point 361 (172/259) ======================= q-point: ( 0.11 0.08 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( 21.124 9.226 3.389) 23.298 1.902 ( 11.197 16.751 12.372) 23.644 2.442 ( -2.956 -6.475 1.824) 7.348 2.713 ( 6.332 2.838 -3.702) 7.865 3.119 ( -0.973 15.455 -0.624) 15.498 3.303 ( -6.849 6.007 0.151) 9.111 4.262 ( -1.948 7.897 0.868) 8.180 4.485 ( -0.031 0.100 -1.631) 1.634 4.553 ( 2.210 3.931 -1.654) 4.803 4.926 ( -5.786 -2.315 3.890) 7.346 5.208 ( 1.456 -5.539 -4.613) 7.354 5.815 ( -10.772 -21.704 1.333) 24.267 7.949 ( -3.260 -0.691 0.763) 3.418 8.189 ( -7.385 4.256 -0.024) 8.523 8.590 ( 9.594 0.939 -0.601) 9.658 9.187 ( -4.506 17.038 -1.112) 17.659 9.353 ( 13.171 -12.460 -1.411) 18.186 9.829 ( 0.556 -3.978 -1.115) 4.168 10.025 ( 1.540 6.919 -3.598) 7.949 10.649 ( 6.921 -1.767 0.937) 7.204 10.898 ( -6.449 -1.713 -0.026) 6.673 11.553 ( 3.596 -3.680 3.431) 6.184 12.204 ( 3.790 -0.350 -0.693) 3.869 13.312 ( -6.595 -14.264 1.367) 15.774 15.015 ( 0.997 11.249 -4.044) 11.996 15.842 ( -6.884 46.690 -0.216) 47.195 19.686 ( 1.641 -16.812 2.277) 17.045 19.833 ( 4.006 -29.737 -3.629) 30.225 20.760 ( -0.701 4.977 1.831) 5.349 21.299 ( 6.445 23.805 -4.390) 25.050 21.831 ( 2.543 1.894 4.365) 5.395 22.271 ( -1.383 4.309 -1.094) 4.656 107.929 ( -0.644 -0.785 0.021) 1.016 107.989 ( 0.584 -0.960 -0.062) 1.125 108.566 ( -1.144 -1.515 1.415) 2.368 108.609 ( -2.205 -2.288 1.097) 3.361 ======================= Grid point 362 (173/259) ======================= q-point: ( 0.22 0.08 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.736 ( 21.119 1.938 2.180) 21.319 2.184 ( 10.226 16.266 -0.563) 19.222 2.363 ( -2.408 -7.962 3.421) 8.994 2.841 ( 9.700 2.935 -1.545) 10.251 3.061 ( -3.523 17.894 -3.858) 18.641 3.236 ( -2.697 4.325 6.663) 8.389 4.236 ( -1.737 7.309 1.493) 7.659 4.463 ( -0.986 -0.984 -1.476) 2.030 4.584 ( 2.509 4.791 -1.667) 5.660 4.845 ( -5.561 -1.671 2.616) 6.369 5.123 ( -5.912 -5.960 -7.856) 11.497 5.655 ( -9.236 -12.116 4.614) 15.918 7.912 ( -1.383 -0.765 0.506) 1.659 8.065 ( -5.953 -0.540 -0.410) 5.992 8.705 ( 0.931 -6.989 0.485) 7.067 9.144 ( 2.395 13.231 0.013) 13.446 9.559 ( 9.383 -5.507 -2.889) 11.257 9.800 ( -2.313 -2.807 -1.545) 3.951 9.963 ( -3.747 1.353 -2.737) 4.833 10.797 ( -4.267 -1.292 1.182) 4.613 10.883 ( 16.737 -1.735 0.288) 16.830 11.639 ( 2.292 0.797 3.512) 4.269 12.283 ( 5.667 -1.822 -1.505) 6.140 13.157 ( -10.215 -8.180 -0.229) 13.088 15.035 ( 3.021 9.577 -0.632) 10.062 15.701 ( -8.543 38.910 0.759) 39.844 19.734 ( 1.950 -16.031 0.880) 16.174 19.897 ( 5.454 -30.436 -2.519) 31.023 20.740 ( -2.191 5.780 -0.077) 6.182 21.344 ( 3.304 15.143 -6.517) 16.813 21.961 ( 4.338 3.592 7.828) 9.643 22.255 ( 2.719 10.372 -2.538) 11.019 107.915 ( -0.839 -0.691 -0.183) 1.103 107.997 ( 0.332 -0.947 -0.106) 1.009 108.548 ( -1.593 -1.290 0.925) 2.249 108.589 ( -1.739 -1.737 2.331) 3.387 ======================= Grid point 363 (174/259) ======================= q-point: ( 0.33 0.08 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.893 ( -5.279 4.044 -4.587) 8.079 2.308 ( 16.449 2.464 -6.724) 17.940 2.478 ( -0.636 1.433 13.372) 13.463 2.894 ( -7.000 15.834 1.703) 17.396 3.113 ( 14.668 3.504 -4.247) 15.668 3.316 ( 8.292 4.083 5.735) 10.877 4.224 ( -1.285 5.038 2.077) 5.599 4.435 ( -1.014 -0.301 -0.639) 1.236 4.612 ( 1.699 6.111 -1.564) 6.533 4.763 ( -6.502 -2.514 0.557) 6.993 4.900 ( -9.252 -2.316 -9.190) 13.245 5.537 ( -7.683 -7.451 3.453) 11.246 7.901 ( -0.253 1.007 -0.135) 1.047 7.977 ( -3.193 -3.672 -0.816) 4.934 8.645 ( -5.479 -2.967 0.176) 6.233 9.256 ( 7.606 1.988 0.444) 7.874 9.566 ( -4.511 0.118 -4.100) 6.097 9.800 ( 3.443 -3.434 -0.163) 4.865 9.899 ( -2.044 -5.896 -0.634) 6.272 10.761 ( -1.669 -0.157 2.731) 3.205 11.180 ( 13.938 -3.193 0.295) 14.302 11.693 ( 1.596 7.616 2.553) 8.190 12.378 ( 6.433 -3.668 -1.651) 7.587 12.970 ( -9.497 -3.891 -1.156) 10.329 15.106 ( 4.508 9.997 1.225) 11.034 15.557 ( -7.671 30.909 0.216) 31.847 19.760 ( 0.723 -15.499 -0.462) 15.523 19.985 ( 5.540 -30.394 -0.948) 30.910 20.685 ( -3.235 6.608 -1.154) 7.448 21.335 ( 1.097 7.258 -5.405) 9.116 22.018 ( -2.885 3.585 5.175) 6.925 22.385 ( 11.644 17.107 -0.479) 20.699 107.898 ( -0.791 -0.580 -0.323) 1.032 108.000 ( 0.014 -0.920 0.036) 0.921 108.530 ( -1.055 -1.020 0.962) 1.755 108.576 ( -1.563 -1.454 2.184) 3.053 ======================= Grid point 364 (175/259) ======================= q-point: (-0.56 0.08 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.694 ( -10.493 8.570 -2.810) 13.836 2.389 ( -10.158 -1.146 6.462) 12.094 2.644 ( 15.854 7.794 -2.296) 17.815 2.765 ( -9.117 15.528 6.129) 19.022 3.280 ( 6.081 -4.472 -2.182) 7.858 3.666 ( 22.953 4.636 4.520) 23.849 4.200 ( -4.428 -2.494 1.403) 5.273 4.404 ( -5.537 4.069 -0.575) 6.895 4.512 ( -9.748 1.779 -7.213) 12.256 4.625 ( 0.055 6.168 -0.934) 6.239 4.804 ( 0.937 -0.612 -2.491) 2.731 5.434 ( -5.418 -5.001 1.804) 7.591 7.890 ( -0.954 1.684 -0.509) 2.001 7.940 ( 0.066 -3.590 -1.340) 3.832 8.567 ( -2.742 -2.078 0.465) 3.472 9.369 ( 4.006 -1.966 -0.178) 4.466 9.458 ( -2.875 0.463 -2.711) 3.978 9.854 ( 2.046 -5.452 -0.144) 5.825 9.869 ( -1.169 -7.666 -0.069) 7.755 10.766 ( -0.378 -0.609 2.864) 2.952 11.353 ( 4.692 -3.300 1.483) 5.925 11.733 ( 1.294 12.419 0.201) 12.488 12.505 ( 8.407 -5.474 -0.221) 10.035 12.800 ( -8.091 -1.865 -2.193) 8.588 15.208 ( 5.233 14.772 2.022) 15.802 15.434 ( -5.546 22.419 -0.861) 23.111 19.755 ( -0.831 -15.152 -0.413) 15.181 20.072 ( 4.666 -30.082 -0.978) 30.457 20.617 ( -3.131 7.340 -0.845) 8.025 21.304 ( -1.140 3.167 -3.003) 4.511 21.998 ( -0.980 5.931 1.617) 6.225 22.582 ( 8.961 17.691 -0.267) 19.833 107.883 ( -0.557 -0.475 -0.246) 0.773 107.998 ( -0.298 -0.898 0.248) 0.978 108.524 ( -0.511 -0.901 0.930) 1.392 108.569 ( -0.778 -1.294 1.814) 2.360 ======================= Grid point 365 (176/259) ======================= q-point: (-0.44 0.08 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.521 ( -8.762 11.275 4.812) 15.068 2.169 ( -19.410 2.126 8.888) 21.454 2.671 ( -8.302 12.702 9.554) 17.932 2.896 ( 14.708 8.925 -6.348) 18.338 3.309 ( -0.320 -2.805 -3.632) 4.601 3.929 ( -20.932 -3.834 -6.858) 22.358 4.107 ( 20.006 0.097 5.351) 20.709 4.294 ( -0.176 3.522 1.304) 3.760 4.462 ( 0.986 7.043 -2.426) 7.514 4.625 ( 0.448 6.034 -0.900) 6.118 4.822 ( 2.714 -1.375 -2.513) 3.946 5.401 ( 0.537 -4.059 3.258) 5.233 7.866 ( -0.862 0.491 -0.204) 1.013 7.953 ( 2.229 -1.967 -1.434) 3.300 8.563 ( 1.677 -2.180 0.784) 2.860 9.372 ( -2.638 -0.492 -0.899) 2.831 9.458 ( 4.247 -1.149 -2.011) 4.837 9.845 ( -1.943 -5.791 0.159) 6.111 9.874 ( 0.685 -7.808 -0.225) 7.841 10.784 ( 0.188 -1.465 1.994) 2.481 11.382 ( -2.546 -4.054 0.526) 4.816 11.746 ( 0.863 12.259 -0.373) 12.295 12.564 ( -6.878 -5.979 -2.618) 9.482 12.732 ( 6.863 -1.018 0.282) 6.944 15.290 ( 0.297 30.275 -0.956) 30.292 15.381 ( 2.829 8.280 0.915) 8.797 19.728 ( -2.114 -15.093 0.470) 15.247 20.127 ( 2.709 -29.438 -2.909) 29.705 20.573 ( -1.520 7.316 0.976) 7.535 21.248 ( -3.533 3.087 -0.460) 4.714 22.025 ( 3.449 5.699 -0.186) 6.664 22.669 ( 1.838 17.211 -3.953) 17.755 107.876 ( -0.159 -0.413 0.095) 0.453 107.993 ( -0.544 -0.879 0.474) 1.137 108.525 ( -0.143 -0.890 0.853) 1.241 108.579 ( 0.572 -1.479 1.543) 2.212 ======================= Grid point 366 (177/259) ======================= q-point: (-0.33 0.08 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.470 ( -4.669 9.445 13.595) 17.200 1.858 ( -23.050 3.435 11.796) 26.120 2.542 ( -16.805 15.346 11.874) 25.669 3.065 ( 9.425 7.020 -8.226) 14.345 3.234 ( -2.721 1.550 -7.486) 8.115 3.540 ( -13.418 -0.217 -5.497) 14.502 4.286 ( 1.355 0.750 0.559) 1.647 4.464 ( 1.946 6.576 -2.516) 7.305 4.502 ( 13.675 0.722 7.825) 15.772 4.608 ( -1.471 4.891 -1.766) 5.405 4.869 ( 5.379 -1.538 -3.407) 6.550 5.513 ( 7.521 -6.420 5.958) 11.545 7.869 ( 1.220 0.316 0.560) 1.380 7.994 ( 3.410 -1.236 -1.157) 3.807 8.632 ( 4.918 -3.644 0.924) 6.191 9.283 ( -5.957 -0.634 -0.604) 6.021 9.549 ( 6.893 2.718 -3.619) 8.246 9.791 ( -4.009 -3.203 0.209) 5.135 9.886 ( 0.931 -8.002 -0.061) 8.056 10.798 ( 0.087 -1.714 0.996) 1.984 11.249 ( -11.507 -5.549 -2.573) 13.031 11.765 ( 0.730 6.942 -0.210) 6.984 12.376 ( -9.113 -1.883 -2.376) 9.605 12.899 ( 9.119 -4.703 1.755) 10.409 15.243 ( -0.947 22.355 -5.243) 22.981 15.514 ( 8.464 23.198 2.581) 24.829 19.690 ( -2.815 -15.532 1.494) 15.856 20.119 ( 0.032 -27.679 -5.716) 28.263 20.581 ( 0.510 5.551 3.251) 6.454 21.180 ( -4.284 5.318 1.871) 7.080 22.110 ( 5.887 3.810 -0.891) 7.069 22.575 ( -7.062 16.927 -8.670) 20.287 107.880 ( 0.398 -0.438 0.552) 0.810 107.987 ( -0.672 -0.866 0.661) 1.280 108.531 ( 0.108 -0.954 0.839) 1.275 108.613 ( 1.925 -2.219 1.077) 3.129 ======================= Grid point 367 (178/259) ======================= q-point: (-0.22 0.08 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( -14.854 8.857 12.111) 21.113 1.559 ( -13.777 1.648 19.428) 23.875 2.285 ( -18.133 20.659 14.173) 30.927 3.004 ( -8.396 -1.876 -9.125) 12.541 3.182 ( 4.791 11.523 -9.037) 15.408 3.430 ( 1.697 2.272 -1.503) 3.209 4.302 ( 0.450 4.977 -0.197) 5.002 4.482 ( 2.297 4.921 -2.675) 6.054 4.549 ( -2.600 3.506 -1.263) 4.544 4.774 ( 8.938 -1.965 7.689) 11.953 4.963 ( 7.407 -2.447 -3.157) 8.416 5.730 ( 11.279 -12.878 4.411) 17.678 7.913 ( 2.667 0.609 0.655) 2.813 8.070 ( 6.285 1.221 -0.693) 6.440 8.716 ( 1.998 -8.589 0.337) 8.824 9.190 ( -2.085 5.713 -1.311) 6.222 9.535 ( -8.028 1.420 -4.056) 9.105 9.761 ( 1.663 3.685 -0.096) 4.044 9.905 ( 0.999 -5.943 0.366) 6.037 10.794 ( -2.242 -2.318 0.734) 3.307 10.977 ( -12.357 -5.207 -3.418) 13.838 11.741 ( -3.194 1.102 -1.036) 3.534 12.236 ( -5.566 -0.517 0.113) 5.591 13.082 ( 9.180 -9.642 2.939) 13.634 15.188 ( 0.273 17.736 -8.022) 19.468 15.704 ( 10.897 38.651 0.454) 40.160 19.655 ( -2.480 -16.654 2.294) 16.993 20.043 ( -2.983 -27.104 -7.358) 28.243 20.629 ( 1.231 4.408 4.601) 6.489 21.132 ( -3.242 9.180 3.835) 10.464 22.207 ( 5.347 2.298 -1.148) 5.932 22.305 ( -13.855 16.357 -9.479) 23.438 107.898 ( 0.975 -0.580 0.739) 1.354 107.980 ( -0.662 -0.861 0.755) 1.323 108.541 ( 0.246 -1.084 0.984) 1.485 108.656 ( 2.152 -3.374 -0.093) 4.003 ======================= Grid point 368 (179/259) ======================= q-point: (-0.11 0.08 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.177 ( -20.162 12.925 8.263) 25.335 1.569 ( -7.473 10.100 21.169) 24.617 2.237 ( -1.408 11.802 18.065) 21.624 2.791 ( -6.748 1.783 -6.954) 9.852 3.180 ( 2.253 11.717 -8.827) 14.842 3.463 ( 1.287 2.808 -1.488) 3.428 4.301 ( -0.327 7.844 -0.259) 7.855 4.491 ( 0.707 2.181 -2.674) 3.523 4.520 ( 0.466 3.481 -0.648) 3.572 4.935 ( 2.997 -3.148 6.288) 7.645 5.073 ( 6.842 -3.566 -2.558) 8.129 5.938 ( 8.663 -24.117 -1.093) 25.650 7.965 ( 2.617 0.293 0.315) 2.653 8.209 ( 9.044 6.431 -0.876) 11.132 8.647 ( -8.541 -3.009 -3.332) 9.649 9.194 ( -0.061 17.834 -2.932) 18.073 9.300 ( -9.253 -11.525 1.258) 14.834 9.780 ( -0.229 7.273 1.191) 7.374 9.929 ( 1.183 -2.712 0.889) 3.089 10.687 ( -6.098 -2.338 -0.544) 6.554 10.907 ( 3.254 -3.639 -0.346) 4.894 11.636 ( -7.260 -2.624 -0.542) 7.739 12.169 ( -2.322 -0.123 0.710) 2.431 13.258 ( 6.777 -15.967 3.631) 17.721 15.126 ( 0.087 15.038 -9.360) 17.713 15.879 ( 8.315 49.947 -3.056) 50.727 19.640 ( -1.174 -18.095 2.596) 18.318 19.914 ( -4.786 -27.705 -5.897) 28.727 20.688 ( 1.177 4.789 4.898) 6.950 21.130 ( 0.049 16.005 4.020) 16.502 22.003 ( -11.992 12.392 -4.696) 17.872 22.274 ( 2.960 1.599 -1.211) 3.576 107.922 ( 1.034 -0.773 0.433) 1.362 107.975 ( -0.393 -0.866 0.700) 1.181 108.554 ( 0.181 -1.259 1.315) 1.830 108.675 ( 0.244 -3.975 -1.229) 4.168 ======================= Grid point 369 (180/259) ======================= q-point: ( 0.00 0.15 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.480 ( -0.147 24.637 3.929) 24.949 1.858 ( 1.801 4.219 21.444) 21.929 2.544 ( 0.165 14.084 -4.949) 14.929 2.783 ( 0.279 6.467 -4.295) 7.768 3.390 ( -1.633 11.231 3.044) 11.751 3.619 ( 0.010 14.843 -5.368) 15.784 4.472 ( 0.156 7.912 2.025) 8.169 4.532 ( -1.137 3.942 -2.667) 4.894 4.632 ( 1.489 6.684 -2.803) 7.400 4.888 ( -1.868 -5.302 4.249) 7.047 5.054 ( 3.765 -6.306 -2.636) 7.803 5.443 ( -2.673 -21.416 -0.354) 21.585 7.974 ( -0.988 -2.323 -0.385) 2.554 8.254 ( -0.560 -5.331 -0.212) 5.364 8.729 ( -6.759 5.034 -1.045) 8.492 8.824 ( 7.188 -13.782 -0.001) 15.544 9.659 ( 2.408 12.809 -0.998) 13.071 9.709 ( -2.296 0.225 -1.915) 2.998 10.102 ( 4.737 6.173 1.536) 7.931 10.543 ( -1.612 -5.385 -0.096) 5.622 10.966 ( 2.610 3.498 -0.582) 4.403 11.452 ( -4.736 -1.304 1.591) 5.164 12.161 ( 0.759 -0.207 0.016) 0.787 13.051 ( 0.880 -12.257 1.974) 12.446 15.329 ( -0.247 14.041 -8.103) 16.213 17.032 ( 0.119 51.920 -8.270) 52.575 19.149 ( -0.780 -28.731 -1.094) 28.762 19.335 ( 0.708 -20.948 -0.279) 20.961 20.809 ( 1.139 1.937 1.086) 2.495 21.572 ( 7.747 13.562 6.065) 16.754 22.003 ( -9.338 10.659 -4.862) 14.982 22.385 ( 0.998 7.964 0.256) 8.030 107.911 ( 0.079 -1.576 0.144) 1.585 107.953 ( 0.191 -1.673 0.496) 1.755 108.529 ( -0.160 -2.032 1.115) 2.323 108.573 ( -1.319 -3.893 0.343) 4.125 ======================= Grid point 370 (181/259) ======================= q-point: ( 0.11 0.15 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.593 ( 9.189 18.273 4.650) 20.975 2.093 ( 6.030 -0.389 17.516) 18.529 2.498 ( 1.582 12.894 -10.734) 16.851 2.803 ( 5.157 5.954 -3.748) 8.723 3.391 ( -2.847 12.710 7.552) 15.056 3.555 ( -1.819 17.459 -6.339) 18.663 4.457 ( -2.473 10.359 1.121) 10.709 4.500 ( -1.350 1.474 -1.724) 2.639 4.647 ( 2.321 5.008 -1.891) 5.834 4.857 ( -4.413 -4.433 3.379) 7.109 5.063 ( -0.212 -7.836 -4.153) 8.871 5.404 ( -1.977 -17.345 1.964) 17.567 7.923 ( -3.110 -3.186 0.332) 4.465 8.231 ( -7.728 0.899 0.894) 7.831 8.507 ( -2.112 -7.375 -0.409) 7.683 9.130 ( 13.873 -8.559 -0.649) 16.314 9.614 ( -2.477 20.065 -2.398) 20.359 9.679 ( -1.356 -8.591 0.217) 8.700 10.165 ( 0.159 5.443 -2.657) 6.059 10.591 ( 7.419 -4.099 0.796) 8.514 10.865 ( -8.822 -0.803 -0.928) 8.907 11.537 ( 8.800 3.163 3.411) 9.954 12.189 ( 2.411 -1.248 -0.576) 2.775 13.051 ( -2.057 -11.414 0.548) 11.611 15.279 ( 0.470 14.479 -4.850) 15.277 16.869 ( -11.929 50.350 -3.107) 51.837 19.158 ( 2.055 -30.893 -0.110) 30.961 19.365 ( 2.973 -19.180 -1.486) 19.466 20.825 ( 0.202 1.205 -0.257) 1.249 21.692 ( 0.748 13.949 -4.655) 14.724 21.916 ( 1.815 6.779 6.558) 9.605 22.425 ( 4.371 11.406 -1.013) 12.257 107.906 ( -0.511 -1.490 0.009) 1.576 107.962 ( 0.455 -1.769 0.173) 1.835 108.529 ( -0.867 -2.077 0.910) 2.428 108.553 ( -1.248 -3.041 1.176) 3.491 ======================= Grid point 371 (182/259) ======================= q-point: ( 0.22 0.15 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.857 ( 14.040 9.235 5.062) 17.551 2.234 ( 2.137 -3.543 -1.225) 4.315 2.508 ( 3.105 13.804 3.843) 14.661 2.908 ( 9.117 3.315 -2.995) 10.153 3.393 ( -3.617 14.359 6.404) 16.133 3.476 ( -0.394 19.781 -5.407) 20.511 4.393 ( -5.814 5.169 0.436) 7.792 4.476 ( 0.256 4.429 0.152) 4.440 4.681 ( 2.528 2.873 -1.618) 4.155 4.796 ( -4.346 -1.985 2.291) 5.299 4.990 ( -3.483 -5.632 -5.585) 8.663 5.388 ( -2.281 -13.128 2.577) 13.571 7.897 ( -0.014 -3.404 0.349) 3.422 8.039 ( -10.717 0.816 1.319) 10.829 8.575 ( 4.919 -6.169 -0.643) 7.916 9.212 ( -1.501 -5.758 -1.353) 6.103 9.632 ( -1.044 1.214 -0.118) 1.605 9.653 ( 4.010 0.890 -0.855) 4.196 10.041 ( -10.368 4.729 -2.465) 11.659 10.743 ( -0.233 -4.858 -0.238) 4.870 10.817 ( 12.426 -4.021 0.618) 13.075 11.732 ( 9.429 8.694 3.010) 13.174 12.233 ( 2.929 -3.277 -0.818) 4.471 12.987 ( -4.797 -8.277 -0.761) 9.597 15.283 ( 2.510 14.474 -0.865) 14.715 16.599 ( -15.721 45.992 -0.696) 48.610 19.213 ( 3.569 -32.945 0.711) 33.146 19.406 ( 3.028 -18.451 -2.447) 18.857 20.811 ( -0.901 1.164 -1.549) 2.137 21.595 ( -3.825 9.921 -7.389) 12.948 22.049 ( 2.414 5.430 9.932) 11.574 22.553 ( 11.153 17.630 -1.669) 20.928 107.895 ( -0.678 -1.315 -0.157) 1.488 107.970 ( 0.294 -1.778 0.057) 1.803 108.515 ( -1.098 -1.819 0.726) 2.246 108.545 ( -1.024 -2.465 1.666) 3.146 ======================= Grid point 372 (183/259) ======================= q-point: ( 0.33 0.15 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.003 ( -1.281 6.402 -1.551) 6.711 2.355 ( 13.469 3.993 -1.394) 14.117 2.585 ( 0.742 7.045 8.921) 11.392 3.053 ( 7.439 -2.422 -0.255) 7.828 3.289 ( -9.340 17.328 0.525) 19.692 3.569 ( 11.991 18.994 0.367) 22.466 4.264 ( -8.270 -1.878 -0.322) 8.487 4.509 ( 2.177 7.187 2.001) 7.772 4.666 ( -5.058 -4.939 -1.116) 7.157 4.763 ( 1.031 6.902 -0.728) 7.017 4.874 ( -3.649 0.366 -5.639) 6.727 5.352 ( -3.214 -10.109 1.275) 10.684 7.872 ( -4.550 -6.159 -0.443) 7.670 7.952 ( 1.290 4.046 1.453) 4.488 8.588 ( -2.560 -2.433 -1.372) 3.789 9.202 ( 2.708 -7.614 -1.008) 8.144 9.552 ( -5.954 -4.703 -0.476) 7.603 9.730 ( 2.051 1.768 -0.302) 2.725 9.843 ( -7.645 -0.739 -1.162) 7.768 10.740 ( -0.173 -2.323 1.189) 2.615 11.081 ( 13.506 -6.117 0.672) 14.842 11.912 ( 8.277 13.091 1.618) 15.572 12.279 ( 2.689 -6.391 -0.277) 6.939 12.879 ( -6.002 -4.655 -1.228) 7.694 15.358 ( 5.185 14.753 2.201) 15.792 16.315 ( -14.332 40.555 -1.677) 43.046 19.290 ( 4.184 -34.651 0.863) 34.913 19.431 ( 1.681 -18.180 -2.398) 18.415 20.774 ( -1.543 2.102 -2.115) 3.358 21.473 ( -4.127 6.359 -5.245) 9.218 22.128 ( -0.002 7.537 6.593) 10.014 22.773 ( 12.723 19.648 -0.128) 23.408 107.881 ( -0.630 -1.104 -0.268) 1.300 107.973 ( 0.023 -1.740 0.112) 1.744 108.504 ( -0.716 -1.503 0.751) 1.826 108.539 ( -0.959 -2.101 1.540) 2.776 ======================= Grid point 373 (184/259) ======================= q-point: (-0.56 0.15 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.918 ( -5.380 12.862 -1.138) 13.988 2.411 ( -9.666 3.422 9.432) 13.932 2.810 ( 18.808 7.475 -4.440) 20.720 3.102 ( -8.997 10.894 1.071) 14.169 3.187 ( 4.216 2.074 4.496) 6.503 3.849 ( 16.757 13.621 1.026) 21.619 4.091 ( -10.836 -7.418 -0.578) 13.144 4.503 ( -9.141 0.362 -3.374) 9.751 4.569 ( 1.885 8.209 2.541) 8.797 4.787 ( 2.296 5.414 -2.912) 6.562 4.802 ( -0.654 4.102 -3.042) 5.148 5.305 ( -2.169 -7.341 0.185) 7.657 7.806 ( -2.468 -5.910 0.412) 6.418 7.999 ( 2.444 6.060 -0.767) 6.579 8.520 ( -2.403 -2.256 -0.973) 3.436 9.254 ( 2.107 -10.008 -0.229) 10.230 9.453 ( -2.767 -1.319 -0.969) 3.215 9.714 ( -1.667 -6.947 -0.414) 7.157 9.780 ( -0.905 -0.336 -0.020) 0.965 10.744 ( -0.442 -1.992 1.354) 2.449 11.266 ( 5.452 -5.016 1.283) 7.519 12.031 ( 3.556 15.844 -0.213) 16.240 12.337 ( 3.515 -11.296 0.973) 11.870 12.769 ( -4.468 -0.932 -1.380) 4.768 15.495 ( 7.106 15.429 3.698) 17.384 16.077 ( -9.059 36.314 -3.547) 37.594 19.367 ( 3.646 -34.518 -0.152) 34.710 19.431 ( 0.180 -19.351 -1.676) 19.424 20.731 ( -1.495 3.669 -1.762) 4.336 21.376 ( -3.256 3.988 -2.257) 5.621 22.165 ( 0.297 10.479 3.098) 10.931 22.966 ( 8.024 18.835 -0.224) 20.474 107.869 ( -0.430 -0.913 -0.210) 1.031 107.972 ( -0.262 -1.689 0.259) 1.729 108.500 ( -0.344 -1.350 0.712) 1.564 108.536 ( -0.517 -1.891 1.311) 2.359 ======================= Grid point 374 (185/259) ======================= q-point: (-0.44 0.15 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.809 ( -7.629 16.323 3.805) 18.415 2.242 ( -17.014 5.325 10.899) 20.895 2.950 ( -3.234 9.337 -1.090) 9.941 3.074 ( 8.998 10.262 -5.122) 14.578 3.316 ( 5.944 4.812 3.751) 8.518 3.847 ( -14.676 -4.070 -1.796) 15.336 4.137 ( 12.294 4.010 0.306) 12.935 4.374 ( -0.988 4.075 0.394) 4.212 4.603 ( 0.180 6.782 1.346) 6.917 4.794 ( 0.888 8.468 -1.929) 8.730 4.798 ( 2.455 0.551 -3.927) 4.664 5.294 ( 0.956 -6.207 0.613) 6.310 7.787 ( -0.227 -5.768 0.971) 5.854 8.019 ( 1.267 6.783 -1.828) 7.138 8.509 ( 1.395 -2.905 -0.150) 3.226 9.265 ( -0.832 -10.544 -0.642) 10.597 9.454 ( 3.870 0.417 -0.988) 4.016 9.702 ( 0.758 -8.725 -0.085) 8.758 9.771 ( -0.365 0.179 0.426) 0.589 10.746 ( -0.492 -2.633 1.275) 2.966 11.282 ( -4.643 -5.668 0.692) 7.359 12.037 ( -1.931 15.492 -0.560) 15.622 12.372 ( -1.504 -12.725 -0.165) 12.815 12.736 ( 2.400 1.202 -0.397) 2.714 15.611 ( 1.439 14.409 0.166) 14.481 16.002 ( 5.714 36.947 -1.664) 37.423 19.392 ( -1.036 -19.981 -0.675) 20.020 19.434 ( 2.168 -34.272 -2.293) 34.416 20.700 ( -0.752 4.817 -0.589) 4.911 21.323 ( -2.012 4.202 0.493) 4.684 22.193 ( 1.357 10.878 0.956) 11.004 23.035 ( 0.474 17.638 -2.845) 17.872 107.864 ( -0.104 -0.807 0.053) 0.815 107.968 ( -0.498 -1.642 0.440) 1.771 108.502 ( -0.097 -1.340 0.636) 1.487 108.542 ( 0.209 -2.073 1.146) 2.378 ======================= Grid point 375 (186/259) ======================= q-point: (-0.33 0.15 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.714 ( -8.090 14.106 9.654) 18.912 1.985 ( -19.767 9.318 10.977) 24.455 2.885 ( -6.099 15.121 3.344) 16.644 3.104 ( -1.104 0.521 -5.352) 5.489 3.415 ( 4.201 11.757 -7.084) 14.355 3.608 ( -7.589 9.131 0.971) 11.913 4.256 ( 4.372 -2.938 -0.938) 5.350 4.502 ( 8.543 0.745 3.873) 9.409 4.615 ( 0.825 6.156 2.339) 6.636 4.763 ( -1.158 8.947 -4.421) 10.047 4.844 ( 4.623 0.056 -2.832) 5.421 5.349 ( 3.845 -9.206 1.743) 10.128 7.816 ( 2.517 -4.990 1.486) 5.784 8.034 ( 2.448 5.092 -1.872) 5.952 8.551 ( 2.265 -4.021 0.454) 4.637 9.203 ( -3.995 -8.233 -1.076) 9.214 9.576 ( 8.667 -3.068 -1.509) 9.317 9.730 ( -0.000 0.683 -0.342) 0.764 9.786 ( 4.260 -0.694 1.150) 4.467 10.742 ( -1.150 -3.947 1.140) 4.266 11.114 ( -13.361 -7.435 -0.616) 15.303 11.964 ( -5.699 11.982 -0.542) 13.279 12.299 ( -4.601 -6.347 -1.278) 7.943 12.820 ( 5.276 -2.656 0.954) 5.983 15.559 ( -2.510 14.265 -5.672) 15.555 16.246 ( 19.115 39.905 0.578) 44.251 19.350 ( -2.882 -17.965 -0.221) 18.196 19.441 ( 0.988 -35.786 -4.391) 36.067 20.699 ( 0.525 4.910 0.822) 5.006 21.308 ( -1.234 6.911 3.061) 7.659 22.231 ( 2.405 8.371 -0.146) 8.711 22.932 ( -8.112 17.117 -6.319) 19.968 107.867 ( 0.329 -0.855 0.408) 1.003 107.961 ( -0.632 -1.610 0.604) 1.832 108.506 ( 0.067 -1.439 0.598) 1.560 108.560 ( 0.794 -2.793 0.950) 3.056 ======================= Grid point 376 (187/259) ======================= q-point: (-0.22 0.15 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.657 ( -11.433 8.271 16.373) 21.614 1.744 ( -11.932 15.316 8.202) 21.076 2.748 ( -11.714 22.193 4.994) 25.586 2.986 ( -5.687 0.614 -6.133) 8.386 3.395 ( 1.464 8.357 -4.203) 9.468 3.599 ( 3.758 15.871 -3.795) 16.746 4.338 ( 4.253 -0.641 1.672) 4.614 4.593 ( 1.496 2.759 0.041) 3.139 4.683 ( -1.278 8.845 -4.454) 9.985 4.737 ( 5.083 0.474 4.486) 6.796 4.912 ( 5.228 -2.020 -2.948) 6.333 5.435 ( 3.654 -15.175 1.306) 15.663 7.887 ( 3.637 -4.133 0.799) 5.563 8.112 ( 8.591 3.737 -1.452) 9.480 8.548 ( -3.844 -7.737 0.573) 8.659 9.169 ( 0.773 -6.289 0.209) 6.340 9.645 ( -3.419 -2.489 -0.361) 4.244 9.702 ( 2.864 3.264 -3.287) 5.446 9.946 ( 8.870 7.462 1.264) 11.660 10.714 ( -3.439 -5.607 1.103) 6.670 10.855 ( -11.095 -6.288 -0.847) 12.781 11.826 ( -9.001 7.224 -0.892) 11.576 12.216 ( -3.673 -1.912 -0.415) 4.162 12.917 ( 4.272 -6.655 1.792) 8.108 15.474 ( -0.989 13.531 -8.123) 15.813 16.628 ( 22.915 45.089 -3.474) 50.697 19.287 ( -3.592 -20.175 -1.192) 20.527 19.403 ( -1.345 -32.141 -4.140) 32.435 20.728 ( 1.528 4.169 1.708) 4.757 21.329 ( 0.162 10.199 5.765) 11.717 22.272 ( 2.329 4.707 -1.225) 5.393 22.666 ( -14.561 17.792 -7.312) 24.125 107.881 ( 0.749 -1.092 0.589) 1.449 107.955 ( -0.639 -1.598 0.707) 1.861 108.513 ( 0.159 -1.621 0.676) 1.763 108.580 ( 0.679 -3.805 0.553) 3.904 ======================= Grid point 377 (188/259) ======================= q-point: (-0.11 0.15 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.524 ( -9.137 20.116 7.389) 23.296 1.731 ( -4.173 7.149 18.544) 20.308 2.601 ( -6.678 21.192 2.699) 22.383 2.852 ( -3.702 4.363 -5.413) 7.877 3.398 ( 0.606 8.893 -1.785) 9.090 3.630 ( 2.828 14.544 -4.676) 15.536 4.422 ( 3.074 3.270 2.450) 5.113 4.587 ( -2.483 5.192 -1.392) 5.921 4.630 ( 1.582 8.937 -4.962) 10.344 4.851 ( 2.205 -4.450 5.162) 7.163 4.987 ( 5.387 -4.500 -2.632) 7.497 5.476 ( 0.125 -20.447 -0.389) 20.451 7.949 ( 3.179 -2.902 -0.546) 4.339 8.278 ( 4.672 0.849 -0.881) 4.829 8.499 ( 5.431 -8.925 -0.109) 10.448 9.104 ( -12.927 -7.457 0.349) 14.927 9.593 ( 2.736 12.807 -1.439) 13.175 9.733 ( 1.752 -2.722 -2.788) 4.272 10.041 ( 0.878 9.344 2.688) 9.762 10.614 ( -5.710 -5.177 0.041) 7.707 10.836 ( 6.921 -1.955 0.508) 7.210 11.629 ( -11.792 2.384 -0.588) 12.044 12.167 ( -1.581 -0.258 0.202) 1.614 12.998 ( 2.914 -10.268 2.377) 10.935 15.399 ( -0.218 13.453 -9.098) 16.242 16.951 ( 16.129 49.674 -8.870) 52.974 19.205 ( -3.610 -25.237 -2.278) 25.596 19.350 ( -1.729 -25.311 -1.112) 25.395 20.772 ( 1.661 3.041 1.788) 3.899 21.412 ( 3.761 12.477 7.416) 14.994 22.236 ( -7.491 6.350 -6.401) 11.722 22.400 ( -5.861 14.019 -0.789) 15.215 107.900 ( 0.787 -1.418 0.408) 1.672 107.950 ( -0.421 -1.602 0.711) 1.803 108.521 ( 0.118 -1.845 0.887) 2.050 108.587 ( -0.325 -4.329 0.181) 4.345 ======================= Grid point 378 (189/259) ======================= q-point: ( 0.00 0.23 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( -1.457 3.276 11.181) 11.741 1.994 ( 1.808 24.893 3.662) 25.226 2.805 ( -1.382 9.343 -8.852) 12.944 2.938 ( 0.834 8.886 -3.523) 9.595 3.660 ( -1.508 15.909 6.843) 17.384 3.919 ( 1.556 13.275 -6.650) 14.929 4.562 ( 1.812 2.882 0.776) 3.491 4.611 ( -1.746 0.337 2.221) 2.845 4.777 ( -1.074 4.028 -2.686) 4.959 4.832 ( -1.599 4.083 -1.111) 4.524 4.942 ( 1.917 -3.792 -0.334) 4.263 5.111 ( 0.179 -12.121 -0.739) 12.145 7.887 ( -0.929 -6.338 -1.669) 6.620 8.064 ( 1.019 -12.905 -0.042) 12.945 8.659 ( -2.503 -2.219 0.416) 3.371 8.818 ( 1.539 4.612 0.050) 4.862 9.532 ( -0.797 -7.201 0.076) 7.246 9.951 ( 2.365 5.140 -0.336) 5.668 10.184 ( -0.403 2.047 1.104) 2.361 10.402 ( 0.078 -8.052 0.506) 8.068 11.143 ( 2.498 13.461 -1.198) 13.743 11.470 ( -3.022 2.873 0.063) 4.170 12.149 ( 0.115 -1.154 -0.309) 1.200 12.840 ( 0.683 -9.281 0.448) 9.317 15.613 ( 0.121 14.454 -6.983) 16.052 17.821 ( 0.166 22.852 -3.416) 23.106 18.619 ( -1.368 -23.028 -3.207) 23.290 18.965 ( 2.389 -14.357 -0.362) 14.559 20.861 ( 0.599 5.043 -0.931) 5.163 21.765 ( 5.004 6.115 7.264) 10.733 22.195 ( -6.808 8.844 -4.970) 12.217 22.618 ( 0.492 13.869 -0.607) 13.891 107.874 ( 0.073 -1.958 0.071) 1.961 107.914 ( 0.063 -2.167 0.480) 2.221 108.490 ( -0.023 -1.818 0.607) 1.917 108.503 ( -0.793 -2.906 0.409) 3.040 ======================= Grid point 379 (190/259) ======================= q-point: ( 0.11 0.23 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.935 ( -0.877 9.028 8.525) 12.448 2.124 ( 7.539 12.274 2.926) 14.699 2.745 ( 0.488 9.347 -5.494) 10.853 2.946 ( 3.071 8.200 -3.789) 9.541 3.684 ( -1.673 15.271 6.616) 16.726 3.891 ( 0.950 15.070 -6.201) 16.324 4.546 ( -2.210 3.161 -1.156) 4.027 4.590 ( -4.031 -1.251 2.539) 4.925 4.723 ( -3.159 3.699 -0.639) 4.906 4.812 ( 0.453 1.553 0.306) 1.646 4.954 ( 0.429 -1.643 -1.476) 2.250 5.135 ( 2.431 -9.529 -0.563) 9.850 7.805 ( -4.018 -8.011 -0.682) 8.988 8.183 ( 7.107 -7.851 0.099) 10.591 8.417 ( -12.189 1.325 0.456) 12.269 9.029 ( 10.155 -1.876 -0.044) 10.327 9.507 ( -2.083 -7.356 0.549) 7.665 9.895 ( -4.920 6.824 -1.640) 8.571 10.219 ( 1.884 -0.310 0.717) 2.039 10.485 ( 6.892 -6.427 0.296) 9.429 10.900 ( -17.124 4.875 -1.094) 17.838 11.678 ( 15.965 10.078 0.922) 18.902 12.147 ( -0.112 -3.131 -0.239) 3.142 12.851 ( 0.203 -8.797 -0.255) 8.803 15.579 ( 1.140 15.465 -4.548) 16.160 17.677 ( -12.985 26.198 -1.118) 29.261 18.590 ( -0.053 -24.725 -1.232) 24.755 19.018 ( 4.085 -14.248 -2.174) 14.980 20.854 ( -0.503 3.556 -1.069) 3.747 21.847 ( -1.527 2.635 -0.358) 3.067 22.104 ( -0.191 11.581 3.433) 12.080 22.699 ( 8.730 14.430 -1.243) 16.911 107.872 ( -0.317 -1.892 -0.038) 1.918 107.921 ( 0.333 -2.287 0.268) 2.326 108.488 ( -0.712 -1.925 0.452) 2.102 108.496 ( -0.296 -2.402 0.814) 2.553 ======================= Grid point 380 (191/259) ======================= q-point: ( 0.22 0.23 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.024 ( 3.657 4.945 6.846) 9.203 2.285 ( 10.491 10.826 -1.575) 15.157 2.726 ( -1.672 8.237 2.335) 8.724 2.980 ( 3.252 4.243 -3.430) 6.352 3.686 ( -3.522 12.400 4.343) 13.603 3.882 ( 3.666 20.105 -4.131) 20.850 4.423 ( -10.429 -1.046 -1.690) 10.617 4.551 ( -1.349 -3.154 0.981) 3.568 4.679 ( -1.747 4.755 2.226) 5.533 4.849 ( 2.412 4.244 1.039) 4.991 4.944 ( 0.314 1.112 -2.728) 2.963 5.166 ( 1.464 -8.328 -1.414) 8.573 7.763 ( -0.346 -7.886 -0.429) 7.905 8.124 ( -8.895 5.763 2.402) 10.868 8.444 ( 9.256 -6.910 -1.205) 11.614 9.082 ( -2.774 -5.706 -1.591) 6.541 9.468 ( -2.774 -6.999 0.706) 7.562 9.842 ( 0.189 6.580 -0.447) 6.598 10.134 ( -13.859 3.925 0.044) 14.404 10.599 ( 4.573 -8.218 -0.198) 9.407 10.752 ( 4.863 -2.553 -0.102) 5.493 11.952 ( 12.594 11.800 1.396) 17.315 12.141 ( -0.056 -5.959 -0.211) 5.963 12.839 ( -1.091 -6.227 -0.722) 6.363 15.595 ( 3.352 16.594 -1.283) 16.977 17.380 ( -18.446 28.533 -0.349) 33.978 18.596 ( 1.298 -27.399 -0.380) 27.433 19.069 ( 3.532 -14.701 -2.934) 15.401 20.830 ( -0.967 2.356 -1.437) 2.924 21.734 ( -6.399 3.770 -5.178) 9.054 22.199 ( 3.243 9.934 8.719) 13.610 22.894 ( 13.262 15.435 -1.240) 20.388 107.864 ( -0.426 -1.680 -0.148) 1.740 107.928 ( 0.271 -2.328 0.148) 2.348 108.479 ( -0.616 -1.693 0.483) 1.865 108.498 ( -0.340 -2.091 0.917) 2.308 ======================= Grid point 381 (192/259) ======================= q-point: ( 0.33 0.23 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.127 ( 3.483 5.777 1.956) 7.024 2.499 ( 10.883 10.300 1.704) 15.080 2.721 ( 0.465 6.137 4.323) 7.521 3.002 ( 1.137 -1.383 -0.797) 1.960 3.611 ( -6.621 12.894 1.527) 14.575 3.986 ( 8.559 20.981 0.860) 22.676 4.184 ( -12.830 -5.588 -3.755) 14.489 4.531 ( -1.315 -3.937 -0.499) 4.181 4.693 ( -0.104 6.777 4.427) 8.096 4.887 ( 0.851 5.439 -1.559) 5.721 4.932 ( 1.083 4.669 -1.903) 5.157 5.168 ( 0.720 -7.428 -2.445) 7.853 7.755 ( -1.131 -4.781 -0.233) 4.919 8.058 ( 0.242 6.103 2.515) 6.605 8.543 ( 1.369 -2.508 -2.123) 3.559 9.010 ( -1.062 -9.903 -1.843) 10.129 9.421 ( -2.788 -6.216 0.707) 6.850 9.825 ( -16.063 -0.634 -0.141) 16.076 9.856 ( -0.522 7.536 0.366) 7.563 10.651 ( 1.717 -6.461 0.003) 6.685 10.959 ( 13.781 -5.849 0.491) 14.979 12.074 ( -0.919 -8.104 1.476) 8.288 12.211 ( 8.520 9.839 -0.243) 13.017 12.804 ( -2.179 -2.560 -0.407) 3.386 15.685 ( 6.369 17.683 1.677) 18.869 17.036 ( -17.907 28.647 -2.005) 33.843 18.628 ( 2.401 -29.954 -0.389) 30.052 19.098 ( 2.009 -15.076 -2.749) 15.456 20.803 ( -0.688 2.031 -1.640) 2.700 21.578 ( -6.519 3.830 -4.012) 8.559 22.317 ( 2.849 11.192 7.283) 13.653 23.124 ( 12.047 14.794 -0.438) 19.084 107.855 ( -0.381 -1.419 -0.223) 1.486 107.932 ( 0.066 -2.293 0.154) 2.299 108.474 ( -0.352 -1.407 0.493) 1.531 108.498 ( -0.373 -1.872 0.865) 2.096 ======================= Grid point 382 (193/259) ======================= q-point: (-0.56 0.23 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.174 ( 0.261 11.974 0.905) 12.011 2.523 ( -9.616 7.462 8.976) 15.123 2.913 ( 13.469 2.372 -9.520) 16.664 3.061 ( 7.542 -1.733 10.055) 12.688 3.493 ( -7.032 15.282 0.209) 16.824 3.927 ( -11.338 -8.540 -2.132) 14.354 4.179 ( 10.195 18.020 0.857) 20.722 4.490 ( -2.778 -0.892 -0.812) 3.028 4.715 ( -1.131 4.922 2.850) 5.799 4.862 ( 0.094 6.989 -4.000) 8.053 4.948 ( 0.656 5.455 -0.069) 5.495 5.167 ( 1.661 -5.568 -3.016) 6.546 7.723 ( -1.988 -1.677 0.622) 2.674 8.132 ( 4.474 6.553 0.907) 7.986 8.491 ( -2.770 -0.290 -2.473) 3.725 9.012 ( 0.745 -12.653 -0.729) 12.696 9.399 ( 0.564 -3.842 1.023) 4.016 9.592 ( -8.117 -5.060 -0.952) 9.612 9.851 ( -0.729 6.564 0.733) 6.645 10.667 ( 0.084 -5.811 0.305) 5.819 11.163 ( 6.486 -5.285 0.644) 8.391 12.052 ( -1.342 -16.770 1.439) 16.885 12.332 ( 4.018 13.493 -0.593) 14.091 12.768 ( -1.171 0.815 0.122) 1.432 15.837 ( 7.665 18.517 3.136) 20.285 16.740 ( -11.184 27.500 -3.703) 29.917 18.671 ( 2.962 -31.927 -1.251) 32.088 19.099 ( 0.199 -15.213 -2.069) 15.354 20.784 ( -0.038 2.533 -1.671) 3.035 21.456 ( -4.297 3.662 -1.584) 5.863 22.404 ( 1.656 13.116 4.692) 14.028 23.294 ( 6.584 13.335 -0.530) 14.882 107.848 ( -0.239 -1.187 -0.192) 1.226 107.932 ( -0.183 -2.223 0.241) 2.244 108.473 ( -0.152 -1.258 0.454) 1.346 108.498 ( -0.228 -1.736 0.756) 1.907 ======================= Grid point 383 (194/259) ======================= q-point: (-0.44 0.23 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.136 ( -6.109 15.567 2.523) 16.912 2.383 ( -13.165 8.691 10.124) 18.744 2.968 ( 4.012 -2.374 -5.755) 7.406 3.348 ( -5.399 11.454 -3.229) 13.068 3.416 ( 16.566 3.604 5.141) 17.716 3.773 ( -4.604 -2.610 1.212) 5.429 4.307 ( 1.152 12.268 -2.198) 12.517 4.453 ( 1.548 4.201 0.963) 4.579 4.698 ( -1.535 2.563 1.043) 3.164 4.854 ( 1.685 6.166 -2.263) 6.781 4.949 ( -0.494 5.109 -0.031) 5.133 5.178 ( 2.075 -4.398 -3.646) 6.078 7.706 ( -0.534 -1.478 1.241) 2.002 8.175 ( 0.132 7.807 -1.087) 7.884 8.461 ( 1.054 -1.306 -0.999) 1.953 9.009 ( -0.613 -13.478 -0.550) 13.503 9.451 ( 2.176 -1.151 -0.694) 2.558 9.539 ( 5.206 -6.809 0.758) 8.605 9.851 ( 0.184 6.867 0.754) 6.910 10.662 ( -0.991 -5.855 0.541) 5.963 11.164 ( -6.794 -6.059 0.571) 9.121 12.068 ( 1.902 -17.473 0.837) 17.596 12.330 ( -3.533 13.275 -0.533) 13.748 12.772 ( 1.331 2.199 -0.095) 2.572 15.940 ( 0.495 18.008 -0.353) 18.018 16.658 ( 6.308 26.864 -1.063) 27.615 18.710 ( 2.943 -32.840 -2.729) 33.084 19.075 ( -1.422 -15.180 -1.232) 15.296 20.777 ( 0.660 3.513 -1.566) 3.903 21.407 ( -0.861 4.002 1.065) 4.230 22.445 ( -0.059 13.748 2.222) 13.927 23.337 ( -0.918 12.094 -2.060) 12.303 107.845 ( -0.024 -1.070 -0.033) 1.070 107.929 ( -0.408 -2.154 0.363) 2.222 108.475 ( -0.045 -1.245 0.382) 1.303 108.502 ( 0.013 -1.844 0.662) 1.959 ======================= Grid point 384 (195/259) ======================= q-point: (-0.33 0.23 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.006 ( -10.711 14.522 5.484) 18.860 2.220 ( -12.421 13.573 8.708) 20.355 3.003 ( 3.786 -0.027 -5.055) 6.316 3.193 ( -6.409 4.616 -4.386) 9.035 3.650 ( 3.093 12.660 -1.161) 13.084 3.831 ( 7.900 6.868 6.930) 12.554 4.242 ( -0.622 4.924 -5.157) 7.157 4.521 ( 2.874 1.531 0.403) 3.281 4.711 ( 1.509 3.771 3.506) 5.365 4.877 ( 1.930 4.709 -1.399) 5.279 4.931 ( -0.969 5.167 -1.094) 5.370 5.180 ( 1.260 -6.400 -4.013) 7.659 7.722 ( 1.169 -3.561 1.157) 3.922 8.159 ( 0.757 6.587 -1.725) 6.851 8.482 ( -0.222 -2.740 0.405) 2.778 8.982 ( -0.616 -12.220 -0.677) 12.254 9.470 ( 2.046 -5.241 -1.265) 5.767 9.777 ( 16.903 1.636 1.775) 17.075 9.863 ( 0.801 7.538 0.075) 7.581 10.637 ( -2.547 -6.548 0.681) 7.059 10.962 ( -14.405 -7.656 0.377) 16.318 12.111 ( 2.027 -11.784 -0.061) 11.957 12.213 ( -8.741 11.817 -0.381) 14.703 12.798 ( 1.409 0.245 -0.304) 1.463 15.867 ( -4.082 16.421 -5.405) 17.763 16.927 ( 20.455 26.386 2.088) 33.452 18.732 ( 2.362 -32.271 -4.463) 32.664 19.032 ( -2.534 -14.946 -0.431) 15.165 20.786 ( 1.648 4.503 -1.361) 4.984 21.434 ( 1.640 5.374 3.521) 6.630 22.440 ( -1.356 12.172 0.253) 12.250 23.226 ( -8.659 11.925 -4.147) 15.310 107.847 ( 0.245 -1.133 0.187) 1.174 107.924 ( -0.551 -2.109 0.479) 2.232 108.477 ( 0.022 -1.341 0.320) 1.379 108.508 ( 0.134 -2.248 0.582) 2.326 ======================= Grid point 385 (196/259) ======================= q-point: (-0.22 0.23 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.872 ( -9.261 12.511 9.178) 18.070 2.083 ( -8.383 18.099 5.452) 20.678 3.000 ( 0.309 3.613 -5.795) 6.836 3.064 ( -4.817 5.510 -3.946) 8.315 3.647 ( -2.638 16.638 4.079) 17.332 3.942 ( 3.064 15.822 -5.314) 16.970 4.310 ( 8.451 -1.397 1.830) 8.759 4.566 ( 2.288 -2.920 0.641) 3.764 4.779 ( 2.026 4.025 3.553) 5.739 4.877 ( -0.390 7.022 -3.041) 7.662 4.912 ( 0.521 2.647 -1.977) 3.344 5.164 ( 0.008 -10.741 -3.078) 11.173 7.762 ( 2.897 -7.175 -0.149) 7.739 8.212 ( 6.397 5.095 -1.218) 8.268 8.407 ( -7.805 -6.204 0.427) 9.979 9.020 ( 3.516 -7.357 0.734) 8.187 9.503 ( 2.278 -5.759 -0.693) 6.231 9.851 ( -0.611 6.098 -0.754) 6.175 10.103 ( 13.412 6.820 1.247) 15.098 10.576 ( -4.770 -7.923 0.715) 9.275 10.745 ( -5.594 -4.079 0.223) 6.927 12.007 ( -13.039 10.252 -0.854) 16.609 12.140 ( 0.803 -6.027 -0.219) 6.084 12.815 ( 0.594 -3.669 0.069) 3.717 15.757 ( -2.330 14.849 -7.366) 16.738 17.344 ( 22.975 24.732 0.481) 33.760 18.724 ( 1.042 -29.728 -5.953) 30.336 18.983 ( -2.781 -14.592 0.449) 14.861 20.814 ( 2.398 5.306 -1.251) 5.956 21.511 ( 2.797 7.308 5.792) 9.736 22.406 ( -1.869 8.777 -1.452) 9.090 22.982 ( -13.710 13.357 -4.885) 19.754 107.856 ( 0.491 -1.394 0.318) 1.512 107.917 ( -0.570 -2.093 0.558) 2.240 108.481 ( 0.075 -1.512 0.333) 1.550 108.513 ( -0.044 -2.765 0.475) 2.806 ======================= Grid point 386 (197/259) ======================= q-point: (-0.11 0.23 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.836 ( -3.176 9.365 11.355) 15.057 2.004 ( -4.334 21.664 3.720) 22.404 2.923 ( -4.283 8.619 -6.902) 11.844 2.967 ( -1.048 7.201 -4.116) 8.360 3.642 ( -1.947 16.461 5.865) 17.583 3.935 ( 2.376 13.692 -7.420) 15.754 4.472 ( 6.025 2.168 3.308) 7.207 4.610 ( 1.024 -3.223 1.528) 3.711 4.806 ( 0.043 5.175 -2.314) 5.669 4.856 ( 0.134 7.977 -1.025) 8.044 4.910 ( 1.322 -2.692 -1.578) 3.389 5.135 ( -1.221 -13.397 -1.597) 13.547 7.829 ( 5.255 -8.568 -1.543) 10.169 8.184 ( -9.957 -9.717 0.015) 13.912 8.441 ( 13.372 3.373 -0.346) 13.795 9.005 ( -8.326 -2.590 0.834) 8.759 9.532 ( 1.034 -6.356 -0.416) 6.453 9.865 ( 4.041 4.656 -0.414) 6.179 10.197 ( -1.257 4.563 1.664) 5.017 10.474 ( -6.558 -8.489 0.598) 10.744 10.881 ( 17.292 6.668 -0.388) 18.537 11.728 ( -16.768 7.120 -0.931) 18.241 12.147 ( 0.318 -1.944 -0.342) 1.999 12.825 ( 0.469 -7.367 0.552) 7.402 15.674 ( -0.638 14.120 -7.856) 16.171 17.698 ( 15.615 22.436 -2.747) 27.473 18.679 ( -0.971 -25.287 -5.745) 25.950 18.950 ( -1.048 -14.601 0.925) 14.668 20.846 ( 1.943 5.690 -1.135) 6.119 21.622 ( 4.132 8.089 7.411) 11.723 22.339 ( -4.020 6.117 -3.954) 8.319 22.717 ( -10.412 15.147 -2.647) 18.570 107.868 ( 0.500 -1.750 0.242) 1.836 107.913 ( -0.390 -2.098 0.582) 2.212 108.485 ( 0.083 -1.707 0.446) 1.766 108.512 ( -0.469 -3.037 0.382) 3.096 ======================= Grid point 387 (198/259) ======================= q-point: ( 0.00 0.31 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.991 ( -0.636 6.578 1.794) 6.848 2.497 ( 1.007 24.539 3.068) 24.750 2.900 ( -1.368 0.685 -5.568) 5.774 3.135 ( 1.100 10.700 -3.053) 11.181 3.926 ( -1.476 7.100 2.821) 7.781 4.140 ( 1.626 9.143 -4.776) 10.442 4.510 ( -1.194 -6.602 2.803) 7.271 4.632 ( 0.895 2.455 1.260) 2.902 4.826 ( -1.470 -2.953 0.286) 3.311 4.863 ( -2.287 5.471 -3.388) 6.830 4.965 ( 0.753 -0.943 0.531) 1.318 5.034 ( 2.163 7.231 -3.051) 8.141 7.738 ( 0.657 -7.854 -2.333) 8.220 7.804 ( 0.281 -11.817 -0.036) 11.820 8.683 ( -1.988 3.649 0.621) 4.201 8.921 ( 1.116 5.220 0.490) 5.360 9.419 ( -1.489 -3.824 0.810) 4.183 9.923 ( 2.382 -6.409 1.130) 6.930 10.173 ( -4.590 -3.222 0.280) 5.615 10.260 ( 3.254 -5.273 -0.174) 6.199 11.442 ( -2.352 15.059 -0.451) 15.248 11.554 ( 2.624 5.193 -1.040) 5.911 12.114 ( -0.556 -2.230 -0.571) 2.368 12.666 ( 0.299 -8.412 -0.248) 8.421 15.918 ( 0.542 16.318 -5.947) 17.376 17.891 ( -1.396 -11.647 2.282) 11.950 18.243 ( 0.304 -14.501 -3.151) 14.842 18.790 ( 2.802 -6.079 -1.793) 6.930 21.050 ( 0.133 13.362 -1.280) 13.423 21.823 ( 2.144 0.083 4.811) 5.267 22.395 ( -3.933 11.423 -2.595) 12.356 22.874 ( 0.252 10.598 -1.178) 10.666 107.836 ( 0.061 -1.808 -0.080) 1.811 107.869 ( 0.032 -2.246 0.261) 2.261 108.454 ( -0.124 -1.677 0.134) 1.687 108.461 ( -0.250 -1.350 0.217) 1.390 ======================= Grid point 388 (199/259) ======================= q-point: ( 0.11 0.31 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.020 ( 2.085 4.955 2.324) 5.856 2.532 ( 1.638 22.822 1.226) 22.913 2.860 ( -0.109 2.329 -2.284) 3.264 3.125 ( 0.197 9.530 -3.336) 10.099 3.899 ( -3.885 4.546 2.415) 6.449 4.155 ( 3.925 10.212 -3.887) 11.610 4.460 ( -6.676 -7.459 2.755) 10.383 4.622 ( -2.714 3.064 -0.109) 4.094 4.797 ( -2.185 2.017 1.509) 3.335 4.843 ( 2.221 3.153 -0.277) 3.866 4.979 ( 0.767 0.979 -0.690) 1.422 5.068 ( 3.623 3.570 -3.161) 5.989 7.644 ( -3.073 -7.061 -1.532) 7.851 7.977 ( 12.435 -10.927 -0.543) 16.563 8.511 ( -12.145 6.473 1.312) 13.825 9.024 ( 3.836 0.333 -0.077) 3.852 9.402 ( -1.288 -2.770 1.396) 3.359 9.922 ( -1.176 -2.853 -1.066) 3.265 10.155 ( 0.380 -5.328 2.702) 5.986 10.347 ( 6.502 -7.083 -1.303) 9.703 11.054 ( -22.950 9.842 -0.409) 24.975 11.895 ( 19.519 10.232 -0.703) 22.049 12.063 ( -4.693 -4.880 0.238) 6.774 12.694 ( 2.689 -6.974 -0.463) 7.489 15.905 ( 2.398 17.365 -4.205) 18.027 17.827 ( -7.783 -8.923 2.631) 12.129 18.205 ( -1.880 -13.413 -2.129) 13.711 18.817 ( 2.259 -7.724 -3.307) 8.701 21.017 ( -2.664 12.464 -0.935) 12.779 21.846 ( -2.608 -2.033 0.991) 3.452 22.358 ( 0.661 13.571 2.036) 13.739 22.953 ( 8.876 10.175 -1.211) 13.557 107.834 ( -0.116 -1.767 -0.122) 1.775 107.873 ( 0.276 -2.352 0.158) 2.373 108.452 ( -0.275 -1.559 0.223) 1.599 108.461 ( -0.010 -1.298 0.285) 1.329 ======================= Grid point 389 (200/259) ======================= q-point: ( 0.22 0.31 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.103 ( 4.855 4.938 3.319) 7.679 2.603 ( 6.516 18.464 -0.387) 19.584 2.841 ( -2.200 3.206 1.682) 4.236 3.086 ( -1.777 6.453 -3.261) 7.445 3.829 ( -5.423 1.933 2.380) 6.230 4.213 ( 3.224 3.133 -3.766) 5.864 4.319 ( -8.377 1.537 1.838) 8.713 4.559 ( -3.702 3.514 0.521) 5.131 4.791 ( -0.653 5.131 3.675) 6.344 4.913 ( 4.592 2.185 0.422) 5.103 4.986 ( 0.944 1.951 -1.056) 2.411 5.098 ( 2.570 1.761 -4.311) 5.319 7.633 ( 2.672 -4.442 -0.958) 5.271 8.162 ( 4.523 -5.173 0.863) 6.925 8.376 ( -0.056 3.403 0.363) 3.423 8.986 ( -6.233 -4.469 -1.551) 7.825 9.382 ( -2.637 -1.299 1.417) 3.263 9.919 ( 0.169 2.022 0.378) 2.064 10.127 ( -8.222 -5.963 2.150) 10.382 10.460 ( 6.423 -5.856 -1.297) 8.788 10.745 ( -6.706 3.430 -0.546) 7.552 11.957 ( -7.260 -10.143 0.768) 12.497 12.203 ( 14.981 10.580 -0.142) 18.341 12.741 ( 2.513 -3.714 -0.196) 4.489 15.947 ( 4.892 18.568 -1.752) 19.281 17.651 ( -13.513 -1.277 1.907) 13.706 18.159 ( -1.450 -15.313 -1.389) 15.444 18.826 ( 2.114 -10.450 -4.351) 11.515 20.953 ( -3.185 10.119 -1.025) 10.658 21.755 ( -6.198 -1.175 -2.073) 6.640 22.439 ( 4.074 13.553 6.041) 15.387 23.144 ( 12.343 9.084 -1.067) 15.363 107.831 ( -0.145 -1.577 -0.169) 1.593 107.880 ( 0.287 -2.405 0.098) 2.424 108.449 ( -0.154 -1.230 0.264) 1.268 108.464 ( -0.000 -1.334 0.358) 1.381 ======================= Grid point 390 (201/259) ======================= q-point: ( 0.33 0.31 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.240 ( 6.980 5.760 3.509) 9.706 2.745 ( 2.822 12.931 3.098) 13.593 2.821 ( 4.430 4.143 -0.422) 6.080 3.018 ( -3.675 3.153 -0.423) 4.861 3.758 ( -4.246 1.544 2.666) 5.246 4.031 ( -14.049 -9.003 -3.547) 17.059 4.374 ( 7.115 16.351 1.216) 17.873 4.511 ( -2.038 2.431 0.857) 3.285 4.811 ( -0.718 5.052 3.059) 5.949 4.983 ( 3.133 1.529 -2.430) 4.249 5.011 ( 1.469 4.365 2.615) 5.296 5.094 ( 1.724 0.817 -5.965) 6.262 7.702 ( 4.262 -0.297 -0.079) 4.273 8.168 ( -0.572 3.629 2.402) 4.390 8.484 ( 6.981 -2.507 -1.543) 7.576 8.847 ( -5.465 -6.208 -2.416) 8.617 9.333 ( -3.273 -2.221 1.300) 4.164 9.782 ( -17.186 -3.310 1.680) 17.582 10.017 ( -1.168 7.302 0.700) 7.428 10.518 ( 1.505 -5.331 -0.421) 5.555 10.836 ( 12.503 -6.644 -0.478) 14.167 11.816 ( -8.898 -15.181 1.058) 17.629 12.431 ( 10.379 9.966 -0.114) 14.390 12.776 ( 1.083 -0.485 0.685) 1.371 16.058 ( 7.755 19.397 0.803) 20.905 17.386 ( -15.711 5.941 -0.382) 16.802 18.136 ( -0.014 -18.207 -1.195) 18.246 18.828 ( 1.655 -12.454 -4.424) 13.319 20.896 ( -2.024 7.736 -1.249) 8.094 21.620 ( -6.406 0.302 -2.253) 6.797 22.568 ( 4.360 13.652 6.716) 15.827 23.349 ( 10.490 7.495 -0.728) 12.913 107.827 ( -0.103 -1.334 -0.206) 1.354 107.884 ( 0.149 -2.381 0.108) 2.388 108.450 ( -0.024 -0.986 0.269) 1.022 108.466 ( -0.023 -1.281 0.370) 1.334 ======================= Grid point 391 (202/259) ======================= q-point: (-0.56 0.31 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( 4.875 8.329 2.542) 9.980 2.681 ( -8.683 7.249 6.107) 12.855 2.926 ( 0.735 0.804 -5.586) 5.691 3.099 ( 14.411 4.472 6.643) 16.486 3.697 ( -8.238 3.592 -2.242) 9.263 3.768 ( -6.959 -6.575 -0.768) 9.604 4.497 ( -0.441 3.658 1.400) 3.941 4.519 ( 6.842 13.745 1.899) 15.471 4.797 ( -1.974 4.014 -0.161) 4.476 4.988 ( -1.894 0.141 -1.380) 2.347 5.033 ( 1.239 7.981 -0.861) 8.123 5.111 ( 3.722 -0.441 -3.277) 4.979 7.749 ( 0.345 4.055 0.960) 4.181 8.225 ( 3.986 1.963 1.500) 4.690 8.523 ( -0.098 3.432 -2.367) 4.170 8.789 ( -0.506 -9.028 -1.458) 9.159 9.319 ( 1.765 -3.619 1.525) 4.306 9.505 ( -11.865 -3.892 0.248) 12.490 10.016 ( -0.368 9.436 1.039) 9.500 10.531 ( 0.226 -6.786 -0.001) 6.790 11.044 ( 7.900 -6.934 -0.192) 10.513 11.678 ( -5.905 -20.108 1.197) 20.991 12.563 ( 4.081 9.593 -0.504) 10.437 12.795 ( 0.562 1.682 1.258) 2.175 16.223 ( 8.206 19.565 2.261) 21.336 17.120 ( -11.102 10.120 -2.289) 15.196 18.138 ( 1.177 -20.523 -1.469) 20.609 18.817 ( 0.575 -13.396 -3.796) 13.935 20.866 ( -0.145 6.269 -1.475) 6.442 21.510 ( -3.995 1.445 -0.925) 4.348 22.679 ( 2.463 14.104 5.366) 15.290 23.488 ( 5.094 5.941 -0.827) 7.870 107.824 ( -0.035 -1.126 -0.202) 1.145 107.886 ( -0.064 -2.314 0.161) 2.320 108.452 ( 0.023 -0.858 0.234) 0.890 108.468 ( -0.025 -1.234 0.327) 1.277 ======================= Grid point 392 (203/259) ======================= q-point: (-0.44 0.31 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.406 ( -4.327 10.939 0.987) 11.805 2.576 ( -7.778 10.134 7.653) 14.892 2.920 ( 2.658 -2.127 -2.135) 4.019 3.446 ( -0.241 1.852 -0.630) 1.971 3.456 ( 8.712 -1.150 -1.464) 8.909 3.767 ( 1.772 0.133 1.600) 2.392 4.494 ( -1.219 6.603 1.301) 6.840 4.633 ( 3.601 13.010 -0.474) 13.507 4.754 ( -1.293 3.403 -0.014) 3.640 4.927 ( -2.342 -0.825 -1.973) 3.171 5.049 ( 0.430 7.116 -0.010) 7.129 5.142 ( 2.323 0.063 -3.616) 4.298 7.739 ( -2.204 4.485 1.356) 5.178 8.271 ( -0.054 0.665 -0.259) 0.716 8.495 ( -0.757 5.082 -1.329) 5.307 8.766 ( -1.376 -10.159 -0.552) 10.266 9.380 ( -0.893 -4.623 -0.894) 4.792 9.468 ( 12.688 -1.324 1.728) 12.874 10.018 ( -0.232 9.364 0.966) 9.417 10.527 ( -0.833 -6.794 0.204) 6.848 11.032 ( -9.028 -7.367 0.258) 11.655 11.685 ( 5.640 -20.331 0.884) 21.118 12.560 ( -3.803 9.704 -0.370) 10.429 12.818 ( 0.832 2.188 0.334) 2.364 16.313 ( -0.813 18.691 -0.939) 18.733 17.041 ( 5.203 11.282 0.427) 12.431 18.154 ( 2.065 -21.892 -2.011) 22.081 18.792 ( -0.525 -13.505 -2.865) 13.816 20.869 ( 1.771 6.236 -1.730) 6.709 21.472 ( -0.217 2.114 1.059) 2.375 22.727 ( -0.672 14.203 2.965) 14.525 23.510 ( -1.825 5.021 -1.574) 5.569 107.823 ( 0.052 -1.031 -0.142) 1.042 107.884 ( -0.281 -2.242 0.225) 2.271 108.454 ( 0.001 -0.845 0.161) 0.860 108.470 ( -0.030 -1.288 0.269) 1.317 ======================= Grid point 393 (204/259) ======================= q-point: (-0.33 0.31 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.274 ( -9.539 11.661 1.371) 15.128 2.508 ( -6.304 14.864 6.579) 17.435 2.975 ( 4.320 -3.069 -2.251) 5.757 3.260 ( -4.796 3.724 -7.210) 9.426 3.815 ( 16.645 -5.136 4.815) 18.073 3.823 ( 3.456 2.081 0.400) 4.054 4.459 ( -3.410 13.522 -0.283) 13.948 4.609 ( -1.188 7.572 -4.887) 9.091 4.794 ( 2.317 4.827 3.663) 6.487 4.893 ( -0.658 -3.367 0.083) 3.432 5.044 ( -0.842 7.090 -0.250) 7.145 5.135 ( 0.679 0.831 -5.437) 5.542 7.693 ( -3.469 0.778 0.435) 3.581 8.245 ( -1.299 0.095 -0.659) 1.460 8.458 ( -4.049 1.388 -0.552) 4.316 8.768 ( 3.622 -8.312 0.644) 9.089 9.398 ( 2.971 -1.582 -1.184) 3.568 9.796 ( 19.558 0.016 1.227) 19.597 10.020 ( 0.084 7.118 0.599) 7.143 10.501 ( -2.552 -5.880 0.275) 6.416 10.810 ( -12.897 -7.285 0.510) 14.821 11.829 ( 8.408 -15.787 0.498) 17.894 12.435 ( -9.567 10.031 -0.367) 13.866 12.813 ( -1.322 0.899 -0.762) 1.771 16.208 ( -5.927 17.357 -5.217) 19.069 17.277 ( 16.326 8.773 3.906) 18.941 18.180 ( 2.681 -22.020 -2.631) 22.338 18.760 ( -0.845 -12.737 -1.980) 12.917 20.903 ( 3.562 7.589 -1.908) 8.598 21.514 ( 2.894 2.453 3.072) 4.882 22.700 ( -3.565 13.434 0.395) 13.905 23.400 ( -8.359 5.334 -2.561) 10.241 107.824 ( 0.163 -1.099 -0.052) 1.112 107.880 ( -0.432 -2.193 0.278) 2.253 108.454 ( -0.024 -0.929 0.072) 0.932 108.471 ( -0.096 -1.458 0.226) 1.478 ======================= Grid point 394 (205/259) ======================= q-point: (-0.22 0.31 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.122 ( -8.053 11.682 1.667) 14.287 2.456 ( -3.613 18.947 4.617) 19.834 3.013 ( 1.808 -3.191 -3.697) 5.207 3.165 ( -0.737 7.004 -5.497) 8.934 3.880 ( 2.297 3.861 1.022) 4.608 4.096 ( 9.691 -4.709 1.956) 10.951 4.393 ( -0.556 13.804 -2.339) 14.012 4.580 ( 0.514 4.658 -1.196) 4.837 4.850 ( 0.275 2.767 3.842) 4.742 4.891 ( 0.481 -3.223 -0.626) 3.318 5.019 ( -1.661 6.191 -0.191) 6.412 5.089 ( -0.343 2.738 -6.830) 7.366 7.640 ( -1.360 -4.371 -1.041) 4.695 8.175 ( -8.720 -8.617 0.119) 12.260 8.412 ( 3.338 6.284 -0.879) 7.169 8.896 ( 7.348 -4.993 1.964) 9.098 9.443 ( 2.336 -0.205 -0.940) 2.527 9.937 ( -3.390 2.706 -0.384) 4.355 10.153 ( 8.858 -2.846 1.609) 9.442 10.414 ( -7.032 -7.884 0.243) 10.567 10.733 ( 8.521 3.845 -0.083) 9.349 11.971 ( 6.659 -10.656 0.116) 12.566 12.215 ( -14.230 10.180 -0.623) 17.507 12.762 ( -3.348 -1.970 -1.020) 4.016 16.070 ( -3.906 16.435 -6.594) 18.134 17.603 ( 15.039 1.912 3.745) 15.616 18.210 ( 3.048 -20.522 -3.165) 20.987 18.739 ( 0.185 -10.643 -1.312) 10.725 20.964 ( 4.617 9.795 -1.945) 11.002 21.610 ( 4.163 2.654 4.703) 6.819 22.616 ( -4.967 11.766 -1.730) 12.888 23.189 ( -11.934 7.180 -2.899) 14.225 107.828 ( 0.270 -1.327 0.008) 1.354 107.874 ( -0.460 -2.174 0.310) 2.244 108.454 ( -0.015 -1.100 0.020) 1.100 108.470 ( -0.234 -1.633 0.199) 1.662 ======================= Grid point 395 (206/259) ======================= q-point: (-0.11 0.31 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.021 ( -4.346 9.574 1.702) 10.651 2.456 ( 0.098 22.569 3.551) 22.846 2.977 ( -1.594 -1.682 -5.475) 5.945 3.138 ( 1.149 9.807 -3.661) 10.531 3.917 ( 0.347 6.501 2.225) 6.880 4.158 ( 0.686 7.173 -4.001) 8.242 4.454 ( 5.074 -2.346 1.476) 5.782 4.598 ( 1.233 3.948 1.267) 4.325 4.850 ( -1.933 -3.302 1.699) 4.187 4.905 ( 1.312 3.631 -2.152) 4.420 4.976 ( -2.605 1.054 -0.454) 2.847 5.041 ( 0.453 6.968 -4.891) 8.525 7.651 ( 4.097 -8.077 -1.737) 9.222 7.973 ( -11.872 -10.659 -0.270) 15.957 8.549 ( 10.524 6.475 -0.281) 12.360 8.980 ( -1.442 -0.594 1.655) 2.274 9.446 ( -1.387 -1.802 -0.389) 2.307 9.878 ( -0.696 -2.603 0.976) 2.866 10.215 ( 0.349 -1.811 0.674) 1.964 10.295 ( -6.434 -8.829 0.226) 10.927 11.064 ( 24.118 10.483 -0.887) 26.313 11.889 ( -18.838 7.763 -0.420) 20.379 12.087 ( 3.585 -3.434 -0.727) 5.017 12.694 ( -2.918 -5.930 -0.538) 6.631 15.973 ( -1.354 15.980 -6.715) 17.386 17.829 ( 6.822 -7.044 2.514) 10.123 18.239 ( 2.711 -17.395 -3.498) 17.949 18.752 ( 2.189 -7.489 -1.031) 7.870 21.028 ( 3.511 12.126 -1.768) 12.747 21.724 ( 3.947 2.193 5.591) 7.187 22.505 ( -5.117 10.295 -3.191) 11.931 22.969 ( -9.044 9.651 -2.032) 13.381 107.833 ( 0.265 -1.624 -0.016) 1.646 107.869 ( -0.307 -2.183 0.315) 2.227 108.454 ( -0.000 -1.348 0.043) 1.349 108.466 ( -0.358 -1.639 0.193) 1.689 ======================= Grid point 396 (207/259) ======================= q-point: ( 0.00 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.167 ( -0.101 10.780 -2.817) 11.142 2.839 ( 0.546 -5.869 -2.634) 6.456 2.972 ( 0.424 21.977 2.685) 22.145 3.357 ( 0.545 11.156 -2.774) 11.508 3.936 ( -0.573 -4.294 -0.116) 4.334 4.136 ( 1.200 -11.036 0.922) 11.139 4.468 ( -0.648 3.621 -2.932) 4.704 4.676 ( -1.228 0.226 -0.297) 1.283 4.833 ( -0.630 5.121 2.694) 5.821 4.962 ( -2.511 3.600 -2.360) 4.983 5.009 ( 1.379 4.408 -1.123) 4.753 5.150 ( 0.866 3.560 -2.694) 4.548 7.594 ( 4.871 -6.053 -1.731) 7.959 7.614 ( -3.522 -7.004 -0.369) 7.848 8.783 ( -1.574 5.957 0.508) 6.182 9.003 ( 1.361 2.334 0.529) 2.753 9.384 ( -2.156 0.317 1.710) 2.770 9.747 ( 0.372 -10.035 1.493) 10.152 10.099 ( -1.770 -3.029 0.448) 3.537 10.174 ( 1.244 -3.978 -1.911) 4.585 11.661 ( -7.068 5.796 -1.065) 9.202 11.717 ( 7.819 11.010 -0.478) 13.512 12.071 ( -0.826 -1.297 -0.648) 1.668 12.495 ( 0.042 -8.825 -0.416) 8.835 16.272 ( 0.785 18.950 -4.615) 19.520 17.539 ( -1.187 -21.060 1.259) 21.131 18.066 ( 0.753 -2.828 -1.769) 3.420 18.610 ( 1.931 -12.160 -0.884) 12.344 21.335 ( 0.219 13.515 -0.119) 13.518 21.789 ( 0.747 -3.186 2.728) 4.261 22.643 ( -2.362 12.777 -1.296) 13.058 23.020 ( 0.180 3.768 -0.817) 3.860 107.805 ( 0.061 -1.151 -0.230) 1.175 107.827 ( 0.051 -1.796 -0.017) 1.797 108.430 ( -0.078 -0.755 -0.109) 0.767 108.440 ( -0.054 -0.840 -0.002) 0.842 ======================= Grid point 397 (208/259) ======================= q-point: ( 0.11 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.176 ( 2.930 10.375 -1.626) 10.903 2.821 ( -0.092 -4.137 -2.134) 4.656 2.994 ( -0.087 20.766 2.030) 20.866 3.321 ( -2.321 9.927 -2.711) 10.549 3.888 ( -4.668 -4.385 0.414) 6.418 4.120 ( -3.448 -12.146 -0.037) 12.626 4.461 ( 1.952 6.003 -1.412) 6.468 4.654 ( -1.636 0.279 0.730) 1.813 4.856 ( 0.218 4.419 3.618) 5.715 4.930 ( 0.728 4.214 -1.165) 4.432 5.022 ( 1.080 3.530 -1.132) 3.861 5.148 ( 1.285 2.661 -3.017) 4.223 7.545 ( 0.383 -2.636 -1.723) 3.172 7.775 ( 12.051 -9.020 -0.529) 15.062 8.652 ( -10.258 7.391 1.297) 12.709 9.007 ( -3.336 -2.383 -0.159) 4.103 9.405 ( 1.680 2.880 2.228) 4.010 9.811 ( 5.860 -7.625 0.685) 9.641 10.056 ( -4.672 -3.575 1.757) 6.139 10.207 ( 4.709 -6.759 -2.096) 8.500 11.270 ( -22.568 11.363 -0.351) 25.270 11.899 ( -5.602 -7.871 -0.333) 9.666 12.123 ( 14.441 9.013 -0.346) 17.026 12.565 ( 6.376 -6.196 -0.377) 8.899 16.276 ( 3.147 19.566 -3.534) 20.130 17.511 ( -3.172 -19.521 1.722) 19.852 18.043 ( -1.752 -2.630 -1.484) 3.492 18.616 ( 0.238 -12.802 -2.290) 13.007 21.295 ( -4.152 13.665 -0.339) 14.286 21.782 ( -3.103 -4.193 0.988) 5.309 22.639 ( 2.025 14.180 1.330) 14.385 23.087 ( 7.405 2.980 -0.747) 8.017 107.805 ( 0.053 -1.113 -0.211) 1.134 107.830 ( 0.263 -1.881 -0.040) 1.900 108.429 ( 0.040 -0.689 -0.006) 0.690 108.440 ( 0.070 -0.836 0.034) 0.839 ======================= Grid point 398 (209/259) ======================= q-point: ( 0.22 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.246 ( 5.414 9.270 0.238) 10.738 2.815 ( 0.838 -2.995 -1.149) 3.316 3.003 ( 0.159 17.794 1.163) 17.832 3.235 ( -5.060 8.242 -1.923) 9.861 3.792 ( -6.132 -4.707 1.499) 7.875 4.010 ( -7.908 -13.093 -1.322) 15.353 4.520 ( 4.842 8.673 0.200) 9.935 4.625 ( -2.442 2.602 1.671) 3.940 4.889 ( 0.080 4.717 3.855) 6.093 4.964 ( 3.396 3.042 -1.069) 4.683 5.033 ( 1.041 2.731 -0.545) 2.973 5.150 ( 1.502 1.832 -3.169) 3.956 7.599 ( 6.674 1.109 -1.225) 6.876 7.996 ( 11.890 -9.327 -0.397) 15.118 8.505 ( -5.928 7.480 1.420) 9.649 8.889 ( -8.008 -5.236 -0.912) 9.611 9.414 ( -3.194 4.199 2.046) 5.658 9.933 ( -11.085 -8.356 3.311) 14.271 9.961 ( 8.872 -0.623 0.251) 8.898 10.320 ( 9.412 -8.261 -1.993) 12.681 10.903 ( -16.431 11.318 -0.455) 19.957 11.720 ( -12.001 -13.075 0.466) 17.754 12.391 ( 13.585 8.041 -0.133) 15.787 12.679 ( 5.889 -2.809 0.290) 6.531 16.333 ( 5.522 19.746 -1.900) 20.591 17.446 ( -5.765 -15.612 1.854) 16.745 17.986 ( -3.106 -2.464 -1.358) 4.191 18.593 ( 0.005 -13.577 -3.876) 14.119 21.198 ( -5.584 12.903 -0.861) 14.085 21.701 ( -5.635 -4.057 -0.483) 6.960 22.726 ( 4.898 14.683 3.862) 15.952 23.249 ( 10.281 1.285 -0.621) 10.380 107.804 ( 0.094 -0.968 -0.200) 0.993 107.835 ( 0.321 -1.937 -0.033) 1.964 108.431 ( 0.158 -0.571 0.070) 0.597 108.443 ( 0.141 -0.813 0.082) 0.829 ======================= Grid point 399 (210/259) ======================= q-point: ( 0.33 0.38 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.369 ( 7.134 7.371 1.827) 10.419 2.815 ( -1.302 -2.517 0.512) 2.879 3.036 ( 4.037 12.565 -3.418) 13.633 3.129 ( -5.673 8.020 3.288) 10.359 3.709 ( -4.392 -5.150 2.440) 7.195 3.832 ( -9.665 -10.299 -2.626) 14.366 4.599 ( -1.516 5.281 1.852) 5.798 4.624 ( 5.341 8.432 1.875) 10.156 4.905 ( -0.632 4.552 1.162) 4.741 5.008 ( 2.499 1.814 -3.006) 4.309 5.063 ( 1.786 1.330 1.804) 2.866 5.152 ( 1.161 2.745 -2.266) 3.744 7.744 ( 8.898 4.365 -0.097) 9.912 8.152 ( 4.769 -4.937 0.623) 6.893 8.496 ( 4.280 3.577 0.156) 5.580 8.745 ( -6.013 -4.415 -1.717) 7.655 9.337 ( -5.938 2.509 1.813) 6.697 9.689 ( -17.132 -5.955 2.860) 18.361 10.115 ( 6.863 2.829 0.716) 7.458 10.462 ( 4.167 -2.665 -1.171) 5.083 10.737 ( 0.942 -0.166 -0.449) 1.057 11.496 ( -13.166 -16.434 0.588) 21.066 12.597 ( 9.216 6.655 0.160) 11.369 12.771 ( 3.572 -0.271 1.231) 3.788 16.446 ( 7.689 18.882 0.003) 20.388 17.327 ( -8.436 -9.369 0.942) 12.642 17.922 ( -2.550 -3.311 -1.635) 4.488 18.564 ( 0.447 -14.479 -4.696) 15.228 21.098 ( -4.283 11.472 -1.272) 12.311 21.590 ( -5.570 -3.233 -0.906) 6.504 22.853 ( 4.995 14.501 4.992) 16.129 23.420 ( 8.582 -0.423 -0.516) 8.607 107.805 ( 0.126 -0.790 -0.203) 0.825 107.840 ( 0.240 -1.937 -0.001) 1.952 108.435 ( 0.202 -0.466 0.100) 0.518 108.446 ( 0.144 -0.769 0.103) 0.789 ======================= Grid point 400 (211/259) ======================= q-point: (-0.56 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.512 ( 6.398 5.477 1.788) 8.610 2.771 ( -4.032 0.995 1.793) 4.523 2.988 ( -4.190 5.556 -2.531) 7.405 3.207 ( 8.314 5.513 4.117) 10.792 3.637 ( -8.777 -4.419 -3.229) 10.343 3.679 ( -1.010 -5.762 1.822) 6.127 4.606 ( 0.774 6.946 1.964) 7.260 4.731 ( 4.155 6.078 2.942) 7.929 4.887 ( -0.618 5.375 -2.034) 5.780 4.996 ( -0.991 1.443 -3.929) 4.301 5.108 ( 2.017 -0.020 0.414) 2.059 5.166 ( 1.111 4.399 0.299) 4.547 7.866 ( 3.122 7.089 1.066) 7.819 8.213 ( 2.161 -2.676 0.822) 3.536 8.592 ( 3.941 2.173 -0.651) 4.548 8.666 ( -1.475 -3.088 -1.790) 3.862 9.275 ( -0.833 -0.448 1.588) 1.848 9.430 ( -10.918 -3.643 1.550) 11.614 10.209 ( 2.596 9.110 0.850) 9.511 10.444 ( -2.151 -0.702 -0.247) 2.276 10.880 ( 9.510 -9.179 -0.398) 13.223 11.273 ( -10.446 -19.583 0.645) 22.205 12.718 ( 3.725 5.922 -0.035) 6.996 12.827 ( 1.555 1.230 1.589) 2.540 16.595 ( 7.391 16.882 1.259) 18.472 17.177 ( -7.243 -2.922 -0.533) 7.828 17.877 ( -0.860 -4.998 -1.694) 5.346 18.538 ( 0.415 -15.005 -4.428) 15.651 21.035 ( -1.348 10.146 -1.385) 10.329 21.503 ( -3.152 -2.313 -0.404) 3.930 22.962 ( 2.635 13.981 4.503) 14.923 23.531 ( 3.804 -1.587 -0.647) 4.172 107.806 ( 0.120 -0.649 -0.212) 0.693 107.843 ( 0.064 -1.894 0.031) 1.895 108.439 ( 0.144 -0.409 0.079) 0.441 108.449 ( 0.088 -0.736 0.079) 0.745 ======================= Grid point 401 (212/259) ======================= q-point: (-0.44 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.567 ( -2.370 5.463 -0.713) 5.998 2.751 ( 0.950 4.655 3.906) 6.151 2.905 ( -3.475 3.099 -0.313) 4.667 3.408 ( 8.791 -3.305 -0.711) 9.418 3.488 ( -2.583 2.481 -0.666) 3.643 3.705 ( 2.358 -5.695 1.185) 6.277 4.651 ( 2.566 8.042 1.222) 8.530 4.804 ( 1.052 1.397 2.768) 3.274 4.864 ( -0.405 8.517 -1.986) 8.755 4.926 ( -1.843 2.961 -5.143) 6.215 5.138 ( 1.429 -0.051 -1.046) 1.772 5.184 ( 0.126 4.498 0.844) 4.578 7.865 ( -4.048 7.432 1.156) 8.542 8.232 ( -0.966 -3.640 0.040) 3.766 8.592 ( -1.875 1.701 0.350) 2.556 8.625 ( -3.131 -2.641 -1.104) 4.243 9.321 ( 3.643 -0.795 -0.165) 3.732 9.442 ( 12.519 -1.614 1.086) 12.669 10.208 ( -3.336 9.046 0.885) 9.682 10.437 ( 1.345 -0.979 0.009) 1.663 10.866 ( -10.512 -8.941 0.117) 13.800 11.275 ( 9.880 -19.964 0.544) 22.282 12.720 ( -3.203 6.350 -0.110) 7.113 12.853 ( 0.061 1.146 0.514) 1.257 16.660 ( -2.009 15.223 -1.144) 15.398 17.136 ( 4.375 -0.674 0.933) 4.524 17.867 ( 1.056 -5.956 -1.339) 6.195 18.513 ( 0.200 -14.804 -3.458) 15.204 21.032 ( 2.078 9.735 -1.288) 10.037 21.479 ( 0.432 -1.643 0.723) 1.846 23.004 ( -1.119 13.281 2.717) 13.602 23.539 ( -2.196 -1.911 -1.012) 3.082 107.806 ( 0.092 -0.597 -0.219) 0.643 107.843 ( -0.138 -1.836 0.046) 1.842 108.441 ( 0.026 -0.412 0.007) 0.413 108.450 ( -0.014 -0.747 0.033) 0.748 ======================= Grid point 402 (213/259) ======================= q-point: (-0.33 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.463 ( -6.525 7.480 -1.852) 10.097 2.807 ( -0.601 14.714 4.890) 15.517 2.873 ( 1.425 -6.481 -1.363) 6.774 3.369 ( -0.683 6.564 -5.709) 8.726 3.669 ( 11.126 -9.353 3.819) 15.028 3.774 ( 4.580 -4.772 0.141) 6.615 4.696 ( 1.705 6.975 -1.131) 7.269 4.780 ( -4.874 8.533 -3.958) 10.594 4.824 ( 0.002 0.399 1.985) 2.025 4.923 ( 2.334 6.557 -0.784) 7.004 5.141 ( 0.407 0.693 -2.679) 2.797 5.180 ( -0.862 4.129 0.033) 4.219 7.750 ( -8.375 4.659 -0.179) 9.585 8.162 ( -7.228 -6.799 0.106) 9.924 8.523 ( -2.670 3.620 -0.804) 4.569 8.654 ( 5.806 -3.501 1.803) 7.015 9.413 ( 6.034 3.046 -0.978) 6.829 9.760 ( 19.044 -3.925 0.228) 19.445 10.116 ( -7.458 2.760 0.690) 7.982 10.428 ( -5.737 -3.026 0.006) 6.486 10.715 ( -0.622 0.334 0.367) 0.796 11.496 ( 12.788 -17.120 0.526) 21.375 12.610 ( -8.715 7.404 -0.419) 11.443 12.823 ( -3.430 -0.178 -0.739) 3.513 16.547 ( -6.297 16.074 -4.129) 17.750 17.298 ( 9.570 -5.990 2.460) 11.555 17.897 ( 3.224 -5.095 -0.813) 6.084 18.499 ( 0.794 -13.800 -2.245) 14.004 21.088 ( 4.998 10.433 -1.037) 11.615 21.527 ( 3.421 -1.359 2.053) 4.215 22.963 ( -4.617 12.513 0.421) 13.344 23.440 ( -7.484 -1.172 -1.384) 7.701 107.806 ( 0.078 -0.663 -0.221) 0.703 107.839 ( -0.292 -1.785 0.041) 1.810 108.440 ( -0.080 -0.475 -0.100) 0.492 108.449 ( -0.131 -0.800 0.002) 0.811 ======================= Grid point 403 (214/259) ======================= q-point: (-0.22 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.330 ( -5.906 9.345 -2.763) 11.395 2.813 ( -0.148 11.622 1.529) 11.723 2.913 ( 2.069 -1.199 0.583) 2.462 3.343 ( 1.809 10.007 -4.522) 11.130 3.846 ( 5.264 -7.339 -0.372) 9.039 3.898 ( 9.080 -10.462 2.860) 14.145 4.636 ( -4.679 4.899 -4.918) 8.371 4.719 ( -0.017 6.994 -1.585) 7.171 4.842 ( -0.636 4.940 2.910) 5.769 4.958 ( 1.868 5.357 -0.301) 5.681 5.109 ( -1.476 2.202 -3.482) 4.376 5.163 ( -0.134 3.397 -1.502) 3.717 7.602 ( -6.260 0.670 -1.281) 6.425 7.982 ( -11.870 -9.759 0.166) 15.368 8.547 ( 5.472 6.466 -0.369) 8.479 8.811 ( 8.726 -3.769 2.228) 9.763 9.490 ( 2.366 4.591 -0.767) 5.222 9.946 ( -11.071 -3.883 1.327) 11.806 10.045 ( 10.898 -3.907 -1.073) 11.627 10.262 ( -9.062 -7.298 -0.158) 11.636 10.892 ( 17.717 11.129 -0.059) 20.922 11.725 ( 12.039 -13.578 0.214) 18.148 12.404 ( -13.574 8.511 -0.676) 16.036 12.721 ( -6.732 -2.404 -1.295) 7.265 16.411 ( -4.442 17.465 -5.062) 18.718 17.459 ( 5.780 -14.600 1.714) 15.796 17.967 ( 4.823 -3.218 -0.710) 5.841 18.514 ( 2.420 -12.382 -1.052) 12.660 21.187 ( 6.337 11.667 -0.663) 13.294 21.621 ( 4.552 -1.435 3.104) 5.694 22.857 ( -6.296 11.835 -1.473) 13.486 23.267 ( -9.883 0.656 -1.444) 10.010 107.806 ( 0.093 -0.833 -0.224) 0.867 107.834 ( -0.329 -1.754 0.025) 1.784 108.437 ( -0.136 -0.591 -0.185) 0.634 108.446 ( -0.203 -0.846 -0.007) 0.870 ======================= Grid point 404 (215/259) ======================= q-point: (-0.11 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.221 ( -3.397 10.472 -3.185) 11.460 2.832 ( 1.738 2.186 -1.328) 3.093 2.945 ( 0.506 11.427 2.156) 11.639 3.352 ( 2.174 11.238 -3.361) 11.929 3.915 ( 2.974 -4.780 -0.596) 5.661 4.060 ( 5.976 -12.736 2.198) 14.239 4.528 ( -2.998 4.958 -4.365) 7.255 4.702 ( -0.887 2.394 -1.014) 2.747 4.838 ( -1.718 6.274 2.470) 6.958 4.986 ( 1.381 4.509 -0.146) 4.718 5.040 ( -2.752 3.181 -3.836) 5.693 5.155 ( 0.759 3.613 -2.409) 4.408 7.535 ( 0.358 -3.209 -1.383) 3.513 7.772 ( -10.726 -9.192 -0.334) 14.130 8.684 ( 8.821 6.782 -0.113) 11.128 8.960 ( 4.822 -1.719 1.786) 5.422 9.459 ( -5.256 2.681 0.133) 5.902 9.783 ( -6.380 -6.297 1.821) 9.147 10.144 ( -4.004 -5.738 -0.266) 7.002 10.156 ( 3.224 -3.674 -1.470) 5.105 11.281 ( 24.043 11.030 -0.819) 26.465 11.899 ( 3.952 -6.910 -0.342) 7.968 12.134 ( -13.037 8.052 -0.712) 15.340 12.579 ( -7.262 -5.828 -0.951) 9.360 16.317 ( -1.741 18.304 -5.113) 19.084 17.530 ( 1.383 -19.874 1.104) 19.953 18.039 ( 3.531 -2.767 -1.419) 4.705 18.564 ( 3.314 -11.730 -0.391) 12.195 21.288 ( 4.774 12.771 -0.298) 13.638 21.723 ( 3.588 -1.992 3.465) 5.371 22.732 ( -5.514 11.719 -2.267) 13.149 23.095 ( -7.216 2.817 -1.104) 7.825 107.806 ( 0.101 -1.035 -0.233) 1.066 107.829 ( -0.206 -1.750 0.008) 1.762 108.433 ( -0.137 -0.713 -0.189) 0.750 108.442 ( -0.172 -0.850 -0.010) 0.867 ======================= Grid point 405 (216/259) ======================= q-point: ( 0.00 0.46 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.408 ( 0.604 12.879 -3.236) 13.293 2.658 ( 0.704 -11.409 -2.454) 11.691 3.388 ( 1.104 18.793 2.387) 18.976 3.558 ( -0.238 6.870 -2.153) 7.203 3.800 ( 0.427 -8.168 0.451) 8.191 3.859 ( 0.621 -12.994 0.559) 13.021 4.557 ( -0.371 4.517 -1.995) 4.952 4.638 ( -0.899 -3.303 -0.605) 3.476 4.959 ( -1.856 4.931 -0.626) 5.306 5.003 ( -1.947 0.268 -1.895) 2.730 5.102 ( 0.927 4.504 -1.341) 4.790 5.169 ( 0.432 -1.570 -1.951) 2.541 7.513 ( 3.122 -1.903 -0.846) 3.753 7.520 ( -1.597 -2.549 -0.759) 3.102 8.907 ( -0.727 5.981 0.300) 6.032 9.000 ( 0.608 -2.706 0.339) 2.794 9.431 ( -1.836 4.413 2.308) 5.308 9.558 ( -0.832 -8.183 2.091) 8.486 10.069 ( -0.519 0.131 -0.797) 0.960 10.102 ( 0.009 -2.922 -1.951) 3.514 11.768 ( -0.921 4.792 -1.120) 5.006 11.832 ( 1.039 -0.283 -0.893) 1.399 12.125 ( -0.094 7.490 -0.346) 7.499 12.310 ( 0.022 -9.673 -0.362) 9.680 16.672 ( 0.614 20.880 -2.824) 21.079 17.102 ( -0.080 -21.967 -0.760) 21.981 18.120 ( 0.565 7.703 -0.973) 7.784 18.342 ( 1.042 -13.416 -0.654) 13.473 21.561 ( 0.200 8.951 0.802) 8.990 21.702 ( 0.252 -5.502 1.532) 5.717 22.878 ( -1.148 10.021 -0.575) 10.103 23.020 ( -0.250 -3.750 -0.427) 3.783 107.792 ( 0.070 -0.161 -0.294) 0.342 107.800 ( 0.069 -0.914 -0.223) 0.943 108.423 ( -0.019 -0.039 -0.184) 0.189 108.427 ( -0.010 -0.451 -0.141) 0.473 ======================= Grid point 406 (217/259) ======================= q-point: ( 0.11 0.46 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.415 ( 2.532 12.864 -2.545) 13.356 2.660 ( 1.469 -10.878 -2.106) 11.177 3.389 ( -2.389 17.229 1.368) 17.447 3.504 ( -4.079 6.925 -1.656) 8.206 3.767 ( -3.972 -6.283 -0.036) 7.433 3.837 ( -3.396 -13.923 0.032) 14.331 4.570 ( 2.793 4.464 -0.672) 5.308 4.636 ( 0.605 -2.073 0.531) 2.224 4.945 ( 0.102 3.595 1.201) 3.792 4.978 ( 0.185 0.419 -0.101) 0.469 5.103 ( 0.409 3.891 -1.554) 4.210 5.159 ( 0.216 -1.390 -2.027) 2.467 7.541 ( 4.954 2.112 -1.293) 5.538 7.623 ( 9.250 -5.992 -0.750) 11.047 8.799 ( -9.216 7.128 0.877) 11.684 8.927 ( -7.705 -5.437 0.264) 9.434 9.501 ( 4.644 6.337 2.556) 8.262 9.648 ( 6.868 -8.111 2.184) 10.850 10.028 ( -3.245 0.874 -0.247) 3.370 10.087 ( 0.959 -4.794 -1.646) 5.158 11.499 ( -18.903 11.287 -0.417) 22.020 11.715 ( -13.391 -10.198 -0.323) 16.835 12.293 ( 13.900 7.849 -0.398) 15.968 12.438 ( 10.492 -6.661 -0.328) 12.432 16.681 ( 2.492 20.711 -2.232) 20.980 17.100 ( 0.230 -21.012 -0.345) 21.016 18.102 ( -1.608 8.095 -1.059) 8.321 18.335 ( -0.807 -14.090 -1.396) 14.182 21.527 ( -4.116 9.410 0.259) 10.274 21.680 ( -3.573 -6.126 0.692) 7.126 22.902 ( 3.563 11.321 0.655) 11.887 23.068 ( 5.444 -4.859 -0.057) 7.298 107.792 ( 0.174 -0.111 -0.250) 0.324 107.801 ( 0.241 -0.980 -0.195) 1.028 108.423 ( 0.143 -0.014 -0.104) 0.178 108.427 ( 0.136 -0.456 -0.086) 0.484 ======================= Grid point 407 (218/259) ======================= q-point: ( 0.22 0.46 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.460 ( 4.063 11.501 -1.532) 12.293 2.679 ( 2.107 -9.652 -1.627) 10.012 3.335 ( -3.716 13.540 -0.442) 14.048 3.397 ( -6.688 6.608 0.127) 9.402 3.677 ( -5.577 -5.195 0.568) 7.642 3.749 ( -5.623 -11.911 -0.502) 13.181 4.637 ( 4.354 3.250 0.329) 5.443 4.660 ( 1.060 0.637 1.430) 1.891 4.970 ( 0.619 3.013 2.337) 3.863 5.000 ( 1.354 0.110 1.047) 1.715 5.098 ( 0.522 3.411 -1.578) 3.795 5.152 ( 0.657 -1.611 -1.645) 2.394 7.671 ( 10.137 5.776 -1.071) 11.716 7.816 ( 12.141 -8.408 -0.731) 14.786 8.650 ( -7.163 6.820 1.039) 9.945 8.778 ( -8.102 -5.945 0.109) 10.050 9.538 ( -3.888 7.889 2.614) 9.175 9.721 ( -4.711 -10.241 3.101) 11.691 10.022 ( 5.703 4.825 -0.308) 7.476 10.152 ( 8.050 -7.932 -1.391) 11.387 11.162 ( -17.455 13.924 -0.307) 22.331 11.445 ( -15.511 -14.170 0.050) 21.009 12.526 ( 11.465 5.539 0.125) 12.734 12.617 ( 8.866 -3.670 0.366) 9.603 16.726 ( 3.843 19.245 -1.267) 19.665 17.101 ( -0.223 -18.217 0.185) 18.219 18.052 ( -2.745 8.644 -1.402) 9.178 18.298 ( -1.391 -14.785 -2.492) 15.058 21.431 ( -6.071 9.941 -0.419) 11.656 21.595 ( -5.680 -6.616 -0.097) 8.721 23.003 ( 6.100 12.344 1.898) 13.899 23.196 ( 7.977 -6.444 0.342) 10.260 107.794 ( 0.253 -0.008 -0.205) 0.326 107.805 ( 0.323 -1.052 -0.150) 1.110 108.426 ( 0.262 -0.001 -0.030) 0.264 108.430 ( 0.235 -0.427 -0.028) 0.488 ======================= Grid point 408 (219/259) ======================= q-point: ( 0.33 0.46 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.535 ( 4.975 8.923 -0.551) 10.231 2.708 ( 2.055 -7.699 -1.170) 8.054 3.243 ( -4.996 8.356 -3.244) 10.262 3.297 ( -5.081 5.398 3.275) 8.104 3.595 ( -3.800 -4.129 1.141) 5.727 3.646 ( -5.194 -7.566 0.099) 9.178 4.692 ( 1.208 3.444 1.540) 3.961 4.718 ( 3.923 1.280 0.612) 4.172 4.989 ( 0.017 3.345 0.948) 3.477 5.026 ( 0.796 -0.469 0.060) 0.926 5.105 ( 1.062 3.127 -0.058) 3.303 5.163 ( 1.312 -1.735 -0.094) 2.177 7.864 ( 10.814 7.239 -0.192) 13.014 8.018 ( 9.557 -7.671 -0.157) 12.256 8.582 ( -0.575 4.290 0.414) 4.348 8.663 ( -3.985 -3.929 -0.473) 5.616 9.423 ( -9.399 5.751 2.376) 11.272 9.555 ( -13.550 -7.047 2.922) 15.550 10.187 ( 10.488 5.404 0.103) 11.799 10.333 ( 11.697 -8.439 -0.764) 14.444 10.883 ( -12.837 12.498 -0.251) 17.918 11.172 ( -14.747 -15.658 0.054) 21.509 12.701 ( 7.580 3.837 0.686) 8.523 12.754 ( 5.689 -1.616 1.147) 6.024 16.796 ( 4.479 15.956 -0.143) 16.574 17.089 ( -1.377 -13.495 0.447) 13.573 17.989 ( -2.580 9.421 -2.036) 9.978 18.254 ( -0.901 -15.648 -3.433) 16.045 21.320 ( -5.227 10.122 -0.865) 11.424 21.490 ( -5.247 -6.778 -0.485) 8.585 23.130 ( 5.620 12.627 2.608) 14.065 23.337 ( 6.817 -7.606 0.573) 10.230 107.798 ( 0.260 0.095 -0.180) 0.330 107.810 ( 0.291 -1.093 -0.111) 1.136 108.431 ( 0.278 -0.004 0.006) 0.278 108.435 ( 0.242 -0.379 0.000) 0.450 ======================= Grid point 409 (220/259) ======================= q-point: (-0.56 0.46 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.619 ( 4.303 5.491 -0.396) 6.988 2.726 ( 0.734 -4.620 -0.982) 4.780 3.135 ( -4.615 8.289 -1.039) 9.544 3.260 ( -1.049 -2.086 1.653) 2.861 3.563 ( -0.995 -2.411 0.102) 2.610 3.577 ( -2.484 -2.842 1.985) 4.264 4.728 ( 1.896 4.549 0.775) 4.989 4.778 ( 2.376 -0.421 0.003) 2.413 4.992 ( 0.316 3.843 -0.495) 3.887 5.026 ( -0.147 0.377 -1.316) 1.377 5.129 ( 0.862 2.834 1.179) 3.188 5.191 ( 1.226 -1.771 1.025) 2.385 8.011 ( 4.113 6.911 0.812) 8.084 8.133 ( 3.038 -5.156 0.588) 6.013 8.610 ( 0.825 0.909 -0.557) 1.348 8.637 ( 1.462 -1.295 -0.632) 2.052 9.299 ( -4.057 2.488 1.775) 5.079 9.360 ( -7.495 -3.371 1.963) 8.450 10.367 ( 8.726 7.498 0.265) 11.508 10.483 ( 1.435 -0.315 -0.272) 1.495 10.740 ( 0.039 -0.252 -0.016) 0.255 10.923 ( -12.384 -14.835 0.082) 19.325 12.805 ( 3.146 2.871 0.668) 4.312 12.836 ( 2.382 -0.413 1.297) 2.743 16.876 ( 3.654 11.127 0.571) 11.725 17.060 ( -1.757 -7.752 0.194) 7.951 17.937 ( -1.154 10.079 -2.339) 10.411 18.218 ( -0.111 -16.294 -3.586) 16.684 21.244 ( -2.195 9.984 -0.875) 10.260 21.414 ( -2.569 -6.649 -0.357) 7.137 23.227 ( 2.613 12.156 2.464) 12.676 23.432 ( 2.935 -7.950 0.456) 8.487 107.800 ( 0.187 0.160 -0.185) 0.308 107.813 ( 0.161 -1.094 -0.099) 1.110 108.435 ( 0.184 -0.019 -0.008) 0.185 108.438 ( 0.156 -0.336 -0.017) 0.371 ======================= Grid point 410 (221/259) ======================= q-point: (-0.44 0.46 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.652 ( -0.503 3.778 -1.716) 4.180 2.730 ( 0.942 -3.744 -0.990) 3.986 3.077 ( -1.457 11.108 1.145) 11.261 3.289 ( 3.328 -9.015 0.568) 9.627 3.543 ( -0.383 2.796 0.522) 2.870 3.603 ( 2.653 -3.690 1.218) 4.705 4.766 ( 1.830 3.249 -0.805) 3.815 4.802 ( 0.663 -0.889 -0.961) 1.467 4.988 ( -0.313 4.380 -0.455) 4.415 5.019 ( 1.241 2.647 -1.788) 3.426 5.147 ( 0.194 2.424 0.841) 2.573 5.213 ( 0.271 -1.840 0.692) 1.985 8.013 ( -4.484 7.035 0.734) 8.375 8.139 ( -3.075 -5.524 0.344) 6.331 8.583 ( -2.144 0.908 0.579) 2.399 8.617 ( -3.716 -1.517 0.079) 4.014 9.344 ( 7.444 2.512 0.079) 7.856 9.399 ( 10.556 -2.640 0.436) 10.890 10.367 ( -9.290 7.446 0.230) 11.907 10.475 ( -1.767 0.263 -0.006) 1.787 10.731 ( -1.251 -0.422 0.310) 1.356 10.915 ( 11.516 -15.284 0.378) 19.141 12.817 ( -2.164 3.362 0.197) 4.003 12.858 ( -0.999 -0.781 0.442) 1.343 16.903 ( -1.311 9.325 -0.491) 9.429 17.057 ( 1.658 -6.281 0.361) 6.506 17.920 ( 1.249 10.131 -1.762) 10.359 18.199 ( 0.845 -15.977 -2.864) 16.253 21.234 ( 1.753 9.797 -0.492) 9.965 21.400 ( 1.144 -6.322 0.232) 6.429 23.252 ( -1.656 11.214 1.499) 11.434 23.442 ( -2.098 -7.510 0.027) 7.798 107.801 ( 0.072 0.165 -0.217) 0.282 107.813 ( -0.011 -1.062 -0.119) 1.068 108.437 ( 0.027 -0.040 -0.071) 0.086 108.440 ( 0.012 -0.319 -0.068) 0.326 ======================= Grid point 411 (222/259) ======================= q-point: (-0.33 0.46 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.594 ( -3.239 6.232 -2.786) 7.556 2.728 ( -0.248 -7.165 -1.913) 7.420 3.106 ( 2.805 14.698 2.732) 15.211 3.380 ( 6.187 -10.962 -0.334) 12.592 3.563 ( 2.071 4.305 0.915) 4.864 3.674 ( 4.362 -5.349 0.147) 6.904 4.763 ( -1.204 1.477 -2.195) 2.906 4.783 ( -1.523 -0.873 -1.798) 2.513 4.998 ( 1.976 6.835 -0.027) 7.115 5.039 ( 2.320 3.498 -2.125) 4.704 5.145 ( -0.687 1.431 -0.372) 1.630 5.208 ( -1.083 -1.894 -0.150) 2.187 7.868 ( -10.962 6.839 -0.279) 12.923 8.014 ( -10.552 -7.569 -0.021) 12.986 8.577 ( 1.034 1.840 0.591) 2.192 8.608 ( 3.955 -1.562 1.673) 4.570 9.509 ( 9.430 6.210 -0.786) 11.319 9.645 ( 13.936 -6.908 -0.429) 15.560 10.186 ( -10.302 5.057 0.041) 11.476 10.315 ( -11.781 -7.218 -0.243) 13.818 10.863 ( 12.568 12.514 0.544) 17.744 11.158 ( 14.567 -16.290 0.560) 21.861 12.731 ( -7.199 4.726 -0.526) 8.628 12.800 ( -5.382 -2.207 -0.625) 5.851 16.843 ( -3.521 13.593 -2.026) 14.187 17.099 ( 2.000 -12.114 0.173) 12.279 17.957 ( 3.695 9.351 -0.815) 10.088 18.209 ( 2.226 -14.550 -1.728) 14.820 21.296 ( 5.001 9.669 0.096) 10.886 21.455 ( 4.169 -5.890 1.041) 7.290 23.192 ( -5.433 10.185 0.168) 11.544 23.361 ( -6.411 -6.482 -0.462) 9.129 107.800 ( -0.025 0.104 -0.261) 0.282 107.811 ( -0.150 -1.007 -0.161) 1.031 108.435 ( -0.116 -0.061 -0.161) 0.207 108.438 ( -0.124 -0.332 -0.120) 0.374 ======================= Grid point 412 (223/259) ======================= q-point: (-0.22 0.46 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.511 ( -3.054 9.122 -3.438) 10.216 2.699 ( -0.722 -9.481 -2.492) 9.830 3.203 ( 4.971 17.042 3.309) 18.058 3.485 ( 5.776 -4.085 -1.893) 7.323 3.634 ( 4.583 -2.247 2.070) 5.508 3.753 ( 4.426 -7.172 -0.541) 8.445 4.694 ( -3.678 2.211 -2.802) 5.125 4.733 ( -2.394 -1.539 -1.806) 3.370 5.043 ( 1.849 8.572 -0.079) 8.770 5.055 ( 1.171 4.073 -2.250) 4.798 5.119 ( -0.949 -0.391 -2.421) 2.629 5.180 ( -1.138 -2.361 -0.732) 2.721 7.663 ( -10.029 5.232 -0.818) 11.341 7.800 ( -11.911 -8.190 -0.144) 14.455 8.659 ( 6.971 4.684 0.612) 8.421 8.739 ( 8.402 -3.565 1.634) 9.272 9.615 ( 1.220 7.640 -0.111) 7.738 9.786 ( -2.118 -9.246 1.028) 9.541 10.051 ( -0.809 2.582 -1.728) 3.210 10.132 ( -6.621 -5.460 -0.985) 8.638 11.149 ( 18.449 14.059 0.172) 23.196 11.440 ( 16.092 -14.695 0.247) 21.794 12.553 ( -11.862 6.330 -0.937) 13.478 12.657 ( -9.540 -4.131 -1.184) 10.463 16.764 ( -2.967 17.684 -2.797) 18.148 17.119 ( 0.392 -17.847 -0.491) 17.858 18.029 ( 4.455 8.120 -0.504) 9.275 18.252 ( 3.375 -13.102 -0.769) 13.551 21.403 ( 6.168 9.424 0.651) 11.282 21.553 ( 5.180 -5.451 1.714) 7.712 23.073 ( -7.008 9.406 -0.885) 11.763 23.221 ( -8.124 -5.104 -0.728) 9.622 107.797 ( -0.055 -0.006 -0.298) 0.303 107.806 ( -0.192 -0.945 -0.203) 0.985 108.431 ( -0.185 -0.071 -0.229) 0.303 108.434 ( -0.183 -0.369 -0.157) 0.441 ======================= Grid point 413 (224/259) ======================= q-point: (-0.11 0.46 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 468 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.442 ( -1.488 11.527 -3.572) 12.159 2.672 ( -0.107 -10.927 -2.615) 11.236 3.316 ( 4.310 18.584 3.132) 19.333 3.548 ( 3.112 4.400 -2.459) 5.924 3.741 ( 4.649 -9.393 2.036) 10.676 3.820 ( 3.249 -9.331 -0.297) 9.885 4.609 ( -3.032 3.675 -2.768) 5.510 4.676 ( -2.324 -2.876 -1.445) 3.970 5.011 ( -2.581 6.491 -1.456) 7.135 5.064 ( -2.426 1.004 -2.045) 3.328 5.088 ( 1.859 3.943 -1.947) 4.774 5.171 ( 0.772 -2.154 -1.572) 2.776 7.526 ( -4.064 2.182 -0.810) 4.683 7.614 ( -8.014 -6.372 -0.401) 10.246 8.811 ( 8.585 5.736 0.320) 10.330 8.906 ( 8.043 -3.679 1.127) 8.916 9.537 ( -8.659 4.895 1.215) 10.021 9.651 ( -9.558 -6.411 2.023) 11.686 10.074 ( 0.242 -1.206 -1.577) 2.000 10.090 ( 3.230 -2.480 -2.157) 4.609 11.503 ( 20.092 11.138 -0.626) 22.981 11.719 ( 13.867 -10.223 -0.501) 17.236 12.303 ( -14.317 8.166 -0.767) 16.500 12.454 ( -11.388 -6.843 -0.943) 13.319 16.701 ( -1.387 19.980 -3.017) 20.254 17.113 ( -0.332 -21.048 -0.841) 21.067 18.094 ( 3.010 7.533 -0.779) 8.149 18.308 ( 2.973 -12.829 -0.397) 13.175 21.509 ( 4.448 9.039 0.938) 10.117 21.651 ( 3.728 -5.229 1.933) 6.707 22.947 ( -5.434 9.256 -1.183) 10.798 23.083 ( -5.892 -3.912 -0.677) 7.105 107.794 ( -0.014 -0.117 -0.313) 0.334 107.802 ( -0.108 -0.902 -0.226) 0.936 108.426 ( -0.149 -0.062 -0.236) 0.286 108.430 ( -0.136 -0.416 -0.167) 0.469 ======================= Grid point 468 (225/259) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 133 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.907 ( -0.000 0.000 0.000) 0.000 1.662 ( -0.000 0.000 0.000) 0.000 2.590 ( -0.000 0.000 0.000) 0.000 2.678 ( 0.000 0.000 0.000) 0.000 2.876 ( -0.000 0.000 0.000) 0.000 3.345 ( -0.000 0.000 0.000) 0.000 4.207 ( -0.000 0.000 0.000) 0.000 4.465 ( -0.000 0.000 0.000) 0.000 4.480 ( -0.000 0.000 0.000) 0.000 5.092 ( 0.000 0.000 0.000) 0.000 5.153 ( -0.000 0.000 0.000) 0.000 6.286 ( -0.000 0.000 0.000) 0.000 8.010 ( 0.000 0.000 0.000) 0.000 8.093 ( -0.000 0.000 0.000) 0.000 8.305 ( -0.000 0.000 0.000) 0.000 9.184 ( -0.000 0.000 0.000) 0.000 9.409 ( -0.000 0.000 0.000) 0.000 9.701 ( -0.000 0.000 0.000) 0.000 9.974 ( -0.000 0.000 0.000) 0.000 10.629 ( 0.000 0.000 0.000) 0.000 10.987 ( 0.000 0.000 0.000) 0.000 11.586 ( -0.000 0.000 0.000) 0.000 12.164 ( -0.000 0.000 0.000) 0.000 13.624 ( -0.000 0.000 0.000) 0.000 14.860 ( -0.000 0.000 0.000) 0.000 15.326 ( -0.000 0.000 0.000) 0.000 19.855 ( -0.000 0.000 0.000) 0.000 20.229 ( -0.000 0.000 0.000) 0.000 20.725 ( -0.000 0.000 0.000) 0.000 20.809 ( 0.000 0.000 0.000) 0.000 21.811 ( -0.000 0.000 0.000) 0.000 22.256 ( -0.000 0.000 0.000) 0.000 107.945 ( -0.000 0.000 0.000) 0.000 107.990 ( 0.000 0.000 0.000) 0.000 108.607 ( -0.000 0.000 0.000) 0.000 108.663 ( -0.000 0.000 0.000) 0.000 ======================= Grid point 470 (226/259) ======================= q-point: ( 0.11 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.195 ( 28.906 0.000 -4.818) 29.305 1.713 ( 8.877 0.000 -7.859) 11.856 2.549 ( -6.939 0.000 -12.248) 14.077 2.669 ( 7.370 0.000 2.357) 7.738 2.880 ( -1.710 0.000 4.672) 4.975 3.357 ( -2.383 0.000 6.415) 6.843 4.200 ( -0.997 0.000 0.889) 1.336 4.472 ( 1.292 0.000 -0.728) 1.483 4.474 ( -0.456 0.000 -0.620) 0.769 5.019 ( -7.003 0.000 2.324) 7.378 5.145 ( -0.532 0.000 -6.317) 6.340 6.141 ( -15.696 0.000 5.265) 16.555 7.979 ( -2.606 0.000 -0.487) 2.651 8.080 ( -1.387 0.000 0.042) 1.388 8.549 ( 21.848 0.000 2.289) 21.967 9.047 ( -10.950 0.000 -0.050) 10.950 9.533 ( 9.611 0.000 -0.132) 9.612 9.678 ( -0.477 0.000 -5.489) 5.510 9.977 ( 0.262 0.000 0.034) 0.264 10.690 ( 6.758 0.000 1.175) 6.859 10.928 ( -5.081 0.000 0.762) 5.138 11.644 ( 3.860 0.000 1.728) 4.229 12.190 ( 3.376 0.000 -0.947) 3.506 13.512 ( -11.720 0.000 -0.041) 11.720 14.872 ( 1.869 0.000 -1.278) 2.264 15.323 ( -1.069 0.000 1.737) 2.040 19.870 ( 1.525 0.000 -0.337) 1.562 20.242 ( 1.509 0.000 -0.206) 1.523 20.709 ( -1.832 0.000 0.102) 1.835 20.882 ( 8.476 0.000 -2.566) 8.856 21.851 ( 4.518 0.000 0.764) 4.582 22.228 ( -3.473 0.000 0.958) 3.602 107.936 ( -0.850 0.000 -0.173) 0.867 107.994 ( 0.494 0.000 -0.353) 0.607 108.591 ( -1.069 0.000 -0.703) 1.279 108.668 ( -0.867 0.000 2.460) 2.608 ======================= Grid point 471 (227/259) ======================= q-point: ( 0.22 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.653 ( 20.114 0.000 -9.175) 22.108 1.859 ( 15.519 0.000 -12.125) 19.694 2.383 ( 4.857 0.000 -11.775) 12.737 2.862 ( 9.596 0.000 5.591) 11.106 2.870 ( -5.055 0.000 7.602) 9.129 3.346 ( -2.699 0.000 5.394) 6.032 4.193 ( -0.687 0.000 1.959) 2.076 4.453 ( -1.162 0.000 -1.338) 1.772 4.502 ( 2.321 0.000 -0.202) 2.330 4.907 ( -6.494 0.000 0.987) 6.569 5.005 ( -9.045 0.000 -8.038) 12.101 5.887 ( -14.930 0.000 3.326) 15.296 7.921 ( -2.955 0.000 -1.006) 3.121 8.047 ( -2.120 0.000 0.084) 2.122 8.850 ( -10.255 0.000 -0.194) 10.257 8.967 ( 18.864 0.000 4.460) 19.384 9.597 ( -3.834 0.000 -5.070) 6.357 9.698 ( 8.386 0.000 -0.110) 8.386 9.982 ( 0.196 0.000 0.053) 0.203 10.816 ( -0.127 0.000 0.057) 0.139 10.951 ( 12.515 0.000 3.511) 12.998 11.696 ( -0.371 0.000 2.458) 2.486 12.267 ( 6.016 0.000 -1.654) 6.239 13.250 ( -15.407 0.000 -0.913) 15.434 14.904 ( 3.070 0.000 -2.207) 3.781 15.314 ( -1.856 0.000 2.905) 3.447 19.895 ( 1.836 0.000 -1.359) 2.284 20.280 ( 2.896 0.000 -0.364) 2.919 20.663 ( -3.387 0.000 0.206) 3.393 21.033 ( 9.425 0.000 -2.968) 9.882 21.997 ( 9.875 0.000 3.329) 10.421 22.149 ( -6.073 0.000 1.433) 6.239 107.916 ( -1.020 0.000 -0.426) 1.105 108.001 ( 0.525 0.000 -0.442) 0.687 108.568 ( -1.027 0.000 -0.303) 1.071 108.659 ( -2.161 0.000 2.395) 3.226 ======================= Grid point 472 (228/259) ======================= q-point: ( 0.33 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.657 ( -3.891 0.000 -12.599) 13.186 2.076 ( 18.236 0.000 -12.329) 22.013 2.599 ( 16.413 0.000 -4.766) 17.091 2.799 ( -9.685 0.000 8.599) 12.951 3.065 ( 8.821 0.000 5.670) 10.487 3.426 ( 9.461 0.000 5.616) 11.003 4.212 ( 0.820 0.000 2.904) 3.018 4.411 ( -1.945 0.000 -2.107) 2.867 4.542 ( 1.071 0.000 0.948) 1.430 4.701 ( -15.099 0.000 -10.763) 18.542 4.826 ( -4.295 0.000 2.214) 4.832 5.663 ( -11.143 0.000 -0.407) 11.151 7.867 ( -2.001 0.000 -1.081) 2.274 8.011 ( -1.871 0.000 0.095) 1.873 8.689 ( -7.097 0.000 -0.239) 7.101 9.255 ( 10.278 0.000 2.174) 10.505 9.486 ( -4.809 0.000 -1.697) 5.100 9.827 ( 6.006 0.000 -0.063) 6.006 9.982 ( -0.393 0.000 0.053) 0.397 10.804 ( -0.507 0.000 1.382) 1.472 11.243 ( 13.417 0.000 2.639) 13.674 11.670 ( -4.148 0.000 2.227) 4.708 12.381 ( 8.285 0.000 -0.982) 8.343 12.989 ( -12.124 0.000 -1.398) 12.204 14.944 ( 2.993 0.000 -2.285) 3.766 15.301 ( -1.938 0.000 2.892) 3.482 19.913 ( 1.398 0.000 -1.592) 2.119 20.339 ( 3.976 0.000 -0.442) 4.000 20.593 ( -4.404 0.000 0.304) 4.414 21.152 ( 6.197 0.000 -2.869) 6.829 22.041 ( -6.771 0.000 1.808) 7.009 22.224 ( 10.353 0.000 4.600) 11.329 107.896 ( -0.756 0.000 -0.473) 0.891 108.006 ( 0.374 0.000 -0.348) 0.511 108.551 ( -0.634 0.000 -0.036) 0.635 108.632 ( -2.220 0.000 1.341) 2.594 ======================= Grid point 473 (229/259) ======================= q-point: ( 0.44 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 259 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.510 ( -2.738 0.000 -5.380) 6.037 2.297 ( 13.049 0.000 -8.017) 15.315 2.667 ( -9.858 0.000 6.588) 11.857 2.717 ( 1.483 0.000 -0.837) 1.702 3.247 ( 5.924 0.000 0.582) 5.953 3.785 ( 22.402 0.000 8.556) 23.981 4.260 ( 1.633 0.000 2.569) 3.044 4.275 ( -21.846 0.000 -9.120) 23.673 4.356 ( -1.929 0.000 -2.184) 2.914 4.567 ( -0.080 0.000 0.272) 0.283 4.805 ( -0.167 0.000 0.955) 0.969 5.502 ( -4.938 0.000 -1.127) 5.065 7.837 ( -0.669 0.000 -0.496) 0.833 7.987 ( -0.744 0.000 0.043) 0.745 8.599 ( -2.530 0.000 -0.109) 2.532 9.364 ( 1.301 0.000 -0.856) 1.557 9.435 ( -0.025 0.000 1.090) 1.090 9.912 ( 3.316 0.000 -0.035) 3.316 9.966 ( -1.373 0.000 0.038) 1.374 10.815 ( 0.373 0.000 0.712) 0.804 11.417 ( 4.244 0.000 1.210) 4.414 11.605 ( -3.003 0.000 0.322) 3.020 12.561 ( 10.830 0.000 1.386) 10.919 12.779 ( -10.451 0.000 -1.829) 10.610 14.971 ( 1.292 0.000 -1.029) 1.651 15.291 ( -0.878 0.000 1.267) 1.542 19.922 ( 0.520 0.000 -0.661) 0.841 20.411 ( 3.988 0.000 -0.385) 4.007 20.515 ( -4.157 0.000 0.330) 4.170 21.215 ( 2.476 0.000 -1.343) 2.817 21.954 ( -3.223 0.000 0.790) 3.318 22.389 ( 4.105 0.000 2.252) 4.682 107.884 ( -0.272 0.000 -0.205) 0.341 108.009 ( 0.136 0.000 -0.132) 0.189 108.544 ( -0.200 0.000 0.016) 0.200 108.608 ( -0.912 0.000 0.382) 0.989 ======================= Grid point 478 (230/259) ======================= q-point: ( 0.00 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 241 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.095 ( -0.000 17.175 0.000) 17.175 1.882 ( -0.000 19.540 0.000) 19.540 2.476 ( -0.000 -12.627 0.000) 12.627 2.628 ( -0.000 3.780 0.000) 3.780 3.125 ( -0.000 17.182 0.000) 17.182 3.382 ( -0.000 3.923 0.000) 3.923 4.293 ( -0.000 8.097 0.000) 8.097 4.474 ( 0.000 0.952 0.000) 0.952 4.515 ( -0.000 3.262 0.000) 3.262 5.067 ( 0.000 -2.452 -0.000) 2.452 5.099 ( -0.000 -5.301 0.000) 5.301 5.932 ( -0.000 -26.819 0.000) 26.819 8.001 ( 0.000 -0.478 0.000) 0.478 8.299 ( -0.000 -0.763 0.000) 0.763 8.439 ( -0.000 22.647 0.000) 22.647 9.163 ( -0.000 -17.645 0.000) 17.645 9.272 ( 0.000 11.084 0.000) 11.084 9.806 ( -0.000 0.239 0.000) 0.239 9.978 ( -0.000 4.433 0.000) 4.433 10.609 ( 0.000 -2.026 0.000) 2.026 10.965 ( 0.000 -1.720 0.000) 1.720 11.536 ( -0.000 -4.072 0.000) 4.072 12.164 ( -0.000 0.011 0.000) 0.011 13.384 ( -0.000 -17.263 0.000) 17.263 14.976 ( -0.000 10.756 0.000) 10.756 15.905 ( -0.000 48.413 0.000) 48.413 19.690 ( -0.000 -14.806 0.000) 14.806 19.773 ( -0.000 -31.676 0.000) 31.676 20.779 ( -0.000 3.609 0.000) 3.609 21.206 ( -0.000 25.631 0.000) 25.631 21.835 ( -0.000 2.839 0.000) 2.839 22.283 ( -0.000 2.872 0.000) 2.872 107.937 ( -0.000 -0.840 0.000) 0.840 107.982 ( 0.000 -0.826 0.000) 0.826 108.588 ( -0.000 -1.812 0.000) 1.812 108.636 ( -0.000 -2.515 0.000) 2.515 ======================= Grid point 480 (231/259) ======================= q-point: ( 0.11 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.301 ( 21.591 10.989 -3.640) 24.499 1.923 ( 8.337 17.068 -11.335) 22.120 2.429 ( -2.987 -6.824 -1.787) 7.661 2.696 ( 6.366 2.780 2.228) 7.295 3.091 ( -2.627 16.295 -0.748) 16.522 3.388 ( -2.608 3.563 5.719) 7.225 4.287 ( -1.071 8.079 1.214) 8.240 4.465 ( -0.742 0.430 -0.109) 0.864 4.525 ( 1.463 3.773 -1.011) 4.171 4.997 ( -6.675 -2.179 2.672) 7.513 5.086 ( -0.870 -5.551 -6.286) 8.431 5.873 ( -7.644 -21.544 4.007) 23.208 7.964 ( -3.070 -0.346 0.488) 3.128 8.194 ( -8.028 5.461 0.533) 9.724 8.596 ( 10.661 0.633 1.427) 10.775 9.172 ( -2.318 15.128 -0.156) 15.305 9.328 ( 9.807 -12.099 -1.309) 15.629 9.806 ( -0.038 1.006 -1.207) 1.572 9.962 ( -0.723 2.974 -2.484) 3.942 10.670 ( 6.732 -2.004 1.027) 7.098 10.900 ( -5.084 -2.537 0.282) 5.688 11.609 ( 5.274 -2.415 2.107) 6.171 12.186 ( 2.919 -0.302 -0.952) 3.085 13.310 ( -7.103 -14.724 -1.480) 16.415 15.002 ( 1.550 10.948 2.802) 11.407 15.849 ( -6.254 45.466 0.688) 45.899 19.693 ( 1.436 -15.998 -2.101) 16.200 19.821 ( 3.485 -30.325 2.923) 30.664 20.759 ( -1.267 3.917 -1.942) 4.552 21.213 ( 2.432 20.832 -4.206) 21.391 21.917 ( 7.192 6.620 4.146) 10.618 22.260 ( -2.500 3.574 0.079) 4.362 107.928 ( -0.791 -0.777 -0.167) 1.121 107.986 ( 0.471 -0.848 -0.340) 1.028 108.574 ( -0.923 -1.590 -0.552) 1.920 108.640 ( -0.677 -2.595 1.931) 3.305 ======================= Grid point 481 (232/259) ======================= q-point: ( 0.22 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.686 ( 20.972 4.953 -6.730) 22.575 1.943 ( 5.979 4.637 -17.461) 19.030 2.457 ( 9.872 9.159 -0.763) 13.487 2.871 ( 9.527 1.106 3.970) 10.380 3.034 ( -4.870 14.358 3.474) 15.555 3.366 ( -3.310 2.904 4.959) 6.632 4.278 ( -1.210 7.281 2.135) 7.683 4.449 ( -1.131 0.506 0.321) 1.280 4.552 ( 2.510 4.280 -1.226) 5.110 4.894 ( -6.134 -1.219 1.608) 6.457 4.952 ( -8.257 -4.896 -7.742) 12.332 5.738 ( -9.793 -13.304 2.771) 16.750 7.921 ( -1.982 0.398 0.081) 2.023 8.060 ( -6.465 0.261 0.093) 6.471 8.714 ( -0.131 -8.111 0.418) 8.123 9.158 ( 2.818 10.756 1.389) 11.205 9.512 ( 7.985 -2.745 -1.259) 8.537 9.774 ( -1.682 1.314 -1.063) 2.385 9.922 ( -1.686 -2.779 -1.362) 3.524 10.804 ( 0.683 -1.697 -0.209) 1.841 10.916 ( 12.492 -3.190 2.555) 13.143 11.702 ( 2.499 1.501 2.647) 3.937 12.253 ( 5.245 -1.253 -1.339) 5.556 13.133 ( -10.203 -9.007 -2.025) 13.760 15.067 ( 2.712 11.928 3.856) 12.826 15.710 ( -8.823 37.555 0.049) 38.578 19.709 ( 2.298 -15.976 -2.760) 16.375 19.921 ( 4.040 -29.612 4.383) 30.206 20.708 ( -2.161 4.485 -2.983) 5.804 21.226 ( 2.948 12.379 -5.304) 13.786 22.116 ( 4.998 6.644 7.595) 11.261 22.220 ( 2.521 10.942 -0.541) 11.242 107.909 ( -0.955 -0.650 -0.398) 1.222 107.992 ( 0.510 -0.872 -0.432) 1.098 108.554 ( -0.897 -1.281 -0.230) 1.580 108.633 ( -1.728 -2.427 1.902) 3.535 ======================= Grid point 482 (233/259) ======================= q-point: ( 0.33 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.725 ( -2.652 6.529 -11.221) 13.251 2.108 ( 20.594 3.219 -12.171) 24.137 2.672 ( 7.338 6.557 3.009) 10.290 2.946 ( -5.853 12.702 1.838) 14.105 3.086 ( 8.846 2.450 4.737) 10.329 3.429 ( 8.997 1.952 5.490) 10.719 4.272 ( -1.457 3.240 2.054) 4.104 4.432 ( -0.853 3.496 0.467) 3.629 4.590 ( 1.527 4.566 -0.236) 4.821 4.680 ( -13.847 -1.724 -9.150) 16.686 4.814 ( -3.852 -0.983 1.610) 4.289 5.576 ( -8.819 -8.195 -0.239) 12.041 7.890 ( -0.994 1.914 -1.092) 2.417 7.973 ( -3.561 -3.136 0.611) 4.784 8.645 ( -5.230 -3.842 -0.293) 6.496 9.270 ( 6.711 0.010 0.781) 6.757 9.516 ( -4.817 2.945 -0.548) 5.672 9.796 ( 3.803 -3.229 -0.242) 4.994 9.889 ( -1.296 -7.088 -0.313) 7.212 10.799 ( -0.476 -0.995 0.966) 1.466 11.202 ( 13.595 -3.916 1.855) 14.269 11.740 ( -0.002 7.182 1.993) 7.453 12.357 ( 7.390 -2.377 -0.279) 7.768 12.937 ( -9.623 -4.362 -1.913) 10.737 15.154 ( 3.839 14.633 3.451) 15.517 15.550 ( -8.202 27.231 -1.014) 28.457 19.730 ( 1.907 -15.331 -2.190) 15.604 20.018 ( 3.011 -29.516 3.859) 29.919 20.644 ( -2.283 5.375 -2.772) 6.464 21.242 ( 2.752 6.540 -3.977) 8.134 22.085 ( -5.397 4.286 1.828) 7.130 22.431 ( 10.916 17.740 5.046) 21.432 107.891 ( -0.709 -0.523 -0.437) 0.983 107.997 ( 0.365 -0.885 -0.342) 1.017 108.540 ( -0.557 -1.076 -0.013) 1.211 108.611 ( -1.804 -1.950 1.090) 2.872 ======================= Grid point 483 (234/259) ======================= q-point: ( 0.44 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.617 ( -1.521 10.097 -4.552) 11.179 2.347 ( 12.453 4.248 -7.931) 15.363 2.719 ( -3.610 5.003 6.990) 9.324 2.839 ( -4.833 10.846 -1.024) 11.918 3.242 ( 4.573 0.313 0.793) 4.652 3.783 ( 21.984 0.538 6.928) 23.056 4.202 ( -12.921 -4.263 -2.584) 13.849 4.349 ( -8.474 4.658 -4.097) 10.501 4.430 ( 0.064 7.161 -0.140) 7.163 4.616 ( 0.201 5.139 0.062) 5.143 4.788 ( -0.418 -1.577 0.705) 1.777 5.446 ( -4.014 -5.329 -0.853) 6.726 7.875 ( 0.175 3.506 -0.877) 3.618 7.931 ( -1.624 -4.777 0.519) 5.072 8.572 ( -2.150 -2.574 -0.077) 3.354 9.365 ( 2.696 -1.058 -0.156) 2.901 9.434 ( -2.628 0.039 0.258) 2.641 9.850 ( 1.931 -5.413 -0.259) 5.753 9.870 ( -0.806 -7.898 0.145) 7.940 10.799 ( -0.148 -1.414 0.443) 1.489 11.378 ( 4.533 -3.646 0.886) 5.885 11.738 ( -0.708 12.128 0.314) 12.153 12.518 ( 8.923 -4.628 1.602) 10.178 12.756 ( -8.583 -1.596 -1.919) 8.938 15.253 ( 4.280 21.941 2.279) 22.470 15.410 ( -5.776 15.196 -1.506) 16.326 19.742 ( 0.715 -14.920 -0.808) 14.959 20.078 ( 1.189 -30.098 1.565) 30.162 20.596 ( -1.058 6.600 -1.194) 6.790 21.260 ( 1.316 3.582 -1.465) 4.088 22.017 ( -2.483 6.251 0.560) 6.749 22.601 ( 4.129 17.902 2.306) 18.516 107.879 ( -0.256 -0.445 -0.189) 0.547 108.000 ( 0.132 -0.892 -0.130) 0.911 108.534 ( -0.176 -0.982 0.021) 0.998 108.592 ( -0.749 -1.562 0.317) 1.761 ======================= Grid point 488 (235/259) ======================= q-point: ( 0.00 0.15 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 241 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.522 ( -0.000 24.079 0.000) 24.079 2.236 ( 0.000 -10.901 0.000) 10.901 2.321 ( -0.000 21.604 -0.000) 21.604 2.737 ( -0.000 6.971 0.000) 6.971 3.486 ( -0.000 17.933 0.000) 17.933 3.517 ( -0.000 10.004 0.000) 10.004 4.500 ( -0.000 10.557 0.000) 10.557 4.505 ( 0.000 3.401 0.000) 3.401 4.598 ( -0.000 4.585 0.000) 4.585 4.956 ( 0.000 -8.279 -0.000) 8.279 5.003 ( -0.000 -3.634 0.000) 3.634 5.436 ( -0.000 -20.853 0.000) 20.853 7.970 ( -0.000 -3.044 0.000) 3.044 8.252 ( -0.000 -5.083 0.000) 5.083 8.717 ( 0.000 6.500 0.000) 6.500 8.823 ( -0.000 -14.107 0.000) 14.107 9.648 ( 0.000 21.662 0.000) 21.662 9.690 ( -0.000 -8.254 0.000) 8.254 10.118 ( -0.000 6.386 0.000) 6.386 10.541 ( 0.000 -5.024 0.000) 5.024 10.961 ( 0.000 2.959 0.000) 2.959 11.469 ( -0.000 -1.865 0.000) 1.865 12.162 ( -0.000 -0.375 0.000) 0.375 13.073 ( 0.000 -13.220 0.000) 13.220 15.240 ( -0.000 14.567 0.000) 14.567 16.958 ( -0.000 51.616 0.000) 51.616 19.137 ( -0.000 -30.564 0.000) 30.564 19.332 ( -0.000 -19.557 0.000) 19.557 20.821 ( -0.000 0.639 0.000) 0.639 21.648 ( -0.000 16.871 0.000) 16.871 21.940 ( -0.000 7.659 0.000) 7.659 22.387 ( -0.000 8.166 0.000) 8.166 107.912 ( -0.000 -1.594 0.000) 1.594 107.957 ( 0.000 -1.619 0.000) 1.619 108.543 ( -0.000 -2.411 0.000) 2.411 108.573 ( -0.000 -3.515 0.000) 3.515 ======================= Grid point 490 (236/259) ======================= q-point: ( 0.11 0.15 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.618 ( 11.252 19.666 -1.966) 22.742 2.119 ( -0.256 -1.680 -17.632) 17.713 2.485 ( 7.363 14.349 11.953) 20.074 2.780 ( 4.057 5.489 1.550) 6.999 3.434 ( -1.723 16.576 -5.007) 17.401 3.533 ( -2.447 11.816 5.739) 13.362 4.467 ( -2.954 4.983 -1.584) 6.006 4.512 ( -0.586 8.241 3.781) 9.086 4.613 ( 1.926 4.381 -1.246) 4.945 4.918 ( -4.588 -6.435 2.023) 8.158 4.968 ( -1.931 -4.207 -4.241) 6.278 5.446 ( -0.424 -19.263 2.079) 19.380 7.935 ( -2.914 -3.618 0.730) 4.702 8.254 ( -6.324 1.236 1.330) 6.580 8.499 ( -3.461 -7.961 -0.211) 8.684 9.116 ( 13.954 -7.786 -0.741) 15.996 9.583 ( -2.898 18.332 -0.536) 18.567 9.693 ( -1.439 -6.506 1.257) 6.781 10.104 ( -1.126 7.730 -3.277) 8.471 10.607 ( 6.602 -4.448 0.653) 7.987 10.849 ( -7.592 -1.639 -0.721) 7.800 11.598 ( 9.933 2.178 2.439) 10.457 12.176 ( 1.891 -0.868 -0.641) 2.178 13.041 ( -2.804 -11.654 -1.539) 12.085 15.263 ( 1.067 14.353 3.432) 14.796 16.856 ( -11.565 49.888 1.574) 51.235 19.169 ( 2.789 -31.037 1.190) 31.185 19.346 ( 1.530 -19.638 -0.444) 19.702 20.807 ( -0.870 0.858 -1.468) 1.910 21.562 ( -3.536 13.690 -7.338) 15.930 22.080 ( 7.646 7.927 8.555) 13.946 22.405 ( 3.285 11.627 -0.852) 12.112 107.905 ( -0.629 -1.483 -0.142) 1.617 107.960 ( 0.412 -1.648 -0.294) 1.724 108.534 ( -0.631 -2.216 -0.298) 2.323 108.576 ( -0.283 -3.507 1.036) 3.668 ======================= Grid point 491 (237/259) ======================= q-point: ( 0.22 0.15 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.867 ( 16.257 12.583 -3.755) 20.898 2.001 ( 3.342 2.313 -16.261) 16.761 2.697 ( 5.724 11.319 8.926) 15.510 2.912 ( 8.819 2.840 2.467) 9.588 3.368 ( -2.261 18.070 -2.724) 18.414 3.517 ( -2.436 12.983 4.579) 13.981 4.378 ( -5.341 1.111 -1.805) 5.747 4.537 ( -0.557 8.298 5.007) 9.708 4.645 ( 2.841 3.856 -1.462) 5.008 4.832 ( -5.998 -3.890 -0.592) 7.173 4.880 ( -3.856 -1.024 -3.083) 5.042 5.431 ( -3.028 -15.903 1.451) 16.254 7.900 ( -1.556 -4.391 -0.266) 4.667 8.074 ( -9.965 2.938 2.033) 10.587 8.561 ( 4.419 -7.116 -0.695) 8.405 9.184 ( -1.713 -6.258 -1.247) 6.607 9.639 ( 6.735 9.795 0.333) 11.891 9.652 ( -4.219 -6.967 1.250) 8.241 9.988 ( -9.002 6.495 -2.615) 11.405 10.733 ( 2.695 -5.494 -0.717) 6.161 10.836 ( 10.629 -4.547 1.030) 11.607 11.790 ( 8.737 7.519 2.501) 11.796 12.218 ( 3.182 -2.472 -0.570) 4.069 12.958 ( -4.750 -7.978 -1.977) 9.493 15.330 ( 2.648 14.194 5.320) 15.388 16.594 ( -17.290 45.395 0.386) 48.578 19.244 ( 3.730 -32.242 2.330) 32.540 19.374 ( 1.889 -19.831 -0.608) 19.930 20.771 ( -1.366 1.592 -2.288) 3.104 21.455 ( -2.304 10.388 -6.613) 12.528 22.211 ( -0.057 4.980 5.532) 7.443 22.557 ( 12.716 18.749 2.766) 22.822 107.890 ( -0.770 -1.251 -0.316) 1.503 107.966 ( 0.470 -1.675 -0.385) 1.782 108.521 ( -0.609 -1.872 -0.096) 1.971 108.574 ( -0.880 -3.241 1.041) 3.516 ======================= Grid point 492 (238/259) ======================= q-point: ( 0.33 0.15 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.898 ( 0.964 10.044 -7.964) 12.855 2.212 ( 21.202 7.388 -10.594) 24.826 2.796 ( -2.366 4.659 9.812) 11.116 3.086 ( 7.345 0.339 0.564) 7.374 3.297 ( -5.461 17.545 2.584) 18.556 3.595 ( 9.755 15.380 1.720) 18.294 4.254 ( -7.234 -4.275 -0.524) 8.419 4.548 ( -1.790 2.995 0.094) 3.490 4.662 ( -5.408 4.615 0.791) 7.154 4.715 ( 0.918 5.156 -3.070) 6.070 4.811 ( -2.851 1.999 0.032) 3.482 5.366 ( -4.211 -11.831 0.007) 12.558 7.850 ( -2.809 -5.535 -1.622) 6.415 7.992 ( -1.701 5.025 2.228) 5.754 8.564 ( -2.714 -3.670 -0.942) 4.661 9.191 ( 3.566 -8.234 0.009) 8.973 9.553 ( -7.444 -2.841 0.636) 7.993 9.727 ( 1.836 1.344 -0.025) 2.275 9.815 ( -5.970 -0.523 -1.544) 6.188 10.753 ( 0.652 -3.660 0.058) 3.718 11.098 ( 13.930 -6.213 0.935) 15.281 11.944 ( 6.424 12.252 1.403) 13.905 12.280 ( 3.823 -5.696 0.493) 6.878 12.848 ( -5.716 -3.922 -1.675) 7.132 15.439 ( 4.864 14.720 5.550) 16.466 16.276 ( -16.441 39.736 -2.010) 43.050 19.324 ( 2.953 -33.741 2.235) 33.944 19.399 ( 1.250 -19.844 -0.435) 19.888 20.730 ( -1.178 2.770 -2.080) 3.659 21.381 ( -1.419 7.025 -4.068) 8.241 22.212 ( -1.746 8.466 2.059) 8.886 22.817 ( 11.161 18.988 4.408) 22.462 107.875 ( -0.574 -1.016 -0.338) 1.215 107.971 ( 0.343 -1.681 -0.307) 1.742 108.512 ( -0.374 -1.609 0.032) 1.652 108.562 ( -0.978 -2.692 0.633) 2.933 ======================= Grid point 493 (239/259) ======================= q-point: ( 0.44 0.15 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.877 ( 0.904 14.775 -2.834) 15.071 2.447 ( 10.620 5.788 -7.385) 14.171 2.808 ( -1.911 2.461 7.126) 7.777 3.091 ( -3.917 12.543 -2.143) 13.314 3.302 ( 1.590 6.135 4.659) 7.866 3.838 ( 13.851 4.648 -0.984) 14.643 4.114 ( -8.813 -2.824 2.078) 9.485 4.423 ( -5.978 3.096 -3.874) 7.767 4.620 ( -0.093 10.597 0.872) 10.633 4.742 ( 0.423 -0.060 0.389) 0.578 4.776 ( -0.574 7.406 -0.213) 7.431 5.303 ( -2.001 -8.482 -0.298) 8.720 7.806 ( -0.962 -5.903 -0.586) 6.009 7.993 ( -0.010 7.190 0.498) 7.207 8.509 ( -1.753 -3.273 -0.195) 3.718 9.255 ( 1.772 -10.287 0.299) 10.443 9.443 ( -3.328 0.406 0.022) 3.353 9.705 ( -1.458 -8.122 -0.366) 8.260 9.777 ( -0.015 0.283 -0.219) 0.358 10.759 ( 0.042 -2.902 0.040) 2.903 11.284 ( 5.353 -5.423 0.450) 7.633 12.029 ( 2.247 15.586 0.155) 15.748 12.359 ( 3.308 -11.351 1.034) 11.868 12.743 ( -3.839 0.452 -0.983) 3.988 15.573 ( 4.861 14.906 3.501) 16.064 16.013 ( -9.129 36.179 -2.406) 37.391 19.376 ( 1.237 -36.144 0.927) 36.177 19.410 ( 0.277 -18.391 -0.181) 18.394 20.703 ( -0.446 3.759 -0.847) 3.879 21.343 ( -0.530 4.504 -1.296) 4.717 22.198 ( -0.721 11.498 0.521) 11.532 22.984 ( 4.107 18.489 1.917) 19.036 107.866 ( -0.207 -0.873 -0.145) 0.909 107.974 ( 0.125 -1.679 -0.116) 1.688 108.508 ( -0.117 -1.478 0.029) 1.483 108.552 ( -0.420 -2.255 0.196) 2.302 ======================= Grid point 498 (240/259) ======================= q-point: ( 0.00 0.23 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 241 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.013 ( 0.000 19.000 0.000) 19.000 2.072 ( -0.000 0.559 0.000) 0.559 2.674 ( -0.000 12.888 -0.000) 12.888 2.900 ( -0.000 9.196 0.000) 9.196 3.784 ( 0.000 15.823 -0.000) 15.823 3.803 ( -0.000 12.639 0.000) 12.639 4.561 ( 0.000 3.648 0.000) 3.648 4.657 ( -0.000 -0.626 -0.000) 0.626 4.731 ( -0.000 10.002 0.000) 10.002 4.821 ( 0.000 -3.240 0.000) 3.240 4.940 ( -0.000 -1.668 0.000) 1.668 5.104 ( -0.000 -12.414 0.000) 12.414 7.869 ( -0.000 -6.942 0.000) 6.942 8.063 ( 0.000 -12.905 0.000) 12.905 8.664 ( 0.000 -2.056 0.000) 2.056 8.818 ( -0.000 5.033 0.000) 5.033 9.532 ( -0.000 -6.924 0.000) 6.924 9.946 ( -0.000 6.455 0.000) 6.455 10.196 ( -0.000 1.278 0.000) 1.278 10.408 ( 0.000 -7.839 0.000) 7.839 11.130 ( 0.000 13.567 0.000) 13.567 11.472 ( -0.000 2.093 0.000) 2.093 12.145 ( -0.000 -1.324 0.000) 1.324 12.846 ( 0.000 -9.889 0.000) 9.889 15.537 ( -0.000 15.072 0.000) 15.072 17.790 ( -0.000 26.866 0.000) 26.866 18.586 ( 0.000 -23.848 0.000) 23.848 18.963 ( -0.000 -15.360 0.000) 15.360 20.853 ( -0.000 4.368 0.000) 4.368 21.855 ( -0.000 4.514 0.000) 4.514 22.129 ( -0.000 10.895 0.000) 10.895 22.612 ( -0.000 13.199 0.000) 13.199 107.875 ( -0.000 -2.021 0.000) 2.021 107.918 ( -0.000 -2.231 0.000) 2.231 108.498 ( -0.000 -2.029 0.000) 2.029 108.505 ( -0.000 -3.022 0.000) 3.022 ======================= Grid point 500 (241/259) ======================= q-point: ( 0.11 0.23 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.033 ( 1.677 8.235 -0.007) 8.404 2.067 ( 4.606 12.025 -7.955) 15.136 2.755 ( 4.396 10.006 7.016) 12.988 2.914 ( 1.365 7.901 0.729) 8.051 3.766 ( 1.185 16.293 -6.249) 17.490 3.806 ( -2.073 13.631 5.784) 14.952 4.524 ( -4.135 2.724 -1.663) 5.223 4.633 ( -3.262 -3.534 0.526) 4.838 4.724 ( -0.411 9.261 2.197) 9.527 4.837 ( 0.692 0.674 2.010) 2.230 4.919 ( -1.008 -0.404 -1.853) 2.148 5.125 ( 1.697 -12.476 -0.294) 12.594 7.805 ( -4.309 -8.751 0.700) 9.779 8.184 ( 9.142 -9.214 0.012) 12.980 8.430 ( -13.473 2.823 0.722) 13.784 9.021 ( 9.394 -1.932 -0.666) 9.614 9.520 ( -1.617 -6.741 0.669) 6.964 9.868 ( -4.749 6.449 -0.811) 8.050 10.220 ( 1.431 2.804 -0.613) 3.208 10.484 ( 6.744 -7.760 -0.314) 10.286 10.883 ( -16.794 5.675 -0.513) 17.735 11.704 ( 16.290 8.015 1.395) 18.208 12.144 ( -0.179 -2.557 -0.007) 2.564 12.840 ( -0.317 -8.617 -0.755) 8.656 15.559 ( 1.353 15.218 2.738) 15.522 17.670 ( -12.859 27.527 0.380) 30.384 18.597 ( 0.279 -25.228 2.157) 25.321 18.980 ( 2.395 -15.504 -1.727) 15.783 20.840 ( -1.245 4.045 -0.326) 4.245 21.763 ( -4.959 6.241 -6.299) 10.160 22.228 ( 4.765 8.085 6.811) 11.596 22.687 ( 8.395 14.697 0.298) 16.929 107.871 ( -0.410 -1.897 -0.089) 1.942 107.921 ( 0.343 -2.248 -0.215) 2.285 108.491 ( -0.407 -2.020 -0.130) 2.065 108.510 ( 0.079 -2.862 0.485) 2.904 ======================= Grid point 501 (242/259) ======================= q-point: ( 0.22 0.23 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.050 ( 4.025 3.961 -5.782) 8.082 2.181 ( 12.568 17.102 -5.172) 21.844 2.858 ( -0.754 5.356 8.314) 9.918 2.974 ( 3.698 3.520 3.066) 5.955 3.723 ( -2.767 14.211 -2.214) 14.646 3.847 ( 3.984 19.396 2.567) 19.967 4.369 ( -10.545 -1.830 -3.350) 11.214 4.572 ( -3.196 -3.844 0.384) 5.014 4.758 ( 0.344 7.475 4.966) 8.981 4.862 ( 0.229 5.312 -0.347) 5.328 4.892 ( 0.406 2.721 -1.339) 3.059 5.141 ( 0.328 -12.241 -0.572) 12.259 7.760 ( -1.178 -7.982 0.046) 8.069 8.175 ( -7.959 5.686 2.394) 10.070 8.421 ( 8.679 -6.785 -0.984) 11.060 9.046 ( -3.820 -6.236 -1.768) 7.523 9.486 ( -2.762 -6.323 0.979) 6.969 9.840 ( 1.087 6.841 0.267) 6.931 10.126 ( -13.712 6.122 -0.855) 15.041 10.591 ( 4.646 -8.230 -0.635) 9.472 10.750 ( 5.654 -3.538 -0.173) 6.672 11.983 ( 12.823 10.892 1.500) 16.892 12.138 ( -0.373 -5.901 -0.050) 5.913 12.824 ( -0.902 -5.273 -0.738) 5.400 15.630 ( 3.531 15.785 4.533) 16.798 17.364 ( -19.780 28.451 -1.119) 34.669 18.624 ( 0.248 -28.151 3.329) 28.348 19.016 ( 3.100 -15.784 -2.320) 16.252 20.809 ( -1.620 3.446 -0.576) 3.852 21.625 ( -5.064 6.157 -5.542) 9.709 22.344 ( 2.943 8.570 5.099) 10.398 22.903 ( 13.305 15.115 2.359) 20.274 107.861 ( -0.508 -1.619 -0.191) 1.708 107.926 ( 0.424 -2.258 -0.288) 2.316 108.484 ( -0.326 -1.748 0.017) 1.778 108.513 ( -0.210 -2.667 0.477) 2.717 ======================= Grid point 502 (243/259) ======================= q-point: ( 0.33 0.23 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.103 ( 5.586 10.024 -3.653) 12.043 2.404 ( 16.543 11.559 -8.725) 21.987 2.863 ( -5.083 2.500 8.060) 9.851 3.077 ( 4.182 -0.266 6.468) 7.707 3.634 ( -6.490 14.384 0.694) 15.796 3.958 ( 4.274 15.203 -4.523) 16.427 4.156 ( -7.511 -1.476 2.125) 7.945 4.527 ( -2.195 -1.866 -0.159) 2.885 4.770 ( -1.878 2.663 0.119) 3.261 4.842 ( -0.977 9.596 0.413) 9.655 4.920 ( 2.119 6.771 -0.042) 7.095 5.135 ( -0.466 -10.591 -0.127) 10.602 7.744 ( -0.662 -4.272 -0.896) 4.415 8.113 ( -0.721 6.518 2.716) 7.098 8.503 ( 0.233 -2.616 -1.647) 3.100 8.982 ( 0.018 -11.062 -0.734) 11.086 9.442 ( -2.714 -5.556 1.311) 6.321 9.809 ( -16.653 1.177 -1.314) 16.746 9.862 ( 0.040 7.587 0.208) 7.590 10.648 ( 2.232 -6.778 -0.380) 7.146 10.966 ( 14.248 -6.851 0.072) 15.809 12.100 ( -1.459 -9.913 1.010) 10.071 12.208 ( 8.668 11.024 0.037) 14.024 12.797 ( -1.595 -1.091 -0.187) 1.941 15.755 ( 6.233 16.873 5.041) 18.680 16.983 ( -19.521 28.376 -3.058) 34.578 18.652 ( 0.130 -30.829 2.848) 30.961 19.050 ( 2.375 -15.983 -1.836) 16.262 20.779 ( -1.099 3.061 -0.563) 3.300 21.505 ( -4.241 4.983 -3.446) 7.395 22.418 ( 2.094 11.793 2.748) 12.288 23.150 ( 10.676 13.765 2.915) 17.662 107.851 ( -0.377 -1.335 -0.202) 1.402 107.931 ( 0.322 -2.244 -0.230) 2.278 108.480 ( -0.174 -1.509 0.074) 1.521 108.511 ( -0.320 -2.321 0.313) 2.364 ======================= Grid point 503 (244/259) ======================= q-point: ( 0.44 0.23 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.172 ( 3.032 13.957 -1.006) 14.317 2.582 ( 8.365 7.606 -7.103) 13.352 2.825 ( -3.649 0.180 5.136) 6.303 3.247 ( 8.832 2.931 7.465) 11.930 3.486 ( -10.150 10.382 -1.547) 14.602 3.839 ( -4.652 -4.609 -5.019) 8.251 4.239 ( 5.770 14.794 4.025) 16.382 4.476 ( -2.936 2.157 -0.902) 3.753 4.725 ( -1.191 0.709 -1.641) 2.148 4.829 ( -0.878 9.632 0.603) 9.691 4.951 ( 1.004 7.841 0.126) 7.906 5.129 ( -0.191 -8.239 0.175) 8.243 7.725 ( -0.504 -1.448 -0.469) 1.603 8.152 ( 1.721 7.851 1.061) 8.107 8.458 ( -1.975 -1.315 -0.718) 2.479 9.004 ( 0.975 -13.248 -0.069) 13.284 9.426 ( 0.171 -2.509 1.497) 2.927 9.565 ( -7.844 -5.198 -1.553) 9.537 9.859 ( -0.317 6.939 0.001) 6.947 10.669 ( 0.566 -6.112 -0.125) 6.139 11.170 ( 6.665 -5.984 0.042) 8.957 12.072 ( -1.450 -17.038 0.419) 17.105 12.325 ( 3.614 13.415 -0.045) 13.893 12.770 ( -1.060 2.041 0.082) 2.301 15.903 ( 5.070 17.900 2.987) 18.842 16.674 ( -10.105 27.716 -2.419) 29.599 18.668 ( 0.036 -32.323 1.094) 32.342 19.070 ( 0.873 -16.071 -0.688) 16.109 20.763 ( -0.331 2.950 -0.235) 2.978 21.431 ( -1.740 4.045 -1.136) 4.547 22.459 ( 0.851 14.100 0.868) 14.152 23.301 ( 3.924 12.787 1.258) 13.435 107.845 ( -0.136 -1.161 -0.086) 1.172 107.934 ( 0.119 -2.228 -0.087) 2.232 108.479 ( -0.048 -1.381 0.038) 1.382 108.508 ( -0.151 -2.048 0.104) 2.056 ======================= Grid point 508 (245/259) ======================= q-point: ( 0.00 0.31 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 241 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.015 ( -0.000 2.035 0.000) 2.035 2.531 ( -0.000 24.555 0.000) 24.555 2.833 ( -0.000 3.217 0.000) 3.217 3.103 ( -0.000 10.876 0.000) 10.876 3.961 ( 0.000 2.945 0.000) 2.945 4.085 ( -0.000 12.146 0.000) 12.146 4.549 ( -0.000 -8.735 0.000) 8.735 4.642 ( -0.000 3.639 0.000) 3.639 4.818 ( -0.000 1.679 0.000) 1.679 4.832 ( -0.000 1.430 0.000) 1.430 4.972 ( -0.000 -0.584 0.000) 0.584 5.004 ( 0.000 6.899 0.000) 6.899 7.714 ( -0.000 -7.904 0.000) 7.904 7.803 ( 0.000 -11.831 0.000) 11.831 8.690 ( 0.000 3.672 0.000) 3.672 8.927 ( -0.000 5.327 0.000) 5.327 9.427 ( -0.000 -3.358 0.000) 3.358 9.934 ( -0.000 -6.145 0.000) 6.145 10.179 ( -0.000 -2.511 0.000) 2.511 10.256 ( 0.000 -6.795 0.000) 6.795 11.437 ( 0.000 15.491 0.000) 15.491 11.543 ( -0.000 4.768 0.000) 4.768 12.108 ( -0.000 -2.333 0.000) 2.333 12.664 ( 0.000 -8.625 0.000) 8.625 15.855 ( -0.000 16.972 0.000) 16.972 17.919 ( -0.000 -11.216 -0.000) 11.216 18.206 ( 0.000 -13.710 0.000) 13.710 18.773 ( -0.000 -5.889 0.000) 5.889 21.038 ( -0.000 13.716 0.000) 13.716 21.875 ( 0.000 -1.534 0.000) 1.534 22.366 ( -0.000 12.653 0.000) 12.653 22.861 ( -0.000 10.634 0.000) 10.634 107.835 ( -0.000 -1.895 0.000) 1.895 107.871 ( -0.000 -2.386 0.000) 2.386 108.456 ( 0.000 -1.903 0.000) 1.903 108.463 ( -0.000 -1.426 0.000) 1.426 ======================= Grid point 510 (246/259) ======================= q-point: ( 0.11 0.31 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.047 ( 3.655 3.118 -0.179) 4.807 2.516 ( 0.426 22.660 -2.223) 22.773 2.875 ( 1.937 2.371 3.604) 4.728 3.093 ( -1.131 9.901 0.448) 9.975 3.935 ( -3.034 2.303 0.686) 3.870 4.112 ( 2.902 11.834 -0.011) 12.185 4.483 ( -6.746 -6.843 -0.660) 9.632 4.617 ( -2.158 3.996 -0.412) 4.560 4.845 ( 1.413 2.512 1.886) 3.444 4.855 ( 1.555 0.680 2.582) 3.090 4.962 ( -0.114 1.912 -0.736) 2.052 5.020 ( 1.685 4.395 -1.332) 4.892 7.630 ( -3.421 -7.692 0.197) 8.420 7.971 ( 12.362 -10.858 -0.103) 16.454 8.536 ( -11.519 6.572 1.027) 13.302 9.010 ( 2.811 -0.043 -1.192) 3.054 9.429 ( -0.288 -1.969 1.211) 2.330 9.900 ( -0.713 -2.195 -1.132) 2.570 10.203 ( 0.658 -3.909 1.763) 4.338 10.315 ( 6.314 -8.439 -1.577) 10.657 11.052 ( -23.446 10.229 0.256) 25.581 11.886 ( 19.444 8.833 -0.127) 21.356 12.072 ( -3.953 -4.067 0.685) 5.713 12.689 ( 2.605 -6.655 -0.018) 7.147 15.881 ( 2.180 17.183 1.911) 17.426 17.859 ( -7.060 -7.556 0.073) 10.341 18.188 ( -2.078 -14.653 0.889) 14.826 18.763 ( -0.054 -7.584 -1.845) 7.805 21.009 ( -3.092 12.609 0.196) 12.984 21.817 ( -4.316 -0.248 -3.398) 5.499 22.428 ( 4.253 11.730 4.181) 13.159 22.943 ( 8.549 10.259 0.395) 13.360 107.833 ( -0.196 -1.788 -0.020) 1.798 107.874 ( 0.288 -2.393 -0.121) 2.413 108.454 ( -0.130 -1.615 0.059) 1.621 108.466 ( 0.161 -1.609 0.150) 1.624 ======================= Grid point 511 (247/259) ======================= q-point: ( 0.22 0.31 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.143 ( 6.797 5.487 0.193) 8.738 2.547 ( 6.078 18.651 -4.147) 20.050 2.918 ( -1.416 0.468 5.003) 5.220 3.078 ( -1.400 7.264 2.453) 7.794 3.872 ( -4.488 1.434 1.614) 4.980 4.146 ( -2.046 -0.003 -2.956) 3.595 4.350 ( -4.071 8.085 1.651) 9.202 4.570 ( -2.682 4.115 0.324) 4.923 4.862 ( -1.192 3.261 1.567) 3.809 4.921 ( 3.681 -2.447 0.579) 4.457 4.976 ( 1.687 4.223 1.034) 4.663 5.031 ( 0.677 4.690 -1.515) 4.975 7.626 ( 2.528 -4.704 0.252) 5.346 8.174 ( 7.636 -7.629 0.281) 10.798 8.392 ( -2.912 5.630 1.005) 6.418 8.943 ( -7.136 -4.418 -2.473) 8.750 9.415 ( -2.857 -0.584 1.687) 3.369 9.928 ( 2.365 2.634 0.499) 3.575 10.160 ( -9.367 -4.167 0.854) 10.288 10.432 ( 7.231 -7.325 -1.351) 10.381 10.736 ( -7.220 3.551 -0.356) 8.054 11.969 ( -6.756 -10.463 0.359) 12.460 12.205 ( 14.754 10.417 0.349) 18.064 12.745 ( 2.999 -2.846 0.560) 4.172 15.964 ( 4.946 17.711 3.391) 18.699 17.659 ( -14.316 0.912 -1.314) 14.405 18.157 ( -2.152 -17.398 1.458) 17.591 18.754 ( 1.024 -10.926 -2.499) 11.255 20.944 ( -3.882 10.154 0.169) 10.872 21.695 ( -5.733 1.006 -3.688) 6.891 22.552 ( 5.271 11.932 4.629) 13.841 23.144 ( 12.017 8.716 1.235) 14.896 107.829 ( -0.235 -1.538 -0.057) 1.557 107.879 ( 0.384 -2.390 -0.161) 2.426 108.453 ( -0.058 -1.293 0.121) 1.300 108.470 ( 0.094 -1.652 0.189) 1.666 ======================= Grid point 512 (248/259) ======================= q-point: ( 0.33 0.31 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( 7.940 7.715 0.697) 11.093 2.656 ( 9.793 13.150 -7.725) 18.125 2.896 ( -5.003 0.135 5.113) 7.155 3.106 ( 1.612 4.060 7.287) 8.496 3.806 ( -4.496 1.914 1.800) 5.207 3.931 ( -14.050 -7.799 -5.849) 17.101 4.424 ( 6.356 17.409 3.035) 18.780 4.539 ( -1.421 3.834 1.959) 4.534 4.831 ( -2.395 2.892 -0.672) 3.815 4.960 ( 1.432 -4.352 -5.051) 6.819 5.024 ( 1.126 5.393 4.177) 6.914 5.041 ( 1.502 6.232 0.518) 6.432 7.699 ( 4.580 0.045 -0.210) 4.585 8.216 ( -0.087 2.093 2.135) 2.991 8.460 ( 5.372 -0.723 -0.734) 5.470 8.798 ( -4.767 -6.823 -2.182) 8.604 9.366 ( -3.331 -1.704 1.786) 4.145 9.804 ( -18.442 -1.479 0.404) 18.505 10.026 ( -0.497 7.433 0.088) 7.450 10.509 ( 2.282 -5.863 -0.476) 6.310 10.824 ( 12.850 -7.181 -0.697) 14.736 11.831 ( -8.514 -15.541 0.331) 17.723 12.430 ( 9.943 10.019 0.082) 14.116 12.794 ( 1.572 0.419 1.042) 1.932 16.109 ( 7.768 18.292 4.096) 20.291 17.352 ( -16.820 8.063 -3.027) 18.897 18.136 ( -1.356 -19.812 1.273) 19.899 18.761 ( 1.396 -13.260 -1.935) 13.473 20.883 ( -2.750 7.756 0.092) 8.230 21.571 ( -4.935 1.569 -2.583) 5.786 22.672 ( 4.353 13.278 3.320) 14.363 23.356 ( 9.540 6.760 1.442) 11.782 107.824 ( -0.166 -1.277 -0.067) 1.289 107.884 ( 0.305 -2.368 -0.127) 2.391 108.454 ( 0.012 -1.066 0.117) 1.072 108.472 ( 0.012 -1.546 0.146) 1.553 ======================= Grid point 513 (249/259) ======================= q-point: ( 0.44 0.31 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.410 ( 4.421 9.408 0.610) 10.412 2.735 ( 4.327 7.073 -6.276) 10.399 2.840 ( -3.765 1.447 3.593) 5.402 3.277 ( 10.238 1.282 9.441) 13.986 3.586 ( -15.377 -1.015 -7.132) 16.981 3.780 ( -1.629 -1.069 0.454) 2.001 4.520 ( 1.365 6.300 -0.273) 6.452 4.573 ( 2.798 13.513 3.697) 14.287 4.778 ( -2.151 4.080 -1.103) 4.742 4.926 ( -0.524 -3.122 -2.927) 4.312 5.066 ( -0.011 4.708 3.430) 5.825 5.070 ( 1.488 4.738 -1.378) 5.154 7.757 ( 1.664 4.318 -0.274) 4.635 8.255 ( 1.752 1.356 1.283) 2.560 8.489 ( -0.000 4.771 -0.759) 4.831 8.767 ( 0.666 -9.808 -0.628) 9.851 9.353 ( 1.498 -3.802 1.678) 4.418 9.497 ( -12.652 -2.349 -1.003) 12.908 10.028 ( 0.042 9.439 0.061) 9.439 10.530 ( 0.585 -6.911 -0.114) 6.937 11.038 ( 8.452 -7.390 -0.315) 11.231 11.692 ( -5.657 -20.396 0.189) 21.166 12.557 ( 3.826 9.780 -0.082) 10.502 12.815 ( 0.146 2.220 0.602) 2.305 16.275 ( 5.866 18.729 2.566) 19.793 17.071 ( -9.525 11.588 -2.303) 15.176 18.126 ( -0.460 -21.038 0.489) 21.049 18.770 ( 0.613 -14.207 -0.715) 14.238 20.850 ( -0.931 6.320 0.034) 6.388 21.493 ( -1.985 1.836 -0.920) 2.856 22.746 ( 1.707 14.283 1.206) 14.435 23.486 ( 3.532 5.551 0.626) 6.609 107.822 ( -0.058 -1.115 -0.030) 1.117 107.887 ( 0.115 -2.348 -0.047) 2.352 108.455 ( 0.017 -0.950 0.048) 0.951 108.473 ( -0.010 -1.436 0.053) 1.437 ======================= Grid point 518 (250/259) ======================= q-point: ( 0.00 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 241 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.136 ( -0.000 9.625 0.000) 9.625 2.810 ( -0.000 -5.417 0.000) 5.417 3.003 ( -0.000 22.411 0.000) 22.411 3.326 ( -0.000 11.166 0.000) 11.166 3.935 ( 0.000 -4.806 0.000) 4.806 4.145 ( -0.000 -9.011 0.000) 9.011 4.439 ( -0.000 1.939 0.000) 1.939 4.674 ( -0.000 -0.494 0.000) 0.494 4.885 ( 0.000 3.844 0.000) 3.844 4.905 ( -0.000 5.997 0.000) 5.997 5.007 ( -0.000 2.858 0.000) 2.858 5.119 ( 0.000 3.797 0.000) 3.797 7.575 ( -0.000 -5.512 0.000) 5.512 7.611 ( 0.000 -7.237 0.000) 7.237 8.789 ( 0.000 5.830 0.000) 5.830 9.008 ( 0.000 2.272 0.000) 2.272 9.402 ( -0.000 0.792 0.000) 0.792 9.762 ( -0.000 -9.754 0.000) 9.754 10.116 ( -0.000 -3.217 0.000) 3.217 10.141 ( 0.000 -4.676 -0.000) 4.676 11.650 ( 0.000 5.565 0.000) 5.565 11.711 ( -0.000 11.091 0.000) 11.091 12.064 ( -0.000 -1.232 0.000) 1.232 12.491 ( 0.000 -8.842 0.000) 8.842 16.223 ( 0.000 19.796 0.000) 19.796 17.552 ( 0.000 -22.137 0.000) 22.137 18.047 ( -0.000 -2.165 0.000) 2.165 18.601 ( -0.000 -11.842 0.000) 11.842 21.335 ( -0.000 14.113 0.000) 14.113 21.817 ( 0.000 -4.026 0.000) 4.026 22.629 ( -0.000 13.278 0.000) 13.278 23.011 ( -0.000 4.050 0.000) 4.050 107.803 ( -0.000 -1.213 0.000) 1.213 107.827 ( -0.000 -1.931 0.000) 1.931 108.429 ( 0.000 -0.834 0.000) 0.834 108.440 ( -0.000 -0.934 0.000) 0.934 ======================= Grid point 520 (251/259) ======================= q-point: ( 0.11 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.173 ( 3.457 9.177 1.334) 9.897 2.804 ( -0.518 -2.999 0.571) 3.097 2.996 ( -0.101 18.624 -1.830) 18.714 3.303 ( -2.738 10.839 1.085) 11.232 3.900 ( -3.818 -4.942 0.732) 6.288 4.101 ( -4.428 -11.465 -1.691) 12.407 4.465 ( 2.460 4.882 1.732) 5.734 4.677 ( -0.452 0.633 1.376) 1.580 4.888 ( 2.071 5.391 -2.327) 6.226 4.940 ( 0.378 4.700 4.233) 6.336 5.008 ( 0.777 2.438 -0.631) 2.635 5.121 ( 0.065 3.589 0.559) 3.633 7.523 ( 0.018 -2.726 -0.298) 2.742 7.769 ( 11.585 -9.103 -0.072) 14.734 8.674 ( -9.535 7.078 0.846) 11.905 8.992 ( -3.841 -2.095 -1.292) 4.562 9.444 ( 2.867 3.188 1.496) 4.541 9.810 ( 5.922 -6.230 -0.755) 8.628 10.104 ( -3.329 -4.829 2.662) 6.441 10.167 ( 4.133 -6.331 -1.636) 7.736 11.269 ( -23.136 11.217 0.273) 25.714 11.895 ( -4.155 -7.377 -0.039) 8.467 12.123 ( 13.571 8.469 0.337) 16.000 12.565 ( 6.653 -6.028 0.394) 8.987 16.251 ( 2.650 19.699 1.130) 19.909 17.536 ( -2.221 -20.792 0.583) 20.919 18.025 ( -2.288 -2.120 -0.137) 3.122 18.577 ( -1.844 -11.882 -1.478) 12.115 21.289 ( -4.607 13.779 -0.230) 14.531 21.775 ( -3.721 -3.601 -1.572) 5.411 22.681 ( 4.338 13.011 2.546) 13.950 23.081 ( 7.202 3.291 0.196) 7.921 107.803 ( -0.025 -1.135 0.033) 1.136 107.829 ( 0.242 -1.940 -0.035) 1.956 108.430 ( 0.097 -0.777 0.104) 0.790 108.441 ( 0.121 -0.938 0.060) 0.947 ======================= Grid point 521 (252/259) ======================= q-point: ( 0.22 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.275 ( 6.136 7.899 2.408) 10.288 2.812 ( 1.002 -1.238 0.649) 1.720 2.968 ( -0.759 13.164 -3.651) 13.682 3.258 ( -3.710 10.202 3.471) 11.397 3.825 ( -5.142 -5.419 1.515) 7.622 3.962 ( -8.559 -12.260 -3.134) 15.277 4.553 ( 5.002 7.136 3.033) 9.227 4.673 ( -1.680 3.750 2.720) 4.928 4.904 ( 0.929 5.247 -3.131) 6.181 4.960 ( 0.173 3.621 1.006) 3.762 5.038 ( 1.751 2.123 1.913) 3.352 5.135 ( 0.845 3.661 1.146) 3.929 7.587 ( 6.889 0.914 0.097) 6.950 7.988 ( 12.101 -9.673 -0.394) 15.498 8.532 ( -6.024 7.177 1.091) 9.433 8.857 ( -8.385 -4.329 -2.154) 9.679 9.459 ( -3.335 4.659 2.132) 6.113 9.961 ( 9.922 -0.878 -0.221) 9.963 10.001 ( -11.086 -7.809 3.050) 13.899 10.280 ( 9.722 -7.932 -1.725) 12.666 10.895 ( -16.813 11.301 -0.324) 20.260 11.726 ( -11.783 -13.411 0.135) 17.853 12.393 ( 13.704 8.256 0.342) 16.003 12.695 ( 6.465 -2.529 1.162) 7.038 16.336 ( 5.408 19.177 2.121) 20.037 17.471 ( -5.716 -16.266 0.468) 17.248 17.966 ( -3.792 -2.270 -0.558) 4.455 18.528 ( -1.598 -12.564 -2.243) 12.863 21.185 ( -6.133 12.749 -0.368) 14.153 21.674 ( -5.456 -2.893 -2.060) 6.510 22.804 ( 6.205 12.801 3.546) 14.661 23.247 ( 10.037 1.480 0.479) 10.157 107.803 ( -0.005 -0.951 0.038) 0.952 107.834 ( 0.342 -1.952 -0.042) 1.982 108.434 ( 0.165 -0.653 0.157) 0.691 108.445 ( 0.167 -0.923 0.092) 0.942 ======================= Grid point 522 (253/259) ======================= q-point: ( 0.33 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.417 ( 7.086 6.120 2.591) 9.715 2.838 ( -0.256 -4.650 1.634) 4.935 2.922 ( 0.674 12.142 -6.133) 13.620 3.244 ( -1.339 8.572 6.395) 10.778 3.742 ( -6.121 -8.411 -1.123) 10.463 3.770 ( -8.166 -6.061 -1.516) 10.282 4.648 ( -0.165 5.456 2.930) 6.195 4.693 ( 3.926 7.414 4.416) 9.480 4.872 ( -1.296 4.134 -3.007) 5.274 4.958 ( -0.054 3.163 -2.987) 4.351 5.086 ( 1.408 1.761 2.382) 3.280 5.165 ( 1.193 4.320 1.489) 4.722 7.746 ( 9.401 4.380 0.176) 10.373 8.161 ( 6.300 -6.279 0.218) 8.897 8.506 ( 2.712 4.183 0.780) 5.046 8.700 ( -6.036 -3.507 -2.502) 7.416 9.380 ( -6.236 2.968 2.133) 7.228 9.741 ( -18.374 -4.994 2.010) 19.147 10.123 ( 7.247 2.568 0.012) 7.688 10.439 ( 5.522 -3.028 -0.988) 6.375 10.726 ( 0.812 0.212 -0.589) 1.025 11.502 ( -12.929 -16.924 0.000) 21.298 12.602 ( 9.056 7.122 0.331) 11.525 12.800 ( 3.848 -0.143 1.423) 4.105 16.474 ( 7.731 17.780 2.718) 19.577 17.331 ( -9.418 -8.428 -0.697) 12.658 17.896 ( -2.994 -3.758 -0.714) 4.857 18.494 ( -0.355 -13.911 -1.845) 14.037 21.081 ( -4.741 11.298 -0.304) 12.256 21.564 ( -4.750 -2.344 -1.620) 5.539 22.937 ( 5.259 12.897 2.938) 14.235 23.420 ( 8.063 -0.344 0.539) 8.089 107.803 ( 0.016 -0.757 0.026) 0.758 107.840 ( 0.283 -1.952 -0.030) 1.973 108.438 ( 0.159 -0.537 0.136) 0.577 108.448 ( 0.130 -0.874 0.081) 0.887 ======================= Grid point 523 (254/259) ======================= q-point: ( 0.44 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.546 ( 4.428 4.606 1.388) 6.538 2.801 ( -2.987 -2.023 0.194) 3.613 2.919 ( 1.675 7.761 -2.829) 8.429 3.318 ( 3.603 2.123 6.024) 7.334 3.551 ( -7.949 -1.163 -4.662) 9.288 3.710 ( -1.659 -5.811 0.746) 6.089 4.653 ( -0.510 6.737 1.786) 6.988 4.810 ( 3.853 2.763 4.693) 6.671 4.832 ( -0.366 5.709 -1.898) 6.027 4.909 ( -2.267 4.535 -4.226) 6.600 5.117 ( 0.539 1.354 0.941) 1.734 5.191 ( 0.532 4.535 0.661) 4.614 7.877 ( 4.089 7.131 -0.038) 8.220 8.227 ( 1.415 -3.227 0.528) 3.563 8.591 ( 3.722 3.428 0.448) 5.080 8.629 ( -0.285 -3.528 -1.565) 3.870 9.306 ( -2.127 -0.483 1.294) 2.536 9.450 ( -12.002 -2.563 0.319) 12.276 10.218 ( 3.038 8.861 -0.009) 9.367 10.439 ( -1.628 -0.933 -0.207) 1.888 10.872 ( 10.004 -9.017 -0.375) 13.474 11.280 ( -10.112 -20.032 0.048) 22.440 12.718 ( 3.432 6.384 0.081) 7.249 12.851 ( 0.982 1.192 0.700) 1.696 16.628 ( 5.764 15.866 1.817) 16.978 17.159 ( -6.822 -1.571 -1.137) 7.092 17.856 ( -1.006 -5.418 -0.291) 5.518 18.484 ( 0.072 -14.842 -0.688) 14.858 21.019 ( -1.736 10.200 -0.109) 10.347 21.493 ( -1.889 -2.026 -0.610) 2.837 23.021 ( 2.052 13.026 1.136) 13.235 23.526 ( 3.021 -1.397 0.233) 3.336 107.804 ( 0.010 -0.637 0.009) 0.638 107.843 ( 0.109 -1.947 -0.010) 1.951 108.441 ( 0.067 -0.473 0.054) 0.481 108.450 ( 0.047 -0.828 0.031) 0.830 ======================= Grid point 528 (255/259) ======================= q-point: ( 0.00 0.46 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 241 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.373 ( -0.000 13.275 0.000) 13.275 2.632 ( -0.000 -11.690 0.000) 11.690 3.417 ( -0.000 18.211 0.000) 18.211 3.532 ( -0.000 8.062 0.000) 8.062 3.803 ( 0.000 -7.038 0.000) 7.038 3.867 ( -0.000 -14.894 0.000) 14.894 4.537 ( -0.000 5.653 0.000) 5.653 4.632 ( -0.000 -3.535 0.000) 3.535 4.955 ( 0.000 2.615 0.000) 2.615 4.978 ( -0.000 0.700 -0.000) 0.700 5.088 ( -0.000 4.595 0.000) 4.595 5.147 ( 0.000 -0.927 0.000) 0.927 7.503 ( -0.000 -1.610 0.000) 1.610 7.513 ( 0.000 -2.660 0.000) 2.660 8.910 ( 0.000 5.900 0.000) 5.900 9.003 ( 0.000 -2.805 0.000) 2.805 9.456 ( -0.000 4.544 0.000) 4.544 9.581 ( 0.000 -7.838 0.000) 7.838 10.068 ( -0.000 -1.299 0.000) 1.299 10.073 ( 0.000 -1.943 -0.000) 1.943 11.756 ( -0.000 4.841 0.000) 4.841 11.822 ( 0.000 -0.506 0.000) 0.506 12.122 ( -0.000 7.586 0.000) 7.586 12.306 ( 0.000 -9.626 0.000) 9.626 16.642 ( 0.000 21.917 0.000) 21.917 17.094 ( 0.000 -23.059 0.000) 23.059 18.110 ( -0.000 7.986 0.000) 7.986 18.335 ( -0.000 -13.473 0.000) 13.473 21.569 ( -0.000 9.290 0.000) 9.290 21.718 ( 0.000 -5.941 0.000) 5.941 22.872 ( 0.000 10.265 0.000) 10.265 23.015 ( -0.000 -3.650 0.000) 3.650 107.789 ( -0.000 -0.162 0.000) 0.162 107.797 ( -0.000 -0.988 0.000) 0.988 108.421 ( 0.000 -0.044 0.000) 0.044 108.425 ( -0.000 -0.500 0.000) 0.500 ======================= Grid point 530 (256/259) ======================= q-point: ( 0.11 0.46 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.396 ( 2.127 12.464 0.764) 12.668 2.641 ( 0.876 -11.214 0.299) 11.253 3.376 ( -3.270 17.179 -2.456) 17.659 3.504 ( -3.525 7.441 1.606) 8.389 3.765 ( -3.844 -7.341 -0.318) 8.293 3.826 ( -3.776 -13.213 -0.818) 13.767 4.572 ( 3.185 5.051 0.892) 6.038 4.652 ( 1.601 -2.767 0.993) 3.347 4.980 ( 1.713 2.802 1.639) 3.671 5.003 ( 1.125 0.617 2.779) 3.061 5.080 ( -0.527 4.766 -0.557) 4.827 5.145 ( -0.344 -1.184 0.592) 1.368 7.522 ( 4.516 2.469 -0.444) 5.166 7.613 ( 8.743 -6.366 -0.275) 10.818 8.811 ( -8.700 6.443 0.321) 10.831 8.924 ( -7.594 -4.630 -0.565) 8.912 9.540 ( 6.186 5.964 1.029) 8.654 9.672 ( 8.357 -7.062 0.077) 10.942 10.042 ( -3.282 -1.018 1.495) 3.747 10.066 ( 0.159 -3.382 -0.176) 3.390 11.495 ( -19.180 11.265 0.126) 22.244 11.713 ( -13.197 -10.269 0.117) 16.722 12.292 ( 14.013 7.977 0.276) 16.127 12.439 ( 10.820 -6.722 0.436) 12.745 16.663 ( 2.108 21.354 0.559) 21.465 17.100 ( 0.422 -22.105 0.368) 22.112 18.088 ( -2.239 7.939 -0.219) 8.252 18.312 ( -2.075 -13.374 -0.764) 13.556 21.525 ( -4.442 9.586 -0.496) 10.577 21.679 ( -3.823 -6.062 -0.762) 7.207 22.922 ( 4.703 10.343 1.248) 11.430 23.071 ( 5.700 -4.196 0.398) 7.089 107.790 ( 0.101 -0.113 0.049) 0.159 107.799 ( 0.186 -1.012 0.024) 1.030 108.422 ( 0.154 -0.043 0.086) 0.182 108.427 ( 0.143 -0.484 0.065) 0.509 ======================= Grid point 531 (257/259) ======================= q-point: ( 0.22 0.46 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.459 ( 3.811 10.236 1.468) 11.021 2.667 ( 1.600 -9.921 0.554) 10.065 3.278 ( -4.552 14.771 -3.834) 15.925 3.438 ( -5.460 4.281 2.622) 7.417 3.674 ( -5.020 -6.713 -1.314) 8.484 3.742 ( -4.895 -8.887 0.228) 10.149 4.651 ( 4.291 3.437 1.347) 5.661 4.696 ( 1.743 -0.804 1.906) 2.704 5.018 ( 0.340 2.178 1.513) 2.674 5.026 ( -1.469 2.672 1.901) 3.593 5.081 ( 1.601 3.888 0.498) 4.234 5.155 ( 0.894 -1.715 1.369) 2.369 7.657 ( 10.355 5.776 -0.226) 11.859 7.804 ( 12.190 -8.539 -0.450) 14.890 8.663 ( -7.073 5.847 0.214) 9.180 8.767 ( -8.159 -4.709 -1.053) 9.479 9.590 ( -3.369 8.183 2.212) 9.121 9.777 ( -2.477 -10.284 1.976) 10.761 10.024 ( 4.262 3.705 0.697) 5.690 10.129 ( 7.959 -6.698 -0.664) 10.424 11.155 ( -17.700 14.105 -0.358) 22.635 11.444 ( -15.568 -14.544 -0.161) 21.305 12.535 ( 11.811 5.939 0.733) 13.240 12.633 ( 9.371 -3.880 1.113) 10.203 16.723 ( 3.749 19.380 1.037) 19.766 17.108 ( -0.084 -19.028 0.537) 19.036 18.030 ( -3.649 8.130 -0.623) 8.933 18.258 ( -2.751 -13.519 -1.321) 13.859 21.418 ( -6.340 10.087 -0.759) 11.938 21.582 ( -5.660 -6.337 -1.108) 8.568 23.043 ( 6.857 10.520 1.910) 12.701 23.206 ( 8.122 -5.367 0.664) 9.758 107.793 ( 0.164 0.001 0.071) 0.179 107.804 ( 0.276 -1.066 0.040) 1.102 108.427 ( 0.239 -0.043 0.132) 0.276 108.431 ( 0.216 -0.443 0.099) 0.503 ======================= Grid point 532 (258/259) ======================= q-point: ( 0.33 0.46 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.547 ( 4.358 7.132 1.685) 8.527 2.701 ( 1.428 -7.898 0.567) 8.046 3.172 ( -3.631 12.194 -3.632) 13.231 3.354 ( -5.548 -2.005 2.182) 6.289 3.589 ( -2.856 -1.925 -1.346) 3.698 3.662 ( -4.363 -5.505 1.113) 7.112 4.724 ( 1.736 2.175 1.616) 3.218 4.743 ( 2.199 0.169 1.947) 2.943 4.995 ( -1.694 4.448 0.081) 4.761 5.019 ( -0.663 1.825 -0.088) 1.943 5.123 ( 1.531 3.130 1.481) 3.786 5.191 ( 1.363 -1.797 1.662) 2.801 7.863 ( 11.458 7.061 0.093) 13.459 8.015 ( 10.399 -7.755 -0.119) 12.973 8.585 ( -1.182 3.324 -0.119) 3.530 8.642 ( -4.102 -2.620 -1.498) 5.093 9.475 ( -9.801 6.205 2.432) 11.852 9.614 ( -14.222 -7.200 2.559) 16.145 10.187 ( 10.681 4.861 -0.084) 11.736 10.319 ( 12.160 -7.617 -0.565) 14.359 10.875 ( -12.572 12.575 -0.576) 17.791 11.168 ( -14.610 -16.081 -0.386) 21.730 12.717 ( 7.585 4.405 0.821) 8.810 12.780 ( 5.813 -1.974 1.255) 6.266 16.808 ( 4.501 15.464 1.258) 16.155 17.098 ( -1.563 -13.548 0.315) 13.642 17.958 ( -3.417 8.875 -0.907) 9.553 18.204 ( -1.917 -14.465 -1.264) 14.646 21.304 ( -5.286 10.306 -0.661) 11.602 21.475 ( -4.899 -6.590 -0.941) 8.265 23.176 ( 5.802 10.650 1.700) 12.247 23.350 ( 6.699 -6.400 0.629) 9.286 107.796 ( 0.150 0.117 0.061) 0.200 107.809 ( 0.237 -1.115 0.038) 1.140 108.432 ( 0.213 -0.047 0.117) 0.247 108.436 ( 0.187 -0.389 0.086) 0.440 ======================= Grid point 533 (259/259) ======================= q-point: ( 0.44 0.46 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.83e-04 5.83e-04 2.32e-04 2.32e-04 Number of triplets: 469 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.625 ( 2.570 4.004 0.916) 4.845 2.717 ( 0.028 -5.050 0.140) 5.052 3.106 ( -1.248 10.149 -1.607) 10.351 3.288 ( -2.537 -6.430 0.823) 6.961 3.554 ( -0.412 1.764 -0.617) 1.914 3.608 ( -2.155 -3.591 0.726) 4.251 4.748 ( 0.170 2.747 1.019) 2.935 4.783 ( 0.753 -1.315 0.647) 1.648 4.981 ( 0.104 4.655 -0.082) 4.657 5.003 ( -0.653 2.817 -0.400) 2.919 5.150 ( 0.488 3.028 0.611) 3.127 5.218 ( 0.517 -1.876 0.703) 2.069 8.020 ( 4.723 6.765 0.080) 8.251 8.141 ( 3.259 -5.246 0.192) 6.178 8.597 ( 0.962 0.778 -0.716) 1.429 8.623 ( 2.632 -0.829 -0.538) 2.812 9.332 ( -5.796 2.621 1.251) 6.483 9.393 ( -9.173 -3.138 1.095) 9.756 10.369 ( 9.061 7.153 0.004) 11.545 10.477 ( 1.804 0.012 -0.265) 1.823 10.737 ( 0.593 -0.190 -0.236) 0.666 10.921 ( -11.969 -15.150 -0.220) 19.309 12.815 ( 2.719 3.386 0.340) 4.356 12.856 ( 1.846 -0.777 0.573) 2.083 16.890 ( 2.985 10.359 0.773) 10.808 17.062 ( -1.923 -7.121 -0.097) 7.377 17.907 ( -1.385 9.554 -0.464) 9.665 18.174 ( -0.618 -15.540 -0.517) 15.560 21.232 ( -2.036 10.276 -0.258) 10.479 21.406 ( -1.932 -6.716 -0.367) 6.998 23.260 ( 2.249 10.683 0.680) 10.938 23.439 ( 2.554 -6.928 0.258) 7.388 107.799 ( 0.061 0.188 0.024) 0.199 107.812 ( 0.092 -1.142 0.015) 1.146 108.436 ( 0.085 -0.053 0.047) 0.111 108.438 ( 0.073 -0.350 0.034) 0.359 =================== 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 3/33696 10.0 277.131 339.506 310.933 0.000 40.624 0.000 3/33696 20.0 140.079 192.080 107.365 0.000 9.280 0.000 3/33696 30.0 63.459 99.932 48.270 0.000 0.927 0.000 3/33696 40.0 36.293 62.926 27.304 0.000 -0.539 0.000 3/33696 50.0 24.636 45.382 18.229 0.000 -0.740 0.000 3/33696 60.0 18.509 35.315 13.493 0.000 -0.699 0.000 3/33696 70.0 14.773 28.716 10.645 0.000 -0.616 0.000 3/33696 80.0 12.260 24.040 8.756 0.000 -0.535 0.000 3/33696 90.0 10.459 20.568 7.416 0.000 -0.464 0.000 3/33696 100.0 9.112 17.911 6.418 0.000 -0.405 0.000 3/33696 110.0 8.069 15.830 5.649 0.000 -0.356 0.000 3/33696 120.0 7.242 14.167 5.039 0.000 -0.316 0.000 3/33696 130.0 6.570 12.816 4.545 0.000 -0.283 0.000 3/33696 140.0 6.015 11.701 4.138 0.000 -0.255 0.000 3/33696 150.0 5.549 10.768 3.796 0.000 -0.231 0.000 3/33696 160.0 5.152 9.977 3.506 0.000 -0.211 0.000 3/33696 170.0 4.810 9.299 3.258 0.000 -0.194 0.000 3/33696 180.0 4.511 8.711 3.042 0.000 -0.179 0.000 3/33696 190.0 4.249 8.197 2.853 0.000 -0.166 0.000 3/33696 200.0 4.017 7.744 2.686 0.000 -0.155 0.000 3/33696 210.0 3.810 7.341 2.538 0.000 -0.145 0.000 3/33696 220.0 3.623 6.980 2.405 0.000 -0.136 0.000 3/33696 230.0 3.455 6.655 2.286 0.000 -0.128 0.000 3/33696 240.0 3.302 6.361 2.178 0.000 -0.121 0.000 3/33696 250.0 3.162 6.094 2.080 0.000 -0.115 0.000 3/33696 260.0 3.035 5.849 1.991 0.000 -0.109 0.000 3/33696 270.0 2.917 5.624 1.909 0.000 -0.104 0.000 3/33696 280.0 2.808 5.416 1.834 0.000 -0.099 0.000 3/33696 290.0 2.708 5.224 1.765 0.000 -0.094 0.000 3/33696 300.0 2.614 5.046 1.701 0.000 -0.090 0.000 3/33696 310.0 2.527 4.880 1.641 0.000 -0.087 0.000 3/33696 320.0 2.446 4.725 1.585 0.000 -0.083 0.000 3/33696 330.0 2.369 4.580 1.534 0.000 -0.080 0.000 3/33696 340.0 2.298 4.444 1.485 0.000 -0.077 0.000 3/33696 350.0 2.231 4.316 1.440 0.000 -0.075 0.000 3/33696 360.0 2.167 4.195 1.397 0.000 -0.072 0.000 3/33696 370.0 2.108 4.082 1.357 0.000 -0.070 0.000 3/33696 380.0 2.051 3.974 1.319 0.000 -0.068 0.000 3/33696 390.0 1.998 3.872 1.284 0.000 -0.065 0.000 3/33696 400.0 1.947 3.775 1.250 0.000 -0.063 0.000 3/33696 410.0 1.899 3.683 1.218 0.000 -0.062 0.000 3/33696 420.0 1.853 3.596 1.187 0.000 -0.060 0.000 3/33696 430.0 1.809 3.512 1.158 0.000 -0.058 0.000 3/33696 440.0 1.768 3.433 1.131 0.000 -0.057 0.000 3/33696 450.0 1.728 3.357 1.105 0.000 -0.055 0.000 3/33696 460.0 1.690 3.284 1.080 0.000 -0.054 0.000 3/33696 470.0 1.654 3.215 1.056 0.000 -0.053 0.000 3/33696 480.0 1.619 3.148 1.033 0.000 -0.051 0.000 3/33696 490.0 1.586 3.084 1.011 0.000 -0.050 0.000 3/33696 500.0 1.554 3.023 0.990 0.000 -0.049 0.000 3/33696 510.0 1.523 2.964 0.970 0.000 -0.048 0.000 3/33696 520.0 1.494 2.908 0.951 0.000 -0.047 0.000 3/33696 530.0 1.465 2.853 0.932 0.000 -0.046 0.000 3/33696 540.0 1.438 2.801 0.915 0.000 -0.045 0.000 3/33696 550.0 1.412 2.750 0.898 0.000 -0.044 0.000 3/33696 560.0 1.387 2.702 0.881 0.000 -0.043 0.000 3/33696 570.0 1.362 2.655 0.865 0.000 -0.042 0.000 3/33696 580.0 1.339 2.609 0.850 0.000 -0.041 0.000 3/33696 590.0 1.316 2.565 0.835 0.000 -0.041 0.000 3/33696 600.0 1.294 2.523 0.821 0.000 -0.040 0.000 3/33696 610.0 1.272 2.482 0.807 0.000 -0.039 0.000 3/33696 620.0 1.252 2.442 0.794 0.000 -0.038 0.000 3/33696 630.0 1.232 2.404 0.781 0.000 -0.038 0.000 3/33696 640.0 1.213 2.367 0.769 0.000 -0.037 0.000 3/33696 650.0 1.194 2.331 0.757 0.000 -0.037 0.000 3/33696 660.0 1.176 2.296 0.745 0.000 -0.036 0.000 3/33696 670.0 1.158 2.262 0.734 0.000 -0.035 0.000 3/33696 680.0 1.141 2.229 0.723 0.000 -0.035 0.000 3/33696 690.0 1.125 2.197 0.712 0.000 -0.034 0.000 3/33696 700.0 1.109 2.165 0.702 0.000 -0.034 0.000 3/33696 710.0 1.093 2.135 0.692 0.000 -0.033 0.000 3/33696 720.0 1.078 2.106 0.682 0.000 -0.033 0.000 3/33696 730.0 1.063 2.077 0.672 0.000 -0.032 0.000 3/33696 740.0 1.049 2.049 0.663 0.000 -0.032 0.000 3/33696 750.0 1.035 2.022 0.654 0.000 -0.031 0.000 3/33696 760.0 1.021 1.996 0.646 0.000 -0.031 0.000 3/33696 770.0 1.008 1.970 0.637 0.000 -0.030 0.000 3/33696 780.0 0.995 1.945 0.629 0.000 -0.030 0.000 3/33696 790.0 0.982 1.921 0.621 0.000 -0.030 0.000 3/33696 800.0 0.970 1.897 0.613 0.000 -0.029 0.000 3/33696 810.0 0.958 1.874 0.605 0.000 -0.029 0.000 3/33696 820.0 0.946 1.851 0.598 0.000 -0.028 0.000 3/33696 830.0 0.935 1.829 0.590 0.000 -0.028 0.000 3/33696 840.0 0.924 1.807 0.583 0.000 -0.028 0.000 3/33696 850.0 0.913 1.786 0.576 0.000 -0.027 0.000 3/33696 860.0 0.902 1.766 0.570 0.000 -0.027 0.000 3/33696 870.0 0.892 1.745 0.563 0.000 -0.027 0.000 3/33696 880.0 0.882 1.726 0.557 0.000 -0.026 0.000 3/33696 890.0 0.872 1.706 0.550 0.000 -0.026 0.000 3/33696 900.0 0.862 1.688 0.544 0.000 -0.026 0.000 3/33696 910.0 0.853 1.669 0.538 0.000 -0.026 0.000 3/33696 920.0 0.844 1.651 0.532 0.000 -0.025 0.000 3/33696 930.0 0.835 1.634 0.526 0.000 -0.025 0.000 3/33696 940.0 0.826 1.616 0.521 0.000 -0.025 0.000 3/33696 950.0 0.817 1.599 0.515 0.000 -0.024 0.000 3/33696 960.0 0.808 1.583 0.510 0.000 -0.024 0.000 3/33696 970.0 0.800 1.567 0.505 0.000 -0.024 0.000 3/33696 980.0 0.792 1.551 0.499 0.000 -0.024 0.000 3/33696 990.0 0.784 1.535 0.494 0.000 -0.023 0.000 3/33696 1000.0 0.776 1.520 0.489 0.000 -0.023 0.000 3/33696 Thermal conductivity related properties were written into "kappa-m9138.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 05:50:54]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|