----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 11:20:04]------------------------- 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 1 3] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.478064050008248 -5.463612000000000 0.000000000000000 b 3.478064050008248 5.463612000000000 0.000000000000000 c -3.272285362405070 0.000000000000000 3.848780823181887 Atomic positions (fractional): *1 Tb 0.63205745256149 0.36794254743851 0.25000000000000 158.925 2 Tb 0.36794254743851 0.63205745256149 0.75000000000000 158.925 *3 Ta 0.90002238954624 0.09997761045376 0.75000000000000 180.948 4 Ta 0.09997761045376 0.90002238954624 0.25000000000000 180.948 *5 O 0.78839338566037 0.72753856458280 0.78459120613105 15.999 *6 O 0.94571513575679 0.36706744807930 0.65945116471355 15.999 7 O 0.21160661433963 0.27246143541720 0.21540879386895 15.999 8 O 0.36706744807930 0.94571513575679 0.15945116471354 15.999 9 O 0.27246143541720 0.21160661433963 0.71540879386895 15.999 10 O 0.63293255192070 0.05428486424321 0.84054883528645 15.999 11 O 0.05428486424321 0.63293255192070 0.34054883528646 15.999 12 O 0.72753856458280 0.78839338566037 0.28459120613105 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.956128100016497 0.000000000000000 0.000000000000000 b 0.000000000000000 10.927224000000001 0.000000000000000 c -3.272285362405070 0.000000000000000 3.848780823181887 Atomic positions (fractional): *1 Tb 0.50000000000000 0.86794254743851 0.25000000000000 158.925 > 1 2 Tb 0.00000000000000 0.63205745256149 0.75000000000000 158.925 > 2 3 Tb 0.00000000000000 0.36794254743851 0.25000000000000 158.925 > 1 4 Tb 0.50000000000000 0.13205745256149 0.75000000000000 158.925 > 2 *5 Ta 0.50000000000000 0.59997761045376 0.75000000000000 180.948 > 3 6 Ta 0.00000000000000 0.90002238954624 0.25000000000000 180.948 > 4 7 Ta 0.00000000000000 0.09997761045376 0.75000000000000 180.948 > 3 8 Ta 0.50000000000000 0.40002238954624 0.25000000000000 180.948 > 4 *9 O 0.75796597512159 0.96957258946121 0.78459120613105 15.999 > 5 *10 O 0.65639129191804 0.71067615616126 0.65945116471355 15.999 > 6 11 O 0.74203402487841 0.53042741053879 0.21540879386895 15.999 > 7 12 O 0.15639129191804 0.78932384383874 0.15945116471355 15.999 > 8 13 O 0.24203402487841 0.96957258946121 0.71540879386895 15.999 > 9 14 O 0.34360870808196 0.71067615616126 0.84054883528645 15.999 > 10 15 O 0.84360870808196 0.78932384383874 0.34054883528646 15.999 > 11 16 O 0.25796597512158 0.53042741053879 0.28459120613105 15.999 > 12 17 O 0.25796597512158 0.46957258946121 0.78459120613105 15.999 > 5 18 O 0.15639129191804 0.21067615616126 0.65945116471355 15.999 > 6 19 O 0.24203402487841 0.03042741053879 0.21540879386895 15.999 > 7 20 O 0.65639129191804 0.28932384383874 0.15945116471355 15.999 > 8 21 O 0.74203402487841 0.46957258946121 0.71540879386895 15.999 > 9 22 O 0.84360870808196 0.21067615616126 0.84054883528645 15.999 > 10 23 O 0.34360870808196 0.28932384383874 0.34054883528646 15.999 > 11 24 O 0.75796597512159 0.03042741053879 0.28459120613105 15.999 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 13.912256200032994 0.000000000000000 0.000000000000000 b 0.000000000000000 10.927224000000001 0.000000000000000 c -9.816856087215211 0.000000000000000 11.546342469545662 Atomic positions (fractional): *1 Tb 0.25000000000000 0.86794254743851 0.08333333333333 158.925 > 1 2 Tb 0.75000000000000 0.86794254743851 0.08333333333333 158.925 > 1 3 Tb 0.25000000000000 0.86794254743851 0.41666666666667 158.925 > 1 4 Tb 0.75000000000000 0.86794254743851 0.41666666666667 158.925 > 1 5 Tb 0.25000000000000 0.86794254743851 0.75000000000000 158.925 > 1 6 Tb 0.75000000000000 0.86794254743851 0.75000000000000 158.925 > 1 7 Tb 0.00000000000000 0.63205745256149 0.25000000000000 158.925 > 2 8 Tb 0.50000000000000 0.63205745256149 0.25000000000000 158.925 > 2 9 Tb 0.00000000000000 0.63205745256149 0.58333333333333 158.925 > 2 10 Tb 0.50000000000000 0.63205745256149 0.58333333333333 158.925 > 2 11 Tb 0.00000000000000 0.63205745256149 0.91666666666667 158.925 > 2 12 Tb 0.50000000000000 0.63205745256149 0.91666666666667 158.925 > 2 13 Tb 0.00000000000000 0.36794254743851 0.08333333333333 158.925 > 1 14 Tb 0.50000000000000 0.36794254743851 0.08333333333333 158.925 > 1 15 Tb 0.00000000000000 0.36794254743851 0.41666666666667 158.925 > 1 16 Tb 0.50000000000000 0.36794254743851 0.41666666666667 158.925 > 1 17 Tb 0.00000000000000 0.36794254743851 0.75000000000000 158.925 > 1 18 Tb 0.50000000000000 0.36794254743851 0.75000000000000 158.925 > 1 19 Tb 0.25000000000000 0.13205745256149 0.25000000000000 158.925 > 2 20 Tb 0.75000000000000 0.13205745256149 0.25000000000000 158.925 > 2 21 Tb 0.25000000000000 0.13205745256149 0.58333333333333 158.925 > 2 22 Tb 0.75000000000000 0.13205745256149 0.58333333333333 158.925 > 2 23 Tb 0.25000000000000 0.13205745256149 0.91666666666667 158.925 > 2 24 Tb 0.75000000000000 0.13205745256149 0.91666666666667 158.925 > 2 *25 Ta 0.25000000000000 0.59997761045376 0.25000000000000 180.948 > 3 26 Ta 0.75000000000000 0.59997761045376 0.25000000000000 180.948 > 3 27 Ta 0.25000000000000 0.59997761045376 0.58333333333333 180.948 > 3 28 Ta 0.75000000000000 0.59997761045376 0.58333333333333 180.948 > 3 29 Ta 0.25000000000000 0.59997761045376 0.91666666666667 180.948 > 3 30 Ta 0.75000000000000 0.59997761045376 0.91666666666667 180.948 > 3 31 Ta 0.00000000000000 0.90002238954624 0.08333333333333 180.948 > 4 32 Ta 0.50000000000000 0.90002238954624 0.08333333333333 180.948 > 4 33 Ta 0.00000000000000 0.90002238954624 0.41666666666667 180.948 > 4 34 Ta 0.50000000000000 0.90002238954624 0.41666666666667 180.948 > 4 35 Ta 0.00000000000000 0.90002238954624 0.75000000000000 180.948 > 4 36 Ta 0.50000000000000 0.90002238954624 0.75000000000000 180.948 > 4 37 Ta 0.00000000000000 0.09997761045376 0.25000000000000 180.948 > 3 38 Ta 0.50000000000000 0.09997761045376 0.25000000000000 180.948 > 3 39 Ta 0.00000000000000 0.09997761045376 0.58333333333333 180.948 > 3 40 Ta 0.50000000000000 0.09997761045376 0.58333333333333 180.948 > 3 41 Ta 0.00000000000000 0.09997761045376 0.91666666666667 180.948 > 3 42 Ta 0.50000000000000 0.09997761045376 0.91666666666667 180.948 > 3 43 Ta 0.25000000000000 0.40002238954624 0.08333333333333 180.948 > 4 44 Ta 0.75000000000000 0.40002238954624 0.08333333333333 180.948 > 4 45 Ta 0.25000000000000 0.40002238954624 0.41666666666667 180.948 > 4 46 Ta 0.75000000000000 0.40002238954624 0.41666666666667 180.948 > 4 47 Ta 0.25000000000000 0.40002238954624 0.75000000000000 180.948 > 4 48 Ta 0.75000000000000 0.40002238954624 0.75000000000000 180.948 > 4 *49 O 0.37898298756079 0.96957258946121 0.26153040204368 15.999 > 5 50 O 0.87898298756079 0.96957258946121 0.26153040204368 15.999 > 5 51 O 0.37898298756079 0.96957258946121 0.59486373537702 15.999 > 5 52 O 0.87898298756079 0.96957258946121 0.59486373537702 15.999 > 5 53 O 0.37898298756079 0.96957258946121 0.92819706871035 15.999 > 5 54 O 0.87898298756079 0.96957258946121 0.92819706871035 15.999 > 5 *55 O 0.32819564595902 0.71067615616126 0.21981705490452 15.999 > 6 56 O 0.82819564595902 0.71067615616126 0.21981705490452 15.999 > 6 57 O 0.32819564595902 0.71067615616126 0.55315038823785 15.999 > 6 58 O 0.82819564595902 0.71067615616126 0.55315038823785 15.999 > 6 59 O 0.32819564595902 0.71067615616126 0.88648372157118 15.999 > 6 60 O 0.82819564595902 0.71067615616126 0.88648372157118 15.999 > 6 61 O 0.37101701243921 0.53042741053879 0.07180293128965 15.999 > 7 62 O 0.87101701243921 0.53042741053879 0.07180293128965 15.999 > 7 63 O 0.37101701243921 0.53042741053879 0.40513626462298 15.999 > 7 64 O 0.87101701243921 0.53042741053879 0.40513626462298 15.999 > 7 65 O 0.37101701243921 0.53042741053879 0.73846959795632 15.999 > 7 66 O 0.87101701243921 0.53042741053879 0.73846959795632 15.999 > 7 67 O 0.07819564595902 0.78932384383874 0.05315038823785 15.999 > 8 68 O 0.57819564595902 0.78932384383874 0.05315038823785 15.999 > 8 69 O 0.07819564595902 0.78932384383874 0.38648372157118 15.999 > 8 70 O 0.57819564595902 0.78932384383874 0.38648372157118 15.999 > 8 71 O 0.07819564595902 0.78932384383874 0.71981705490451 15.999 > 8 72 O 0.57819564595902 0.78932384383874 0.71981705490451 15.999 > 8 73 O 0.12101701243921 0.96957258946121 0.23846959795632 15.999 > 9 74 O 0.62101701243921 0.96957258946121 0.23846959795632 15.999 > 9 75 O 0.12101701243921 0.96957258946121 0.57180293128965 15.999 > 9 76 O 0.62101701243921 0.96957258946121 0.57180293128965 15.999 > 9 77 O 0.12101701243921 0.96957258946121 0.90513626462298 15.999 > 9 78 O 0.62101701243921 0.96957258946121 0.90513626462298 15.999 > 9 79 O 0.17180435404098 0.71067615616126 0.28018294509548 15.999 > 10 80 O 0.67180435404098 0.71067615616126 0.28018294509548 15.999 > 10 81 O 0.17180435404098 0.71067615616126 0.61351627842882 15.999 > 10 82 O 0.67180435404098 0.71067615616126 0.61351627842882 15.999 > 10 83 O 0.17180435404098 0.71067615616126 0.94684961176215 15.999 > 10 84 O 0.67180435404098 0.71067615616126 0.94684961176215 15.999 > 10 85 O 0.42180435404098 0.78932384383874 0.11351627842882 15.999 > 11 86 O 0.92180435404098 0.78932384383874 0.11351627842882 15.999 > 11 87 O 0.42180435404098 0.78932384383874 0.44684961176215 15.999 > 11 88 O 0.92180435404098 0.78932384383874 0.44684961176215 15.999 > 11 89 O 0.42180435404098 0.78932384383874 0.78018294509549 15.999 > 11 90 O 0.92180435404098 0.78932384383874 0.78018294509549 15.999 > 11 91 O 0.12898298756079 0.53042741053879 0.09486373537702 15.999 > 12 92 O 0.62898298756079 0.53042741053879 0.09486373537702 15.999 > 12 93 O 0.12898298756079 0.53042741053879 0.42819706871035 15.999 > 12 94 O 0.62898298756079 0.53042741053879 0.42819706871035 15.999 > 12 95 O 0.12898298756079 0.53042741053879 0.76153040204368 15.999 > 12 96 O 0.62898298756079 0.53042741053879 0.76153040204368 15.999 > 12 97 O 0.12898298756079 0.46957258946121 0.26153040204368 15.999 > 5 98 O 0.62898298756079 0.46957258946121 0.26153040204368 15.999 > 5 99 O 0.12898298756079 0.46957258946121 0.59486373537702 15.999 > 5 100 O 0.62898298756079 0.46957258946121 0.59486373537702 15.999 > 5 101 O 0.12898298756079 0.46957258946121 0.92819706871035 15.999 > 5 102 O 0.62898298756079 0.46957258946121 0.92819706871035 15.999 > 5 103 O 0.07819564595902 0.21067615616126 0.21981705490452 15.999 > 6 104 O 0.57819564595902 0.21067615616126 0.21981705490452 15.999 > 6 105 O 0.07819564595902 0.21067615616126 0.55315038823785 15.999 > 6 106 O 0.57819564595902 0.21067615616126 0.55315038823785 15.999 > 6 107 O 0.07819564595902 0.21067615616126 0.88648372157118 15.999 > 6 108 O 0.57819564595902 0.21067615616126 0.88648372157118 15.999 > 6 109 O 0.12101701243921 0.03042741053879 0.07180293128965 15.999 > 7 110 O 0.62101701243921 0.03042741053879 0.07180293128965 15.999 > 7 111 O 0.12101701243921 0.03042741053879 0.40513626462298 15.999 > 7 112 O 0.62101701243921 0.03042741053879 0.40513626462298 15.999 > 7 113 O 0.12101701243921 0.03042741053879 0.73846959795632 15.999 > 7 114 O 0.62101701243921 0.03042741053879 0.73846959795632 15.999 > 7 115 O 0.32819564595902 0.28932384383874 0.05315038823785 15.999 > 8 116 O 0.82819564595902 0.28932384383874 0.05315038823785 15.999 > 8 117 O 0.32819564595902 0.28932384383874 0.38648372157118 15.999 > 8 118 O 0.82819564595902 0.28932384383874 0.38648372157118 15.999 > 8 119 O 0.32819564595902 0.28932384383874 0.71981705490451 15.999 > 8 120 O 0.82819564595902 0.28932384383874 0.71981705490451 15.999 > 8 121 O 0.37101701243921 0.46957258946121 0.23846959795632 15.999 > 9 122 O 0.87101701243921 0.46957258946121 0.23846959795632 15.999 > 9 123 O 0.37101701243921 0.46957258946121 0.57180293128965 15.999 > 9 124 O 0.87101701243921 0.46957258946121 0.57180293128965 15.999 > 9 125 O 0.37101701243921 0.46957258946121 0.90513626462298 15.999 > 9 126 O 0.87101701243921 0.46957258946121 0.90513626462298 15.999 > 9 127 O 0.42180435404098 0.21067615616126 0.28018294509548 15.999 > 10 128 O 0.92180435404098 0.21067615616126 0.28018294509548 15.999 > 10 129 O 0.42180435404098 0.21067615616126 0.61351627842882 15.999 > 10 130 O 0.92180435404098 0.21067615616126 0.61351627842882 15.999 > 10 131 O 0.42180435404098 0.21067615616126 0.94684961176215 15.999 > 10 132 O 0.92180435404098 0.21067615616126 0.94684961176215 15.999 > 10 133 O 0.17180435404098 0.28932384383874 0.11351627842882 15.999 > 11 134 O 0.67180435404098 0.28932384383874 0.11351627842882 15.999 > 11 135 O 0.17180435404098 0.28932384383874 0.44684961176215 15.999 > 11 136 O 0.67180435404098 0.28932384383874 0.44684961176215 15.999 > 11 137 O 0.17180435404098 0.28932384383874 0.78018294509549 15.999 > 11 138 O 0.67180435404098 0.28932384383874 0.78018294509549 15.999 > 11 139 O 0.37898298756079 0.03042741053879 0.09486373537702 15.999 > 12 140 O 0.87898298756079 0.03042741053879 0.09486373537702 15.999 > 12 141 O 0.37898298756079 0.03042741053879 0.42819706871035 15.999 > 12 142 O 0.87898298756079 0.03042741053879 0.42819706871035 15.999 > 12 143 O 0.37898298756079 0.03042741053879 0.76153040204368 15.999 > 12 144 O 0.87898298756079 0.03042741053879 0.76153040204368 15.999 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.9291788 0.0000000 -0.3063424 0.0000000 4.6180463 0.0000000 -0.3063427 0.0000000 4.7216162 -------------------------- Born effective charges -------------------------- 1 Tb 4.5208578 -0.0000000 0.0464040 0.0000000 3.9231537 0.0000000 0.4319033 -0.0000000 4.3068829 2 Tb 4.5208578 -0.0000000 0.0464040 0.0000000 3.9231537 0.0000000 0.4319033 -0.0000000 4.3068829 3 Ta 5.8338675 -0.0000000 -0.9712979 0.0000000 5.4742077 0.0000000 -1.3983893 -0.0000000 5.3856807 4 Ta 5.8338675 -0.0000000 -0.9712979 0.0000000 5.4742077 0.0000000 -1.3983893 -0.0000000 5.3856807 5 O -1.9476177 -0.2467474 0.1151172 -0.1976900 -2.1077070 0.4694061 0.0891923 0.5694957 -3.2953011 6 O -3.2297449 -0.9387213 0.3473298 -0.9301576 -2.5909737 0.5975343 0.3940507 0.5261689 -1.5509807 7 O -1.9476177 -0.2467474 0.1151172 -0.1976900 -2.1077070 0.4694061 0.0891923 0.5694957 -3.2953011 8 O -3.2297449 0.9387213 0.3473298 0.9301576 -2.5909737 -0.5975343 0.3940507 -0.5261689 -1.5509807 9 O -1.9476177 0.2467474 0.1151172 0.1976900 -2.1077070 -0.4694061 0.0891923 -0.5694957 -3.2953011 10 O -3.2297449 0.9387213 0.3473298 0.9301576 -2.5909737 -0.5975343 0.3940507 -0.5261689 -1.5509807 11 O -3.2297449 -0.9387213 0.3473298 -0.9301576 -2.5909737 0.5975343 0.3940507 0.5261689 -1.5509807 12 O -1.9476177 0.2467474 0.1151172 0.1976900 -2.1077070 -0.4694061 0.0891923 -0.5694957 -3.2953011 ---------------------------------------------------------------------------- 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: 9972/9972 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2074 Number of blocks in projector: 2074 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: 440 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 262 Use standard eigh solver. Tree of FC basis block matrices: - (2074, 2047), data: False |-- (262, 258), data: True |-- (262, 258), data: True |-- (262, 258), data: True |-- (424, 420), data: True |-- (424, 420), data: True |-- (440, 433), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.005 Solver_block: 100 / 400 - Time: 0.846 Solver_block: 200 / 400 - Time: 0.822 Solver_block: 300 / 400 - Time: 0.814 Solver_block: 400 / 400 - Time: 0.832 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 3.401 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) Permutation basis: 432/432 Permutation basis: 9972/9972 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2074 Number of blocks in projector: 2074 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: 440 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 262 Use standard eigh solver. Tree of FC basis block matrices: - (2074, 2047), data: False |-- (262, 258), data: True |-- (262, 258), data: True |-- (262, 258), data: True |-- (424, 420), data: True |-- (424, 420), data: True |-- (440, 433), 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 11:20:29]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 11:20:29]------------------------- 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 1 3] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.478064050008248 -5.463612000000000 0.000000000000000 b 3.478064050008248 5.463612000000000 0.000000000000000 c -3.272285362405070 0.000000000000000 3.848780823181887 Atomic positions (fractional): 1 Tb 0.63205745256149 0.36794254743851 0.25000000000000 158.925 2 Tb 0.36794254743851 0.63205745256149 0.75000000000000 158.925 3 Ta 0.90002238954624 0.09997761045376 0.75000000000000 180.948 4 Ta 0.09997761045376 0.90002238954624 0.25000000000000 180.948 5 O 0.78839338566037 0.72753856458280 0.78459120613105 15.999 6 O 0.94571513575679 0.36706744807930 0.65945116471355 15.999 7 O 0.21160661433963 0.27246143541720 0.21540879386895 15.999 8 O 0.36706744807930 0.94571513575679 0.15945116471354 15.999 9 O 0.27246143541720 0.21160661433963 0.71540879386895 15.999 10 O 0.63293255192070 0.05428486424321 0.84054883528645 15.999 11 O 0.05428486424321 0.63293255192070 0.34054883528646 15.999 12 O 0.72753856458280 0.78839338566037 0.28459120613105 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.912256200032994 0.000000000000000 0.000000000000000 b 0.000000000000000 10.927224000000001 0.000000000000000 c -9.816856087215211 0.000000000000000 11.546342469545662 Atomic positions (fractional): 1 Tb 0.25000000000000 0.86794254743851 0.08333333333333 158.925 > 1 2 Tb 0.75000000000000 0.86794254743851 0.08333333333333 158.925 > 1 3 Tb 0.25000000000000 0.86794254743851 0.41666666666667 158.925 > 1 4 Tb 0.75000000000000 0.86794254743851 0.41666666666667 158.925 > 1 5 Tb 0.25000000000000 0.86794254743851 0.75000000000000 158.925 > 1 6 Tb 0.75000000000000 0.86794254743851 0.75000000000000 158.925 > 1 7 Tb 0.00000000000000 0.63205745256149 0.25000000000000 158.925 > 7 8 Tb 0.50000000000000 0.63205745256149 0.25000000000000 158.925 > 7 9 Tb 0.00000000000000 0.63205745256149 0.58333333333333 158.925 > 7 10 Tb 0.50000000000000 0.63205745256149 0.58333333333333 158.925 > 7 11 Tb 0.00000000000000 0.63205745256149 0.91666666666667 158.925 > 7 12 Tb 0.50000000000000 0.63205745256149 0.91666666666667 158.925 > 7 13 Tb 0.00000000000000 0.36794254743851 0.08333333333333 158.925 > 1 14 Tb 0.50000000000000 0.36794254743851 0.08333333333333 158.925 > 1 15 Tb 0.00000000000000 0.36794254743851 0.41666666666667 158.925 > 1 16 Tb 0.50000000000000 0.36794254743851 0.41666666666667 158.925 > 1 17 Tb 0.00000000000000 0.36794254743851 0.75000000000000 158.925 > 1 18 Tb 0.50000000000000 0.36794254743851 0.75000000000000 158.925 > 1 19 Tb 0.25000000000000 0.13205745256149 0.25000000000000 158.925 > 7 20 Tb 0.75000000000000 0.13205745256149 0.25000000000000 158.925 > 7 21 Tb 0.25000000000000 0.13205745256149 0.58333333333333 158.925 > 7 22 Tb 0.75000000000000 0.13205745256149 0.58333333333333 158.925 > 7 23 Tb 0.25000000000000 0.13205745256149 0.91666666666667 158.925 > 7 24 Tb 0.75000000000000 0.13205745256149 0.91666666666667 158.925 > 7 25 Ta 0.25000000000000 0.59997761045376 0.25000000000000 180.948 > 25 26 Ta 0.75000000000000 0.59997761045376 0.25000000000000 180.948 > 25 27 Ta 0.25000000000000 0.59997761045376 0.58333333333333 180.948 > 25 28 Ta 0.75000000000000 0.59997761045376 0.58333333333333 180.948 > 25 29 Ta 0.25000000000000 0.59997761045376 0.91666666666667 180.948 > 25 30 Ta 0.75000000000000 0.59997761045376 0.91666666666667 180.948 > 25 31 Ta 0.00000000000000 0.90002238954624 0.08333333333333 180.948 > 31 32 Ta 0.50000000000000 0.90002238954624 0.08333333333333 180.948 > 31 33 Ta 0.00000000000000 0.90002238954624 0.41666666666667 180.948 > 31 34 Ta 0.50000000000000 0.90002238954624 0.41666666666667 180.948 > 31 35 Ta 0.00000000000000 0.90002238954624 0.75000000000000 180.948 > 31 36 Ta 0.50000000000000 0.90002238954624 0.75000000000000 180.948 > 31 37 Ta 0.00000000000000 0.09997761045376 0.25000000000000 180.948 > 25 38 Ta 0.50000000000000 0.09997761045376 0.25000000000000 180.948 > 25 39 Ta 0.00000000000000 0.09997761045376 0.58333333333333 180.948 > 25 40 Ta 0.50000000000000 0.09997761045376 0.58333333333333 180.948 > 25 41 Ta 0.00000000000000 0.09997761045376 0.91666666666667 180.948 > 25 42 Ta 0.50000000000000 0.09997761045376 0.91666666666667 180.948 > 25 43 Ta 0.25000000000000 0.40002238954624 0.08333333333333 180.948 > 31 44 Ta 0.75000000000000 0.40002238954624 0.08333333333333 180.948 > 31 45 Ta 0.25000000000000 0.40002238954624 0.41666666666667 180.948 > 31 46 Ta 0.75000000000000 0.40002238954624 0.41666666666667 180.948 > 31 47 Ta 0.25000000000000 0.40002238954624 0.75000000000000 180.948 > 31 48 Ta 0.75000000000000 0.40002238954624 0.75000000000000 180.948 > 31 49 O 0.37898298756079 0.96957258946121 0.26153040204368 15.999 > 49 50 O 0.87898298756079 0.96957258946121 0.26153040204368 15.999 > 49 51 O 0.37898298756079 0.96957258946121 0.59486373537702 15.999 > 49 52 O 0.87898298756079 0.96957258946121 0.59486373537702 15.999 > 49 53 O 0.37898298756079 0.96957258946121 0.92819706871035 15.999 > 49 54 O 0.87898298756079 0.96957258946121 0.92819706871035 15.999 > 49 55 O 0.32819564595902 0.71067615616126 0.21981705490452 15.999 > 55 56 O 0.82819564595902 0.71067615616126 0.21981705490452 15.999 > 55 57 O 0.32819564595902 0.71067615616126 0.55315038823785 15.999 > 55 58 O 0.82819564595902 0.71067615616126 0.55315038823785 15.999 > 55 59 O 0.32819564595902 0.71067615616126 0.88648372157118 15.999 > 55 60 O 0.82819564595902 0.71067615616126 0.88648372157118 15.999 > 55 61 O 0.37101701243921 0.53042741053879 0.07180293128965 15.999 > 61 62 O 0.87101701243921 0.53042741053879 0.07180293128965 15.999 > 61 63 O 0.37101701243921 0.53042741053879 0.40513626462298 15.999 > 61 64 O 0.87101701243921 0.53042741053879 0.40513626462298 15.999 > 61 65 O 0.37101701243921 0.53042741053879 0.73846959795632 15.999 > 61 66 O 0.87101701243921 0.53042741053879 0.73846959795632 15.999 > 61 67 O 0.07819564595902 0.78932384383874 0.05315038823785 15.999 > 67 68 O 0.57819564595902 0.78932384383874 0.05315038823785 15.999 > 67 69 O 0.07819564595902 0.78932384383874 0.38648372157118 15.999 > 67 70 O 0.57819564595902 0.78932384383874 0.38648372157118 15.999 > 67 71 O 0.07819564595902 0.78932384383874 0.71981705490451 15.999 > 67 72 O 0.57819564595902 0.78932384383874 0.71981705490451 15.999 > 67 73 O 0.12101701243921 0.96957258946121 0.23846959795632 15.999 > 73 74 O 0.62101701243921 0.96957258946121 0.23846959795632 15.999 > 73 75 O 0.12101701243921 0.96957258946121 0.57180293128965 15.999 > 73 76 O 0.62101701243921 0.96957258946121 0.57180293128965 15.999 > 73 77 O 0.12101701243921 0.96957258946121 0.90513626462298 15.999 > 73 78 O 0.62101701243921 0.96957258946121 0.90513626462298 15.999 > 73 79 O 0.17180435404098 0.71067615616126 0.28018294509548 15.999 > 79 80 O 0.67180435404098 0.71067615616126 0.28018294509548 15.999 > 79 81 O 0.17180435404098 0.71067615616126 0.61351627842882 15.999 > 79 82 O 0.67180435404098 0.71067615616126 0.61351627842882 15.999 > 79 83 O 0.17180435404098 0.71067615616126 0.94684961176215 15.999 > 79 84 O 0.67180435404098 0.71067615616126 0.94684961176215 15.999 > 79 85 O 0.42180435404098 0.78932384383874 0.11351627842882 15.999 > 85 86 O 0.92180435404098 0.78932384383874 0.11351627842882 15.999 > 85 87 O 0.42180435404098 0.78932384383874 0.44684961176215 15.999 > 85 88 O 0.92180435404098 0.78932384383874 0.44684961176215 15.999 > 85 89 O 0.42180435404098 0.78932384383874 0.78018294509549 15.999 > 85 90 O 0.92180435404098 0.78932384383874 0.78018294509549 15.999 > 85 91 O 0.12898298756079 0.53042741053879 0.09486373537702 15.999 > 91 92 O 0.62898298756079 0.53042741053879 0.09486373537702 15.999 > 91 93 O 0.12898298756079 0.53042741053879 0.42819706871035 15.999 > 91 94 O 0.62898298756079 0.53042741053879 0.42819706871035 15.999 > 91 95 O 0.12898298756079 0.53042741053879 0.76153040204368 15.999 > 91 96 O 0.62898298756079 0.53042741053879 0.76153040204368 15.999 > 91 97 O 0.12898298756079 0.46957258946121 0.26153040204368 15.999 > 49 98 O 0.62898298756079 0.46957258946121 0.26153040204368 15.999 > 49 99 O 0.12898298756079 0.46957258946121 0.59486373537702 15.999 > 49 100 O 0.62898298756079 0.46957258946121 0.59486373537702 15.999 > 49 101 O 0.12898298756079 0.46957258946121 0.92819706871035 15.999 > 49 102 O 0.62898298756079 0.46957258946121 0.92819706871035 15.999 > 49 103 O 0.07819564595902 0.21067615616126 0.21981705490452 15.999 > 55 104 O 0.57819564595902 0.21067615616126 0.21981705490452 15.999 > 55 105 O 0.07819564595902 0.21067615616126 0.55315038823785 15.999 > 55 106 O 0.57819564595902 0.21067615616126 0.55315038823785 15.999 > 55 107 O 0.07819564595902 0.21067615616126 0.88648372157118 15.999 > 55 108 O 0.57819564595902 0.21067615616126 0.88648372157118 15.999 > 55 109 O 0.12101701243921 0.03042741053879 0.07180293128965 15.999 > 61 110 O 0.62101701243921 0.03042741053879 0.07180293128965 15.999 > 61 111 O 0.12101701243921 0.03042741053879 0.40513626462298 15.999 > 61 112 O 0.62101701243921 0.03042741053879 0.40513626462298 15.999 > 61 113 O 0.12101701243921 0.03042741053879 0.73846959795632 15.999 > 61 114 O 0.62101701243921 0.03042741053879 0.73846959795632 15.999 > 61 115 O 0.32819564595902 0.28932384383874 0.05315038823785 15.999 > 67 116 O 0.82819564595902 0.28932384383874 0.05315038823785 15.999 > 67 117 O 0.32819564595902 0.28932384383874 0.38648372157118 15.999 > 67 118 O 0.82819564595902 0.28932384383874 0.38648372157118 15.999 > 67 119 O 0.32819564595902 0.28932384383874 0.71981705490451 15.999 > 67 120 O 0.82819564595902 0.28932384383874 0.71981705490451 15.999 > 67 121 O 0.37101701243921 0.46957258946121 0.23846959795632 15.999 > 73 122 O 0.87101701243921 0.46957258946121 0.23846959795632 15.999 > 73 123 O 0.37101701243921 0.46957258946121 0.57180293128965 15.999 > 73 124 O 0.87101701243921 0.46957258946121 0.57180293128965 15.999 > 73 125 O 0.37101701243921 0.46957258946121 0.90513626462298 15.999 > 73 126 O 0.87101701243921 0.46957258946121 0.90513626462298 15.999 > 73 127 O 0.42180435404098 0.21067615616126 0.28018294509548 15.999 > 79 128 O 0.92180435404098 0.21067615616126 0.28018294509548 15.999 > 79 129 O 0.42180435404098 0.21067615616126 0.61351627842882 15.999 > 79 130 O 0.92180435404098 0.21067615616126 0.61351627842882 15.999 > 79 131 O 0.42180435404098 0.21067615616126 0.94684961176215 15.999 > 79 132 O 0.92180435404098 0.21067615616126 0.94684961176215 15.999 > 79 133 O 0.17180435404098 0.28932384383874 0.11351627842882 15.999 > 85 134 O 0.67180435404098 0.28932384383874 0.11351627842882 15.999 > 85 135 O 0.17180435404098 0.28932384383874 0.44684961176215 15.999 > 85 136 O 0.67180435404098 0.28932384383874 0.44684961176215 15.999 > 85 137 O 0.17180435404098 0.28932384383874 0.78018294509549 15.999 > 85 138 O 0.67180435404098 0.28932384383874 0.78018294509549 15.999 > 85 139 O 0.37898298756079 0.03042741053879 0.09486373537702 15.999 > 91 140 O 0.87898298756079 0.03042741053879 0.09486373537702 15.999 > 91 141 O 0.37898298756079 0.03042741053879 0.42819706871035 15.999 > 91 142 O 0.87898298756079 0.03042741053879 0.42819706871035 15.999 > 91 143 O 0.37898298756079 0.03042741053879 0.76153040204368 15.999 > 91 144 O 0.87898298756079 0.03042741053879 0.76153040204368 15.999 > 91 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.9291788 0.0000000 -0.3063424 0.0000000 4.6180463 0.0000000 -0.3063427 0.0000000 4.7216162 -------------------------- Born effective charges -------------------------- 1 Tb 4.5208578 -0.0000000 0.0464040 0.0000000 3.9231537 0.0000000 0.4319033 -0.0000000 4.3068829 2 Tb 4.5208578 -0.0000000 0.0464040 0.0000000 3.9231537 0.0000000 0.4319033 -0.0000000 4.3068829 3 Ta 5.8338675 -0.0000000 -0.9712979 0.0000000 5.4742077 0.0000000 -1.3983893 -0.0000000 5.3856807 4 Ta 5.8338675 -0.0000000 -0.9712979 0.0000000 5.4742077 0.0000000 -1.3983893 -0.0000000 5.3856807 5 O -1.9476177 -0.2467474 0.1151172 -0.1976900 -2.1077070 0.4694061 0.0891923 0.5694957 -3.2953011 6 O -3.2297449 -0.9387213 0.3473298 -0.9301576 -2.5909737 0.5975343 0.3940507 0.5261689 -1.5509807 7 O -1.9476177 -0.2467474 0.1151172 -0.1976900 -2.1077070 0.4694061 0.0891923 0.5694957 -3.2953011 8 O -3.2297449 0.9387213 0.3473298 0.9301576 -2.5909737 -0.5975343 0.3940507 -0.5261689 -1.5509807 9 O -1.9476177 0.2467474 0.1151172 0.1976900 -2.1077070 -0.4694061 0.0891923 -0.5694957 -3.2953011 10 O -3.2297449 0.9387213 0.3473298 0.9301576 -2.5909737 -0.5975343 0.3940507 -0.5261689 -1.5509807 11 O -3.2297449 -0.9387213 0.3473298 -0.9301576 -2.5909737 0.5975343 0.3940507 0.5261689 -1.5509807 12 O -1.9476177 0.2467474 0.1151172 0.1976900 -2.1077070 -0.4694061 0.0891923 -0.5694957 -3.2953011 ---------------------------------------------------------------------------- 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] [-0.0065 0.0000 0.0076] [ 0.0065 0.0000 -0.0076] 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] [-0.0065 0.0000 0.0076] [ 0.0065 0.0000 -0.0076] 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] [-0.0065 0.0000 0.0076] [ 0.0065 0.0000 -0.0076] Computing fc3[ 55, 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] [-0.0065 0.0000 0.0076] [ 0.0065 0.0000 -0.0076] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (zx) 0.00000000 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 11:20:54]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 11:20:54]------------------------- 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 1 3] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.478064050008248 -5.463612000000000 0.000000000000000 b 3.478064050008248 5.463612000000000 0.000000000000000 c -3.272285362405070 0.000000000000000 3.848780823181887 Atomic positions (fractional): 1 Tb 0.63205745256149 0.36794254743851 0.25000000000000 158.925 2 Tb 0.36794254743851 0.63205745256149 0.75000000000000 158.925 3 Ta 0.90002238954624 0.09997761045376 0.75000000000000 180.948 4 Ta 0.09997761045376 0.90002238954624 0.25000000000000 180.948 5 O 0.78839338566037 0.72753856458280 0.78459120613105 15.999 6 O 0.94571513575679 0.36706744807930 0.65945116471355 15.999 7 O 0.21160661433963 0.27246143541720 0.21540879386895 15.999 8 O 0.36706744807930 0.94571513575679 0.15945116471354 15.999 9 O 0.27246143541720 0.21160661433963 0.71540879386895 15.999 10 O 0.63293255192070 0.05428486424321 0.84054883528645 15.999 11 O 0.05428486424321 0.63293255192070 0.34054883528646 15.999 12 O 0.72753856458280 0.78839338566037 0.28459120613105 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.912256200032994 0.000000000000000 0.000000000000000 b 0.000000000000000 10.927224000000001 0.000000000000000 c -9.816856087215211 0.000000000000000 11.546342469545662 Atomic positions (fractional): 1 Tb 0.25000000000000 0.86794254743851 0.08333333333333 158.925 > 1 2 Tb 0.75000000000000 0.86794254743851 0.08333333333333 158.925 > 1 3 Tb 0.25000000000000 0.86794254743851 0.41666666666667 158.925 > 1 4 Tb 0.75000000000000 0.86794254743851 0.41666666666667 158.925 > 1 5 Tb 0.25000000000000 0.86794254743851 0.75000000000000 158.925 > 1 6 Tb 0.75000000000000 0.86794254743851 0.75000000000000 158.925 > 1 7 Tb 0.00000000000000 0.63205745256149 0.25000000000000 158.925 > 7 8 Tb 0.50000000000000 0.63205745256149 0.25000000000000 158.925 > 7 9 Tb 0.00000000000000 0.63205745256149 0.58333333333333 158.925 > 7 10 Tb 0.50000000000000 0.63205745256149 0.58333333333333 158.925 > 7 11 Tb 0.00000000000000 0.63205745256149 0.91666666666667 158.925 > 7 12 Tb 0.50000000000000 0.63205745256149 0.91666666666667 158.925 > 7 13 Tb 0.00000000000000 0.36794254743851 0.08333333333333 158.925 > 1 14 Tb 0.50000000000000 0.36794254743851 0.08333333333333 158.925 > 1 15 Tb 0.00000000000000 0.36794254743851 0.41666666666667 158.925 > 1 16 Tb 0.50000000000000 0.36794254743851 0.41666666666667 158.925 > 1 17 Tb 0.00000000000000 0.36794254743851 0.75000000000000 158.925 > 1 18 Tb 0.50000000000000 0.36794254743851 0.75000000000000 158.925 > 1 19 Tb 0.25000000000000 0.13205745256149 0.25000000000000 158.925 > 7 20 Tb 0.75000000000000 0.13205745256149 0.25000000000000 158.925 > 7 21 Tb 0.25000000000000 0.13205745256149 0.58333333333333 158.925 > 7 22 Tb 0.75000000000000 0.13205745256149 0.58333333333333 158.925 > 7 23 Tb 0.25000000000000 0.13205745256149 0.91666666666667 158.925 > 7 24 Tb 0.75000000000000 0.13205745256149 0.91666666666667 158.925 > 7 25 Ta 0.25000000000000 0.59997761045376 0.25000000000000 180.948 > 25 26 Ta 0.75000000000000 0.59997761045376 0.25000000000000 180.948 > 25 27 Ta 0.25000000000000 0.59997761045376 0.58333333333333 180.948 > 25 28 Ta 0.75000000000000 0.59997761045376 0.58333333333333 180.948 > 25 29 Ta 0.25000000000000 0.59997761045376 0.91666666666667 180.948 > 25 30 Ta 0.75000000000000 0.59997761045376 0.91666666666667 180.948 > 25 31 Ta 0.00000000000000 0.90002238954624 0.08333333333333 180.948 > 31 32 Ta 0.50000000000000 0.90002238954624 0.08333333333333 180.948 > 31 33 Ta 0.00000000000000 0.90002238954624 0.41666666666667 180.948 > 31 34 Ta 0.50000000000000 0.90002238954624 0.41666666666667 180.948 > 31 35 Ta 0.00000000000000 0.90002238954624 0.75000000000000 180.948 > 31 36 Ta 0.50000000000000 0.90002238954624 0.75000000000000 180.948 > 31 37 Ta 0.00000000000000 0.09997761045376 0.25000000000000 180.948 > 25 38 Ta 0.50000000000000 0.09997761045376 0.25000000000000 180.948 > 25 39 Ta 0.00000000000000 0.09997761045376 0.58333333333333 180.948 > 25 40 Ta 0.50000000000000 0.09997761045376 0.58333333333333 180.948 > 25 41 Ta 0.00000000000000 0.09997761045376 0.91666666666667 180.948 > 25 42 Ta 0.50000000000000 0.09997761045376 0.91666666666667 180.948 > 25 43 Ta 0.25000000000000 0.40002238954624 0.08333333333333 180.948 > 31 44 Ta 0.75000000000000 0.40002238954624 0.08333333333333 180.948 > 31 45 Ta 0.25000000000000 0.40002238954624 0.41666666666667 180.948 > 31 46 Ta 0.75000000000000 0.40002238954624 0.41666666666667 180.948 > 31 47 Ta 0.25000000000000 0.40002238954624 0.75000000000000 180.948 > 31 48 Ta 0.75000000000000 0.40002238954624 0.75000000000000 180.948 > 31 49 O 0.37898298756079 0.96957258946121 0.26153040204368 15.999 > 49 50 O 0.87898298756079 0.96957258946121 0.26153040204368 15.999 > 49 51 O 0.37898298756079 0.96957258946121 0.59486373537702 15.999 > 49 52 O 0.87898298756079 0.96957258946121 0.59486373537702 15.999 > 49 53 O 0.37898298756079 0.96957258946121 0.92819706871035 15.999 > 49 54 O 0.87898298756079 0.96957258946121 0.92819706871035 15.999 > 49 55 O 0.32819564595902 0.71067615616126 0.21981705490452 15.999 > 55 56 O 0.82819564595902 0.71067615616126 0.21981705490452 15.999 > 55 57 O 0.32819564595902 0.71067615616126 0.55315038823785 15.999 > 55 58 O 0.82819564595902 0.71067615616126 0.55315038823785 15.999 > 55 59 O 0.32819564595902 0.71067615616126 0.88648372157118 15.999 > 55 60 O 0.82819564595902 0.71067615616126 0.88648372157118 15.999 > 55 61 O 0.37101701243921 0.53042741053879 0.07180293128965 15.999 > 61 62 O 0.87101701243921 0.53042741053879 0.07180293128965 15.999 > 61 63 O 0.37101701243921 0.53042741053879 0.40513626462298 15.999 > 61 64 O 0.87101701243921 0.53042741053879 0.40513626462298 15.999 > 61 65 O 0.37101701243921 0.53042741053879 0.73846959795632 15.999 > 61 66 O 0.87101701243921 0.53042741053879 0.73846959795632 15.999 > 61 67 O 0.07819564595902 0.78932384383874 0.05315038823785 15.999 > 67 68 O 0.57819564595902 0.78932384383874 0.05315038823785 15.999 > 67 69 O 0.07819564595902 0.78932384383874 0.38648372157118 15.999 > 67 70 O 0.57819564595902 0.78932384383874 0.38648372157118 15.999 > 67 71 O 0.07819564595902 0.78932384383874 0.71981705490451 15.999 > 67 72 O 0.57819564595902 0.78932384383874 0.71981705490451 15.999 > 67 73 O 0.12101701243921 0.96957258946121 0.23846959795632 15.999 > 73 74 O 0.62101701243921 0.96957258946121 0.23846959795632 15.999 > 73 75 O 0.12101701243921 0.96957258946121 0.57180293128965 15.999 > 73 76 O 0.62101701243921 0.96957258946121 0.57180293128965 15.999 > 73 77 O 0.12101701243921 0.96957258946121 0.90513626462298 15.999 > 73 78 O 0.62101701243921 0.96957258946121 0.90513626462298 15.999 > 73 79 O 0.17180435404098 0.71067615616126 0.28018294509548 15.999 > 79 80 O 0.67180435404098 0.71067615616126 0.28018294509548 15.999 > 79 81 O 0.17180435404098 0.71067615616126 0.61351627842882 15.999 > 79 82 O 0.67180435404098 0.71067615616126 0.61351627842882 15.999 > 79 83 O 0.17180435404098 0.71067615616126 0.94684961176215 15.999 > 79 84 O 0.67180435404098 0.71067615616126 0.94684961176215 15.999 > 79 85 O 0.42180435404098 0.78932384383874 0.11351627842882 15.999 > 85 86 O 0.92180435404098 0.78932384383874 0.11351627842882 15.999 > 85 87 O 0.42180435404098 0.78932384383874 0.44684961176215 15.999 > 85 88 O 0.92180435404098 0.78932384383874 0.44684961176215 15.999 > 85 89 O 0.42180435404098 0.78932384383874 0.78018294509549 15.999 > 85 90 O 0.92180435404098 0.78932384383874 0.78018294509549 15.999 > 85 91 O 0.12898298756079 0.53042741053879 0.09486373537702 15.999 > 91 92 O 0.62898298756079 0.53042741053879 0.09486373537702 15.999 > 91 93 O 0.12898298756079 0.53042741053879 0.42819706871035 15.999 > 91 94 O 0.62898298756079 0.53042741053879 0.42819706871035 15.999 > 91 95 O 0.12898298756079 0.53042741053879 0.76153040204368 15.999 > 91 96 O 0.62898298756079 0.53042741053879 0.76153040204368 15.999 > 91 97 O 0.12898298756079 0.46957258946121 0.26153040204368 15.999 > 49 98 O 0.62898298756079 0.46957258946121 0.26153040204368 15.999 > 49 99 O 0.12898298756079 0.46957258946121 0.59486373537702 15.999 > 49 100 O 0.62898298756079 0.46957258946121 0.59486373537702 15.999 > 49 101 O 0.12898298756079 0.46957258946121 0.92819706871035 15.999 > 49 102 O 0.62898298756079 0.46957258946121 0.92819706871035 15.999 > 49 103 O 0.07819564595902 0.21067615616126 0.21981705490452 15.999 > 55 104 O 0.57819564595902 0.21067615616126 0.21981705490452 15.999 > 55 105 O 0.07819564595902 0.21067615616126 0.55315038823785 15.999 > 55 106 O 0.57819564595902 0.21067615616126 0.55315038823785 15.999 > 55 107 O 0.07819564595902 0.21067615616126 0.88648372157118 15.999 > 55 108 O 0.57819564595902 0.21067615616126 0.88648372157118 15.999 > 55 109 O 0.12101701243921 0.03042741053879 0.07180293128965 15.999 > 61 110 O 0.62101701243921 0.03042741053879 0.07180293128965 15.999 > 61 111 O 0.12101701243921 0.03042741053879 0.40513626462298 15.999 > 61 112 O 0.62101701243921 0.03042741053879 0.40513626462298 15.999 > 61 113 O 0.12101701243921 0.03042741053879 0.73846959795632 15.999 > 61 114 O 0.62101701243921 0.03042741053879 0.73846959795632 15.999 > 61 115 O 0.32819564595902 0.28932384383874 0.05315038823785 15.999 > 67 116 O 0.82819564595902 0.28932384383874 0.05315038823785 15.999 > 67 117 O 0.32819564595902 0.28932384383874 0.38648372157118 15.999 > 67 118 O 0.82819564595902 0.28932384383874 0.38648372157118 15.999 > 67 119 O 0.32819564595902 0.28932384383874 0.71981705490451 15.999 > 67 120 O 0.82819564595902 0.28932384383874 0.71981705490451 15.999 > 67 121 O 0.37101701243921 0.46957258946121 0.23846959795632 15.999 > 73 122 O 0.87101701243921 0.46957258946121 0.23846959795632 15.999 > 73 123 O 0.37101701243921 0.46957258946121 0.57180293128965 15.999 > 73 124 O 0.87101701243921 0.46957258946121 0.57180293128965 15.999 > 73 125 O 0.37101701243921 0.46957258946121 0.90513626462298 15.999 > 73 126 O 0.87101701243921 0.46957258946121 0.90513626462298 15.999 > 73 127 O 0.42180435404098 0.21067615616126 0.28018294509548 15.999 > 79 128 O 0.92180435404098 0.21067615616126 0.28018294509548 15.999 > 79 129 O 0.42180435404098 0.21067615616126 0.61351627842882 15.999 > 79 130 O 0.92180435404098 0.21067615616126 0.61351627842882 15.999 > 79 131 O 0.42180435404098 0.21067615616126 0.94684961176215 15.999 > 79 132 O 0.92180435404098 0.21067615616126 0.94684961176215 15.999 > 79 133 O 0.17180435404098 0.28932384383874 0.11351627842882 15.999 > 85 134 O 0.67180435404098 0.28932384383874 0.11351627842882 15.999 > 85 135 O 0.17180435404098 0.28932384383874 0.44684961176215 15.999 > 85 136 O 0.67180435404098 0.28932384383874 0.44684961176215 15.999 > 85 137 O 0.17180435404098 0.28932384383874 0.78018294509549 15.999 > 85 138 O 0.67180435404098 0.28932384383874 0.78018294509549 15.999 > 85 139 O 0.37898298756079 0.03042741053879 0.09486373537702 15.999 > 91 140 O 0.87898298756079 0.03042741053879 0.09486373537702 15.999 > 91 141 O 0.37898298756079 0.03042741053879 0.42819706871035 15.999 > 91 142 O 0.87898298756079 0.03042741053879 0.42819706871035 15.999 > 91 143 O 0.37898298756079 0.03042741053879 0.76153040204368 15.999 > 91 144 O 0.87898298756079 0.03042741053879 0.76153040204368 15.999 > 91 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.9291788 0.0000000 -0.3063424 0.0000000 4.6180463 0.0000000 -0.3063427 0.0000000 4.7216162 -------------------------- Born effective charges -------------------------- 1 Tb 4.5208578 -0.0000000 0.0464040 0.0000000 3.9231537 0.0000000 0.4319033 -0.0000000 4.3068829 2 Tb 4.5208578 -0.0000000 0.0464040 0.0000000 3.9231537 0.0000000 0.4319033 -0.0000000 4.3068829 3 Ta 5.8338675 -0.0000000 -0.9712979 0.0000000 5.4742077 0.0000000 -1.3983893 -0.0000000 5.3856807 4 Ta 5.8338675 -0.0000000 -0.9712979 0.0000000 5.4742077 0.0000000 -1.3983893 -0.0000000 5.3856807 5 O -1.9476177 -0.2467474 0.1151172 -0.1976900 -2.1077070 0.4694061 0.0891923 0.5694957 -3.2953011 6 O -3.2297449 -0.9387213 0.3473298 -0.9301576 -2.5909737 0.5975343 0.3940507 0.5261689 -1.5509807 7 O -1.9476177 -0.2467474 0.1151172 -0.1976900 -2.1077070 0.4694061 0.0891923 0.5694957 -3.2953011 8 O -3.2297449 0.9387213 0.3473298 0.9301576 -2.5909737 -0.5975343 0.3940507 -0.5261689 -1.5509807 9 O -1.9476177 0.2467474 0.1151172 0.1976900 -2.1077070 -0.4694061 0.0891923 -0.5694957 -3.2953011 10 O -3.2297449 0.9387213 0.3473298 0.9301576 -2.5909737 -0.5975343 0.3940507 -0.5261689 -1.5509807 11 O -3.2297449 -0.9387213 0.3473298 -0.9301576 -2.5909737 0.5975343 0.3940507 0.5261689 -1.5509807 12 O -1.9476177 0.2467474 0.1151172 0.1976900 -2.1077070 -0.4694061 0.0891923 -0.5694957 -3.2953011 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 10 10 13 ] 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: 301, Lambda: 0.18 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/361) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 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 3.278 ( 0.000 0.000 0.000) 0.000 3.286 ( 0.000 0.000 0.000) 0.000 3.867 ( 0.000 0.000 0.000) 0.000 4.147 ( 0.000 0.000 0.000) 0.000 4.685 ( 0.000 0.000 0.000) 0.000 5.042 ( 0.000 0.000 0.000) 0.000 5.085 ( 0.000 0.000 0.000) 0.000 5.379 ( 0.000 0.000 0.000) 0.000 5.409 ( 0.000 0.000 0.000) 0.000 5.718 ( 0.000 0.000 0.000) 0.000 5.839 ( 0.000 0.000 0.000) 0.000 7.141 ( 0.000 0.000 0.000) 0.000 7.586 ( 0.000 0.000 0.000) 0.000 8.814 ( 0.000 0.000 0.000) 0.000 9.478 ( 0.000 0.000 0.000) 0.000 9.540 ( 0.000 0.000 0.000) 0.000 10.204 ( 0.000 0.000 0.000) 0.000 10.215 ( 0.000 0.000 0.000) 0.000 11.043 ( 0.000 0.000 0.000) 0.000 11.739 ( 0.000 0.000 0.000) 0.000 12.407 ( 0.000 0.000 0.000) 0.000 12.729 ( 0.000 0.000 0.000) 0.000 13.270 ( 0.000 0.000 0.000) 0.000 14.276 ( 0.000 0.000 0.000) 0.000 16.113 ( 0.000 0.000 0.000) 0.000 16.153 ( 0.000 0.000 0.000) 0.000 19.088 ( 0.000 0.000 0.000) 0.000 19.596 ( 0.000 0.000 0.000) 0.000 19.612 ( 0.000 0.000 0.000) 0.000 19.730 ( 0.000 0.000 0.000) 0.000 20.926 ( 0.000 0.000 0.000) 0.000 23.548 ( 0.000 0.000 0.000) 0.000 24.191 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/361) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.566 ( 17.317 -14.860 14.777) 27.185 0.623 ( 12.814 -24.459 17.204) 32.533 1.161 ( 43.690 -12.457 32.205) 55.688 3.271 ( -1.949 0.443 0.389) 2.037 3.316 ( 7.347 1.669 -2.083) 7.817 3.827 ( -4.287 3.504 2.803) 6.206 4.169 ( 0.453 -0.584 -0.358) 0.822 4.679 ( 2.102 4.405 -1.402) 5.079 4.979 ( -11.421 6.760 1.367) 13.342 5.063 ( -9.083 -2.507 1.915) 9.615 5.551 ( 7.843 3.210 9.048) 12.397 5.704 ( 0.285 -0.048 -0.137) 0.320 5.821 ( -5.032 -3.966 0.503) 6.427 6.295 ( 62.428 53.213 -28.813) 86.943 7.196 ( 7.462 -0.197 -1.415) 7.598 7.846 ( -11.044 -35.552 -19.052) 41.820 8.969 ( -11.217 -27.855 -4.581) 30.376 9.485 ( 1.365 -0.850 -0.797) 1.794 9.560 ( 5.114 9.634 3.332) 11.405 10.141 ( -4.329 -5.065 -7.703) 10.184 10.859 ( 10.523 26.484 -10.480) 30.364 11.534 ( 46.451 7.693 -25.058) 53.337 11.838 ( -7.547 1.310 19.371) 20.830 12.390 ( 0.623 -1.520 -3.905) 4.237 13.145 ( -5.639 -57.039 -32.717) 65.997 13.289 ( 1.259 -1.444 0.970) 2.147 14.237 ( -3.217 1.108 -1.686) 3.797 16.006 ( -6.471 2.606 -7.607) 10.321 17.792 ( -70.127 52.318 126.623) 153.910 19.233 ( -18.639 -19.058 2.511) 26.775 19.547 ( -6.433 0.381 -1.766) 6.682 19.611 ( -4.807 -7.733 0.086) 9.105 20.964 ( 3.142 1.307 3.788) 5.092 22.206 ( 75.291 37.006 -60.032) 103.160 23.841 ( -7.217 -40.607 -21.221) 46.383 24.203 ( -0.314 -0.729 1.527) 1.721 ======================= Grid point 2 (3/361) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.126 ( 16.635 -15.372 13.843) 26.545 1.232 ( 12.501 -21.636 17.986) 30.788 2.243 ( 40.246 -10.020 27.899) 49.985 3.231 ( -3.681 1.860 1.280) 4.318 3.369 ( 8.118 4.847 -4.493) 10.468 3.800 ( -1.127 4.317 6.795) 8.129 4.132 ( -0.939 3.085 -4.252) 5.336 4.631 ( 3.110 5.608 -4.897) 8.069 4.742 ( -10.922 4.150 -1.000) 11.726 5.040 ( 0.043 -2.985 -1.873) 3.524 5.660 ( -5.422 5.904 7.786) 11.175 5.726 ( 0.227 -1.784 1.478) 2.328 5.822 ( 2.483 -3.787 1.742) 4.852 6.387 ( 30.923 22.697 -9.090) 39.421 7.262 ( 6.807 1.534 -6.609) 9.611 7.783 ( -5.855 -20.155 -11.307) 23.840 9.002 ( -9.199 -11.883 2.672) 15.263 9.507 ( 1.654 4.479 0.498) 4.801 9.571 ( 6.328 9.576 2.099) 11.668 10.041 ( -2.974 -4.660 -5.059) 7.494 10.695 ( 3.409 9.744 -4.556) 11.284 11.787 ( 15.957 2.239 -2.613) 16.324 11.989 ( 1.437 -7.552 7.867) 10.999 12.381 ( 3.354 -2.234 -4.360) 5.938 13.183 ( -1.236 -25.204 -15.193) 29.455 13.375 ( 3.146 -2.656 5.685) 7.019 14.125 ( -5.979 2.351 -3.056) 7.115 15.714 ( -11.206 4.627 -12.817) 17.643 17.882 ( -28.818 24.816 62.136) 72.851 19.158 ( -1.348 -1.271 -6.637) 6.891 19.397 ( -11.988 -1.886 -0.585) 12.150 19.567 ( -7.041 -7.493 -5.616) 11.716 21.087 ( 4.739 0.999 8.258) 9.574 22.214 ( 37.319 15.281 -32.114) 51.551 23.859 ( -2.167 -18.150 -8.678) 20.235 24.225 ( -1.242 -0.617 2.598) 2.944 ======================= Grid point 3 (4/361) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.651 ( 15.095 -14.846 11.361) 24.028 1.814 ( 11.127 -18.268 19.207) 28.748 3.084 ( 19.437 2.736 6.054) 20.541 3.192 ( 4.499 -0.130 10.070) 11.030 3.361 ( 6.577 3.294 1.790) 7.571 3.835 ( 0.276 9.866 0.125) 9.870 4.029 ( 4.603 -0.092 -4.775) 6.633 4.505 ( -8.451 4.787 -0.278) 9.716 4.650 ( 4.207 -2.042 -5.870) 7.505 5.066 ( -0.818 -4.123 1.604) 4.499 5.578 ( -9.002 7.492 7.051) 13.670 5.691 ( -7.154 -4.183 -0.250) 8.291 5.988 ( 10.975 1.357 3.327) 11.549 6.533 ( 19.664 11.125 -2.120) 22.692 7.167 ( -0.770 2.379 -12.114) 12.369 7.803 ( 1.379 -16.395 -7.367) 18.027 8.937 ( -12.464 1.778 3.341) 13.026 9.461 ( 4.906 9.699 -0.601) 10.886 9.645 ( 1.023 -1.985 3.096) 3.817 10.033 ( 3.249 3.377 1.987) 5.090 10.690 ( 1.675 -9.710 -1.303) 9.940 11.827 ( -2.850 10.055 2.955) 10.861 12.214 ( 12.160 -10.587 -2.054) 16.253 12.428 ( 4.704 -2.777 -1.425) 5.645 13.199 ( -1.760 -14.538 -7.987) 16.680 13.574 ( 6.560 -5.119 9.176) 12.387 13.951 ( -8.059 4.059 -3.736) 9.766 15.317 ( -12.999 5.536 -14.837) 20.489 18.023 ( -12.559 14.331 38.380) 42.850 19.046 ( 2.473 6.618 -8.560) 11.099 19.267 ( -11.794 -6.100 2.360) 13.486 19.410 ( -6.802 -4.391 -11.816) 14.324 21.256 ( 3.473 0.717 9.575) 10.210 22.213 ( 22.366 7.195 -21.253) 31.682 23.903 ( 0.898 -10.813 -4.295) 11.669 24.234 ( -2.489 0.245 2.852) 3.794 ======================= Grid point 4 (5/361) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.089 ( 11.876 -11.834 7.357) 18.309 2.331 ( 7.055 -13.422 17.669) 23.284 3.017 ( -2.983 5.573 -0.671) 6.357 3.224 ( 1.288 4.701 -3.601) 6.061 3.549 ( -6.111 14.450 -8.102) 17.657 3.843 ( 19.522 -2.828 8.652) 21.540 4.199 ( 13.328 -4.144 0.564) 13.969 4.339 ( -10.354 3.093 0.889) 10.843 4.687 ( 3.954 -3.676 -3.555) 6.464 5.124 ( -1.698 -6.127 3.233) 7.133 5.432 ( -9.989 10.703 5.246) 15.552 5.643 ( -3.702 -3.836 0.162) 5.333 6.149 ( 9.369 2.003 0.533) 9.595 6.671 ( 9.960 5.441 1.415) 11.437 6.958 ( -4.777 0.603 -10.551) 11.598 7.927 ( 5.860 -13.643 -4.660) 15.562 8.724 ( -11.925 9.310 1.813) 15.237 9.476 ( 4.731 4.510 0.833) 6.589 9.669 ( -2.457 -1.463 0.758) 2.959 10.094 ( 4.177 4.431 3.357) 6.953 10.898 ( 5.433 -20.011 3.820) 21.085 11.620 ( -8.533 15.589 -2.767) 17.986 12.425 ( 10.260 -3.494 -3.441) 11.372 12.525 ( 3.858 -5.394 1.255) 6.750 13.217 ( -1.844 -8.435 -1.572) 8.776 13.705 ( -5.917 4.615 -3.690) 8.362 13.895 ( 6.390 -5.336 9.756) 12.825 14.911 ( -11.261 5.343 -13.083) 18.070 18.177 ( -3.588 7.284 20.695) 22.231 18.939 ( -0.193 5.553 -0.664) 5.596 19.190 ( -7.851 -5.861 -11.501) 15.109 19.221 ( -2.001 -1.022 -1.401) 2.648 21.380 ( 1.170 0.860 6.056) 6.227 22.210 ( 11.248 2.717 -11.207) 16.108 23.971 ( 2.471 -6.436 -2.067) 7.197 24.218 ( -2.930 1.206 2.120) 3.812 ======================= Grid point 5 (6/361) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 326 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.312 ( -0.000 0.000 0.000) 0.000 2.559 ( 0.000 -0.000 0.000) 0.000 3.056 ( 0.000 -0.000 0.000) 0.000 3.113 ( 0.000 -0.000 0.000) 0.000 3.316 ( 0.000 0.000 0.000) 0.000 4.149 ( 0.000 -0.000 0.000) 0.000 4.151 ( -0.000 0.000 0.000) 0.000 4.352 ( 0.000 -0.000 0.000) 0.000 4.714 ( 0.000 -0.000 0.000) 0.000 5.203 ( 0.000 -0.000 0.000) 0.000 5.285 ( 0.000 -0.000 0.000) 0.000 5.643 ( 0.000 -0.000 0.000) 0.000 6.214 ( 0.000 -0.000 -0.000) 0.000 6.740 ( 0.000 -0.000 0.000) 0.000 6.831 ( 0.000 -0.000 0.000) 0.000 8.032 ( 0.000 -0.000 0.000) 0.000 8.574 ( 0.000 -0.000 0.000) 0.000 9.499 ( 0.000 0.000 0.000) 0.000 9.656 ( -0.000 -0.000 0.000) 0.000 10.126 ( 0.000 -0.000 0.000) 0.000 11.229 ( 0.000 0.000 0.000) 0.000 11.297 ( 0.000 -0.000 0.000) 0.000 12.483 ( 0.000 -0.000 0.000) 0.000 12.607 ( 0.000 0.000 0.000) 0.000 13.247 ( 0.000 -0.000 0.000) 0.000 13.580 ( 0.000 -0.000 0.000) 0.000 14.087 ( 0.000 -0.000 0.000) 0.000 14.677 ( 0.000 -0.000 0.000) 0.000 18.252 ( 0.000 -0.000 0.000) 0.000 18.929 ( 0.000 -0.000 -0.000) 0.000 19.052 ( -0.000 -0.000 0.000) 0.000 19.209 ( 0.000 0.000 0.000) 0.000 21.421 ( 0.000 -0.000 0.000) 0.000 22.211 ( 0.000 -0.000 0.000) 0.000 24.014 ( 0.000 -0.000 0.000) 0.000 24.198 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 12 (7/361) ======================= q-point: ( 0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.958 ( 21.373 0.000 14.611) 25.890 1.008 ( 12.830 0.000 25.007) 28.106 2.155 ( 43.599 0.000 30.523) 53.221 3.251 ( -2.344 -0.000 1.197) 2.632 3.416 ( 9.637 0.000 -4.735) 10.738 3.835 ( -3.108 -0.000 6.172) 6.910 4.163 ( -1.108 -0.000 -1.649) 1.986 4.688 ( 5.234 0.000 -9.587) 10.922 4.798 ( -18.907 -0.000 4.349) 19.401 4.996 ( 3.655 0.000 -6.758) 7.684 5.699 ( -3.328 -0.000 3.255) 4.655 5.706 ( -9.908 -0.000 2.475) 10.212 5.798 ( 9.921 0.000 7.296) 12.315 6.756 ( 28.646 0.000 -26.545) 39.054 7.300 ( 7.879 0.000 -1.691) 8.058 7.412 ( -5.316 -0.000 -6.966) 8.763 8.850 ( -6.865 -0.000 10.676) 12.693 9.506 ( 3.323 0.000 -2.209) 3.990 9.761 ( 8.700 0.000 4.018) 9.583 9.936 ( -4.113 -0.000 -7.985) 8.982 10.868 ( -6.793 -0.000 -5.086) 8.486 11.756 ( 36.735 0.000 -26.089) 45.057 12.029 ( -6.331 -0.000 18.710) 19.752 12.328 ( 2.328 0.000 -4.384) 4.963 12.847 ( 5.949 0.000 -4.725) 7.597 13.358 ( 1.560 0.000 7.370) 7.534 14.149 ( -5.637 -0.000 -3.033) 6.402 15.757 ( -11.912 -0.000 -12.602) 17.341 18.161 ( -53.025 -0.000 68.577) 86.686 19.132 ( 8.025 0.000 -5.707) 9.847 19.413 ( -9.652 -0.000 -3.819) 10.380 19.456 ( -6.638 -0.000 -3.913) 7.705 21.100 ( 2.989 0.000 9.974) 10.412 22.410 ( 39.726 0.000 -51.662) 65.170 23.625 ( 3.784 0.000 1.133) 3.950 24.219 ( -1.159 -0.000 3.093) 3.303 ======================= Grid point 13 (8/361) ======================= q-point: ( 0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.461 ( 18.918 -4.989 14.356) 24.267 1.534 ( 11.917 -10.007 23.644) 28.305 3.085 ( 37.612 -0.894 22.096) 43.631 3.225 ( -3.063 2.257 2.318) 4.455 3.439 ( 2.743 3.007 -3.633) 5.456 3.908 ( 4.873 -0.597 2.778) 5.641 4.071 ( -4.353 3.564 -4.647) 7.297 4.581 ( -14.137 2.757 1.237) 14.456 4.627 ( 5.922 -0.391 -11.220) 12.693 4.987 ( 2.365 -3.421 -4.642) 6.233 5.609 ( -9.592 -1.400 4.733) 10.787 5.674 ( -6.989 0.882 4.590) 8.408 6.022 ( 10.316 1.458 5.899) 11.973 6.778 ( 16.790 13.112 -9.252) 23.226 7.208 ( -2.693 2.091 -11.578) 12.070 7.461 ( 1.264 -17.546 -3.607) 17.958 8.888 ( -11.073 -3.493 11.224) 16.149 9.461 ( -5.201 -1.098 -4.308) 6.842 9.838 ( 10.964 11.383 0.884) 15.829 9.987 ( 6.883 -6.000 2.542) 9.478 10.679 ( -5.082 3.225 -5.359) 8.059 11.998 ( 25.071 1.809 -11.244) 27.536 12.113 ( -4.908 6.062 15.986) 17.787 12.365 ( 4.472 -4.718 -1.921) 6.779 12.893 ( 2.254 -13.778 -8.997) 16.609 13.520 ( 4.859 -1.255 10.659) 11.781 14.005 ( -7.395 1.616 -3.770) 8.457 15.385 ( -14.133 1.857 -15.015) 20.703 18.223 ( -24.303 6.246 39.157) 46.508 19.164 ( 2.869 -0.132 -4.772) 5.570 19.194 ( -7.823 4.674 -4.913) 10.353 19.322 ( -5.633 -5.596 -7.904) 11.203 21.279 ( 2.019 1.132 13.149) 13.352 22.317 ( 24.662 3.496 -34.372) 42.448 23.732 ( 4.290 -6.081 0.195) 7.445 24.238 ( -2.415 0.087 3.985) 4.660 ======================= Grid point 14 (9/361) ======================= q-point: ( 0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.923 ( 15.272 -5.536 12.438) 20.459 2.078 ( 10.078 -12.673 21.015) 26.529 3.143 ( -3.704 6.737 -0.466) 7.702 3.319 ( -3.120 5.299 -3.441) 7.047 3.786 ( 18.111 3.734 7.635) 20.006 3.826 ( -2.219 7.318 -2.998) 8.214 4.079 ( 12.578 -7.493 -4.156) 15.219 4.376 ( -11.461 0.703 -1.813) 11.625 4.636 ( 6.702 -1.912 -3.833) 7.954 5.002 ( -1.663 -6.439 -1.412) 6.798 5.575 ( -9.639 4.447 5.524) 11.967 5.595 ( -3.956 -1.106 4.369) 5.997 6.189 ( 7.112 2.055 2.437) 7.794 6.787 ( 6.242 7.594 -1.509) 9.945 6.978 ( -4.687 1.119 -12.541) 13.435 7.622 ( 3.263 -17.413 -0.671) 17.729 8.823 ( -14.176 1.753 6.152) 15.552 9.350 ( -7.959 -6.913 -2.448) 10.822 9.889 ( 8.814 13.582 0.602) 16.202 10.179 ( 9.006 3.290 3.050) 10.062 10.633 ( 3.462 -8.919 0.697) 9.592 11.955 ( -2.360 20.671 2.063) 20.907 12.341 ( 17.025 -4.440 -0.847) 17.615 12.454 ( 2.431 -3.003 1.547) 4.162 12.963 ( -0.669 -17.813 -4.432) 18.368 13.757 ( 4.852 -0.416 6.712) 8.292 13.838 ( -4.348 0.492 0.265) 4.383 14.984 ( -13.047 2.557 -13.883) 19.222 18.292 ( -8.780 4.928 17.573) 20.253 19.009 ( -11.499 -0.831 3.406) 12.022 19.060 ( -8.108 -2.523 -7.338) 11.222 19.270 ( 10.734 3.214 -8.853) 14.280 21.427 ( -0.354 3.476 11.520) 12.038 22.231 ( 14.628 -0.185 -23.270) 27.487 23.855 ( 4.976 -5.390 0.389) 7.346 24.241 ( -3.396 1.025 4.118) 5.435 ======================= Grid point 15 (10/361) ======================= q-point: ( 0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.279 ( 11.176 -2.286 6.866) 13.314 2.502 ( 2.349 -6.703 13.004) 14.818 3.030 ( -2.496 2.618 2.786) 4.566 3.168 ( -4.396 2.495 -6.839) 8.504 3.465 ( -9.633 12.991 -6.519) 17.437 4.105 ( 14.299 -2.311 -2.815) 14.755 4.157 ( -15.349 -2.847 -0.779) 15.631 4.294 ( 8.444 -4.061 -5.851) 11.047 4.732 ( 5.165 1.439 2.577) 5.949 5.041 ( -0.423 -10.685 -1.046) 10.745 5.408 ( -6.924 6.658 -2.098) 9.832 5.659 ( 1.213 1.543 6.290) 6.589 6.223 ( -3.345 1.024 0.805) 3.590 6.715 ( -5.653 -1.553 -6.242) 8.563 6.869 ( 2.950 2.898 1.286) 4.331 7.856 ( 3.967 -15.482 4.566) 16.622 8.636 ( -11.388 4.464 0.838) 12.260 9.293 ( -9.009 -10.994 -1.143) 14.260 9.857 ( 2.652 9.169 -1.288) 9.631 10.213 ( 6.320 10.168 -2.551) 12.240 10.953 ( 13.138 -14.432 8.353) 21.229 11.686 ( -4.105 26.048 -1.803) 26.431 12.476 ( -0.265 -0.667 1.013) 1.242 12.598 ( 9.553 -0.864 1.024) 9.647 13.093 ( -0.375 -15.094 1.716) 15.196 13.640 ( -2.917 4.632 -2.514) 6.024 14.047 ( 6.001 -3.579 4.079) 8.090 14.682 ( -6.436 0.404 -5.025) 8.175 18.254 ( -3.528 0.195 -6.731) 7.602 18.890 ( -7.634 -4.470 -4.665) 10.001 19.004 ( -6.021 -1.376 14.831) 16.066 19.307 ( 13.635 6.751 -7.015) 16.754 21.472 ( -1.858 5.239 5.031) 7.497 22.173 ( 4.151 -3.901 -11.537) 12.866 23.976 ( 4.717 -3.195 1.015) 5.787 24.225 ( -2.982 2.165 3.495) 5.079 ======================= Grid point 16 (11/361) ======================= q-point: (-0.50 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.322 ( -4.798 12.621 -3.119) 13.858 2.510 ( -3.222 5.174 -8.481) 10.444 2.983 ( -3.664 1.904 -1.666) 4.453 3.146 ( -4.688 -4.643 6.144) 9.016 3.331 ( 4.160 -6.993 4.201) 9.158 3.892 ( -16.343 1.284 -7.021) 17.834 4.216 ( -5.016 -1.136 -9.008) 10.373 4.280 ( 5.124 -2.758 1.418) 5.989 4.767 ( -1.466 4.648 2.966) 5.706 5.157 ( 1.661 -10.042 -1.573) 10.299 5.256 ( 4.944 -0.566 -11.418) 12.455 5.728 ( 3.691 5.176 4.347) 7.701 6.125 ( -11.374 -0.453 2.477) 11.649 6.572 ( -11.685 -5.559 -3.243) 13.340 6.963 ( 4.617 1.041 7.286) 8.688 8.050 ( -4.179 -2.286 9.060) 10.236 8.539 ( 2.223 -7.431 -2.743) 8.227 9.253 ( -9.712 -11.499 -0.479) 15.059 9.796 ( -0.498 0.997 -2.589) 2.819 10.138 ( 4.650 12.254 -5.944) 14.392 11.349 ( 0.976 20.546 2.967) 20.782 11.380 ( 10.313 -3.004 2.171) 10.958 12.459 ( -6.104 0.654 4.005) 7.330 12.642 ( -0.840 6.533 -0.150) 6.589 13.231 ( 1.098 -7.369 2.114) 7.744 13.651 ( 7.455 -0.303 3.133) 8.092 13.984 ( -5.598 3.754 -10.348) 12.350 14.795 ( 8.352 -6.873 11.744) 15.966 18.043 ( -2.730 -6.881 -23.818) 24.942 18.842 ( -3.498 -4.562 3.576) 6.770 19.183 ( 2.324 -0.541 14.886) 15.076 19.366 ( 13.291 7.989 -3.522) 15.902 21.412 ( -2.580 4.378 -2.152) 5.518 22.129 ( -7.127 -6.123 -0.171) 9.398 24.055 ( 2.016 2.009 2.709) 3.929 24.215 ( 0.165 1.463 1.537) 2.128 ======================= Grid point 17 (12/361) ======================= q-point: (-0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.967 ( -11.091 18.760 -9.246) 23.674 2.133 ( -10.976 15.335 -14.635) 23.871 3.008 ( -4.433 -4.177 1.697) 6.323 3.144 ( -4.564 -5.497 0.709) 7.179 3.425 ( -11.932 8.577 -12.156) 19.071 3.622 ( -0.562 -11.373 2.816) 11.730 4.012 ( -9.708 -2.228 -0.573) 9.977 4.421 ( 6.673 -4.254 0.339) 7.921 4.700 ( -5.298 3.229 1.721) 6.439 5.120 ( 1.903 1.532 -6.569) 7.009 5.361 ( 7.238 -15.197 -7.461) 18.412 5.781 ( 3.549 5.088 2.836) 6.821 5.988 ( -9.033 1.198 0.816) 9.149 6.373 ( -20.743 -7.016 -0.629) 21.907 7.130 ( 2.183 -1.407 9.690) 10.032 8.024 ( -5.609 7.754 8.060) 12.512 8.750 ( 10.006 -17.269 -1.394) 20.007 9.214 ( -10.243 -10.890 1.096) 14.990 9.776 ( -0.346 -4.189 -2.552) 4.917 9.990 ( 2.022 10.884 -6.918) 13.054 11.069 ( -0.170 29.140 1.349) 29.172 11.676 ( 9.756 -6.850 0.109) 11.922 12.386 ( -8.889 5.566 5.528) 11.856 12.504 ( -5.392 7.271 -1.015) 9.109 13.333 ( 4.073 -0.094 3.507) 5.376 13.702 ( -7.309 7.262 -5.899) 11.873 13.877 ( 10.258 -3.106 3.953) 11.423 15.185 ( 11.449 -8.648 14.242) 20.217 17.751 ( 0.249 -14.034 -35.868) 38.516 18.951 ( 1.226 -3.794 9.914) 10.686 19.367 ( 12.191 4.445 -1.133) 13.025 19.497 ( 8.297 5.023 10.436) 14.248 21.271 ( -4.660 2.696 -6.769) 8.649 22.068 ( -17.938 -8.508 8.383) 21.551 24.080 ( 1.533 7.702 5.995) 9.880 24.233 ( 2.149 0.392 -0.843) 2.342 ======================= Grid point 18 (13/361) ======================= q-point: (-0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.473 ( -11.908 21.360 -13.142) 27.763 1.631 ( -14.026 19.559 -11.683) 26.754 2.523 ( -29.715 19.342 -17.997) 39.761 3.187 ( 1.626 -3.870 0.641) 4.246 3.268 ( -1.700 -3.718 0.836) 4.172 3.669 ( -1.422 -9.759 -6.974) 12.079 4.053 ( -0.909 -5.602 8.370) 10.112 4.525 ( 0.593 -5.159 -1.573) 5.426 4.672 ( 1.362 -3.470 2.544) 4.513 5.076 ( 1.602 0.887 -2.675) 3.241 5.475 ( 2.396 -13.658 -8.529) 16.280 5.757 ( -6.741 1.251 1.792) 7.087 5.921 ( 3.323 6.082 0.918) 6.991 6.101 ( -26.973 -9.195 0.686) 28.506 7.237 ( -3.866 -0.989 6.633) 7.741 8.021 ( 1.818 7.435 8.248) 11.252 9.023 ( 8.664 -14.541 -1.201) 16.969 9.199 ( -9.693 -12.211 3.306) 15.938 9.735 ( 3.084 9.374 -4.778) 10.964 9.936 ( -0.854 -7.903 1.915) 8.176 10.848 ( -0.444 24.882 3.271) 25.100 11.750 ( 1.518 -0.519 -7.617) 7.784 12.213 ( -6.996 13.286 0.736) 15.034 12.408 ( -4.693 1.184 3.345) 5.884 13.376 ( 2.684 2.039 -7.855) 8.547 13.583 ( -1.171 10.781 17.822) 20.863 14.091 ( 8.303 -0.156 5.369) 9.889 15.591 ( 9.872 -8.743 12.857) 18.417 17.430 ( 4.612 -22.066 -50.390) 55.202 19.167 ( 8.052 0.137 10.907) 13.558 19.468 ( 13.394 4.963 -3.970) 14.826 19.695 ( 7.750 6.361 8.914) 13.416 21.081 ( -6.972 0.748 -6.629) 9.649 21.961 ( -29.232 -12.135 13.349) 34.351 24.136 ( 5.198 11.382 10.442) 16.297 24.238 ( 1.443 0.806 -1.531) 2.253 ======================= Grid point 19 (14/361) ======================= q-point: (-0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.948 ( -10.000 24.172 -11.564) 28.601 1.066 ( -18.900 20.312 -13.501) 30.856 1.647 ( -22.252 37.304 -15.918) 46.262 3.225 ( -3.940 -5.675 1.173) 7.007 3.288 ( 0.692 -0.029 0.233) 0.730 3.701 ( 2.564 -9.897 -3.640) 10.852 4.162 ( 0.408 -1.741 3.491) 3.922 4.547 ( -1.893 -8.839 -0.838) 9.078 4.834 ( 7.323 -8.403 0.855) 11.179 5.086 ( 3.082 0.069 -0.708) 3.163 5.441 ( -3.925 -8.792 -10.986) 14.608 5.651 ( -27.420 -7.165 10.547) 30.240 5.816 ( -14.022 -3.681 -3.150) 14.836 5.930 ( 3.891 6.823 0.240) 7.858 7.207 ( -5.887 1.090 1.989) 6.309 8.130 ( 6.440 5.083 7.493) 11.111 9.238 ( 7.616 -7.378 2.483) 10.891 9.251 ( -7.044 -16.574 3.444) 18.335 9.671 ( 10.203 12.737 -0.545) 16.329 10.082 ( -5.315 -14.522 8.479) 17.636 10.668 ( -4.643 17.580 4.099) 18.639 11.544 ( -8.551 6.224 -12.662) 16.497 12.006 ( -3.177 13.602 -1.479) 14.046 12.400 ( -1.838 0.002 2.822) 3.368 13.290 ( 0.589 0.638 -4.775) 4.853 13.860 ( 8.549 12.691 35.512) 38.668 14.257 ( 7.282 6.875 10.969) 14.853 15.916 ( 5.181 -7.157 9.940) 13.299 16.999 ( 5.846 -29.784 -76.104) 81.933 19.437 ( 18.141 5.754 6.937) 20.257 19.566 ( 10.079 2.460 -2.715) 10.725 19.782 ( 6.232 9.433 -0.040) 11.306 20.937 ( -5.523 -1.319 -1.279) 5.820 21.754 ( -41.875 -15.027 15.135) 46.993 24.219 ( 1.032 2.014 -0.770) 2.390 24.309 ( 9.828 11.551 16.875) 22.689 ======================= Grid point 20 (15/361) ======================= q-point: (-0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.474 ( 0.000 25.758 0.000) 25.758 0.539 ( 0.000 29.058 0.000) 29.058 0.956 ( 0.000 51.110 0.000) 51.110 3.240 ( -0.000 -4.163 -0.000) 4.163 3.292 ( 0.000 0.736 0.000) 0.736 3.791 ( -0.000 -8.009 -0.000) 8.009 4.210 ( -0.000 -1.267 -0.000) 1.267 4.609 ( -0.000 -7.826 -0.000) 7.826 4.964 ( -0.000 -7.187 -0.000) 7.187 5.102 ( 0.000 0.641 0.000) 0.641 5.347 ( -0.000 -3.550 -0.000) 3.550 5.401 ( -0.000 -0.727 -0.000) 0.727 5.739 ( 0.000 2.088 0.000) 2.088 5.902 ( 0.000 5.982 0.000) 5.982 7.154 ( 0.000 1.429 0.000) 1.429 8.229 ( 0.000 0.619 0.000) 0.619 9.374 ( -0.000 -16.564 -0.000) 16.564 9.409 ( -0.000 -7.051 -0.000) 7.051 10.011 ( -0.000 -18.595 -0.000) 18.595 10.034 ( 0.000 1.832 0.000) 1.832 10.437 ( 0.000 21.327 0.000) 21.327 11.209 ( 0.000 14.569 0.000) 14.569 11.856 ( 0.000 11.449 0.000) 11.449 12.407 ( -0.000 -0.124 -0.000) 0.124 13.267 ( -0.000 -0.163 -0.000) 0.163 14.204 ( -0.000 -7.450 -0.000) 7.450 14.663 ( 0.000 1.278 0.000) 1.278 16.164 ( 0.000 1.180 0.000) 1.180 16.236 ( -0.000 -8.956 -0.000) 8.956 19.613 ( 0.000 0.156 0.000) 0.156 19.668 ( 0.000 7.537 0.000) 7.537 19.747 ( 0.000 1.737 0.000) 1.737 20.916 ( -0.000 -1.000 -0.000) 1.000 21.489 ( -0.000 -3.991 -0.000) 3.991 24.203 ( 0.000 1.256 0.000) 1.256 24.561 ( -0.000 -0.564 -0.000) 0.564 ======================= Grid point 23 (16/361) ======================= q-point: ( 0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.896 ( 18.557 0.000 13.476) 22.934 1.927 ( 9.228 0.000 23.482) 25.230 3.213 ( -2.520 -0.000 -0.382) 2.549 3.381 ( -6.501 -0.000 -3.272) 7.278 3.781 ( 27.431 0.000 11.389) 29.701 3.946 ( -10.001 -0.000 -1.247) 10.079 3.996 ( 11.373 0.000 -7.505) 13.626 4.375 ( -11.660 -0.000 -5.299) 12.807 4.618 ( 7.543 0.000 -3.568) 8.345 4.932 ( -0.788 -0.000 -3.867) 3.947 5.581 ( -3.757 -0.000 8.317) 9.126 5.619 ( -9.203 -0.000 3.884) 9.989 6.210 ( 6.163 0.000 2.915) 6.818 6.898 ( 6.441 0.000 -6.476) 9.133 6.982 ( -8.851 -0.000 -11.013) 14.129 7.419 ( 4.164 0.000 2.626) 4.923 8.829 ( -13.829 -0.000 9.075) 16.541 9.292 ( -7.814 -0.000 -4.300) 8.919 10.029 ( 2.078 0.000 -0.368) 2.111 10.202 ( 19.915 0.000 7.125) 21.151 10.557 ( -1.701 -0.000 -4.886) 5.174 12.258 ( 14.780 0.000 -0.756) 14.800 12.315 ( 1.750 0.000 15.085) 15.187 12.373 ( 6.242 0.000 -3.193) 7.011 12.719 ( -0.276 -0.000 -10.318) 10.322 13.741 ( 7.760 0.000 11.115) 13.556 13.855 ( -7.788 -0.000 -3.773) 8.654 15.006 ( -13.679 -0.000 -14.196) 19.714 18.341 ( -10.853 -0.000 16.619) 19.849 18.964 ( -11.260 -0.000 -2.916) 11.631 19.068 ( -11.496 -0.000 -1.445) 11.587 19.305 ( 14.194 0.000 -8.645) 16.620 21.468 ( -1.435 -0.000 15.189) 15.257 22.224 ( 16.280 0.000 -29.718) 33.885 23.801 ( 6.070 0.000 1.787) 6.327 24.251 ( -3.437 -0.000 4.821) 5.920 ======================= Grid point 24 (17/361) ======================= q-point: ( 0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.268 ( 13.147 1.659 11.911) 17.817 2.359 ( 8.007 -7.045 17.468) 20.467 3.120 ( -5.026 4.671 -2.429) 7.278 3.198 ( -8.898 0.462 -5.334) 10.384 3.689 ( -14.451 9.133 -3.985) 17.553 4.037 ( -10.349 -6.870 -0.850) 12.451 4.082 ( 13.161 -0.487 -7.848) 15.331 4.258 ( 13.285 -0.726 -9.349) 16.261 4.755 ( 7.103 1.007 5.479) 9.026 4.876 ( -3.750 -5.887 -2.835) 7.533 5.489 ( -8.393 2.191 -2.810) 9.119 5.686 ( 2.104 1.009 9.738) 10.014 6.245 ( -5.183 0.999 2.527) 5.852 6.703 ( -9.263 0.104 -10.951) 14.344 6.910 ( 2.865 1.281 0.539) 3.185 7.603 ( 5.026 -9.020 7.914) 13.010 8.690 ( -14.646 1.311 3.120) 15.032 9.165 ( -6.541 -3.195 -1.870) 7.516 9.941 ( -6.427 1.524 -5.132) 8.364 10.452 ( 10.835 13.580 -0.405) 17.378 10.710 ( 16.573 -12.419 7.264) 21.946 12.190 ( -0.776 27.287 3.658) 27.542 12.461 ( -0.260 -1.350 2.147) 2.550 12.583 ( 15.649 -0.547 1.721) 15.753 12.737 ( -0.417 -22.053 -1.035) 22.081 13.706 ( -4.936 2.072 -2.563) 5.935 13.990 ( 8.381 -1.954 6.014) 10.499 14.687 ( -9.345 0.108 -7.717) 12.120 18.258 ( -6.109 0.167 -11.195) 12.755 18.815 ( -8.107 -2.488 -0.566) 8.499 19.001 ( -6.210 0.258 14.041) 15.355 19.398 ( 14.535 2.678 -8.111) 16.858 21.578 ( -4.817 4.577 12.329) 14.006 22.092 ( 8.597 -3.691 -22.876) 24.715 23.927 ( 6.427 -1.592 2.323) 7.017 24.256 ( -3.546 0.962 5.034) 6.232 ======================= Grid point 25 (18/361) ======================= q-point: (-0.60 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.498 ( 8.242 4.838 0.835) 9.594 2.561 ( -5.230 2.462 2.322) 6.230 3.021 ( -7.418 0.223 -2.100) 7.713 3.049 ( -3.158 -3.403 6.199) 7.745 3.351 ( -9.107 7.096 -4.591) 12.424 3.842 ( -14.256 -6.516 -6.351) 16.912 4.192 ( 8.955 -1.969 -6.746) 11.383 4.283 ( 1.173 4.344 -3.191) 5.516 4.822 ( 0.191 -1.671 -0.617) 1.792 4.921 ( -0.742 -9.082 0.448) 9.123 5.291 ( -1.189 1.553 -13.454) 13.595 5.819 ( 3.946 4.236 7.589) 9.545 6.136 ( -14.350 1.608 6.399) 15.795 6.470 ( -11.495 -5.207 -7.019) 14.440 6.985 ( 4.099 1.102 5.044) 6.593 7.883 ( 3.986 -11.166 10.345) 15.735 8.496 ( -10.379 0.464 -1.805) 10.545 9.105 ( -5.852 -4.825 0.133) 7.586 9.754 ( -8.566 -2.897 -7.016) 11.445 10.416 ( 6.809 14.404 -4.652) 16.597 11.177 ( 18.193 -9.482 8.233) 22.106 11.936 ( 0.573 32.729 1.946) 32.792 12.461 ( -5.242 -0.186 4.285) 6.773 12.741 ( 5.047 3.929 0.247) 6.401 12.972 ( 1.067 -20.060 3.773) 20.440 13.672 ( 5.320 1.567 1.752) 5.816 14.025 ( -2.029 0.908 -10.293) 10.530 14.681 ( 4.776 -4.941 9.749) 11.927 17.941 ( -7.311 -3.917 -25.180) 26.511 18.779 ( -2.833 -2.278 4.852) 6.063 19.183 ( 2.851 0.372 17.215) 17.453 19.478 ( 13.492 4.060 -6.460) 15.500 21.534 ( -5.135 8.365 2.382) 10.100 21.992 ( -2.144 -8.453 -10.577) 13.708 24.057 ( 5.441 -0.839 2.614) 6.094 24.258 ( -2.149 2.283 4.632) 5.594 ======================= Grid point 26 (19/361) ======================= q-point: (-0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.298 ( -9.034 15.627 -6.875) 19.315 2.358 ( -8.001 9.890 -12.673) 17.956 2.958 ( -6.498 -0.997 3.760) 7.573 3.045 ( -5.839 -4.555 1.876) 7.639 3.378 ( 3.246 -10.006 3.438) 11.067 3.611 ( -10.123 2.934 -6.277) 12.267 4.015 ( -9.100 5.911 -6.365) 12.580 4.352 ( 5.366 -2.974 1.451) 6.304 4.755 ( -6.457 2.226 -2.626) 7.317 5.031 ( 1.217 -16.542 -2.598) 16.789 5.148 ( 4.606 -1.767 -13.498) 14.371 5.873 ( -3.205 5.095 5.018) 7.837 6.018 ( -5.811 1.624 3.615) 7.034 6.257 ( -18.299 -5.941 -2.409) 19.389 7.118 ( 3.469 0.036 7.575) 8.331 8.084 ( -4.844 -1.553 9.755) 11.002 8.440 ( 3.325 -13.067 -4.072) 14.085 9.078 ( -5.952 -4.614 1.972) 7.785 9.608 ( -7.661 -9.138 -6.047) 13.370 10.279 ( 3.760 15.284 -6.734) 17.120 11.556 ( 14.122 -3.959 2.396) 14.861 11.682 ( 2.565 33.766 4.747) 34.194 12.426 ( -7.472 0.458 5.302) 9.173 12.667 ( -4.298 8.455 -1.660) 9.628 13.206 ( 3.326 -13.449 4.390) 14.533 13.790 ( -5.618 2.461 -11.862) 13.354 13.863 ( 12.340 1.127 7.364) 14.415 15.017 ( 10.028 -9.016 13.063) 18.775 17.540 ( -7.091 -8.704 -32.299) 34.194 18.902 ( 3.787 -1.766 10.873) 11.648 19.435 ( 10.721 3.231 7.102) 13.259 19.575 ( 9.874 2.954 2.644) 10.640 21.360 ( -5.755 6.990 -5.655) 10.675 21.902 ( -12.988 -9.667 -0.862) 16.214 24.159 ( 4.039 1.147 3.493) 5.462 24.269 ( 0.228 3.309 3.517) 4.834 ======================= Grid point 27 (20/361) ======================= q-point: (-0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.871 ( -8.909 21.241 -12.618) 26.263 1.934 ( -15.008 14.175 -9.857) 22.876 2.815 ( -15.014 7.925 -1.975) 17.091 3.065 ( -5.405 -7.350 1.804) 9.300 3.360 ( 2.608 14.409 -5.417) 15.613 3.461 ( -1.973 -12.220 -7.175) 14.307 3.938 ( -3.445 -5.937 9.200) 11.478 4.450 ( 2.588 -3.122 -2.684) 4.863 4.616 ( -4.948 -2.677 -1.608) 5.851 5.072 ( 2.235 -1.467 -5.952) 6.525 5.185 ( 0.961 -17.404 -5.722) 18.345 5.767 ( -15.087 -0.015 5.123) 15.933 5.987 ( -8.387 -1.708 -7.710) 11.520 6.037 ( -4.256 3.513 5.707) 7.939 7.232 ( -0.296 0.575 6.319) 6.352 8.097 ( -2.981 1.481 6.725) 7.503 8.645 ( 5.776 -20.817 -4.070) 21.983 9.074 ( -5.089 -4.496 4.245) 8.009 9.554 ( -7.529 -14.862 -3.600) 17.044 10.124 ( 4.394 14.586 -3.729) 15.683 11.428 ( 2.657 35.217 4.070) 35.551 11.759 ( 7.610 1.468 -2.882) 8.268 12.374 ( -6.582 1.759 4.231) 8.019 12.482 ( -5.445 8.916 -1.780) 10.598 13.379 ( 3.835 -3.432 -3.734) 6.358 13.622 ( -3.781 -3.259 3.125) 5.889 14.136 ( 12.209 3.825 10.864) 16.785 15.403 ( 8.898 -11.277 11.539) 18.426 17.111 ( -5.931 -12.662 -38.816) 41.258 19.170 ( 10.462 0.251 14.082) 17.544 19.559 ( 12.892 4.721 -5.455) 14.773 19.794 ( 8.747 4.148 12.058) 15.463 21.123 ( -8.184 3.928 -7.429) 11.730 21.758 ( -21.759 -10.400 2.695) 24.267 24.243 ( 2.860 0.606 1.758) 3.411 24.296 ( 3.104 5.653 5.949) 8.774 ======================= Grid point 28 (21/361) ======================= q-point: (-0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.389 ( -10.652 22.219 -11.877) 27.353 1.430 ( -13.227 21.225 -9.090) 26.610 2.340 ( -11.870 34.623 -4.453) 36.871 3.082 ( -5.317 -9.508 1.300) 10.971 3.323 ( 4.890 4.848 -0.937) 6.949 3.481 ( 0.439 -13.624 -5.054) 14.538 4.099 ( -0.697 -5.184 9.385) 10.744 4.397 ( -2.309 -6.565 -6.707) 9.665 4.684 ( 3.088 -7.806 1.787) 8.583 5.066 ( 1.713 -2.227 -2.176) 3.554 5.239 ( -2.267 -13.098 -6.899) 14.977 5.555 ( -24.345 -3.104 5.635) 25.181 5.823 ( -1.312 1.407 -4.025) 4.461 6.049 ( 2.457 5.690 1.410) 6.356 7.241 ( -3.159 2.713 2.496) 4.855 8.165 ( 2.094 -0.573 4.928) 5.385 8.837 ( 1.441 -21.687 -4.478) 22.192 9.137 ( -0.978 -6.361 5.465) 8.443 9.553 ( -7.814 -17.348 -2.591) 19.202 10.085 ( 5.992 9.551 2.955) 11.656 11.194 ( 1.725 34.818 4.629) 35.166 11.688 ( -0.250 8.592 -8.483) 12.077 12.251 ( -3.582 11.810 -0.916) 12.375 12.393 ( -2.639 -0.426 2.109) 3.405 13.309 ( 0.047 1.358 -5.728) 5.887 13.813 ( 2.331 -10.777 10.437) 15.182 14.420 ( 10.754 7.097 18.143) 22.252 15.740 ( 4.844 -12.015 9.638) 16.147 16.635 ( -5.441 -11.958 -44.647) 46.540 19.502 ( 10.706 2.109 13.571) 17.414 19.631 ( 14.308 4.084 -6.355) 16.180 19.954 ( 5.670 9.378 4.053) 11.684 20.921 ( -6.899 -0.229 -2.204) 7.246 21.536 ( -25.534 -10.318 2.281) 27.634 24.252 ( 0.611 1.762 -0.576) 1.951 24.426 ( 5.941 3.051 8.680) 10.952 ======================= Grid point 29 (22/361) ======================= q-point: (-0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.940 ( 0.000 25.037 0.000) 25.037 1.057 ( 0.000 27.354 0.000) 27.354 1.846 ( 0.000 45.251 0.000) 45.251 3.128 ( -0.000 -8.015 -0.000) 8.015 3.320 ( 0.000 2.732 0.000) 2.732 3.589 ( -0.000 -13.652 -0.000) 13.652 4.182 ( -0.000 -1.532 -0.000) 1.532 4.427 ( -0.000 -11.315 -0.000) 11.315 4.808 ( -0.000 -9.240 -0.000) 9.240 5.093 ( -0.000 -1.913 -0.000) 1.913 5.246 ( -0.000 -7.676 -0.000) 7.676 5.389 ( -0.000 -0.453 -0.000) 0.453 5.782 ( 0.000 2.229 0.000) 2.229 6.022 ( 0.000 6.366 0.000) 6.366 7.195 ( 0.000 3.182 0.000) 3.182 8.232 ( -0.000 -0.750 -0.000) 0.750 9.008 ( -0.000 -21.523 -0.000) 21.523 9.255 ( -0.000 -8.752 -0.000) 8.752 9.639 ( -0.000 -20.290 -0.000) 20.290 10.110 ( 0.000 5.466 0.000) 5.466 10.934 ( 0.000 32.246 0.000) 32.246 11.485 ( 0.000 14.538 0.000) 14.538 12.098 ( 0.000 13.645 0.000) 13.645 12.398 ( -0.000 -0.900 -0.000) 0.900 13.268 ( 0.000 0.373 0.000) 0.373 14.019 ( -0.000 -12.431 -0.000) 12.431 14.682 ( 0.000 0.668 0.000) 0.668 16.011 ( -0.000 -14.871 -0.000) 14.871 16.193 ( 0.000 1.878 0.000) 1.878 19.620 ( 0.000 0.638 0.000) 0.638 19.788 ( 0.000 2.537 0.000) 2.537 19.855 ( 0.000 12.443 0.000) 12.443 20.891 ( -0.000 -1.733 -0.000) 1.733 21.385 ( -0.000 -7.201 -0.000) 7.201 24.234 ( 0.000 1.983 0.000) 1.983 24.546 ( -0.000 -1.029 -0.000) 1.029 ======================= Grid point 34 (23/361) ======================= q-point: ( 0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.528 ( 4.274 0.000 3.116) 5.289 2.590 ( 4.900 0.000 7.830) 9.237 3.006 ( -8.550 -0.000 -0.139) 8.551 3.038 ( -5.459 -0.000 -0.870) 5.527 3.457 ( -16.021 -0.000 -4.678) 16.690 3.744 ( -11.925 -0.000 -7.565) 14.122 4.169 ( 9.724 0.000 -5.087) 10.974 4.357 ( 9.696 0.000 -4.844) 10.839 4.722 ( -5.673 -0.000 -4.473) 7.225 4.893 ( -0.979 -0.000 4.618) 4.720 5.304 ( -2.273 -0.000 -15.090) 15.260 5.862 ( 4.407 0.000 8.892) 9.925 6.161 ( -17.615 -0.000 10.616) 20.567 6.412 ( -10.149 -0.000 -11.544) 15.371 6.996 ( 3.989 0.000 4.261) 5.837 7.767 ( 6.361 0.000 10.730) 12.474 8.503 ( -13.556 -0.000 -0.856) 13.583 9.064 ( -4.397 -0.000 0.167) 4.400 9.725 ( -10.221 -0.000 -8.494) 13.289 10.572 ( 3.319 0.000 -4.817) 5.850 11.070 ( 22.300 0.000 9.339) 24.176 12.446 ( -0.665 -0.000 0.591) 0.890 12.498 ( -4.815 -0.000 14.151) 14.948 12.539 ( 3.856 0.000 -3.396) 5.138 12.781 ( 7.083 0.000 0.705) 7.118 13.688 ( 3.991 0.000 1.669) 4.326 14.031 ( -0.170 -0.000 -10.105) 10.107 14.633 ( 2.978 0.000 8.575) 9.077 17.905 ( -8.861 -0.000 -25.439) 26.938 18.759 ( -2.195 -0.000 5.159) 5.606 19.188 ( 2.582 0.000 18.422) 18.602 19.514 ( 13.477 0.000 -7.833) 15.588 21.649 ( -10.368 -0.000 12.244) 16.044 21.878 ( 4.060 0.000 -22.686) 23.047 24.047 ( 6.187 0.000 2.913) 6.838 24.280 ( -2.497 -0.000 5.418) 5.966 ======================= Grid point 35 (24/361) ======================= q-point: (-0.60 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.443 ( -9.644 2.767 -4.981) 11.201 2.550 ( -1.210 7.287 -11.579) 13.735 2.962 ( -9.277 0.557 6.050) 11.089 2.993 ( -7.662 -0.948 3.378) 8.428 3.234 ( -2.747 -4.663 -4.026) 6.745 3.577 ( -5.412 -3.242 -0.516) 6.329 4.188 ( 0.103 6.499 -5.313) 8.395 4.359 ( 2.229 6.670 1.107) 7.119 4.686 ( -0.058 -14.074 -4.575) 14.799 4.807 ( -10.412 -1.272 -3.793) 11.154 5.131 ( 4.445 -0.539 -14.706) 15.373 5.968 ( -11.806 4.913 8.417) 15.309 6.030 ( -5.169 -0.886 6.904) 8.671 6.162 ( -11.305 -3.622 -7.346) 13.960 7.123 ( 4.264 0.295 6.635) 7.892 8.006 ( 5.231 -3.975 9.374) 11.447 8.312 ( -8.862 -2.379 -3.420) 9.792 9.029 ( -3.329 -1.060 1.919) 3.986 9.488 ( -9.509 -3.476 -8.323) 13.107 10.485 ( 0.019 6.249 -6.824) 9.253 11.480 ( 18.320 -2.620 6.002) 19.455 12.308 ( 3.139 30.963 3.326) 31.298 12.432 ( -7.545 1.680 6.365) 10.013 12.776 ( -3.477 1.909 -1.953) 4.421 12.857 ( 3.733 -23.207 5.333) 24.102 13.820 ( -4.205 0.995 -13.954) 14.608 13.880 ( 12.987 0.343 7.347) 14.925 14.889 ( 9.015 -4.041 12.019) 15.558 17.436 ( -10.132 -2.759 -29.830) 31.624 18.882 ( 4.972 -0.511 11.370) 12.420 19.484 ( 8.822 1.715 15.675) 18.069 19.601 ( 11.289 0.320 -5.446) 12.538 21.518 ( -8.297 9.855 -3.445) 13.336 21.716 ( -7.988 -10.439 -7.803) 15.286 24.162 ( 4.752 -0.130 2.684) 5.459 24.318 ( -0.388 1.503 5.202) 5.429 ======================= Grid point 36 (25/361) ======================= q-point: (-0.50 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.153 ( -12.598 10.085 -6.390) 17.356 2.224 ( -5.933 15.273 -13.522) 21.244 2.826 ( -9.659 -2.631 2.081) 10.225 2.962 ( -7.531 -4.660 1.400) 8.966 3.245 ( -0.655 -10.183 -7.426) 12.620 3.618 ( 3.172 5.444 5.014) 8.052 3.953 ( -6.525 12.443 0.555) 14.061 4.410 ( 2.972 -0.941 0.331) 3.135 4.573 ( -7.585 -1.966 -7.725) 11.003 4.835 ( -0.396 -19.561 -2.457) 19.719 5.048 ( 2.293 -1.596 -9.137) 9.555 5.765 ( -21.845 -0.074 6.660) 22.838 5.956 ( -7.668 -1.189 -6.291) 9.990 6.098 ( 2.405 2.355 3.289) 4.706 7.254 ( 2.707 1.458 6.517) 7.205 8.104 ( -5.055 0.312 4.567) 6.820 8.326 ( 4.781 -13.490 -2.132) 14.470 9.024 ( -2.781 -0.992 2.819) 4.083 9.332 ( -7.936 -8.863 -5.787) 13.230 10.335 ( -0.119 8.063 -5.086) 9.534 11.752 ( 11.687 1.064 0.616) 11.751 12.109 ( 3.561 33.907 5.040) 34.464 12.376 ( -7.528 0.305 4.149) 8.601 12.632 ( -5.209 6.217 -2.984) 8.642 13.178 ( 4.463 -18.412 4.862) 19.560 13.588 ( -5.056 -0.086 -10.195) 11.380 14.192 ( 14.206 2.005 11.320) 18.274 15.210 ( 8.309 -8.696 9.554) 15.360 16.954 ( -9.843 -5.070 -30.908) 32.832 19.175 ( 11.335 0.230 15.961) 19.577 19.635 ( 11.289 3.386 -6.128) 13.284 19.841 ( 10.205 1.130 15.061) 18.228 21.227 ( -8.725 7.278 -9.823) 15.020 21.572 ( -16.971 -9.913 -2.602) 19.826 24.247 ( 2.920 0.046 1.759) 3.409 24.371 ( 1.986 2.594 5.059) 6.022 ======================= Grid point 37 (26/361) ======================= q-point: (-0.40 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.748 ( -11.191 18.112 -8.952) 23.096 1.833 ( -5.902 20.713 -7.452) 22.790 2.774 ( -5.595 8.518 5.017) 11.359 2.903 ( -5.954 -7.568 -1.107) 9.693 3.222 ( -1.127 -13.288 -8.397) 15.759 3.542 ( 4.722 19.547 -1.398) 20.158 3.987 ( -1.717 -5.783 12.935) 14.273 4.321 ( -3.571 -2.118 -10.929) 11.691 4.556 ( 1.120 -5.886 1.662) 6.218 4.963 ( -1.083 -16.839 -2.672) 17.084 5.010 ( 1.015 -3.802 -4.717) 6.143 5.522 ( -19.204 -0.904 3.248) 19.497 5.838 ( -1.521 0.170 -3.219) 3.564 6.131 ( 1.805 3.239 1.311) 3.933 7.306 ( -0.206 4.243 3.188) 5.311 8.118 ( -1.421 -4.160 3.390) 5.551 8.493 ( 3.141 -15.208 -2.806) 15.780 9.049 ( -0.503 -2.912 2.930) 4.162 9.270 ( -7.087 -12.408 -3.049) 14.611 10.240 ( 1.744 6.673 -1.033) 6.974 11.789 ( 3.241 14.985 0.720) 15.348 11.909 ( 3.215 29.036 0.262) 29.214 12.333 ( -3.844 -1.609 1.766) 4.526 12.471 ( -3.402 7.735 -1.788) 8.638 13.327 ( 0.975 -0.565 -5.022) 5.146 13.556 ( -0.588 -16.072 3.714) 16.506 14.503 ( 10.514 2.600 13.009) 16.928 15.502 ( 4.750 -12.752 6.353) 15.018 16.504 ( -7.787 -3.695 -27.403) 28.726 19.531 ( 8.059 1.188 14.849) 16.937 19.699 ( 14.464 3.031 -5.965) 15.937 20.111 ( 8.172 7.320 9.924) 14.794 20.938 ( -8.572 2.402 -6.370) 10.947 21.355 ( -18.991 -9.562 -3.508) 21.550 24.280 ( 0.937 1.258 0.302) 1.598 24.457 ( 3.270 0.783 4.691) 5.772 ======================= Grid point 38 (27/361) ======================= q-point: (-0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.386 ( 0.000 23.462 0.000) 23.462 1.531 ( 0.000 24.192 0.000) 24.192 2.557 ( 0.000 30.112 0.000) 30.112 2.951 ( -0.000 -11.083 -0.000) 11.083 3.308 ( -0.000 -16.564 -0.000) 16.564 3.432 ( 0.000 11.483 0.000) 11.483 4.158 ( -0.000 -1.028 -0.000) 1.028 4.220 ( -0.000 -10.598 -0.000) 10.598 4.646 ( -0.000 -7.954 -0.000) 7.954 5.031 ( -0.000 -4.617 -0.000) 4.617 5.062 ( -0.000 -12.534 -0.000) 12.534 5.386 ( 0.000 0.152 0.000) 0.152 5.809 ( 0.000 0.631 0.000) 0.631 6.120 ( 0.000 4.165 0.000) 4.165 7.272 ( 0.000 5.150 0.000) 5.150 8.184 ( -0.000 -4.748 -0.000) 4.748 8.640 ( -0.000 -17.562 -0.000) 17.562 9.119 ( -0.000 -5.564 -0.000) 5.564 9.308 ( -0.000 -15.290 -0.000) 15.290 10.209 ( 0.000 4.965 0.000) 4.965 11.583 ( 0.000 37.601 0.000) 37.601 11.723 ( 0.000 11.284 0.000) 11.284 12.306 ( 0.000 6.109 0.000) 6.109 12.385 ( 0.000 1.858 0.000) 1.858 13.283 ( 0.000 1.217 0.000) 1.217 13.751 ( -0.000 -16.967 -0.000) 16.967 14.687 ( 0.000 0.040 0.000) 0.040 15.720 ( -0.000 -16.015 -0.000) 16.015 16.229 ( 0.000 1.839 0.000) 1.839 19.635 ( 0.000 0.944 0.000) 0.944 19.834 ( 0.000 2.397 0.000) 2.397 20.102 ( 0.000 13.967 0.000) 13.967 20.856 ( -0.000 -1.899 -0.000) 1.899 21.233 ( -0.000 -9.143 -0.000) 9.143 24.271 ( 0.000 1.986 0.000) 1.986 24.525 ( -0.000 -1.228 -0.000) 1.228 ======================= Grid point 45 (28/361) ======================= q-point: ( 0.40 -0.60 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.260 ( -10.326 -0.000 -2.821) 10.705 2.371 ( -3.767 -0.000 -15.300) 15.756 2.848 ( -11.913 -0.000 3.435) 12.399 2.856 ( -10.496 -0.000 -2.529) 10.797 3.144 ( 1.901 0.000 -6.122) 6.411 3.629 ( 2.629 0.000 10.198) 10.531 4.175 ( -2.814 -0.000 -1.909) 3.400 4.456 ( -0.737 -0.000 3.848) 3.918 4.532 ( 0.398 0.000 -3.421) 3.444 4.553 ( -8.104 -0.000 -11.115) 13.755 5.033 ( 2.191 0.000 -10.073) 10.309 5.764 ( -24.417 -0.000 7.183) 25.451 5.945 ( -5.935 -0.000 -5.809) 8.305 6.120 ( 3.110 0.000 2.623) 4.068 7.270 ( 3.996 0.000 6.843) 7.925 8.136 ( -6.885 -0.000 -3.273) 7.623 8.167 ( 5.482 0.000 5.552) 7.803 9.021 ( -1.778 -0.000 2.741) 3.267 9.246 ( -8.057 -0.000 -6.960) 10.647 10.410 ( -2.111 -0.000 -5.640) 6.022 11.759 ( 13.637 0.000 2.521) 13.868 12.351 ( -5.979 -0.000 0.864) 6.041 12.632 ( -7.367 -0.000 5.780) 9.363 12.755 ( 8.353 0.000 2.079) 8.608 12.763 ( -0.735 -0.000 2.661) 2.760 13.591 ( -4.728 -0.000 -12.350) 13.224 14.210 ( 14.913 0.000 10.982) 18.520 15.124 ( 8.057 0.000 8.685) 11.847 16.910 ( -10.809 -0.000 -28.224) 30.223 19.178 ( 11.558 0.000 16.598) 20.226 19.670 ( 10.121 0.000 -7.095) 12.360 19.848 ( 11.229 0.000 17.029) 20.398 21.354 ( -4.544 -0.000 -19.224) 19.754 21.422 ( -19.641 -0.000 4.007) 20.046 24.247 ( 3.057 0.000 1.998) 3.652 24.394 ( 1.435 0.000 4.563) 4.783 ======================= Grid point 47 (29/361) ======================= q-point: (-0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.040 ( -7.241 12.393 -4.717) 15.109 2.120 ( -4.283 7.754 -8.200) 12.071 2.704 ( -5.941 -4.095 -0.235) 7.219 2.826 ( -4.611 -6.953 5.003) 9.728 3.065 ( -1.360 -2.747 -9.832) 10.299 3.822 ( 5.826 2.153 9.989) 11.762 4.033 ( -3.953 14.876 2.288) 15.561 4.303 ( -5.170 -0.239 -11.801) 12.886 4.484 ( 1.048 -1.001 1.517) 2.098 4.634 ( -1.171 -17.284 0.742) 17.340 4.953 ( 1.000 -1.901 -7.159) 7.474 5.514 ( -17.162 -0.111 2.587) 17.356 5.834 ( -2.548 -0.295 -2.570) 3.631 6.169 ( 1.565 0.989 0.940) 2.076 7.377 ( 2.124 2.667 4.169) 5.386 8.044 ( -3.069 -2.868 -0.949) 4.307 8.300 ( 3.022 -5.491 1.305) 6.402 9.029 ( -0.648 0.417 1.731) 1.895 9.109 ( -5.255 -5.177 -3.433) 8.136 10.323 ( -0.924 2.284 -2.527) 3.529 11.908 ( 6.405 3.017 -0.191) 7.083 12.286 ( -3.151 -1.013 -0.071) 3.310 12.520 ( -2.308 20.356 6.183) 21.399 12.600 ( -0.444 15.028 -2.831) 15.299 13.100 ( 3.714 -24.235 3.910) 24.827 13.404 ( -3.996 -0.680 -7.538) 8.559 14.531 ( 10.487 0.721 10.416) 14.798 15.323 ( 4.617 -5.611 4.538) 8.567 16.468 ( -8.234 -0.726 -20.473) 22.078 19.546 ( 7.231 0.436 15.388) 17.008 19.737 ( 13.762 1.119 -5.739) 14.953 20.205 ( 10.711 2.605 15.259) 18.824 21.011 ( -8.868 5.037 -13.107) 16.607 21.192 ( -17.590 -7.513 -3.887) 19.519 24.296 ( 1.341 0.439 0.972) 1.713 24.464 ( 1.842 0.148 2.956) 3.486 ======================= Grid point 48 (30/361) ======================= q-point: (-0.40 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.786 ( 0.000 19.671 0.000) 19.671 1.920 ( 0.000 16.939 0.000) 16.939 2.739 ( -0.000 -11.055 -0.000) 11.055 2.894 ( 0.000 8.303 0.000) 8.303 3.004 ( -0.000 -15.672 -0.000) 15.672 3.778 ( 0.000 23.886 0.000) 23.886 4.060 ( -0.000 -6.418 -0.000) 6.418 4.145 ( -0.000 -0.509 -0.000) 0.509 4.531 ( -0.000 -4.356 -0.000) 4.356 4.789 ( -0.000 -16.841 -0.000) 16.841 4.943 ( -0.000 -4.270 -0.000) 4.270 5.392 ( 0.000 0.378 0.000) 0.378 5.807 ( -0.000 -0.591 -0.000) 0.591 6.173 ( 0.000 1.801 0.000) 1.801 7.375 ( 0.000 5.565 0.000) 5.565 8.070 ( -0.000 -6.727 -0.000) 6.727 8.392 ( -0.000 -9.184 -0.000) 9.184 9.055 ( -0.000 -1.704 -0.000) 1.704 9.094 ( -0.000 -7.896 -0.000) 7.896 10.282 ( 0.000 2.809 0.000) 2.809 11.895 ( 0.000 7.346 0.000) 7.346 12.271 ( 0.000 36.472 0.000) 36.472 12.289 ( -0.000 -3.259 -0.000) 3.259 12.492 ( 0.000 5.313 0.000) 5.313 13.307 ( 0.000 1.169 0.000) 1.169 13.389 ( -0.000 -22.943 -0.000) 22.943 14.687 ( 0.000 0.049 0.000) 0.049 15.463 ( -0.000 -10.953 -0.000) 10.953 16.257 ( 0.000 1.117 0.000) 1.117 19.651 ( 0.000 0.704 0.000) 0.704 19.871 ( 0.000 1.462 0.000) 1.462 20.343 ( 0.000 11.489 0.000) 11.489 20.826 ( -0.000 -1.273 -0.000) 1.273 21.064 ( -0.000 -8.653 -0.000) 8.653 24.302 ( 0.000 1.292 0.000) 1.292 24.504 ( -0.000 -0.918 -0.000) 0.918 ======================= Grid point 58 (31/361) ======================= q-point: (-0.50 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( 0.000 0.000 0.000) 0.000 2.051 ( -0.000 -0.000 -0.000) 0.000 2.623 ( -0.000 -0.000 -0.000) 0.000 2.821 ( -0.000 -0.000 -0.000) 0.000 2.957 ( -0.000 -0.000 -0.000) 0.000 3.999 ( -0.000 -0.000 -0.000) 0.000 4.107 ( 0.000 0.000 0.000) 0.000 4.127 ( -0.000 -0.000 -0.000) 0.000 4.491 ( -0.000 -0.000 -0.000) 0.000 4.552 ( -0.000 -0.000 -0.000) 0.000 4.899 ( -0.000 -0.000 -0.000) 0.000 5.396 ( -0.000 -0.000 -0.000) 0.000 5.800 ( -0.000 -0.000 -0.000) 0.000 6.189 ( -0.000 -0.000 -0.000) 0.000 7.437 ( -0.000 -0.000 -0.000) 0.000 7.994 ( -0.000 -0.000 -0.000) 0.000 8.308 ( -0.000 -0.000 -0.000) 0.000 9.021 ( -0.000 -0.000 -0.000) 0.000 9.042 ( -0.000 -0.000 -0.000) 0.000 10.308 ( -0.000 -0.000 -0.000) 0.000 11.971 ( -0.000 -0.000 -0.000) 0.000 12.249 ( -0.000 -0.000 -0.000) 0.000 12.542 ( -0.000 -0.000 -0.000) 0.000 12.840 ( 0.000 0.000 0.000) 0.000 12.950 ( -0.000 -0.000 -0.000) 0.000 13.319 ( -0.000 -0.000 -0.000) 0.000 14.689 ( -0.000 -0.000 -0.000) 0.000 15.357 ( -0.000 -0.000 -0.000) 0.000 16.267 ( -0.000 -0.000 -0.000) 0.000 19.658 ( -0.000 -0.000 -0.000) 0.000 19.885 ( -0.000 -0.000 -0.000) 0.000 20.467 ( -0.000 -0.000 -0.000) 0.000 20.814 ( -0.000 -0.000 -0.000) 0.000 20.967 ( -0.000 -0.000 -0.000) 0.000 24.315 ( -0.000 -0.000 -0.000) 0.000 24.495 ( -0.000 -0.000 -0.000) 0.000 ======================= Grid point 105 (32/361) ======================= q-point: ( 0.00 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.525 ( -4.269 -0.000 26.430) 26.772 0.638 ( 10.618 0.000 30.741) 32.523 1.119 ( -6.926 -0.000 54.107) 54.548 3.257 ( -0.510 -0.000 -2.132) 2.192 3.333 ( -0.280 -0.000 4.710) 4.719 3.926 ( -2.279 -0.000 5.720) 6.157 4.108 ( 4.589 0.000 -3.827) 5.975 4.660 ( -1.864 -0.000 -5.978) 6.261 4.962 ( 0.221 0.000 -7.762) 7.765 5.167 ( 15.118 0.000 -5.591) 16.119 5.510 ( 2.157 0.000 9.040) 9.293 5.808 ( -3.779 -0.000 10.385) 11.051 5.868 ( -0.909 -0.000 2.948) 3.085 7.224 ( -5.995 -0.000 8.226) 10.179 7.306 (-125.094 -0.000 1.804) 125.107 7.536 ( -1.275 -0.000 -5.035) 5.194 8.865 ( 3.387 0.000 5.536) 6.490 9.450 ( -4.826 -0.000 -2.557) 5.462 9.593 ( 0.606 0.000 4.763) 4.801 10.089 ( -1.309 -0.000 -8.371) 8.473 10.442 ( 38.692 0.000 5.471) 39.077 11.023 ( -2.256 -0.000 -2.102) 3.084 12.267 ( -17.659 -0.000 11.169) 20.895 12.357 ( -1.891 -0.000 -4.862) 5.216 12.671 ( 5.868 0.000 -5.248) 7.872 13.335 ( -1.602 -0.000 5.707) 5.927 14.261 ( -1.070 -0.000 -1.461) 1.811 16.015 ( -1.822 -0.000 -9.586) 9.757 19.008 ( 2.146 0.000 -7.656) 7.951 19.340 ( 92.557 0.000 -2.391) 92.588 19.575 ( 11.546 0.000 -2.065) 11.729 19.627 ( -3.602 -0.000 0.927) 3.720 20.906 ( 8.568 0.000 -1.406) 8.683 22.305 (-147.775 -0.000 -1.504) 147.783 23.588 ( -2.357 -0.000 3.753) 4.432 24.187 ( 2.679 0.000 -0.436) 2.714 ======================= Grid point 106 (33/361) ======================= q-point: ( 0.10 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.925 ( 9.043 -8.184 22.123) 25.262 1.165 ( 7.906 -9.792 27.299) 30.060 1.942 ( 23.847 -7.587 42.216) 49.076 3.251 ( 5.736 2.126 -3.960) 7.287 3.357 ( -5.915 0.252 7.197) 9.319 3.937 ( -4.685 2.751 7.331) 9.125 4.111 ( 3.317 2.843 -5.211) 6.800 4.545 ( 1.659 1.920 -10.892) 11.184 4.864 ( 2.131 2.139 -9.616) 10.079 5.133 ( -10.715 0.667 -4.247) 11.545 5.595 ( 2.787 -0.036 7.010) 7.544 5.858 ( -6.903 0.672 6.944) 9.815 5.898 ( -6.469 -0.055 15.420) 16.722 6.478 ( -10.758 25.067 23.349) 35.907 7.247 ( -2.476 3.297 5.256) 6.681 7.590 ( -7.733 -26.047 -8.398) 28.438 9.011 ( 0.910 -3.383 6.458) 7.348 9.438 ( 1.943 -6.973 -2.376) 7.618 9.645 ( 2.847 10.187 4.032) 11.320 9.976 ( -3.258 -7.865 -6.899) 10.958 10.717 ( 12.677 24.168 -3.620) 27.530 11.245 ( 20.106 -27.705 -6.312) 34.809 12.216 ( -5.324 7.535 8.699) 12.681 12.303 ( -0.827 -0.336 2.167) 2.344 12.808 ( 5.505 -20.053 -9.415) 22.827 13.411 ( 0.277 -0.760 7.956) 7.997 14.192 ( -4.128 1.119 -2.695) 5.056 15.779 ( -7.483 3.158 -14.750) 16.839 18.828 ( 0.802 28.114 3.536) 28.346 19.237 ( -19.566 -0.382 -6.271) 20.550 19.534 ( -7.636 -2.553 -3.469) 8.767 19.774 ( -24.739 -0.890 12.399) 27.686 21.023 ( 12.205 7.688 4.044) 14.981 21.575 ( 12.393 -3.165 -7.704) 14.932 23.694 ( -2.657 -15.690 -0.346) 15.917 24.227 ( 2.150 -0.323 0.757) 2.302 ======================= Grid point 107 (34/361) ======================= q-point: ( 0.20 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.415 ( 13.318 -9.580 17.048) 23.659 1.714 ( 9.531 -13.472 24.027) 29.148 2.813 ( 25.934 -4.956 27.086) 37.825 3.261 ( 5.246 5.157 -3.433) 8.118 3.359 ( -4.896 0.119 8.461) 9.776 3.917 ( -2.971 4.361 2.714) 5.934 3.991 ( 0.020 7.793 -9.441) 12.242 4.443 ( 3.962 -2.049 -10.975) 11.846 4.735 ( -4.379 5.682 -0.785) 7.216 5.006 ( -3.637 -7.717 -3.059) 9.063 5.695 ( 3.495 0.886 -1.312) 3.837 5.815 ( -9.733 -1.168 5.886) 11.434 6.037 ( -5.321 5.141 25.079) 26.148 6.540 ( 5.196 14.271 15.805) 21.919 7.173 ( -5.725 1.882 -4.055) 7.263 7.632 ( -3.982 -16.419 -1.518) 16.963 9.078 ( -1.204 3.246 3.381) 4.839 9.495 ( 0.445 3.322 -0.734) 3.431 9.631 ( 1.635 -0.030 4.044) 4.362 10.002 ( 1.588 -5.659 0.890) 5.944 10.617 ( 2.782 5.999 -3.442) 7.455 11.666 ( 18.168 -14.737 -4.270) 23.780 12.151 ( -0.700 4.480 -1.958) 4.939 12.360 ( 1.319 1.657 5.212) 5.626 12.951 ( 3.188 -19.389 -6.223) 20.612 13.558 ( 3.408 -1.945 9.681) 10.446 14.061 ( -6.699 2.396 -3.247) 7.820 15.411 ( -10.586 4.889 -16.816) 20.463 18.633 ( -11.522 20.542 13.813) 27.304 18.967 ( -0.143 1.948 -11.780) 11.941 19.383 ( -9.422 -5.408 -7.055) 12.953 19.562 ( -24.433 -1.093 10.905) 26.778 21.202 ( 14.354 7.016 2.523) 16.175 21.751 ( 20.534 -4.737 -12.169) 24.334 23.779 ( -0.611 -10.655 -1.002) 10.720 24.265 ( 1.026 0.295 1.293) 1.677 ======================= Grid point 108 (35/361) ======================= q-point: ( 0.30 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.872 ( 12.942 -8.562 12.125) 19.693 2.256 ( 9.444 -13.728 20.960) 26.776 3.139 ( -3.202 7.352 3.069) 8.586 3.223 ( 3.426 7.300 -3.872) 8.945 3.606 ( 11.333 -0.616 9.991) 15.121 3.718 ( -0.908 11.005 -6.267) 12.697 3.950 ( 8.736 -5.067 -3.816) 10.796 4.413 ( 1.001 -3.985 -6.423) 7.625 4.683 ( -4.761 0.390 7.956) 9.280 5.032 ( 2.166 -7.952 -4.798) 9.537 5.626 ( -4.093 5.435 -4.462) 8.137 5.759 ( -9.031 -0.692 6.505) 11.151 6.242 ( -5.048 6.288 27.864) 29.008 6.689 ( 4.483 7.191 11.953) 14.652 6.986 ( -7.889 -0.122 -7.018) 10.560 7.749 ( 0.584 -11.774 3.823) 12.393 8.964 ( -7.918 9.377 -1.161) 12.327 9.477 ( 4.372 7.067 2.652) 8.723 9.693 ( -3.796 -4.590 1.190) 6.074 10.101 ( 3.649 2.130 4.161) 5.930 10.678 ( 5.247 -13.195 0.384) 14.205 11.798 ( -0.497 9.683 -4.578) 10.722 12.175 ( 12.256 -5.228 -2.958) 13.649 12.442 ( 4.422 -2.433 1.623) 5.301 13.098 ( 0.763 -14.903 -0.761) 14.942 13.753 ( 2.962 -1.190 5.411) 6.283 13.905 ( -5.055 0.747 0.710) 5.159 15.008 ( -10.533 5.387 -15.002) 19.106 18.450 ( -10.024 7.859 2.409) 12.963 18.904 ( 11.096 7.379 -5.579) 14.446 19.171 ( -9.663 -1.336 -9.730) 13.778 19.399 ( -19.536 -5.060 10.606) 22.798 21.323 ( 12.219 6.943 -4.383) 14.722 21.952 ( 12.522 -7.244 -2.619) 14.701 23.858 ( 2.162 -7.113 -0.909) 7.490 24.276 ( -0.536 1.829 1.301) 2.308 ======================= Grid point 109 (36/361) ======================= q-point: ( 0.40 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.202 ( 8.743 -4.151 4.439) 10.648 2.668 ( -1.896 -4.918 13.446) 14.442 3.052 ( 1.452 2.116 3.981) 4.737 3.104 ( -0.831 6.664 -7.167) 9.822 3.385 ( -3.927 11.001 -7.092) 13.665 3.891 ( 14.068 -2.858 -4.928) 15.178 4.192 ( 7.973 -6.190 0.677) 10.117 4.364 ( -5.854 -4.748 1.066) 7.612 4.754 ( -2.381 -1.441 9.223) 9.633 5.076 ( 3.308 -7.219 -5.171) 9.476 5.384 ( -7.617 8.592 -9.276) 14.761 5.731 ( -5.621 1.745 6.552) 8.807 6.400 ( -9.668 4.474 18.587) 21.423 6.805 ( -3.081 0.772 11.088) 11.535 6.864 ( -3.225 -0.761 4.775) 5.812 7.958 ( 4.937 -8.611 7.828) 12.641 8.707 ( -9.282 11.098 -3.111) 14.799 9.516 ( 0.287 1.582 3.034) 3.433 9.661 ( -1.248 0.356 -1.487) 1.974 10.135 ( -1.090 0.016 0.358) 1.148 10.987 ( 10.472 -17.630 4.993) 21.104 11.506 ( -6.557 18.862 -8.224) 21.596 12.383 ( 11.490 -1.570 -0.718) 11.619 12.573 ( 3.979 -5.166 3.280) 7.299 13.211 ( 0.189 -7.055 0.904) 7.115 13.641 ( -6.197 4.255 -2.168) 7.824 14.048 ( 3.422 -5.112 3.329) 6.994 14.705 ( -4.409 3.224 -5.687) 7.885 18.244 ( -6.002 0.159 -12.491) 13.859 18.923 ( 3.008 2.864 -10.417) 11.214 19.012 ( 4.542 5.886 5.183) 9.063 19.339 ( -14.607 -7.021 10.177) 19.137 21.328 ( 9.593 5.358 -10.302) 15.062 22.169 ( 3.730 -8.626 6.414) 11.378 23.946 ( 4.132 -4.047 -0.830) 5.843 24.247 ( -1.633 3.790 0.973) 4.240 ======================= Grid point 110 (37/361) ======================= q-point: (-0.50 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.216 ( -2.522 8.187 -8.453) 12.035 2.531 ( -14.421 11.428 -1.323) 18.448 2.977 ( 0.243 1.027 0.112) 1.061 3.238 ( -1.237 -0.184 0.978) 1.587 3.364 ( 10.688 -11.568 7.053) 17.257 4.031 ( 4.509 -2.942 -9.951) 11.314 4.091 ( -5.955 0.976 -3.940) 7.207 4.410 ( -7.099 -5.361 2.849) 9.341 4.825 ( -4.582 0.981 8.777) 9.950 5.086 ( 0.146 8.156 -11.470) 14.075 5.174 ( 5.423 -10.706 -3.860) 12.607 5.716 ( -2.825 4.988 5.977) 8.282 6.300 ( -11.015 0.813 -2.596) 11.346 6.868 ( -10.117 -0.935 13.434) 16.843 7.040 ( -4.268 -3.489 25.740) 26.323 8.170 ( -1.326 4.905 12.406) 13.406 8.498 ( 2.279 -0.268 -7.250) 7.605 9.515 ( -5.782 -4.293 1.654) 7.389 9.639 ( 3.119 3.257 -1.779) 4.848 10.093 ( -4.902 -4.572 -3.206) 7.430 11.118 ( -2.678 22.921 -7.157) 24.161 11.366 ( 9.368 -14.955 3.243) 17.942 12.491 ( 3.870 1.207 0.493) 4.084 12.665 ( -4.434 0.990 5.775) 7.348 13.226 ( 2.091 3.062 -2.338) 4.383 13.618 ( 3.172 -3.775 3.504) 6.049 13.978 ( -7.585 3.188 -7.688) 11.261 14.796 ( 9.922 -4.716 9.119) 14.277 17.945 ( -4.776 -3.958 -26.543) 27.259 18.881 ( 4.500 0.457 -0.203) 4.528 19.134 ( 8.181 3.836 2.596) 9.401 19.358 ( -8.330 -4.071 12.306) 15.408 21.263 ( 7.303 3.254 -13.606) 15.781 22.366 ( -5.172 -10.405 13.160) 17.556 24.019 ( 3.578 0.187 0.213) 3.589 24.193 ( -0.549 4.769 -0.095) 4.802 ======================= Grid point 111 (38/361) ======================= q-point: (-0.40 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.860 ( -10.592 14.850 -12.796) 22.281 2.128 ( -18.328 16.922 -3.004) 25.126 3.063 ( 3.182 -4.361 3.145) 6.247 3.256 ( -1.994 -5.059 0.057) 5.439 3.547 ( -19.840 0.811 -9.313) 21.932 3.737 ( -1.356 -7.076 0.058) 7.205 4.124 ( -0.564 -2.144 -2.804) 3.574 4.369 ( 0.488 -0.378 1.956) 2.051 4.790 ( -6.193 -0.638 1.342) 6.369 5.006 ( 5.516 2.023 -3.135) 6.659 5.338 ( 6.855 -10.514 -2.313) 12.763 5.711 ( 0.649 6.768 4.678) 8.253 6.074 ( -9.180 0.301 -8.292) 12.374 6.860 ( -18.911 -5.153 15.015) 24.691 7.334 ( -9.743 -5.705 29.279) 31.380 8.079 ( -8.201 15.086 8.182) 19.020 8.653 ( 15.961 -6.902 -3.817) 17.803 9.488 ( -6.522 -5.142 2.071) 8.559 9.629 ( 1.474 0.874 -3.361) 3.772 10.023 ( -5.482 -7.495 -2.972) 9.750 10.835 ( 0.668 20.064 -2.543) 20.235 11.615 ( 7.584 -9.637 -2.746) 12.567 12.501 ( -0.821 2.297 1.016) 2.642 12.548 ( -14.474 7.980 6.537) 17.774 13.234 ( 6.757 4.337 -1.968) 8.267 13.716 ( -7.554 7.857 -1.028) 10.947 13.822 ( 7.001 -5.377 3.655) 9.554 15.164 ( 14.450 -6.774 11.012) 19.390 17.548 ( -1.495 -6.104 -37.989) 38.506 19.018 ( 7.112 -2.428 5.985) 9.607 19.208 ( 2.317 0.331 0.990) 2.541 19.476 ( 1.619 2.313 11.835) 12.167 21.148 ( 4.914 1.949 -15.442) 16.321 22.533 ( -14.072 -14.169 18.614) 27.300 24.044 ( 0.380 7.280 5.374) 9.057 24.161 ( 3.760 2.444 -3.380) 5.616 ======================= Grid point 112 (39/361) ======================= q-point: (-0.30 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.386 ( -15.630 15.835 -9.611) 24.237 1.642 ( -21.071 20.546 -1.586) 29.473 2.748 ( -37.122 12.606 -17.468) 42.919 3.185 ( 0.152 -4.459 4.043) 6.021 3.416 ( -1.105 -7.741 4.768) 9.159 3.744 ( -5.880 -6.525 -6.288) 10.803 4.133 ( -0.464 -0.398 3.902) 3.949 4.486 ( 9.562 -3.961 -0.604) 10.367 4.760 ( -4.077 -4.995 2.513) 6.920 5.047 ( 2.437 0.237 0.961) 2.631 5.474 ( 4.454 -8.844 -4.393) 10.833 5.719 ( 2.654 6.320 1.762) 7.077 5.860 ( -4.632 2.268 -6.697) 8.453 6.809 ( -27.462 -14.319 18.371) 36.009 7.522 ( -17.665 -5.344 23.103) 29.570 7.973 ( -0.802 13.023 8.373) 15.503 8.871 ( 16.151 3.621 -2.219) 16.700 9.481 ( -3.227 -3.696 1.017) 5.011 9.576 ( -5.092 -6.331 -3.480) 8.838 10.048 ( 1.470 -3.317 3.898) 5.325 10.720 ( 1.259 6.479 1.572) 6.785 11.673 ( 2.608 -4.381 -10.483) 11.657 12.330 ( -16.726 7.358 8.032) 19.960 12.473 ( -3.168 1.842 2.728) 4.569 13.237 ( 4.739 3.690 -5.767) 8.327 13.606 ( -1.662 14.836 14.383) 20.731 14.027 ( 7.601 -3.249 3.643) 9.034 15.566 ( 14.766 -6.487 9.174) 18.555 17.079 ( 2.194 -6.980 -50.337) 50.866 19.205 ( -1.808 -4.379 5.693) 7.406 19.274 ( 10.322 2.179 3.433) 11.093 19.605 ( 4.527 6.671 7.337) 10.901 21.004 ( 3.319 0.912 -14.850) 15.244 22.681 ( -23.168 -22.050 22.709) 39.226 24.060 ( 1.550 13.084 11.625) 17.571 24.163 ( 4.965 1.374 -3.943) 6.487 ======================= Grid point 113 (40/361) ======================= q-point: (-0.20 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.910 ( -20.609 15.047 -1.395) 25.556 1.118 ( -24.175 20.962 0.415) 32.000 1.821 ( -45.722 18.935 -9.003) 50.300 3.260 ( -0.093 -2.558 2.691) 3.714 3.451 ( -11.353 -4.534 2.642) 12.507 3.709 ( 3.854 -5.191 -0.986) 6.540 4.146 ( 1.140 0.114 -2.901) 3.119 4.641 ( 2.208 -6.591 1.342) 7.079 4.850 ( 3.228 -5.935 5.736) 8.863 5.080 ( 0.441 0.750 1.453) 1.693 5.472 ( -2.615 -7.144 -11.377) 13.686 5.707 ( 0.450 2.427 1.626) 2.956 5.789 ( 5.278 6.699 -0.088) 8.529 6.836 ( -31.915 -32.177 23.526) 51.063 7.480 ( -22.089 -2.144 14.221) 26.358 8.049 ( 3.598 5.721 14.194) 15.721 9.005 ( 17.240 16.421 1.703) 23.870 9.462 ( 2.774 3.277 -3.342) 5.441 9.548 ( -9.563 -13.932 0.378) 16.902 10.172 ( 6.136 6.074 6.045) 10.540 10.799 ( -0.948 -13.570 5.099) 14.527 11.522 ( -4.482 -3.792 -18.356) 19.272 12.165 ( -19.441 -3.843 12.197) 23.270 12.450 ( -3.641 -0.446 2.313) 4.336 13.213 ( 4.019 1.806 -2.509) 5.070 13.736 ( 13.142 30.284 25.713) 41.845 14.177 ( 5.608 -1.038 2.159) 6.098 15.902 ( 12.271 -4.198 5.050) 13.918 16.481 ( -1.121 -3.106 -55.256) 55.355 19.225 ( 0.905 3.174 0.209) 3.307 19.476 ( 8.159 0.359 5.549) 9.874 19.647 ( 2.625 8.234 2.746) 9.067 20.889 ( 3.994 -0.334 -11.436) 12.118 22.848 ( -32.418 -39.531 25.252) 57.021 24.137 ( 5.417 7.237 4.097) 9.925 24.208 ( 6.005 12.148 13.893) 19.408 ======================= Grid point 114 (41/361) ======================= q-point: (-0.10 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.526 ( -23.387 11.172 10.743) 28.057 0.576 ( -27.993 14.220 4.722) 31.751 1.053 ( -41.169 22.650 30.004) 55.751 3.292 ( -0.848 -1.138 1.173) 1.842 3.331 ( -7.703 -0.964 -0.596) 7.786 3.840 ( 3.340 -3.688 3.888) 6.315 4.115 ( 2.138 0.095 -4.925) 5.369 4.702 ( -1.911 -3.856 1.543) 4.571 5.009 ( 1.371 -5.114 -1.418) 5.482 5.091 ( 1.520 2.012 0.764) 2.635 5.355 ( 1.021 -1.880 -2.121) 3.013 5.742 ( 0.040 1.065 5.307) 5.413 5.828 ( 4.187 3.178 1.475) 5.460 7.083 ( -22.795 -48.307 16.902) 56.025 7.371 ( -23.771 -16.411 12.996) 31.675 8.306 ( -2.720 -19.707 12.717) 23.611 9.128 ( 25.600 26.275 -8.356) 37.624 9.459 ( 8.582 8.754 2.815) 12.578 9.563 ( -2.525 -3.456 4.931) 6.530 10.207 ( 3.388 7.274 -1.436) 8.152 10.843 ( -35.688 -27.086 -36.820) 57.991 11.108 ( -7.471 9.697 -10.198) 15.932 12.207 ( -19.885 -33.589 13.067) 41.163 12.418 ( -3.627 -1.947 -1.332) 4.326 13.226 ( 4.052 6.386 -8.667) 11.502 13.590 ( 6.723 59.914 -48.703) 77.503 14.257 ( 2.403 -0.523 0.117) 2.462 16.049 ( 5.025 -3.793 -3.383) 7.148 16.592 ( 45.047 -10.510 97.754) 108.146 19.172 ( 7.551 15.401 -5.233) 17.933 19.594 ( 1.811 -0.052 -0.010) 1.811 19.635 ( 0.604 4.902 3.810) 6.238 20.851 ( 5.970 -0.688 -7.186) 9.367 23.106 ( -41.985 -74.401 15.914) 86.899 24.163 ( 3.398 0.807 -1.956) 4.003 24.401 ( 6.671 18.018 -4.639) 19.766 ======================= Grid point 116 (42/361) ======================= q-point: ( 0.10 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.334 ( 13.238 0.000 21.961) 25.642 1.566 ( 8.408 0.000 26.402) 27.709 2.766 ( 30.024 0.000 29.188) 41.873 3.317 ( 9.062 0.000 -5.050) 10.374 3.356 ( -7.341 -0.000 8.777) 11.442 3.937 ( -5.477 -0.000 1.690) 5.732 4.096 ( 0.185 0.000 -4.293) 4.297 4.419 ( 3.920 0.000 -15.939) 16.414 4.840 ( 6.507 0.000 -6.709) 9.347 4.877 ( -17.045 -0.000 0.618) 17.057 5.699 ( 4.148 0.000 -0.547) 4.184 5.803 ( -10.315 -0.000 6.765) 12.336 6.082 ( -5.046 -0.000 25.168) 25.668 6.729 ( 0.820 0.000 11.284) 11.314 7.234 ( -5.414 -0.000 -10.555) 11.862 7.379 ( -2.841 -0.000 10.647) 11.019 9.103 ( -6.832 -0.000 14.017) 15.593 9.420 ( 3.975 0.000 -5.652) 6.910 9.815 ( 2.303 0.000 -3.357) 4.071 9.843 ( 6.954 0.000 3.701) 7.878 10.751 ( -7.426 -0.000 -6.602) 9.936 11.475 ( 32.729 0.000 -4.688) 33.063 12.208 ( 4.811 0.000 -7.330) 8.768 12.437 ( -7.276 -0.000 20.055) 21.334 12.690 ( 5.301 0.000 -10.094) 11.401 13.540 ( 3.179 0.000 9.416) 9.939 14.084 ( -6.305 -0.000 -3.356) 7.143 15.457 ( -11.477 -0.000 -16.735) 20.293 18.856 ( -24.837 -0.000 2.799) 24.995 18.976 ( 10.700 0.000 -9.854) 14.547 19.322 ( -11.460 -0.000 -4.808) 12.427 19.551 ( -26.553 -0.000 14.218) 30.120 21.304 ( 8.715 0.000 10.612) 13.732 21.681 ( 26.806 0.000 -23.253) 35.486 23.665 ( 2.117 0.000 2.540) 3.307 24.268 ( 1.347 0.000 1.680) 2.153 ======================= Grid point 117 (43/361) ======================= q-point: ( 0.20 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.790 ( 13.866 -0.886 18.433) 23.083 2.035 ( 8.700 -8.317 23.065) 26.017 3.244 ( -0.761 3.405 3.185) 4.724 3.346 ( 4.685 5.009 -3.662) 7.775 3.545 ( 17.734 -3.026 16.476) 24.395 3.861 ( 1.174 -3.323 -6.659) 7.534 3.965 ( -3.000 10.926 -7.235) 13.443 4.315 ( 3.598 -5.719 -14.180) 15.708 4.699 ( -9.165 0.929 6.294) 11.156 4.902 ( 3.519 -4.786 -2.234) 6.347 5.684 ( -1.683 1.299 -4.593) 5.061 5.753 ( -9.149 -0.068 8.721) 12.640 6.325 ( -7.268 2.291 29.299) 30.274 6.823 ( 1.658 5.682 6.827) 9.036 6.998 ( -7.220 1.343 -10.547) 12.851 7.529 ( -3.095 -9.415 12.143) 15.673 9.085 ( -12.009 3.865 6.671) 14.271 9.368 ( -5.724 -6.816 -3.647) 9.619 9.872 ( 12.005 12.930 2.552) 17.828 10.060 ( 9.207 -7.089 4.639) 12.512 10.569 ( -3.612 -0.780 -5.536) 6.656 11.878 ( 24.253 -0.584 -1.455) 24.304 12.191 ( 6.919 4.947 -6.019) 10.420 12.476 ( -1.426 8.135 5.932) 10.169 12.765 ( -0.450 -19.413 0.778) 19.434 13.725 ( 5.954 -1.081 8.543) 10.469 13.935 ( -7.662 1.311 -3.077) 8.360 15.074 ( -12.225 1.783 -15.156) 19.553 18.553 ( -13.533 3.180 -5.216) 14.847 19.011 ( 12.869 3.296 -10.041) 16.653 19.118 ( -10.483 -2.680 -3.800) 11.468 19.361 ( -21.978 -0.168 12.757) 25.413 21.494 ( 8.844 10.063 4.647) 14.180 21.790 ( 16.842 -9.400 -14.716) 24.260 23.755 ( 4.061 -3.320 1.685) 5.509 24.299 ( 0.006 0.681 2.171) 2.275 ======================= Grid point 118 (44/361) ======================= q-point: ( 0.30 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.168 ( 11.411 0.674 12.150) 16.682 2.497 ( 5.854 -10.864 18.327) 22.094 3.145 ( -5.597 5.326 0.190) 7.729 3.225 ( -4.386 6.399 -5.439) 9.475 3.645 ( -5.857 15.550 -11.094) 19.980 3.840 ( 13.453 -1.728 -5.702) 14.714 4.050 ( 13.106 -8.333 3.015) 15.821 4.238 ( -5.990 -9.394 -7.633) 13.505 4.746 ( -0.067 0.486 10.192) 10.203 4.946 ( -0.410 -5.971 -2.368) 6.437 5.505 ( -6.516 4.122 -10.510) 13.035 5.764 ( -4.033 1.648 9.310) 10.279 6.494 ( -13.873 5.490 23.023) 27.435 6.772 ( -8.295 -2.443 0.774) 8.681 6.895 ( 0.455 2.014 5.620) 5.987 7.757 ( 0.189 -11.082 13.105) 17.163 8.877 ( -13.319 7.026 -0.656) 15.072 9.316 ( -9.042 -10.856 -1.125) 14.173 9.900 ( 4.755 12.122 0.396) 13.027 10.198 ( 4.991 7.250 -1.075) 8.867 10.691 ( 11.137 -14.961 5.136) 19.345 11.904 ( 3.251 23.233 -6.070) 24.232 12.339 ( 16.121 -3.055 0.608) 16.419 12.511 ( 4.158 -1.059 2.615) 5.025 12.967 ( -1.618 -18.044 5.054) 18.808 13.737 ( -6.373 4.975 -2.691) 8.521 13.952 ( 5.690 -4.636 3.748) 8.241 14.749 ( -8.442 1.517 -8.253) 11.903 18.251 ( -8.578 0.479 -16.557) 18.653 18.930 ( -5.406 -1.490 -5.449) 7.819 19.103 ( 11.965 3.442 -4.062) 13.096 19.267 ( -14.204 -1.036 14.069) 20.019 21.486 ( 9.368 11.510 -8.884) 17.296 21.977 ( 4.858 -12.211 1.386) 13.215 23.875 ( 5.712 -3.195 1.293) 6.672 24.305 ( -1.263 2.280 2.390) 3.536 ======================= Grid point 119 (45/361) ======================= q-point: (-0.60 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.347 ( 4.829 6.360 -0.280) 7.991 2.673 ( -10.211 2.990 3.691) 11.261 3.051 ( -3.252 4.877 -2.424) 6.343 3.167 ( 4.082 -6.665 8.988) 11.911 3.320 ( -5.012 7.976 -7.549) 12.072 3.952 ( 5.984 -5.313 -9.871) 12.707 4.099 ( -5.076 -1.309 -2.426) 5.776 4.277 ( 0.667 -7.361 0.776) 7.432 4.849 ( -1.122 0.617 6.267) 6.397 4.983 ( 1.365 -8.759 -1.605) 9.008 5.206 ( -5.765 4.340 -14.297) 16.015 5.810 ( -0.563 5.017 7.796) 9.287 6.337 ( -12.229 3.628 -2.986) 13.101 6.811 ( -18.588 -5.463 20.876) 28.481 7.011 ( 0.092 0.056 15.890) 15.890 8.048 ( 3.197 -12.671 12.011) 17.749 8.595 ( -11.772 7.056 -3.960) 14.285 9.280 ( -8.816 -11.436 -0.237) 14.442 9.817 ( -2.609 3.458 -2.929) 5.229 10.144 ( 5.073 12.559 -3.857) 14.084 11.106 ( 14.408 -13.293 6.865) 20.770 11.613 ( 1.880 29.603 -4.970) 30.076 12.504 ( 3.786 0.301 1.562) 4.107 12.671 ( 5.226 -0.389 6.092) 8.036 13.145 ( -0.338 -11.852 2.670) 12.153 13.615 ( 0.327 3.070 0.080) 3.088 13.991 ( -3.016 -1.416 -7.441) 8.153 14.711 ( 5.153 -4.193 5.677) 8.739 17.881 ( -8.063 -2.822 -26.116) 27.477 18.866 ( -1.303 -1.824 1.468) 2.679 19.187 ( 9.765 2.493 -4.558) 11.061 19.329 ( -2.235 0.029 14.660) 14.829 21.373 ( 7.023 8.628 -13.157) 17.230 22.154 ( -4.307 -12.478 7.928) 15.398 24.000 ( 6.200 -1.611 1.063) 6.493 24.283 ( -1.588 4.284 2.499) 5.208 ======================= Grid point 120 (46/361) ======================= q-point: (-0.50 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.148 ( -5.665 15.712 -11.229) 20.126 2.397 ( -15.655 11.638 -2.872) 19.717 3.029 ( 0.888 1.065 4.815) 5.010 3.172 ( -4.405 -3.645 -0.907) 5.789 3.447 ( 3.388 -10.242 3.971) 11.496 3.733 ( -17.661 3.549 -7.691) 19.587 4.063 ( -1.492 -2.333 -3.840) 4.734 4.331 ( 1.432 -3.357 2.145) 4.233 4.803 ( -5.945 0.936 -4.201) 7.339 5.026 ( 2.651 -0.179 -5.443) 6.057 5.115 ( 3.690 -12.786 -1.386) 13.380 5.841 ( 1.311 7.278 5.561) 9.253 6.093 ( -8.954 1.738 -6.968) 11.478 6.773 ( -25.924 -5.153 17.813) 31.873 7.242 ( -5.960 -3.849 23.272) 24.329 8.272 ( -10.483 4.018 9.822) 14.916 8.431 ( 8.562 -12.665 -5.893) 16.384 9.264 ( -8.649 -10.778 1.331) 13.884 9.735 ( -3.204 -4.698 -3.251) 6.551 10.020 ( 3.146 14.150 -5.127) 15.376 11.322 ( 3.561 29.527 -1.718) 29.790 11.464 ( 12.007 -5.493 2.687) 13.474 12.531 ( -2.029 0.972 2.448) 3.325 12.694 ( -8.098 7.294 5.853) 12.371 13.243 ( 4.754 -4.069 -2.272) 6.658 13.730 ( 7.892 -3.605 2.097) 8.926 13.817 ( -4.971 2.725 -1.729) 5.927 15.015 ( 12.956 -9.022 8.671) 18.012 17.442 ( -6.954 -5.032 -33.422) 34.506 18.960 ( 2.540 -3.331 7.574) 8.655 19.244 ( 8.835 3.261 -2.906) 9.856 19.517 ( 5.320 1.658 12.020) 13.249 21.217 ( 4.368 5.629 -14.967) 16.577 22.270 ( -13.419 -14.324 11.668) 22.834 24.105 ( 5.613 0.549 1.575) 5.855 24.250 ( -0.435 5.977 2.694) 6.571 ======================= Grid point 121 (47/361) ======================= q-point: (-0.40 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.721 ( -10.668 19.694 -10.396) 24.693 1.981 ( -18.437 15.659 -4.392) 24.584 3.015 ( -25.334 10.306 -3.423) 27.564 3.138 ( 3.455 1.621 1.919) 4.272 3.287 ( -5.902 -2.496 0.166) 6.410 3.578 ( -5.220 -11.112 -5.557) 13.476 4.089 ( -1.829 -4.628 6.821) 8.443 4.415 ( 4.186 -3.083 -1.451) 5.398 4.683 ( -2.950 -3.492 -3.462) 5.734 5.038 ( 1.472 -1.422 -0.352) 2.077 5.261 ( 2.773 -13.797 -4.270) 14.706 5.834 ( -1.738 5.969 0.961) 6.291 5.918 ( -0.028 3.617 -3.365) 4.940 6.611 ( -34.522 -8.191 18.028) 39.798 7.427 ( -12.213 -4.538 20.142) 23.989 8.144 ( -3.895 6.206 2.102) 7.623 8.702 ( 9.246 -17.875 -2.017) 20.226 9.262 ( -8.402 -10.524 2.713) 13.737 9.722 ( -0.362 -2.024 -2.826) 3.495 9.914 ( 2.210 4.565 0.440) 5.090 11.096 ( 4.007 30.458 1.324) 30.749 11.627 ( 6.400 -1.049 -4.293) 7.778 12.499 ( -7.634 2.216 4.501) 9.135 12.512 ( -9.853 9.398 2.739) 13.889 13.272 ( 4.962 0.768 -8.097) 9.527 13.731 ( -1.585 -2.350 6.749) 7.320 14.011 ( 11.840 2.306 9.426) 15.308 15.404 ( 14.360 -10.901 6.614) 19.204 16.959 ( -5.361 -5.587 -39.397) 40.150 19.147 ( 4.618 -2.040 8.305) 9.719 19.328 ( 10.571 3.475 -0.016) 11.128 19.713 ( 7.170 4.953 8.964) 12.502 21.037 ( 2.213 2.876 -15.226) 15.653 22.311 ( -23.342 -18.296 13.708) 32.673 24.187 ( 4.905 1.105 -1.193) 5.167 24.248 ( 2.060 7.749 8.110) 11.404 ======================= Grid point 122 (48/361) ======================= q-point: (-0.30 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.264 ( -12.963 21.803 -4.327) 25.732 1.470 ( -22.405 17.359 -6.543) 29.089 2.312 ( -30.373 31.759 -0.956) 43.955 3.216 ( 0.823 -2.141 2.356) 3.289 3.331 ( -6.955 -7.772 3.318) 10.945 3.564 ( 0.244 -10.441 -1.824) 10.602 4.148 ( -0.192 -0.173 -0.645) 0.695 4.486 ( -0.665 -9.406 0.859) 9.468 4.731 ( 3.041 -6.585 2.685) 7.735 5.074 ( 0.698 -1.608 1.380) 2.231 5.307 ( -1.239 -10.798 -8.727) 13.939 5.762 ( -0.983 3.278 1.375) 3.688 5.907 ( 3.944 5.461 -0.034) 6.737 6.403 ( -42.068 -15.373 21.540) 49.699 7.441 ( -18.038 -1.803 13.533) 22.622 8.129 ( 3.851 2.898 1.699) 5.110 8.937 ( 7.645 -16.989 -5.566) 19.443 9.290 ( -6.325 -11.375 2.933) 13.341 9.669 ( 2.957 7.446 -1.404) 8.133 10.051 ( 0.864 -11.823 8.363) 14.507 10.906 ( 1.916 25.682 2.007) 25.832 11.556 ( -0.766 5.807 -9.478) 11.142 12.281 ( -13.125 11.095 5.727) 18.116 12.456 ( -3.515 0.265 0.844) 3.625 13.228 ( 3.372 0.789 -5.113) 6.176 13.912 ( 5.241 -6.227 7.707) 11.209 14.278 ( 14.840 9.264 12.390) 21.438 15.762 ( 13.230 -11.141 1.958) 17.407 16.434 ( -6.180 -1.504 -35.525) 36.090 19.294 ( 10.362 4.030 0.340) 11.124 19.492 ( 8.081 1.264 6.429) 10.403 19.817 ( 4.794 9.707 3.922) 11.515 20.883 ( 2.843 -0.140 -12.534) 12.853 22.265 ( -35.057 -25.025 14.928) 45.586 24.193 ( 3.413 2.475 -2.725) 5.020 24.383 ( 5.820 5.439 12.278) 14.636 ======================= Grid point 123 (49/361) ======================= q-point: (-0.20 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.858 ( -15.476 21.758 2.991) 26.868 0.930 ( -16.028 22.675 3.914) 28.043 1.672 ( -23.637 39.377 16.873) 48.928 3.239 ( -4.794 -5.159 0.439) 7.057 3.310 ( -1.765 -0.522 0.941) 2.067 3.710 ( 1.612 -10.247 4.315) 11.235 4.111 ( 2.555 -0.511 -6.489) 6.992 4.574 ( -2.832 -9.488 2.232) 10.150 4.885 ( 3.031 -7.938 0.468) 8.510 5.110 ( -0.056 -0.171 -0.091) 0.201 5.285 ( 2.121 -5.866 -0.280) 6.244 5.776 ( -0.105 2.220 5.058) 5.524 5.903 ( -1.033 2.643 1.614) 3.264 6.226 ( -51.966 -26.283 29.262) 65.173 7.322 ( -16.442 0.659 9.367) 18.934 8.202 ( 3.678 -1.014 -0.045) 3.816 9.100 ( 8.580 -13.330 -10.416) 18.968 9.346 ( -3.395 -11.892 -0.629) 12.383 9.720 ( 10.323 1.900 4.587) 11.454 10.202 ( -10.229 -12.871 -0.150) 16.441 10.675 ( -5.716 21.024 -5.931) 22.580 11.346 ( -0.251 14.717 -0.973) 14.751 12.099 ( -10.688 8.598 8.853) 16.326 12.415 ( -1.906 -0.011 -1.243) 2.275 13.242 ( 3.072 -0.082 -0.589) 3.129 14.041 ( 4.579 -4.243 -16.002) 17.177 14.406 ( 10.805 14.543 -21.178) 27.870 15.937 ( 6.301 -8.362 -10.706) 14.975 16.399 ( 12.887 -8.439 47.837) 50.256 19.414 ( 18.930 7.863 -5.133) 21.131 19.624 ( 4.492 3.346 0.461) 5.620 19.781 ( -0.137 10.735 3.219) 11.208 20.828 ( 5.580 -1.671 -8.243) 10.094 22.114 ( -51.271 -33.477 16.773) 63.488 24.189 ( 2.922 1.981 -1.869) 3.995 24.537 ( 2.315 1.745 0.824) 3.014 ======================= Grid point 124 (50/361) ======================= q-point: (-0.10 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.750 ( -1.255 20.338 17.245) 26.695 0.810 ( 12.163 15.930 24.223) 31.440 1.432 ( -7.717 30.110 39.939) 50.609 3.222 ( -0.736 -3.835 -1.845) 4.319 3.332 ( -0.679 0.207 4.323) 4.381 3.857 ( -1.952 -7.338 6.195) 9.800 4.096 ( 4.749 -1.746 -6.292) 8.074 4.600 ( -1.858 -5.951 -4.270) 7.557 4.932 ( 0.892 -4.174 -7.036) 8.230 5.136 ( 9.344 -2.406 -3.117) 10.140 5.489 ( 3.990 -2.490 9.038) 10.189 5.814 ( -8.249 -0.256 10.752) 13.554 5.882 ( -4.793 -1.289 5.852) 7.673 6.165 ( -48.776 -36.528 39.244) 72.481 7.233 ( -8.455 1.005 7.548) 11.379 8.108 ( -10.475 8.599 -11.174) 17.565 9.084 ( 5.808 2.482 -18.654) 19.694 9.432 ( 0.008 -12.183 1.759) 12.309 9.754 ( -21.030 21.059 -5.650) 30.293 10.046 ( 7.556 -15.266 -0.536) 17.042 10.382 ( 10.123 14.239 -1.860) 17.569 11.317 ( 9.545 20.062 2.922) 22.408 12.076 ( -8.375 -1.841 15.803) 17.980 12.363 ( -0.646 0.180 -4.408) 4.459 13.224 ( 5.230 17.543 -19.186) 26.518 13.433 ( -6.543 21.011 -16.142) 27.292 14.248 ( -1.389 -0.521 -2.023) 2.509 15.948 ( -0.960 -6.995 -9.857) 12.125 17.944 ( 27.527 -63.569 53.071) 87.266 19.509 ( -5.452 -1.592 -7.849) 9.688 19.594 ( 18.528 8.018 -8.346) 21.846 19.784 ( 9.132 8.582 2.879) 12.858 20.847 ( 2.396 -3.822 -2.147) 4.996 21.774 ( -56.690 -21.516 16.298) 62.787 24.175 ( -14.676 23.566 -18.761) 33.507 24.200 ( 1.756 2.572 -1.670) 3.534 ======================= Grid point 127 (51/361) ======================= q-point: ( 0.20 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.199 ( 12.192 0.000 15.979) 20.099 2.366 ( 6.939 0.000 18.466) 19.727 3.197 ( -5.883 -0.000 -1.462) 6.062 3.297 ( -6.964 -0.000 -4.799) 8.457 3.793 ( 4.457 0.000 -12.165) 12.955 3.909 ( -0.685 -0.000 -2.549) 2.640 3.949 ( 17.361 0.000 5.402) 18.182 4.075 ( -4.483 -0.000 -15.693) 16.320 4.756 ( 1.932 0.000 10.320) 10.499 4.885 ( -3.061 -0.000 -0.128) 3.063 5.540 ( -6.118 -0.000 -11.233) 12.791 5.781 ( -3.246 -0.000 10.315) 10.814 6.559 ( -15.644 -0.000 33.110) 36.619 6.744 ( -8.727 -0.000 -12.205) 15.004 6.914 ( 0.375 0.000 4.751) 4.766 7.639 ( -2.128 -0.000 17.089) 17.221 8.948 ( -16.928 -0.000 2.096) 17.057 9.208 ( -4.545 -0.000 -3.608) 5.802 10.004 ( -4.610 -0.000 -2.510) 5.249 10.364 ( 22.553 0.000 9.389) 24.429 10.469 ( 2.196 0.000 -3.629) 4.242 12.245 ( 22.181 0.000 2.645) 22.338 12.249 ( 10.033 0.000 -9.763) 13.999 12.555 ( 2.097 0.000 -4.970) 5.394 12.681 ( -7.229 -0.000 17.304) 18.753 13.792 ( -7.631 -0.000 -2.468) 8.020 13.901 ( 7.364 0.000 3.482) 8.146 14.762 ( -9.771 -0.000 -9.055) 13.322 18.257 ( -9.682 -0.000 -18.187) 20.603 18.909 ( -7.205 -0.000 -2.819) 7.737 19.135 ( 13.760 0.000 -7.660) 15.748 19.265 ( -14.056 -0.000 14.690) 20.332 21.703 ( 14.574 0.000 -22.582) 26.877 21.756 ( -0.313 -0.000 13.921) 13.925 23.844 ( 6.360 0.000 2.212) 6.734 24.326 ( -1.061 -0.000 2.831) 3.024 ======================= Grid point 128 (52/361) ======================= q-point: ( 0.30 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.461 ( 6.514 5.893 6.854) 11.141 2.634 ( -0.398 -5.301 7.405) 9.115 3.110 ( -4.361 0.962 0.106) 4.467 3.117 ( -6.012 0.606 0.679) 6.081 3.523 ( -8.834 11.133 -11.335) 18.179 3.841 ( -4.046 -6.640 -12.337) 14.583 4.021 ( 6.928 -4.596 -0.715) 8.345 4.203 ( 9.544 -1.278 2.485) 9.945 4.805 ( -6.505 -3.207 -1.874) 7.491 4.919 ( 2.603 0.040 7.381) 7.826 5.247 ( -8.365 0.732 -17.229) 19.166 5.881 ( 1.001 2.142 8.629) 8.947 6.434 ( -11.343 5.848 -6.997) 14.554 6.691 ( -23.154 -6.347 25.999) 35.388 7.017 ( 0.476 0.255 12.081) 12.093 7.854 ( 0.423 -6.355 14.651) 15.975 8.686 ( -15.359 2.517 -3.421) 15.935 9.141 ( -4.525 -3.707 -0.174) 5.852 9.817 ( -10.181 -0.819 -7.281) 12.543 10.422 ( 6.348 13.085 -2.173) 14.705 10.876 ( 19.828 -10.610 9.009) 24.226 12.140 ( 8.285 24.412 -6.604) 26.612 12.513 ( 3.927 1.611 3.007) 5.202 12.635 ( 10.806 -5.545 3.917) 12.761 12.863 ( -4.065 -14.381 10.644) 18.348 13.677 ( -2.441 2.444 -0.314) 3.468 13.955 ( 0.850 -1.643 -8.262) 8.466 14.655 ( 1.283 -1.686 2.970) 3.648 17.846 ( -10.015 -0.974 -25.823) 27.715 18.834 ( -3.064 -1.189 2.428) 4.086 19.235 ( 13.040 2.225 -6.623) 14.794 19.324 ( -2.051 -0.722 13.638) 13.810 21.553 ( 7.799 9.209 -17.478) 21.240 21.931 ( -5.098 -10.210 9.727) 14.995 23.975 ( 7.086 -0.821 2.168) 7.456 24.338 ( -1.506 1.570 3.311) 3.961 ======================= Grid point 129 (53/361) ======================= q-point: (-0.60 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.404 ( -2.159 11.491 -7.695) 13.998 2.541 ( -12.310 4.170 -2.956) 13.329 3.067 ( -1.707 0.891 5.617) 5.938 3.154 ( -10.302 1.534 -0.940) 10.458 3.277 ( 2.125 -5.443 0.768) 5.894 3.699 ( -8.443 -6.895 -5.647) 12.276 4.111 ( 0.477 5.012 -0.599) 5.070 4.291 ( 3.226 1.207 1.588) 3.793 4.754 ( -2.552 -7.695 -6.166) 10.185 4.929 ( -7.082 -5.638 -8.859) 12.666 5.014 ( 2.029 -0.594 -2.017) 2.922 5.959 ( 2.323 4.769 5.280) 7.484 6.147 ( -9.864 4.543 -6.249) 12.529 6.658 ( -29.756 -7.019 20.789) 36.972 7.198 ( -3.090 -1.239 18.414) 18.712 8.112 ( 2.428 -11.107 10.565) 15.520 8.410 ( -10.881 2.329 -5.862) 12.577 9.127 ( -4.653 -4.484 1.891) 6.733 9.609 ( -9.398 -5.916 -7.115) 13.189 10.320 ( 3.409 14.398 -4.769) 15.546 11.316 ( 16.453 -6.543 6.169) 18.750 11.940 ( 7.435 32.162 -1.232) 33.033 12.542 ( -2.742 0.731 3.393) 4.423 12.798 ( -2.068 3.573 5.608) 6.964 13.058 ( 0.750 -15.761 3.763) 16.221 13.715 ( 6.418 1.771 -2.015) 6.956 13.822 ( -1.268 -1.769 -3.493) 4.115 14.861 ( 11.022 -6.854 6.223) 14.394 17.373 ( -10.148 -2.491 -29.770) 31.550 18.911 ( 2.816 -1.895 7.951) 8.645 19.314 ( 12.039 3.889 -4.971) 13.593 19.525 ( 6.300 -0.774 11.712) 13.322 21.346 ( 3.756 7.829 -16.883) 18.985 22.023 ( -12.681 -11.890 9.540) 19.829 24.103 ( 6.394 -0.344 1.771) 6.644 24.339 ( -0.834 3.420 3.748) 5.142 ======================= Grid point 130 (54/361) ======================= q-point: (-0.50 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.072 ( -7.644 17.705 -10.049) 21.746 2.218 ( -15.781 10.516 -5.393) 19.716 3.020 ( -9.014 -3.837 3.108) 10.278 3.111 ( -3.940 -2.050 4.899) 6.613 3.342 ( -4.234 -12.215 -5.364) 13.997 3.524 ( -7.566 15.175 -2.986) 17.218 4.015 ( -3.768 -0.198 5.770) 6.894 4.374 ( 3.079 -1.557 -0.507) 3.487 4.620 ( -3.762 -3.663 -8.704) 10.165 4.951 ( 1.611 -13.467 -4.442) 14.272 5.032 ( -0.528 -5.098 -0.537) 5.153 5.929 ( -6.671 3.997 -2.946) 8.316 5.992 ( 2.459 4.958 1.773) 5.812 6.478 ( -35.807 -6.899 17.460) 40.430 7.367 ( -7.114 -1.920 17.473) 18.963 8.208 ( -6.167 1.025 -2.779) 6.842 8.377 ( 4.461 -15.168 3.380) 16.168 9.124 ( -4.907 -4.683 1.941) 7.055 9.504 ( -7.298 -12.417 -4.074) 14.968 10.174 ( 3.246 14.282 -3.650) 15.095 11.586 ( 10.399 3.254 1.612) 11.014 11.747 ( 7.183 31.424 1.272) 32.259 12.507 ( -6.189 0.170 2.442) 6.655 12.687 ( -10.946 8.006 3.980) 14.133 13.235 ( 5.655 -6.873 -3.026) 9.401 13.622 ( -3.756 -6.289 -3.832) 8.267 14.056 ( 14.355 1.666 11.642) 18.557 15.190 ( 13.620 -11.500 3.370) 18.141 16.884 ( -9.339 -2.635 -30.732) 32.227 19.124 ( 8.828 -0.666 9.896) 13.278 19.395 ( 11.289 3.632 -3.084) 12.253 19.779 ( 9.782 2.122 10.672) 14.631 21.112 ( 0.791 5.174 -16.723) 17.523 22.013 ( -21.497 -14.144 9.212) 27.332 24.201 ( 4.838 0.463 0.557) 4.892 24.356 ( 1.149 4.240 5.360) 6.930 ======================= Grid point 131 (55/361) ======================= q-point: (-0.40 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.665 ( -9.836 21.092 -5.760) 23.975 1.776 ( -17.671 16.504 -5.898) 24.888 2.837 ( -18.701 20.255 3.235) 27.757 3.108 ( -8.399 -10.102 2.697) 13.411 3.305 ( 2.460 2.919 0.274) 3.827 3.353 ( -0.597 -5.583 -2.318) 6.074 4.120 ( -0.414 -3.368 5.923) 6.826 4.338 ( -3.359 -5.631 -5.357) 8.467 4.614 ( 1.597 -6.109 1.179) 6.423 5.010 ( 0.806 -6.497 -1.632) 6.747 5.089 ( -0.507 -11.530 -3.917) 12.188 5.817 ( -3.168 2.571 1.052) 4.213 5.975 ( -5.673 2.037 2.900) 6.689 6.227 ( -31.260 -5.243 14.262) 34.758 7.425 ( -11.867 0.182 12.507) 17.242 8.142 ( 1.599 -1.762 -3.541) 4.266 8.605 ( 2.350 -16.560 2.179) 16.867 9.128 ( -3.216 -6.259 0.574) 7.060 9.499 ( -7.997 -16.446 -2.232) 18.423 10.106 ( 5.622 9.987 1.365) 11.541 11.501 ( 4.918 35.510 2.899) 35.966 11.681 ( 4.316 7.516 -3.732) 9.437 12.438 ( -7.313 -0.056 2.109) 7.611 12.495 ( -9.118 9.094 3.155) 13.258 13.247 ( 3.699 0.897 -6.183) 7.261 13.714 ( 1.214 -13.902 2.427) 14.165 14.394 ( 14.551 3.608 11.821) 19.092 15.517 ( 12.747 -14.608 -1.655) 19.458 16.426 ( -7.913 0.340 -22.965) 24.292 19.362 ( 15.570 3.295 -0.461) 15.921 19.519 ( 7.701 1.595 6.229) 10.032 19.986 ( 8.329 8.284 7.428) 13.899 20.890 ( 0.720 1.125 -14.770) 14.830 21.889 ( -30.508 -16.853 8.879) 35.966 24.236 ( 2.882 2.140 -1.381) 3.846 24.442 ( 3.288 1.694 7.098) 8.004 ======================= Grid point 132 (56/361) ======================= q-point: (-0.30 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.269 ( -11.733 22.603 1.890) 25.537 1.363 ( -7.561 23.850 2.276) 25.123 2.374 ( -14.678 34.842 7.414) 38.528 3.104 ( -7.011 -9.402 0.853) 11.759 3.336 ( 3.167 4.365 1.517) 5.602 3.478 ( -0.145 -14.590 5.054) 15.441 4.099 ( 0.399 -0.693 -8.088) 8.128 4.381 ( -2.592 -10.881 3.692) 11.779 4.734 ( 1.567 -8.171 1.461) 8.447 5.082 ( 0.395 -2.820 1.279) 3.121 5.135 ( 2.052 -10.651 -0.332) 10.852 5.783 ( -19.114 -4.335 11.714) 22.833 5.844 ( -15.253 -1.906 8.418) 17.525 6.090 ( -6.228 2.766 4.055) 7.929 7.352 ( -12.542 2.603 8.353) 15.293 8.169 ( 3.894 -3.430 -4.246) 6.705 8.811 ( 2.176 -16.355 1.877) 16.606 9.156 ( -0.482 -8.149 -3.682) 8.956 9.518 ( -6.774 -17.527 -0.442) 18.795 10.147 ( 2.646 3.965 1.673) 5.052 11.226 ( 1.208 35.119 -2.793) 35.251 11.604 ( 2.393 13.020 2.320) 13.440 12.303 ( -8.164 11.137 5.968) 15.043 12.407 ( -2.659 -0.648 -0.848) 2.865 13.246 ( 3.454 0.658 -0.657) 3.577 13.862 ( 1.656 -13.283 -5.400) 14.434 14.577 ( 7.617 5.240 -10.362) 13.887 15.732 ( 8.382 -13.746 -11.282) 19.660 16.300 ( 2.651 -2.717 21.243) 21.579 19.491 ( 13.908 1.977 -8.301) 16.317 19.699 ( 8.474 4.172 4.487) 10.457 20.005 ( 0.135 13.184 2.959) 13.513 20.794 ( 5.405 -2.010 -9.141) 10.808 21.682 ( -34.918 -17.278 10.385) 40.319 24.231 ( 2.233 2.501 -1.469) 3.660 24.539 ( 0.382 -0.853 1.769) 2.000 ======================= Grid point 133 (57/361) ======================= q-point: (-0.20 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.149 ( 8.597 20.380 17.185) 28.010 1.176 ( 2.051 24.588 9.655) 26.496 2.057 ( -5.606 34.885 21.399) 41.307 3.119 ( -1.190 -7.303 -0.928) 7.457 3.353 ( -0.797 2.588 3.665) 4.557 3.671 ( -1.727 -12.448 7.370) 14.569 4.036 ( 3.048 -4.749 -9.707) 11.228 4.472 ( -0.195 -7.204 -0.064) 7.207 4.805 ( -0.951 -8.723 -3.749) 9.542 5.107 ( 3.470 -0.943 -0.685) 3.661 5.388 ( 6.730 -10.002 10.869) 16.232 5.634 ( -32.752 -9.759 24.212) 41.883 5.863 ( -1.232 1.359 8.443) 8.641 6.036 ( -3.190 3.889 2.282) 5.524 7.264 ( -8.204 2.514 6.583) 10.815 8.154 ( -1.849 -1.323 -6.883) 7.248 8.996 ( 6.248 -10.197 -4.815) 12.892 9.165 ( -2.383 -13.288 -3.689) 13.995 9.672 ( 1.469 -19.992 3.040) 20.275 10.051 ( -5.640 10.643 -3.159) 12.452 10.856 ( -0.010 32.423 -5.389) 32.868 11.618 ( 5.896 13.206 8.773) 16.915 12.191 ( -5.195 11.068 8.362) 14.812 12.362 ( -0.710 -0.402 -3.704) 3.793 13.307 ( 3.908 1.550 2.770) 5.034 13.749 ( -1.872 3.337 -26.395) 26.671 14.308 ( -3.144 7.889 -12.036) 14.731 15.777 ( 1.054 -11.322 -11.465) 16.148 17.098 ( 14.709 -31.091 50.389) 61.009 19.481 ( -1.013 -1.217 -11.552) 11.660 19.727 ( 4.148 6.231 -5.211) 9.120 19.927 ( -1.192 7.981 2.339) 8.402 20.803 ( 3.866 -0.959 -3.165) 5.087 21.531 ( -17.459 -9.095 10.188) 22.166 24.227 ( 1.927 1.863 -0.740) 2.780 24.419 ( -8.601 5.753 -10.071) 14.440 ======================= Grid point 134 (58/361) ======================= q-point: (-0.10 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.197 ( 9.764 19.994 13.222) 25.883 1.417 ( 13.145 15.193 20.264) 28.535 2.210 ( 14.577 20.408 35.047) 43.096 3.178 ( 4.438 -5.653 -3.186) 7.861 3.353 ( -5.963 0.294 6.693) 8.969 3.827 ( -2.882 -9.208 7.165) 12.018 4.021 ( 2.532 -6.572 -8.900) 11.350 4.499 ( 2.635 -2.322 -5.809) 6.788 4.778 ( -2.933 -6.855 -6.262) 9.737 5.131 ( -3.191 0.603 -0.476) 3.282 5.593 ( 4.643 -0.516 5.714) 7.381 5.759 ( -9.695 -11.592 19.713) 24.839 5.930 ( -4.632 2.996 4.455) 7.091 6.111 ( 1.550 -10.058 20.096) 22.526 7.230 ( -4.462 0.290 3.671) 5.785 7.934 ( -7.061 10.057 -10.328) 16.052 9.031 ( 6.572 -1.842 -7.559) 10.185 9.320 ( 0.963 -19.423 1.976) 19.547 9.736 ( -7.856 15.728 5.748) 18.497 9.981 ( 3.362 -11.093 -1.452) 11.682 10.591 ( 5.141 16.080 -3.306) 17.203 11.667 ( 9.255 16.310 0.935) 18.776 12.155 ( -5.486 3.038 8.146) 10.280 12.314 ( 2.493 0.936 -3.862) 4.691 13.235 ( 4.400 21.072 -19.402) 28.980 13.438 ( -0.649 2.154 7.231) 7.573 14.162 ( -4.947 -1.468 -2.999) 5.968 15.670 ( -5.830 -8.454 -15.117) 18.275 18.129 ( 2.379 -39.932 33.411) 52.121 19.225 ( -11.930 -1.228 -12.409) 17.257 19.616 ( -4.743 5.794 -4.589) 8.782 19.792 ( -17.741 1.038 4.334) 18.292 20.920 ( 14.361 -1.945 0.455) 14.500 21.606 ( 11.593 -0.151 -1.006) 11.637 24.031 ( -8.498 16.266 -8.921) 20.406 24.238 ( 1.628 0.762 0.240) 1.814 ======================= Grid point 138 (59/361) ======================= q-point: ( 0.30 -0.70 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.538 ( -5.475 -0.000 -1.618) 5.710 2.556 ( -5.383 -0.000 -6.912) 8.761 3.075 ( -1.480 -0.000 5.080) 5.291 3.125 ( -5.080 -0.000 5.196) 7.267 3.297 ( -12.992 -0.000 -8.349) 15.443 3.598 ( -2.865 -0.000 -4.327) 5.190 4.143 ( 7.203 0.000 1.887) 7.446 4.361 ( 6.549 0.000 3.419) 7.387 4.632 ( -7.512 -0.000 -4.457) 8.734 4.881 ( -10.243 -0.000 -17.175) 19.998 5.012 ( 1.281 0.000 0.141) 1.289 6.000 ( 2.550 0.000 3.756) 4.540 6.215 ( -9.253 -0.000 -6.789) 11.477 6.571 ( -31.544 -0.000 23.494) 39.332 7.188 ( -2.252 -0.000 16.850) 17.000 8.006 ( 2.008 0.000 11.784) 11.954 8.430 ( -12.451 -0.000 -6.304) 13.956 9.088 ( -3.389 -0.000 2.400) 4.152 9.553 ( -10.653 -0.000 -8.423) 13.581 10.466 ( 0.462 0.000 -5.745) 5.764 11.245 ( 19.833 0.000 8.580) 21.610 12.336 ( 11.071 0.000 -7.207) 13.210 12.603 ( -0.551 -0.000 4.845) 4.876 12.725 ( 1.441 0.000 8.045) 8.173 12.868 ( -6.467 -0.000 8.120) 10.380 13.763 ( 9.511 0.000 5.922) 11.204 13.776 ( -3.890 -0.000 -13.431) 13.983 14.794 ( 10.020 0.000 5.166) 11.274 17.351 ( -11.100 -0.000 -28.430) 30.520 18.893 ( 3.371 0.000 8.036) 8.714 19.358 ( 13.683 0.000 -7.384) 15.548 19.509 ( 5.712 0.000 13.248) 14.427 21.442 ( 4.478 0.000 -20.937) 21.411 21.892 ( -13.379 -0.000 12.179) 18.092 24.099 ( 6.575 0.000 2.126) 6.910 24.371 ( -0.902 -0.000 3.833) 3.938 ======================= Grid point 140 (60/361) ======================= q-point: (-0.60 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.319 ( -7.105 7.639 -9.264) 13.952 2.364 ( -10.778 4.939 -3.378) 12.327 2.978 ( -10.742 1.533 -1.934) 11.022 3.095 ( -12.174 -4.816 2.438) 13.317 3.130 ( -1.659 -5.650 -1.668) 6.120 3.648 ( 3.655 0.177 5.855) 6.905 4.165 ( -4.701 11.230 1.932) 12.327 4.385 ( 2.349 5.343 -0.387) 5.850 4.557 ( -3.713 -2.474 -11.563) 12.394 4.642 ( -1.260 -17.784 -4.456) 18.377 4.997 ( -1.853 -0.667 -1.715) 2.611 5.973 ( -4.651 1.075 -5.103) 6.987 6.094 ( -1.025 4.826 3.483) 6.039 6.359 ( -35.752 -5.164 17.804) 40.272 7.350 ( -4.008 -0.298 16.035) 16.531 8.187 ( 2.962 -4.862 5.568) 7.964 8.204 ( -7.857 -1.033 -4.088) 8.917 9.080 ( -3.305 -0.664 2.827) 4.400 9.340 ( -8.775 -4.931 -6.226) 11.835 10.360 ( -0.221 5.422 -5.755) 7.910 11.587 ( 14.459 -0.374 5.241) 15.384 12.295 ( 6.757 18.805 -3.068) 20.216 12.563 ( -4.254 11.109 5.396) 13.063 12.790 ( -10.042 2.955 3.582) 11.064 12.974 ( 2.533 -20.377 4.901) 21.111 13.560 ( -4.100 -0.975 -11.366) 12.122 14.071 ( 15.983 0.270 11.503) 19.694 15.028 ( 12.967 -5.092 1.271) 13.989 16.855 ( -10.742 -0.665 -26.493) 28.595 19.117 ( 10.887 -0.137 10.672) 15.245 19.448 ( 11.454 1.763 -5.613) 12.877 19.796 ( 11.580 0.184 12.411) 16.975 21.204 ( 0.387 3.753 -19.731) 20.088 21.813 ( -20.731 -6.594 9.199) 23.619 24.206 ( 4.862 0.089 1.582) 5.114 24.407 ( 0.419 1.388 3.914) 4.174 ======================= Grid point 141 (61/361) ======================= q-point: (-0.50 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.000 ( -9.786 14.708 -5.450) 18.488 2.072 ( -10.217 14.671 -3.656) 18.248 2.891 ( -8.677 -8.543 3.690) 12.724 3.021 ( -9.996 -2.028 5.310) 11.499 3.092 ( -4.306 -9.387 -6.120) 12.005 3.671 ( 3.232 19.396 0.885) 19.684 4.063 ( -1.963 0.452 7.462) 7.729 4.284 ( -4.699 -1.199 -10.392) 11.467 4.515 ( 1.038 -4.397 1.118) 4.655 4.773 ( 0.481 -16.286 -3.003) 16.568 4.970 ( -1.035 -3.542 -0.586) 3.736 5.856 ( -4.881 1.691 0.231) 5.171 5.993 ( -25.168 0.242 9.940) 27.061 6.169 ( -9.876 -1.865 4.964) 11.210 7.444 ( -6.710 1.583 11.949) 13.795 8.080 ( -0.707 -3.783 -6.587) 7.629 8.369 ( 0.468 -9.047 6.832) 11.346 9.064 ( -2.745 -0.973 0.931) 3.058 9.246 ( -7.013 -10.333 -2.977) 12.838 10.259 ( 1.663 5.960 -2.851) 6.813 11.776 ( 7.970 4.492 2.248) 9.421 12.149 ( 6.009 28.621 -0.554) 29.250 12.441 ( -7.247 4.984 1.904) 9.000 12.640 ( -10.394 5.747 4.059) 12.552 13.209 ( 5.470 -9.076 -1.989) 10.782 13.453 ( -2.839 -10.986 -3.338) 11.827 14.433 ( 13.883 1.163 11.139) 17.837 15.273 ( 12.412 -10.682 -3.544) 16.755 16.436 ( -8.260 0.581 -17.733) 19.571 19.410 ( 18.100 1.814 -0.994) 18.218 19.546 ( 7.214 1.149 5.180) 8.955 20.106 ( 12.495 4.526 11.164) 17.356 20.927 ( -1.553 2.591 -18.000) 18.251 21.638 ( -27.576 -10.393 6.836) 30.252 24.267 ( 2.705 1.177 0.313) 2.967 24.460 ( 1.635 0.511 3.823) 4.189 ======================= Grid point 142 (62/361) ======================= q-point: (-0.40 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.671 ( -8.448 20.879 2.599) 22.673 1.778 ( -4.135 20.811 1.206) 21.253 2.840 ( -9.026 13.545 -0.487) 16.285 2.907 ( -6.842 -11.229 2.113) 13.318 3.193 ( -1.294 -15.568 6.804) 17.039 3.541 ( 4.120 18.934 1.286) 19.420 4.081 ( -4.016 -1.577 -11.261) 12.059 4.207 ( 0.270 -7.055 6.924) 9.889 4.599 ( -0.021 -6.220 1.978) 6.527 4.891 ( 1.460 -15.370 -0.890) 15.465 5.022 ( 0.632 -3.666 2.774) 4.640 5.702 ( -29.784 -2.892 13.692) 32.908 5.843 ( -3.637 -0.188 3.943) 5.367 6.143 ( 0.131 2.205 -0.073) 2.210 7.417 ( -8.965 4.312 7.541) 12.483 8.075 ( 3.471 -6.095 -6.506) 9.567 8.541 ( -1.688 -12.646 6.925) 14.517 9.059 ( 0.154 -2.630 -2.033) 3.327 9.230 ( -5.846 -12.587 -0.813) 13.902 10.230 ( 2.529 4.138 -0.347) 4.862 11.798 ( 2.615 11.708 -0.262) 12.000 11.908 ( 2.954 34.146 0.473) 34.276 12.355 ( -4.503 -1.988 0.236) 4.928 12.506 ( -7.101 8.171 5.361) 12.080 13.264 ( 4.049 0.965 -0.846) 4.248 13.570 ( 0.143 -18.587 -2.953) 18.821 14.637 ( 5.366 1.959 -2.654) 6.299 15.469 ( 9.065 -13.797 -9.193) 18.896 16.279 ( 0.102 -0.112 8.314) 8.316 19.514 ( 11.945 0.798 -11.314) 16.472 19.764 ( 9.270 2.753 6.285) 11.533 20.243 ( 1.519 12.213 3.011) 12.670 20.759 ( 5.449 -1.634 -9.284) 10.888 21.420 ( -27.062 -11.897 8.414) 30.735 24.276 ( 1.436 2.212 -0.735) 2.737 24.517 ( 0.037 -1.352 1.201) 1.809 ======================= Grid point 143 (63/361) ======================= q-point: (-0.30 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.527 ( 4.684 20.395 11.340) 23.801 1.624 ( 3.196 23.809 8.080) 25.345 2.603 ( -3.429 21.473 6.515) 22.700 2.962 ( -1.324 -9.386 1.024) 9.534 3.418 ( -0.806 -12.799 7.966) 15.097 3.470 ( -1.079 10.332 5.700) 11.849 3.930 ( -0.604 -6.403 -12.540) 14.093 4.359 ( 3.535 -4.738 3.814) 7.035 4.647 ( -2.512 -7.934 -1.822) 8.519 5.072 ( 3.242 -6.645 0.801) 7.437 5.147 ( 0.816 -11.517 11.402) 16.227 5.542 ( -18.777 -2.304 15.317) 24.341 5.877 ( -1.391 -0.096 6.872) 7.012 6.109 ( -0.742 3.515 -0.825) 3.686 7.327 ( -7.961 4.311 5.288) 10.484 8.088 ( 1.845 -5.126 -7.522) 9.287 8.729 ( -2.308 -16.421 6.856) 17.943 9.028 ( 0.621 -2.912 -7.797) 8.346 9.345 ( 2.381 -15.076 3.540) 15.668 10.204 ( -0.773 6.395 0.149) 6.443 11.495 ( -0.359 35.758 -5.981) 36.256 11.828 ( 1.099 10.618 7.028) 12.781 12.323 ( -2.063 -1.232 -1.470) 2.817 12.419 ( -2.932 9.925 5.712) 11.821 13.337 ( 4.177 1.771 5.124) 6.844 13.635 ( -0.376 -12.698 -11.694) 17.266 14.461 ( -4.693 7.117 -14.939) 17.200 15.547 ( 3.074 -13.304 -12.781) 18.703 16.707 ( 10.080 -13.639 35.293) 39.156 19.463 ( 1.272 -0.801 -14.931) 15.007 19.817 ( -0.338 3.704 -1.886) 4.171 20.077 ( -5.774 7.773 -5.782) 11.278 20.815 ( 6.427 2.482 1.622) 7.078 21.379 ( -5.992 -8.066 10.094) 14.242 24.262 ( 1.017 1.930 -0.889) 2.356 24.470 ( -4.947 0.835 -4.952) 7.050 ======================= Grid point 144 (64/361) ======================= q-point: (-0.20 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.607 ( 9.636 23.726 8.737) 27.057 1.687 ( 14.273 14.241 14.900) 25.071 2.597 ( 7.116 18.366 20.082) 28.129 3.056 ( 3.384 -7.237 -1.094) 8.064 3.397 ( -6.462 5.858 7.016) 11.194 3.625 ( -1.708 -11.911 6.344) 13.603 3.880 ( 2.984 -8.376 -9.958) 13.350 4.470 ( 4.354 -0.898 -0.412) 4.465 4.643 ( -2.760 -7.290 -2.930) 8.327 5.142 ( 0.423 -0.058 1.914) 1.961 5.453 ( -1.476 -17.324 12.940) 21.673 5.600 ( -0.598 -1.301 13.322) 13.399 5.974 ( -0.338 0.742 6.436) 6.487 6.055 ( -2.119 1.533 6.696) 7.189 7.250 ( -6.295 1.816 2.950) 7.185 8.015 ( -1.394 0.355 -8.674) 8.793 8.937 ( -3.503 -21.137 3.072) 21.645 8.984 ( 5.897 -2.247 -6.739) 9.233 9.621 ( 6.776 -16.551 4.436) 18.426 10.090 ( -4.523 13.820 3.843) 15.040 11.091 ( -0.442 33.823 -5.257) 34.232 11.842 ( -1.253 4.971 5.765) 7.715 12.263 ( -0.283 3.052 -4.526) 5.467 12.379 ( 1.094 8.971 4.136) 9.939 13.463 ( 1.226 0.985 8.288) 8.436 13.486 ( 2.988 4.537 -17.334) 18.166 14.173 ( -7.386 3.213 -6.664) 10.454 15.483 ( -3.479 -11.593 -15.829) 19.927 17.511 ( 7.880 -26.676 37.773) 46.910 19.201 ( -9.371 -1.241 -15.990) 18.575 19.722 ( -3.970 5.154 -3.271) 7.282 19.813 ( -14.323 1.244 -4.562) 15.083 20.944 ( 11.947 4.038 2.576) 12.872 21.577 ( 11.316 -2.838 4.499) 12.504 24.243 ( -6.381 5.803 -7.068) 11.151 24.255 ( -0.462 2.769 -1.794) 3.332 ======================= Grid point 145 (65/361) ======================= q-point: (-0.10 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( 12.364 18.292 9.580) 24.068 1.973 ( 13.163 13.490 18.685) 26.540 2.914 ( 13.803 4.099 17.517) 22.676 3.149 ( 3.390 -6.625 -2.645) 7.898 3.384 ( -2.767 4.654 12.886) 13.977 3.719 ( -1.640 -13.310 -5.909) 14.655 3.915 ( 4.126 -3.387 -3.046) 6.146 4.479 ( 2.166 1.176 -4.620) 5.236 4.651 ( -1.322 -3.096 1.134) 3.552 5.125 ( -0.619 4.811 -0.853) 4.925 5.631 ( -1.237 -7.932 0.425) 8.039 5.821 ( -5.161 -2.091 12.075) 13.298 5.935 ( -3.592 -2.292 12.724) 13.419 6.336 ( 7.412 -7.681 17.194) 20.238 7.157 ( -7.086 -0.127 -2.292) 7.448 7.859 ( -0.731 8.083 -5.830) 9.993 8.972 ( -1.510 -9.449 -4.145) 10.428 9.201 ( 6.631 -17.372 1.802) 18.681 9.835 ( -2.778 0.969 4.338) 5.241 9.985 ( -0.204 5.432 6.721) 8.644 10.786 ( 2.913 23.269 -2.794) 23.616 11.821 ( -2.800 0.420 0.058) 2.831 12.170 ( 4.445 6.619 -6.015) 9.988 12.391 ( 3.997 5.215 2.214) 6.933 13.253 ( 1.549 11.013 -9.112) 14.378 13.614 ( 5.034 4.571 9.976) 12.073 14.010 ( -8.103 -2.545 -3.025) 9.016 15.284 ( -8.453 -8.817 -17.124) 21.034 18.206 ( -0.968 -23.917 25.844) 35.226 18.923 ( -4.259 -2.418 -12.913) 13.811 19.465 ( -8.335 2.388 -13.365) 15.930 19.607 ( -18.359 4.367 8.854) 20.845 21.129 ( 14.566 -0.516 -1.490) 14.651 21.809 ( 15.907 1.465 -1.204) 16.020 23.984 ( -3.491 10.408 -5.122) 12.113 24.257 ( 0.223 -0.524 0.282) 0.635 ======================= Grid point 150 (66/361) ======================= q-point: ( 0.40 -0.60 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.160 ( -6.594 -0.000 -4.800) 8.156 2.222 ( -9.262 -0.000 -1.792) 9.433 2.813 ( -11.556 -0.000 -0.722) 11.579 2.895 ( -5.814 -0.000 1.148) 5.926 3.068 ( -6.626 -0.000 0.389) 6.637 3.825 ( 6.419 0.000 7.919) 10.194 4.181 ( -5.258 -0.000 0.790) 5.317 4.258 ( -3.526 -0.000 -14.423) 14.848 4.480 ( 1.496 0.000 -0.349) 1.536 4.544 ( -0.676 -0.000 2.527) 2.616 4.937 ( -1.621 -0.000 -1.082) 1.949 5.873 ( -4.397 -0.000 -0.824) 4.473 5.993 ( -37.261 -0.000 14.658) 40.040 6.151 ( 1.736 0.000 0.175) 1.745 7.463 ( -4.278 -0.000 11.732) 12.488 8.041 ( -2.956 -0.000 -6.020) 6.707 8.283 ( 0.766 0.000 6.664) 6.708 9.070 ( -2.424 -0.000 1.847) 3.047 9.138 ( -6.784 -0.000 -3.698) 7.726 10.315 ( 0.102 0.000 -4.136) 4.137 11.819 ( 9.468 0.000 3.958) 10.262 12.321 ( -2.478 -0.000 -3.068) 3.944 12.693 ( -10.182 -0.000 3.312) 10.707 12.818 ( 6.799 0.000 3.395) 7.599 12.861 ( -1.977 -0.000 3.800) 4.283 13.381 ( -2.454 -0.000 -8.304) 8.659 14.443 ( 13.728 0.000 11.175) 17.701 15.168 ( 12.383 0.000 -4.258) 13.095 16.442 ( -8.311 -0.000 -16.376) 18.365 19.427 ( 18.876 0.000 -1.037) 18.904 19.557 ( 6.974 0.000 4.451) 8.273 20.147 ( 14.432 0.000 12.791) 19.284 20.958 ( -2.182 -0.000 -20.202) 20.320 21.535 ( -27.113 -0.000 7.168) 28.044 24.278 ( 2.704 0.000 1.116) 2.925 24.465 ( 1.033 0.000 2.587) 2.785 ======================= Grid point 152 (67/361) ======================= q-point: (-0.50 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.004 ( -5.445 13.922 3.080) 15.263 2.073 ( -3.413 8.510 1.501) 9.291 2.715 ( -7.106 -6.804 1.862) 10.013 2.874 ( -4.685 -8.210 -4.909) 10.651 3.023 ( -3.121 -0.442 9.837) 10.330 3.899 ( 5.113 12.085 -4.438) 13.852 4.070 ( -6.881 4.533 -5.639) 9.985 4.141 ( 2.590 -1.269 4.894) 5.680 4.518 ( -0.480 -2.364 2.078) 3.184 4.597 ( -0.473 -14.551 -2.468) 14.767 4.968 ( 0.549 -1.739 5.815) 6.094 5.672 ( -29.309 -0.666 12.886) 32.024 5.833 ( -3.117 -0.508 2.599) 4.090 6.168 ( 1.674 0.614 -1.124) 2.108 7.491 ( -6.200 2.801 6.727) 9.567 7.983 ( 1.726 -3.068 -4.581) 5.777 8.369 ( -2.422 -5.326 5.567) 8.076 9.040 ( -1.101 0.031 0.045) 1.103 9.073 ( -3.553 -4.536 -0.786) 5.815 10.284 ( 1.620 1.528 -1.478) 2.673 11.938 ( 3.457 4.412 3.262) 6.484 12.260 ( -0.724 -0.640 -2.288) 2.484 12.559 ( -3.602 17.815 -1.825) 18.267 12.642 ( -4.847 16.209 6.485) 18.119 13.141 ( 3.285 -23.697 -0.168) 23.924 13.305 ( 0.071 -1.264 -2.098) 2.450 14.662 ( 4.222 0.753 0.937) 4.390 15.276 ( 9.580 -6.059 -8.953) 14.444 16.282 ( -0.451 0.176 3.719) 3.750 19.523 ( 11.546 0.258 -13.116) 17.475 19.798 ( 9.288 0.950 6.927) 11.626 20.419 ( 3.618 5.814 2.233) 7.203 20.738 ( 5.760 -0.624 -8.722) 10.471 21.254 ( -25.452 -5.361 8.421) 27.340 24.306 ( 0.816 0.964 0.074) 1.265 24.497 ( 0.140 -0.696 0.349) 0.791 ======================= Grid point 153 (68/361) ======================= q-point: (-0.40 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.875 ( 1.745 16.870 6.188) 18.053 2.022 ( 3.121 18.458 9.970) 21.210 2.727 ( -2.770 -6.275 -1.398) 7.000 2.835 ( -0.795 -4.584 1.238) 4.814 3.197 ( -0.230 -8.375 11.599) 14.309 3.792 ( 5.423 15.275 -2.181) 16.355 3.832 ( -8.481 2.551 -7.578) 11.656 4.301 ( 6.273 -1.840 5.701) 8.674 4.527 ( -2.461 -5.075 -1.823) 5.928 4.774 ( 1.716 -19.057 3.340) 19.423 5.086 ( -0.163 -1.108 9.448) 9.514 5.516 ( -14.179 -0.772 12.658) 19.022 5.860 ( -1.061 -1.464 5.235) 5.538 6.157 ( 0.264 1.707 -1.480) 2.275 7.412 ( -7.857 4.384 3.523) 9.662 8.003 ( 3.795 -3.323 -5.162) 7.217 8.458 ( -4.918 -12.133 4.923) 13.986 9.012 ( -0.633 0.279 -3.388) 3.458 9.134 ( 2.686 -7.832 3.815) 9.117 10.291 ( 1.971 3.155 1.176) 3.901 11.932 ( -1.073 8.452 3.125) 9.075 12.190 ( 1.615 26.595 -5.929) 27.296 12.285 ( -3.064 2.100 -1.965) 4.202 12.580 ( -3.686 7.255 7.772) 11.253 13.311 ( -3.072 -17.652 -4.320) 18.431 13.383 ( 7.191 -1.745 4.085) 8.452 14.556 ( -6.091 3.466 -10.412) 12.551 15.322 ( 4.625 -10.100 -12.954) 17.064 16.547 ( 8.544 -4.774 25.086) 26.928 19.452 ( 2.807 -0.442 -17.563) 17.792 19.867 ( -2.263 1.782 -0.365) 2.903 20.189 ( -8.127 4.094 -14.508) 17.126 20.898 ( 8.614 6.308 8.783) 13.825 21.228 ( -2.423 -8.390 11.572) 14.497 24.293 ( -0.150 1.313 -0.897) 1.597 24.471 ( -2.653 -0.339 -3.190) 4.163 ======================= Grid point 154 (69/361) ======================= q-point: (-0.30 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.934 ( 11.774 12.594 9.553) 19.710 2.037 ( 7.728 22.475 9.118) 25.456 2.760 ( 2.765 -1.025 4.227) 5.154 2.941 ( 2.840 -5.012 3.001) 6.496 3.393 ( -0.564 -10.556 5.690) 12.005 3.609 ( -7.798 8.595 1.468) 11.697 3.771 ( 6.475 3.053 -2.316) 7.524 4.455 ( 2.998 -1.432 1.281) 3.561 4.530 ( 2.044 -4.242 0.306) 4.718 5.024 ( 1.586 -17.390 3.232) 17.759 5.213 ( -3.414 -3.521 13.858) 14.700 5.584 ( 1.531 -0.665 10.598) 10.729 5.959 ( 1.525 -1.796 7.705) 8.057 6.104 ( -2.643 2.772 -0.104) 3.832 7.294 ( -8.117 2.736 1.646) 8.723 7.999 ( 2.967 -0.641 -6.645) 7.306 8.572 ( -5.478 -18.213 2.923) 19.242 8.968 ( 2.166 0.364 -3.638) 4.250 9.360 ( 7.105 -11.372 5.928) 14.661 10.294 ( 0.370 8.386 4.817) 9.678 11.738 ( -0.793 33.970 -5.199) 34.375 11.913 ( -7.645 4.660 0.948) 9.003 12.266 ( 3.126 -1.072 -5.422) 6.350 12.570 ( -0.550 9.485 7.479) 12.091 13.338 ( -3.328 -13.470 -7.545) 15.794 13.555 ( 7.680 3.041 7.580) 11.211 14.256 ( -10.242 4.740 -9.941) 15.040 15.266 ( -1.307 -11.342 -16.293) 19.895 17.147 ( 10.328 -13.625 33.332) 37.462 19.181 ( -7.481 -0.957 -18.861) 20.313 19.793 ( -5.274 2.567 1.666) 6.097 19.838 ( -11.080 1.378 -15.358) 18.988 21.053 ( 9.286 7.477 6.469) 13.564 21.504 ( 10.952 -5.025 9.083) 15.090 24.262 ( -1.105 0.452 -1.519) 1.932 24.344 ( -4.417 3.255 -6.225) 8.298 ======================= Grid point 155 (70/361) ======================= q-point: (-0.20 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( 9.382 20.312 5.809) 23.116 2.191 ( 16.437 10.646 13.354) 23.703 2.914 ( 4.350 -3.356 6.001) 8.136 3.031 ( 0.796 -6.075 -1.180) 6.239 3.482 ( -3.386 -10.132 -6.671) 12.595 3.535 ( 2.119 5.847 10.818) 12.478 3.876 ( 8.852 2.296 3.962) 9.966 4.456 ( -3.464 -3.346 0.623) 4.856 4.643 ( 6.675 1.754 0.966) 6.969 5.151 ( 0.242 -4.254 0.389) 4.279 5.407 ( -5.031 -12.303 11.304) 17.449 5.779 ( 3.278 -1.294 12.236) 12.733 5.961 ( -3.973 2.781 -1.036) 4.959 6.230 ( 5.992 -4.607 15.132) 16.914 7.165 ( -8.296 0.904 -1.139) 8.423 7.947 ( 2.840 2.458 -6.423) 7.441 8.684 ( -5.373 -19.259 -0.922) 20.016 9.015 ( 6.452 -4.233 -0.375) 7.726 9.646 ( 6.534 -11.867 5.418) 14.590 10.253 ( -3.346 14.901 8.740) 17.597 11.334 ( 0.073 34.055 -5.558) 34.506 11.774 ( -11.778 -3.660 -1.546) 12.430 12.256 ( 7.232 2.025 -7.340) 10.502 12.560 ( 1.805 11.450 5.005) 12.626 13.293 ( -1.284 -6.333 -7.663) 10.024 13.728 ( 7.006 6.778 9.592) 13.676 13.988 ( -10.656 0.383 -4.057) 11.409 15.101 ( -6.091 -10.621 -17.607) 21.445 17.817 ( 6.104 -17.617 29.946) 35.276 18.885 ( -5.243 -1.719 -13.938) 14.991 19.478 ( -10.056 -0.128 -16.618) 19.424 19.699 ( -10.621 4.735 5.668) 12.936 21.177 ( 11.198 5.219 -0.977) 12.394 21.808 ( 12.804 -1.465 6.854) 14.597 24.136 ( -3.934 5.954 -6.136) 9.412 24.249 ( -0.592 -0.126 -1.409) 1.533 ======================= Grid point 156 (71/361) ======================= q-point: (-0.10 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.090 ( 10.330 14.433 5.053) 18.454 2.486 ( 10.308 10.476 17.029) 22.494 2.999 ( -3.637 -7.229 0.926) 8.145 3.096 ( 3.684 -6.453 -4.011) 8.444 3.428 ( -3.584 -11.442 -8.588) 14.749 3.725 ( 10.476 2.960 7.671) 13.318 4.040 ( 12.900 5.594 3.099) 14.398 4.443 ( -4.552 -0.818 2.025) 5.048 4.705 ( 1.331 2.986 4.550) 5.603 5.147 ( 1.855 3.207 -3.870) 5.357 5.481 ( -6.886 -9.621 -1.445) 11.919 5.781 ( -8.372 1.848 2.542) 8.942 6.127 ( -0.264 -5.330 23.637) 24.232 6.572 ( 6.367 -5.940 14.431) 16.854 7.001 ( -8.286 1.479 -4.038) 9.335 7.910 ( 4.328 5.216 -1.182) 6.880 8.735 ( -6.526 -15.218 -2.677) 16.773 9.228 ( 10.160 -12.711 2.225) 16.424 9.823 ( -1.669 -1.135 1.964) 2.816 10.147 ( -4.780 12.373 7.915) 15.446 11.044 ( 4.993 25.611 -1.176) 26.120 11.612 ( -11.776 -9.465 -6.107) 16.296 12.276 ( 10.827 3.772 -5.050) 12.528 12.549 ( 3.673 9.038 2.689) 10.120 13.250 ( 0.448 0.594 -2.790) 2.888 13.749 ( -6.807 -0.625 -2.189) 7.178 13.947 ( 3.445 4.789 9.259) 10.979 14.880 ( -7.937 -8.361 -14.904) 18.842 18.276 ( -2.366 -10.548 13.839) 17.561 18.782 ( 6.406 -5.301 -6.055) 10.285 19.159 ( -8.676 -1.829 -14.135) 16.686 19.532 ( -15.126 8.105 7.482) 18.721 21.261 ( 11.138 0.229 -6.987) 13.150 22.047 ( 9.983 3.138 5.926) 12.026 23.987 ( 0.344 6.404 -3.622) 7.365 24.237 ( -1.214 -2.261 -0.389) 2.595 ======================= Grid point 162 (72/361) ======================= q-point: (-0.50 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.067 ( 0.542 -0.000 1.551) 1.643 2.211 ( 2.006 0.000 14.603) 14.740 2.669 ( -0.128 -0.000 3.926) 3.928 2.716 ( -1.574 -0.000 -4.794) 5.046 3.131 ( -0.420 -0.000 10.863) 10.871 3.775 ( -2.437 -0.000 -14.238) 14.445 4.116 ( -0.425 0.000 2.753) 2.786 4.284 ( 7.067 -0.000 7.129) 10.038 4.442 ( -0.070 -0.000 -4.326) 4.326 4.542 ( -1.048 0.000 3.413) 3.570 5.075 ( -0.910 -0.000 11.544) 11.580 5.510 ( -13.016 -0.000 11.866) 17.612 5.843 ( -0.766 -0.000 4.297) 4.365 6.172 ( 0.620 -0.000 -1.550) 1.670 7.458 ( -7.807 -0.000 2.093) 8.082 7.976 ( 4.392 -0.000 -1.746) 4.726 8.334 ( -5.573 -0.000 2.424) 6.077 9.018 ( -0.889 -0.000 -1.755) 1.968 9.061 ( 2.327 -0.000 3.828) 4.479 10.319 ( 2.837 -0.000 1.368) 3.150 12.009 ( -3.146 -0.000 3.536) 4.733 12.228 ( 1.905 -0.000 -2.394) 3.060 12.559 ( -2.440 -0.000 -0.664) 2.529 12.792 ( -2.123 0.000 -2.434) 3.230 12.938 ( -2.946 -0.000 -0.811) 3.056 13.389 ( 6.092 -0.000 6.479) 8.893 14.589 ( -6.932 -0.000 -8.121) 10.678 15.221 ( 5.432 -0.000 -13.185) 14.260 16.507 ( 8.208 -0.000 21.704) 23.204 19.447 ( 3.379 -0.000 -18.597) 18.901 19.883 ( -2.767 -0.000 -0.040) 2.767 20.226 ( -8.838 -0.000 -17.838) 19.908 21.000 ( 15.123 -0.000 12.324) 19.508 21.108 ( -7.402 0.000 11.778) 13.911 24.306 ( -0.799 -0.000 -0.853) 1.169 24.467 ( -1.686 -0.000 -2.812) 3.278 ======================= Grid point 164 (73/361) ======================= q-point: (-0.40 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.122 ( 8.132 6.577 4.502) 11.387 2.390 ( 4.699 13.609 14.087) 20.143 2.692 ( 4.523 -1.903 0.372) 4.921 2.819 ( 4.109 -8.792 2.422) 10.002 3.244 ( -1.741 -4.464 6.301) 7.916 3.585 ( -2.139 -2.718 -12.168) 12.650 4.079 ( 1.918 18.937 7.946) 20.626 4.407 ( 1.045 -3.164 -2.154) 3.968 4.502 ( 6.789 0.664 5.743) 8.917 4.664 ( 0.494 -17.972 4.132) 18.448 5.197 ( -3.550 -0.060 13.646) 14.100 5.575 ( 1.857 -0.250 10.030) 10.203 5.926 ( 2.766 -1.275 5.962) 6.695 6.140 ( -2.027 1.046 -1.263) 2.607 7.335 ( -9.189 1.381 -0.112) 9.293 8.026 ( 5.577 3.332 -2.057) 6.814 8.295 ( -7.129 -10.747 0.126) 12.897 8.984 ( 0.195 0.919 -1.789) 2.021 9.215 ( 6.671 -4.265 6.896) 10.500 10.396 ( 3.549 2.781 5.192) 6.877 11.929 ( -10.897 1.202 1.080) 11.016 12.246 ( 5.076 -0.709 -4.411) 6.762 12.358 ( 0.636 26.174 -10.213) 28.104 12.705 ( -1.575 6.308 7.749) 10.115 13.007 ( -4.260 -21.076 -4.709) 22.012 13.595 ( 7.230 1.186 11.179) 13.366 14.321 ( -12.386 1.979 -9.466) 15.714 15.105 ( 0.298 -5.124 -16.594) 17.370 16.991 ( 11.282 -3.994 29.512) 31.846 19.168 ( -6.288 -0.377 -20.605) 21.546 19.822 ( -5.732 0.780 2.634) 6.357 19.856 ( -9.928 0.475 -19.197) 21.618 21.194 ( 7.001 6.721 7.318) 12.155 21.401 ( 11.498 -5.500 13.241) 18.379 24.268 ( -1.974 0.131 -1.838) 2.700 24.380 ( -2.728 0.894 -5.400) 6.115 ======================= Grid point 165 (74/361) ======================= q-point: (-0.30 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.299 ( 10.929 6.540 8.576) 15.354 2.451 ( 10.346 17.685 5.891) 21.319 2.840 ( 4.905 -3.943 4.015) 7.464 2.926 ( 0.952 -5.522 -2.709) 6.224 3.306 ( -2.293 -7.674 -2.621) 8.428 3.527 ( 4.673 -5.028 -2.268) 7.229 4.087 ( 5.445 17.526 12.329) 22.110 4.393 ( -4.118 -2.592 1.679) 5.148 4.678 ( 9.821 1.262 1.816) 10.066 4.900 ( -1.082 -19.152 4.601) 19.726 5.313 ( -3.300 -0.654 12.250) 12.703 5.769 ( 5.640 -0.089 11.090) 12.441 6.000 ( -1.887 1.042 -3.503) 4.113 6.163 ( 3.833 -2.519 11.127) 12.035 7.185 ( -9.002 1.017 -0.991) 9.113 7.990 ( 0.926 3.266 -4.933) 5.988 8.358 ( -2.218 -15.417 0.105) 15.576 8.981 ( 2.640 -0.334 -0.793) 2.776 9.471 ( 8.258 -6.844 7.840) 13.286 10.470 ( 0.851 8.352 8.322) 11.821 11.710 ( -15.844 -2.497 -5.470) 16.947 11.969 ( -0.014 33.200 -7.299) 33.993 12.272 ( 7.575 0.292 -6.408) 9.927 12.742 ( 0.326 7.455 7.407) 10.514 13.062 ( -3.187 -17.785 -5.676) 18.939 13.825 ( 6.799 3.590 12.426) 14.612 14.011 ( -13.261 1.540 -6.375) 14.794 14.922 ( -4.098 -8.039 -18.144) 20.264 17.576 ( 9.862 -8.642 29.757) 32.518 18.861 ( -5.070 -0.915 -14.807) 15.678 19.474 ( -9.744 -0.185 -19.232) 21.560 19.763 ( -7.299 2.250 4.376) 8.803 21.294 ( 8.978 6.552 -0.602) 11.131 21.762 ( 10.173 -3.228 13.443) 17.164 24.195 ( -3.625 0.928 -3.548) 5.156 24.264 ( -1.027 1.530 -5.365) 5.672 ======================= Grid point 166 (75/361) ======================= q-point: (-0.20 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.360 ( 5.859 13.715 -0.275) 14.916 2.614 ( 3.467 3.120 10.833) 11.795 2.900 ( 4.645 -3.103 -1.241) 5.723 2.995 ( 3.893 -3.959 -2.803) 6.220 3.280 ( -0.197 -4.333 -4.253) 6.075 3.713 ( 12.552 -4.520 0.385) 13.346 4.193 ( 7.821 11.275 9.603) 16.748 4.401 ( -6.991 -2.990 8.165) 11.157 4.773 ( 4.504 3.710 0.933) 5.909 5.063 ( -1.290 -12.948 0.423) 13.019 5.369 ( -3.773 -1.134 2.149) 4.488 5.825 ( -6.897 2.739 -2.006) 7.687 6.062 ( 2.532 -1.935 19.302) 19.563 6.464 ( 7.699 -5.815 13.911) 16.929 7.033 ( -7.960 1.737 -1.788) 8.341 7.932 ( 0.186 -2.497 -3.185) 4.052 8.468 ( 0.040 -11.853 -1.293) 11.923 9.066 ( 6.111 -5.338 0.828) 8.156 9.733 ( 6.769 -5.498 6.255) 10.732 10.427 ( -6.609 14.656 7.441) 17.715 11.415 ( -12.713 -3.377 -12.071) 17.853 11.619 ( -1.493 27.341 -1.160) 27.406 12.312 ( 9.326 0.710 -5.657) 10.931 12.731 ( -0.378 9.594 4.064) 10.426 13.121 ( -1.089 -13.673 -3.308) 14.110 13.756 ( -9.756 1.084 -3.344) 10.370 14.037 ( 4.489 4.173 11.148) 12.722 14.719 ( -4.932 -8.514 -14.789) 17.763 18.095 ( 4.670 -8.447 21.207) 23.301 18.714 ( 2.755 -2.351 -7.504) 8.333 19.125 ( -7.381 -1.567 -17.888) 19.414 19.660 ( -11.344 5.433 6.024) 13.946 21.317 ( 9.019 5.062 -7.592) 12.829 22.071 ( 7.236 -0.245 13.631) 15.435 24.077 ( -1.735 3.152 -4.444) 5.718 24.202 ( -0.711 -1.208 -3.292) 3.578 ======================= Grid point 167 (76/361) ======================= q-point: (-0.10 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.289 ( 1.439 4.016 -5.378) 6.864 2.630 ( -11.781 -6.857 3.110) 13.981 2.992 ( -0.249 -3.652 -5.002) 6.198 3.104 ( 12.336 3.949 8.206) 15.333 3.293 ( 3.849 1.634 -1.276) 4.372 3.916 ( 15.941 -0.735 -5.321) 16.822 4.268 ( -2.013 2.446 0.055) 3.168 4.431 ( -4.048 3.063 10.707) 11.849 4.792 ( -3.061 2.282 6.260) 7.332 5.111 ( 0.824 -7.514 -6.486) 9.961 5.285 ( -2.387 2.070 -6.033) 6.811 5.705 ( -6.796 -1.079 2.216) 7.229 6.335 ( -5.101 -2.506 17.911) 18.792 6.749 ( 2.365 -3.900 11.695) 12.553 6.919 ( -5.905 3.677 7.568) 10.280 7.994 ( 1.784 -6.195 4.569) 7.902 8.524 ( 0.175 -6.679 -4.070) 7.823 9.280 ( 9.386 -12.597 1.972) 15.832 9.836 ( -2.989 6.496 1.455) 7.297 10.235 ( -7.782 11.897 3.331) 14.601 11.166 ( -7.950 -9.682 -11.811) 17.218 11.410 ( 2.095 19.995 1.860) 20.190 12.395 ( 8.907 -0.123 -2.117) 9.157 12.682 ( -2.061 6.189 3.518) 7.411 13.185 ( -0.138 -9.278 -2.417) 9.589 13.626 ( -3.861 2.134 0.530) 4.443 14.107 ( -2.326 0.690 -0.591) 2.497 14.645 ( 2.450 -2.770 -0.523) 3.735 18.245 ( -2.757 0.187 -6.741) 7.285 18.829 ( 10.424 -6.427 -4.206) 12.948 18.924 ( -1.391 -3.503 -0.085) 3.770 19.490 ( -14.080 8.357 7.567) 18.038 21.293 ( 8.697 1.176 -11.833) 14.732 22.290 ( 2.066 4.600 13.690) 14.589 24.005 ( 1.129 1.923 -2.403) 3.278 24.179 ( -0.699 -3.110 -1.945) 3.734 ======================= Grid point 174 (77/361) ======================= q-point: (-0.40 0.60 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.357 ( 11.228 0.000 7.007) 13.235 2.682 ( -0.499 -0.000 12.440) 12.450 2.775 ( 9.544 0.000 -3.429) 10.141 2.853 ( 6.810 0.000 -2.606) 7.291 3.226 ( -2.155 -0.000 1.041) 2.393 3.466 ( 4.983 0.000 -6.054) 7.841 4.307 ( -2.620 -0.000 10.954) 11.263 4.434 ( 2.625 0.000 3.578) 4.438 4.576 ( 2.860 0.000 0.845) 2.982 4.713 ( 6.563 0.000 6.359) 9.138 5.311 ( -3.383 -0.000 12.373) 12.827 5.769 ( 6.510 0.000 11.548) 13.256 6.005 ( 0.099 0.000 -3.356) 3.358 6.141 ( 2.034 0.000 8.205) 8.453 7.195 ( -9.158 -0.000 -1.187) 9.234 8.063 ( -11.146 -0.000 -3.714) 11.749 8.168 ( 9.814 0.000 -0.117) 9.815 8.982 ( 1.177 0.000 -0.802) 1.424 9.407 ( 8.805 0.000 8.819) 12.463 10.548 ( 2.946 0.000 8.211) 8.724 11.685 ( -17.765 -0.000 -6.093) 18.781 12.271 ( 7.731 0.000 -6.638) 10.190 12.416 ( 4.969 0.000 -13.008) 13.924 12.752 ( -7.981 -0.000 1.299) 8.086 12.824 ( -0.574 -0.000 6.875) 6.899 13.858 ( 6.469 0.000 13.852) 15.288 14.028 ( -14.468 -0.000 -7.116) 16.124 14.842 ( -3.155 -0.000 -18.488) 18.756 17.498 ( 11.028 0.000 29.209) 31.221 18.852 ( -4.869 -0.000 -15.159) 15.922 19.473 ( -9.442 -0.000 -20.299) 22.388 19.783 ( -6.483 -0.000 4.187) 7.718 21.367 ( 8.720 0.000 -2.018) 8.951 21.722 ( 8.761 0.000 17.483) 19.555 24.200 ( -3.519 -0.000 -2.637) 4.398 24.281 ( -1.090 -0.000 -6.741) 6.828 ======================= Grid point 176 (78/361) ======================= q-point: (-0.30 0.60 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.540 ( 1.420 5.084 0.639) 5.317 2.621 ( -6.914 -1.021 -3.162) 7.671 2.871 ( 10.488 -0.789 -1.763) 10.664 2.978 ( 5.952 1.362 5.087) 7.947 3.258 ( 8.017 0.810 -1.459) 8.188 3.602 ( 14.332 -5.433 -1.320) 15.384 4.350 ( -6.936 -0.984 6.235) 9.378 4.437 ( 0.431 13.018 11.878) 17.628 4.769 ( 4.298 -13.349 1.479) 14.102 4.834 ( 0.889 -0.464 4.079) 4.200 5.373 ( -1.595 0.415 3.154) 3.558 5.870 ( -6.080 1.626 -6.122) 8.780 6.046 ( 3.992 -0.184 19.653) 20.055 6.375 ( 8.727 -3.066 11.808) 14.999 7.057 ( -7.581 0.759 -0.777) 7.658 7.864 ( -10.672 -3.010 -2.514) 11.369 8.333 ( 10.393 -3.313 -1.437) 11.002 9.011 ( 3.393 -1.202 0.037) 3.599 9.660 ( 9.263 -2.130 8.663) 12.860 10.628 ( -2.852 6.337 7.179) 9.991 11.318 ( -19.435 -3.720 -10.944) 22.612 12.163 ( 2.261 26.170 -9.011) 27.770 12.317 ( 8.581 0.054 -5.926) 10.429 12.795 ( -3.904 -19.090 -0.626) 19.495 12.864 ( -3.547 3.674 6.077) 7.938 13.773 ( -10.250 0.487 -3.259) 10.767 14.087 ( 2.855 1.307 10.762) 11.210 14.600 ( -2.140 -3.729 -14.326) 14.957 17.987 ( 8.138 -3.047 23.734) 25.275 18.688 ( 1.395 -0.645 -7.812) 7.962 19.106 ( -6.552 -0.533 -20.119) 21.166 19.725 ( -9.165 1.707 5.514) 10.831 21.406 ( 8.271 3.376 -8.610) 12.407 22.053 ( 4.800 -1.048 19.505) 20.114 24.104 ( -4.577 0.258 -3.056) 5.509 24.196 ( 1.393 0.216 -6.868) 7.011 ======================= Grid point 177 (79/361) ======================= q-point: (-0.20 -0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.320 ( -8.051 -0.316 -13.288) 15.540 2.498 ( -13.814 -6.218 -2.854) 15.415 3.007 ( 5.275 4.539 2.017) 7.245 3.137 ( 8.389 0.497 6.636) 10.708 3.396 ( 15.871 6.848 0.547) 17.294 3.858 ( 17.809 -5.044 -4.554) 19.062 4.299 ( -8.532 1.203 2.843) 9.073 4.486 ( -7.346 2.834 12.505) 14.777 4.821 ( -2.193 0.584 0.348) 2.296 4.926 ( -1.451 -9.387 0.314) 9.504 5.355 ( 3.291 3.383 -3.258) 5.735 5.694 ( -7.097 -0.117 -3.485) 7.908 6.313 ( -2.841 0.062 17.565) 17.793 6.679 ( 6.989 -3.482 11.620) 14.000 6.977 ( -5.313 2.441 8.613) 10.410 7.792 ( -8.494 -11.886 3.168) 14.949 8.469 ( 10.647 -0.795 -4.384) 11.542 9.117 ( 6.651 -5.360 1.033) 8.604 9.883 ( 6.092 0.515 5.953) 8.533 10.493 ( -10.696 13.616 2.585) 17.507 10.975 ( -15.849 -9.529 -12.038) 22.066 11.864 ( 2.954 26.147 -4.828) 26.752 12.387 ( 7.810 -0.579 -2.927) 8.361 12.780 ( -9.839 4.128 4.002) 11.396 12.929 ( -0.829 -17.423 -0.693) 17.456 13.671 ( -1.057 2.087 1.535) 2.798 14.078 ( -7.448 -2.866 -6.618) 10.368 14.614 ( 8.244 -0.683 5.392) 9.875 18.249 ( 0.601 0.147 -0.584) 0.851 18.727 ( 8.457 -4.082 -1.303) 9.480 18.877 ( 0.854 -1.644 -5.971) 6.252 19.615 ( -12.366 4.810 6.654) 14.843 21.347 ( 7.466 3.784 -13.272) 15.691 22.340 ( 0.193 1.174 20.912) 20.946 24.008 ( -4.180 -1.152 -2.141) 4.836 24.150 ( 3.071 -0.276 -6.125) 6.858 ======================= Grid point 178 (80/361) ======================= q-point: (-0.10 -0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.062 ( -9.896 -7.854 -13.198) 18.270 2.300 ( -17.548 -12.412 -4.853) 22.035 3.036 ( 3.538 6.670 2.265) 7.883 3.264 ( 2.713 2.098 2.492) 4.239 3.579 ( 14.311 10.810 4.925) 18.598 4.063 ( -12.128 -1.801 -4.741) 13.146 4.071 ( 8.869 1.533 -9.429) 13.035 4.437 ( -13.922 -2.772 5.450) 15.206 4.822 ( -7.268 0.226 10.291) 12.600 4.950 ( 5.954 -5.258 -9.238) 12.183 5.345 ( 7.500 7.507 -3.303) 11.114 5.630 ( -4.311 -4.365 3.387) 7.008 6.297 ( -9.435 0.449 -2.813) 9.855 6.878 ( -1.483 0.937 10.735) 10.877 7.116 ( -7.223 3.998 30.528) 31.625 7.909 ( -7.035 -18.813 9.231) 22.105 8.553 ( 12.780 2.503 -7.003) 14.786 9.321 ( 8.718 -10.399 1.360) 13.638 9.875 ( -6.662 13.191 0.694) 14.794 10.228 ( -9.063 9.430 -1.383) 13.152 10.783 ( -6.621 -13.403 -8.129) 17.016 11.675 ( 5.821 18.657 -2.615) 19.718 12.461 ( 3.655 -1.900 -0.851) 4.206 12.639 ( -14.477 -1.566 5.349) 15.513 13.083 ( 4.132 -11.465 0.080) 12.187 13.706 ( 4.291 4.668 3.713) 7.347 13.885 ( -9.334 -6.140 -8.868) 14.264 14.871 ( 12.583 3.227 11.481) 17.337 18.016 ( -1.493 3.572 -27.101) 27.376 18.858 ( 9.355 -1.701 -0.520) 9.523 19.055 ( 7.131 -4.102 9.969) 12.925 19.463 ( -12.392 6.234 8.166) 16.096 21.248 ( 6.691 1.167 -15.329) 16.766 22.526 ( -5.977 6.857 21.127) 23.002 23.971 ( -2.857 -4.649 0.742) 5.507 24.139 ( 4.038 -1.057 -4.993) 6.508 ======================= Grid point 186 (81/361) ======================= q-point: (-0.30 -0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.310 ( -11.340 -0.000 -15.182) 18.950 2.436 ( -14.577 -0.000 -4.882) 15.373 3.074 ( 11.674 0.000 5.360) 12.846 3.135 ( 2.839 0.000 5.913) 6.559 3.472 ( 20.037 0.000 -1.613) 20.102 3.792 ( 18.120 0.000 -2.582) 18.303 4.312 ( -9.471 -0.000 7.218) 11.908 4.519 ( -12.048 -0.000 3.277) 12.486 4.803 ( 4.752 0.000 3.062) 5.653 4.848 ( -5.713 -0.000 4.454) 7.244 5.387 ( 4.294 0.000 -2.177) 4.815 5.695 ( -7.036 -0.000 -6.317) 9.456 6.320 ( -2.923 -0.000 17.777) 18.016 6.641 ( 10.696 0.000 10.903) 15.273 7.001 ( -5.005 -0.000 8.913) 10.222 7.669 ( -12.916 -0.000 3.217) 13.310 8.464 ( 13.115 0.000 -4.644) 13.913 9.071 ( 5.735 0.000 0.553) 5.762 9.886 ( 8.341 0.000 7.594) 11.280 10.655 ( -6.675 -0.000 3.305) 7.448 10.854 ( -20.846 -0.000 -12.671) 24.395 12.203 ( 3.456 0.000 -14.269) 14.682 12.380 ( 7.683 0.000 -3.215) 8.329 12.675 ( -2.497 -0.000 7.013) 7.444 12.820 ( -13.563 -0.000 4.396) 14.258 13.691 ( 0.054 0.000 1.740) 1.741 14.045 ( -8.431 -0.000 -9.259) 12.522 14.610 ( 9.756 0.000 7.606) 12.371 18.250 ( 2.235 0.000 2.307) 3.212 18.689 ( 7.024 0.000 -1.766) 7.242 18.862 ( 1.999 0.000 -7.544) 7.805 19.660 ( -11.438 -0.000 6.440) 13.126 21.390 ( 7.065 0.000 -14.180) 15.843 22.348 ( -0.792 -0.000 24.311) 24.324 23.993 ( -6.041 -0.000 -2.253) 6.448 24.150 ( 4.362 0.000 -7.615) 8.776 ======================= Grid point 187 (82/361) ======================= q-point: (-0.20 -0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.956 ( -13.682 -3.172 -14.591) 20.252 2.126 ( -20.230 -5.486 -6.962) 22.087 3.172 ( 2.396 6.323 2.156) 7.097 3.286 ( 7.194 -0.346 3.037) 7.817 3.727 ( 17.264 4.524 1.217) 17.888 4.000 ( 4.030 -3.057 -2.566) 5.672 4.155 ( -9.993 7.310 -7.488) 14.470 4.319 ( -13.243 -9.056 0.738) 16.060 4.832 ( -7.846 1.100 11.485) 13.953 4.897 ( 5.195 -1.622 -2.270) 5.897 5.444 ( 7.464 3.196 -1.951) 8.351 5.564 ( -4.706 -2.511 -0.727) 5.384 6.311 ( -8.476 0.673 -2.901) 8.983 6.911 ( 7.964 2.032 9.814) 12.801 7.167 ( -8.929 1.360 32.296) 33.536 7.610 ( -11.197 -10.648 8.458) 17.615 8.571 ( 12.871 0.002 -8.305) 15.318 9.202 ( 8.983 -2.974 1.432) 9.570 10.028 ( 1.168 3.845 3.867) 5.577 10.387 ( -16.788 5.820 -7.914) 19.451 10.620 ( -5.082 -4.666 -1.295) 7.020 12.002 ( 3.858 13.752 -12.378) 18.900 12.427 ( 2.114 -1.685 -1.758) 3.224 12.630 ( -19.104 1.260 6.863) 20.338 12.845 ( 2.239 -12.092 6.963) 14.131 13.767 ( 1.651 1.678 -0.224) 2.364 13.794 ( -5.002 -2.810 -7.227) 9.227 14.910 ( 13.422 1.061 12.643) 18.470 18.065 ( 0.491 1.476 -27.763) 27.806 18.830 ( 10.755 -1.007 1.646) 10.926 19.003 ( 7.273 -1.450 11.164) 13.403 19.551 ( -13.026 2.693 6.789) 14.934 21.279 ( 5.810 1.420 -17.051) 18.070 22.611 ( -6.360 2.335 27.972) 28.781 23.894 ( -6.104 -2.656 -0.709) 6.695 24.133 ( 5.807 -0.030 -7.246) 9.286 ======================= Grid point 188 (83/361) ======================= q-point: (-0.10 -0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.635 ( -15.372 -8.880 -12.348) 21.625 1.828 ( -22.259 -14.081 -4.861) 26.784 3.152 ( 0.791 4.161 -1.372) 4.452 3.350 ( -2.746 5.386 -1.282) 6.180 3.530 ( -26.979 -0.534 -10.632) 29.004 3.878 ( 6.163 6.235 -0.523) 8.782 4.123 ( -5.002 -1.114 1.395) 5.311 4.347 ( 9.348 -2.557 -0.861) 9.729 4.828 ( -8.081 2.699 7.934) 11.642 4.972 ( 7.580 -1.213 -2.260) 8.002 5.477 ( 6.115 4.539 -1.539) 7.769 5.599 ( 0.782 -5.091 3.034) 5.978 6.083 ( -8.968 1.082 -9.856) 13.369 6.992 ( -9.100 9.998 13.202) 18.896 7.426 ( -12.622 3.366 35.221) 37.565 7.743 ( -6.858 -20.037 10.127) 23.475 8.664 ( 14.256 -3.348 -8.359) 16.861 9.394 ( 8.918 -4.181 0.995) 9.900 9.880 ( -11.311 14.547 -0.126) 18.427 10.093 ( -7.867 -0.509 -4.856) 9.259 10.644 ( 2.668 -1.792 1.214) 3.436 11.811 ( 4.745 10.701 -10.408) 15.664 12.422 ( -9.872 -3.925 2.551) 10.926 12.473 ( -10.641 -0.881 7.534) 13.067 13.080 ( 3.920 -12.289 5.087) 13.865 13.575 ( -8.852 -5.898 -6.298) 12.362 13.905 ( 7.470 3.267 4.127) 9.138 15.256 ( 15.265 3.284 12.404) 19.942 17.647 ( 4.097 4.160 -41.509) 41.918 19.037 ( 11.985 -0.096 4.007) 12.638 19.225 ( 1.907 1.407 7.967) 8.312 19.450 ( -6.854 -0.297 8.187) 10.681 21.136 ( 4.681 0.220 -16.846) 17.486 22.770 ( -13.046 10.902 28.680) 33.341 23.880 ( -4.119 -8.917 3.612) 10.465 24.139 ( 5.852 -0.599 -6.042) 8.432 ======================= Grid point 197 (84/361) ======================= q-point: (-0.20 -0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.554 ( -17.981 -0.000 -10.620) 20.883 1.684 ( -24.268 -0.000 -7.400) 25.371 3.190 ( -3.205 -0.000 -5.413) 6.291 3.432 ( 7.044 0.000 2.216) 7.385 3.506 ( -34.715 -0.000 -12.107) 36.766 3.936 ( 6.066 0.000 -2.068) 6.409 4.117 ( -10.635 -0.000 4.700) 11.627 4.309 ( 18.727 0.000 -3.476) 19.047 4.858 ( -8.810 -0.000 11.708) 14.653 4.963 ( 7.620 0.000 -2.333) 7.969 5.514 ( -0.471 -0.000 2.243) 2.292 5.548 ( 6.373 0.000 -1.368) 6.519 6.097 ( -8.560 -0.000 -10.407) 13.475 7.170 ( 9.234 0.000 7.666) 12.002 7.387 ( -25.017 -0.000 38.183) 45.648 7.531 ( -9.313 -0.000 15.076) 17.720 8.622 ( 11.260 0.000 -10.806) 15.606 9.360 ( 11.078 0.000 1.849) 11.231 10.032 ( -7.329 -0.000 0.256) 7.333 10.066 ( -12.663 -0.000 -6.658) 14.306 10.650 ( 4.938 0.000 4.219) 6.494 11.925 ( 3.815 0.000 -17.026) 17.448 12.398 ( -1.364 -0.000 -0.885) 1.626 12.487 ( -21.824 -0.000 17.125) 27.740 12.905 ( 0.608 0.000 6.961) 6.988 13.522 ( -7.463 -0.000 -8.928) 11.637 13.935 ( 7.522 0.000 4.040) 8.538 15.286 ( 15.528 0.000 12.843) 20.151 17.687 ( 6.462 0.000 -42.786) 43.271 19.033 ( 11.990 0.000 4.130) 12.681 19.239 ( 6.396 0.000 11.005) 12.728 19.452 ( -12.521 -0.000 5.473) 13.665 21.141 ( 4.410 0.000 -17.685) 18.227 22.883 ( -11.557 -0.000 35.545) 37.377 23.783 ( -6.505 -0.000 0.249) 6.510 24.133 ( 6.170 0.000 -6.842) 9.213 ======================= Grid point 198 (85/361) ======================= q-point: (-0.10 -0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.188 ( -21.877 -4.590 -5.847) 23.105 1.304 ( -25.749 -13.269 -2.863) 29.108 2.600 ( -41.997 -3.803 -22.410) 47.754 3.260 ( -3.071 2.766 3.997) 5.749 3.524 ( 0.640 3.323 4.940) 5.988 3.810 ( -7.973 1.159 -5.685) 9.860 4.133 ( 2.322 0.074 0.993) 2.526 4.535 ( 14.949 1.202 -0.329) 15.001 4.848 ( -6.665 3.482 7.647) 10.725 5.038 ( 3.585 -0.444 0.401) 3.635 5.572 ( 5.349 2.224 -0.543) 5.818 5.622 ( 4.295 -3.436 0.468) 5.521 5.843 ( -7.475 0.052 -10.489) 12.881 7.158 ( -12.809 23.524 16.132) 31.268 7.565 ( -10.797 -8.911 9.508) 16.923 7.677 ( -13.657 -11.696 37.223) 41.338 8.688 ( 11.326 -8.834 -7.657) 16.277 9.484 ( 5.090 0.927 -3.422) 6.203 9.828 ( -11.180 10.393 -0.418) 15.270 9.979 ( 0.947 -5.479 2.264) 6.003 10.778 ( 6.271 5.181 4.485) 9.289 11.757 ( 3.438 2.675 -16.488) 17.053 12.329 ( -12.639 7.094 10.165) 17.703 12.454 ( -10.869 0.987 15.229) 18.736 13.040 ( -0.134 -17.545 4.589) 18.136 13.379 ( -5.434 -5.014 -0.347) 7.402 14.077 ( 6.739 1.589 3.235) 7.642 15.642 ( 14.903 2.018 10.054) 18.090 17.182 ( 9.856 3.359 -58.279) 59.202 19.238 ( 4.097 -0.691 4.234) 5.932 19.317 ( -0.920 6.218 4.447) 7.700 19.477 ( 2.884 -6.823 6.719) 10.001 20.996 ( 3.781 -0.086 -15.080) 15.546 23.083 ( -17.185 18.670 38.232) 45.887 23.782 ( -3.873 -14.802 7.009) 16.830 24.143 ( 5.208 -0.648 -5.292) 7.453 ======================= Grid point 208 (86/361) ======================= q-point: (-0.10 -0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.803 ( -28.175 -0.000 0.095) 28.175 0.828 ( -28.725 -0.000 8.416) 29.932 1.652 ( -52.081 -0.000 -14.573) 54.081 3.289 ( -1.161 -0.000 2.991) 3.209 3.491 ( -12.951 -0.000 1.960) 13.099 3.755 ( 5.796 0.000 -0.568) 5.823 4.146 ( 1.450 0.000 -3.308) 3.612 4.704 ( 4.244 0.000 0.466) 4.270 4.915 ( 2.595 0.000 8.617) 9.000 5.066 ( 0.051 0.000 0.040) 0.065 5.550 ( -4.022 -0.000 -13.330) 13.923 5.688 ( -0.269 -0.000 1.213) 1.243 5.704 ( 7.284 0.000 1.660) 7.471 7.325 ( -13.441 -0.000 8.212) 15.751 7.509 ( 4.834 0.000 2.731) 5.552 7.932 ( -21.558 -0.000 64.496) 68.003 8.687 ( 8.743 0.000 -5.501) 10.330 9.466 ( 2.475 0.000 -7.326) 7.732 9.703 ( -10.069 -0.000 -1.388) 10.164 10.081 ( 6.505 0.000 4.769) 8.066 10.952 ( 5.728 0.000 3.250) 6.586 11.590 ( 2.065 0.000 -20.871) 20.973 12.369 ( 1.703 0.000 -0.617) 1.811 12.752 ( -13.885 -0.000 56.817) 58.489 12.843 ( -5.188 -0.000 -4.717) 7.012 13.305 ( -3.085 -0.000 2.262) 3.825 14.200 ( 4.751 0.000 1.903) 5.118 15.935 ( 11.130 0.000 4.688) 12.077 16.516 ( 2.861 0.000 -66.817) 66.878 19.192 ( -6.954 -0.000 -0.485) 6.971 19.477 ( 8.119 0.000 3.440) 8.818 19.558 ( 1.942 0.000 4.761) 5.142 20.892 ( 4.347 0.000 -11.165) 11.981 23.634 ( -5.818 -0.000 2.316) 6.262 23.645 ( -7.970 -0.000 59.483) 60.015 24.150 ( 3.815 0.000 -3.437) 5.135 ======================= Grid point 209 (87/361) ======================= q-point: ( 0.00 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.058 ( -3.258 -0.000 26.861) 27.057 1.210 ( 7.478 0.000 26.099) 27.149 2.124 ( -4.591 -0.000 45.469) 45.700 3.194 ( -1.151 -0.000 -4.098) 4.256 3.468 ( 0.611 0.000 8.478) 8.500 3.995 ( 8.217 0.000 -7.054) 10.830 4.081 ( -4.693 -0.000 8.657) 9.848 4.468 ( -3.868 -0.000 -13.106) 13.665 4.757 ( 0.926 0.000 -11.598) 11.635 5.078 ( 4.199 0.000 -3.013) 5.168 5.659 ( 3.828 0.000 5.010) 6.305 5.951 ( -0.389 -0.000 4.999) 5.015 6.146 ( -3.264 -0.000 23.506) 23.731 7.328 ( -42.643 -0.000 2.939) 42.745 7.392 ( -2.427 -0.000 -8.954) 9.277 7.532 ( -18.908 -0.000 20.416) 27.827 9.044 ( 5.433 0.000 12.165) 13.323 9.392 ( -8.596 -0.000 -2.730) 9.019 9.699 ( 1.699 0.000 5.130) 5.404 9.924 ( -4.749 -0.000 -7.452) 8.836 10.559 ( 24.186 0.000 6.397) 25.018 10.957 ( -4.336 -0.000 -4.489) 6.241 12.222 ( -2.002 -0.000 -8.552) 8.783 12.542 ( 5.963 0.000 -7.204) 9.352 12.548 ( -7.114 -0.000 15.792) 17.321 13.461 ( -0.048 -0.000 6.140) 6.141 14.221 ( -1.953 -0.000 -2.377) 3.077 15.747 ( -2.637 -0.000 -16.698) 16.905 18.798 ( 5.048 0.000 -13.006) 13.951 19.259 ( 22.004 0.000 -6.053) 22.821 19.519 ( 22.939 0.000 -3.310) 23.177 19.623 ( -7.606 -0.000 -1.727) 7.800 20.905 ( 16.215 0.000 2.083) 16.349 22.264 ( -74.423 -0.000 -2.511) 74.465 23.681 ( -4.523 -0.000 5.095) 6.813 24.169 ( 5.353 0.000 -1.542) 5.570 ======================= Grid point 210 (88/361) ======================= q-point: ( 0.10 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.407 ( 4.179 -1.805 25.282) 25.688 1.646 ( 10.116 -6.251 21.049) 24.175 2.734 ( 12.545 -4.428 34.632) 37.099 3.160 ( 5.055 1.520 -4.955) 7.240 3.546 ( -6.446 0.165 11.301) 13.012 3.962 ( 3.756 6.604 -9.390) 12.078 4.050 ( -7.434 3.327 1.135) 8.223 4.271 ( 1.587 -3.468 -15.845) 16.297 4.700 ( 5.971 0.663 -3.872) 7.148 5.029 ( -5.324 -1.820 -3.641) 6.701 5.703 ( -1.663 0.845 2.389) 3.031 5.975 ( -5.700 0.093 6.126) 8.368 6.421 ( -5.935 1.390 32.911) 33.471 6.891 ( -16.727 16.735 16.451) 28.818 7.250 ( -8.823 -4.045 -6.611) 11.744 7.660 ( -10.723 -8.881 17.920) 22.693 9.145 ( 4.327 13.834 4.859) 15.287 9.452 ( -0.543 -14.882 5.110) 15.744 9.685 ( -0.020 8.623 0.280) 8.628 9.905 ( -0.154 -12.335 -0.539) 12.348 10.666 ( 4.263 19.457 -2.455) 20.070 11.182 ( 17.659 -25.278 -0.418) 30.839 12.101 ( 0.714 -0.161 -9.066) 9.095 12.458 ( 2.582 9.966 -3.047) 10.737 12.761 ( -1.291 -14.303 9.203) 17.057 13.565 ( 2.881 -0.985 6.787) 7.439 14.135 ( -4.814 0.953 -2.836) 5.668 15.442 ( -7.007 3.205 -18.190) 19.755 18.714 ( 9.491 6.572 -10.635) 15.696 19.033 ( -13.360 2.327 -13.093) 18.850 19.440 ( -8.209 1.190 -5.068) 9.721 19.841 ( 6.606 -1.143 -2.839) 7.280 21.160 ( 9.974 8.089 9.054) 15.713 21.571 ( -19.973 -3.511 2.803) 20.472 23.723 ( -2.960 -7.520 2.293) 8.401 24.228 ( 4.550 -0.062 -0.739) 4.610 ======================= Grid point 211 (89/361) ======================= q-point: ( 0.20 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.795 ( 8.070 -1.688 20.143) 21.765 2.127 ( 12.853 -10.051 17.706) 24.078 3.161 ( 8.595 5.019 -3.519) 10.556 3.245 ( 3.649 0.713 12.839) 13.367 3.594 ( -2.848 -1.812 8.505) 9.151 3.779 ( 2.057 11.999 -8.717) 14.973 3.863 ( -5.268 1.211 -6.330) 8.324 4.231 ( 5.477 -8.910 -9.933) 14.424 4.793 ( 3.798 1.881 6.638) 7.876 4.946 ( -5.941 -6.179 -0.343) 8.579 5.662 ( -2.696 2.102 -2.978) 4.534 5.943 ( -8.400 0.732 6.513) 10.654 6.726 ( -12.242 6.052 38.534) 40.882 6.826 ( -0.588 8.410 11.288) 14.089 7.064 ( -10.871 -2.700 -3.427) 11.714 7.800 ( -8.131 -4.999 17.197) 19.668 9.095 ( 0.380 11.216 -1.401) 11.309 9.521 ( 2.824 8.179 3.925) 9.502 9.716 ( -6.512 -10.278 2.971) 12.525 10.061 ( 5.318 -6.648 5.089) 9.918 10.552 ( 1.558 0.845 -3.235) 3.688 11.634 ( 16.749 -12.960 0.840) 21.194 12.010 ( 4.022 2.962 -9.454) 10.693 12.377 ( 5.040 4.205 -5.554) 8.598 12.982 ( -1.099 -13.502 8.254) 15.863 13.720 ( 4.871 -2.482 6.026) 8.136 14.003 ( -6.801 1.760 -2.289) 7.389 15.075 ( -8.565 4.937 -15.977) 18.789 18.620 ( -10.150 5.415 -11.679) 16.394 18.722 ( 9.611 2.813 -11.302) 15.100 19.244 ( -9.244 -0.284 -5.328) 10.674 19.758 ( -15.643 0.464 5.529) 16.598 21.193 ( 6.368 11.085 -1.793) 12.909 21.710 ( 10.896 -10.884 5.341) 16.301 23.778 ( -0.209 -6.294 0.399) 6.310 24.275 ( 3.141 0.954 -0.234) 3.291 ======================= Grid point 212 (90/361) ======================= q-point: ( 0.30 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.127 ( 7.269 -0.462 12.698) 14.639 2.609 ( 12.260 -10.750 14.673) 21.935 3.123 ( 1.741 7.241 -5.231) 9.101 3.205 ( -9.861 7.449 2.521) 12.613 3.474 ( -0.744 13.295 -9.760) 16.510 3.653 ( 6.774 -1.091 -8.958) 11.284 4.019 ( 8.289 -9.003 6.767) 13.983 4.294 ( 2.742 -10.709 -5.786) 12.477 4.891 ( -3.701 0.291 10.977) 11.588 4.970 ( -0.229 -5.078 1.489) 5.297 5.486 ( -7.754 4.865 -8.667) 12.606 5.896 ( -7.122 1.864 6.515) 9.831 6.681 ( -9.885 5.234 -1.560) 11.293 6.947 ( -2.754 2.747 9.582) 10.341 7.134 ( -12.052 -0.805 40.170) 41.947 7.952 ( -2.396 -3.885 13.930) 14.659 8.915 ( -6.848 11.460 -2.157) 13.524 9.567 ( 1.841 5.164 5.913) 8.064 9.678 ( -4.867 -2.864 -2.469) 6.163 10.165 ( -2.193 -0.086 1.300) 2.551 10.719 ( 10.256 -15.604 3.927) 19.081 11.656 ( -2.789 13.769 -9.657) 17.048 12.136 ( 17.625 -5.090 0.071) 18.346 12.438 ( 9.498 -4.161 -2.070) 10.574 13.160 ( -1.342 -9.701 5.793) 11.379 13.766 ( -6.185 3.863 -1.412) 7.427 13.969 ( 2.617 -5.833 2.455) 6.849 14.759 ( -5.774 4.516 -9.087) 11.675 18.247 ( -10.737 0.732 -18.253) 21.189 18.756 ( 12.129 3.355 -8.218) 15.031 19.081 ( -5.608 0.829 -0.928) 5.745 19.612 ( -16.333 -2.251 8.559) 18.576 21.148 ( 9.508 8.076 -10.268) 16.157 22.052 ( 8.462 -11.078 9.722) 16.995 23.846 ( 3.182 -4.151 -0.721) 5.279 24.290 ( 1.261 2.932 0.273) 3.204 ======================= Grid point 213 (91/361) ======================= q-point: (-0.60 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.258 ( -0.016 5.345 1.060) 5.449 2.840 ( -12.737 4.934 4.002) 14.234 3.013 ( -1.286 4.769 -0.881) 5.018 3.159 ( 11.751 -5.046 6.011) 14.131 3.270 ( -1.841 4.821 -4.107) 6.595 3.742 ( 15.046 -2.107 -7.771) 17.065 4.173 ( -2.216 -3.085 -1.464) 4.071 4.365 ( 0.729 -12.287 -3.278) 12.738 4.954 ( -3.851 -1.095 7.506) 8.507 5.049 ( -0.228 -4.601 4.577) 6.494 5.161 ( -11.141 6.213 -11.202) 16.977 5.862 ( -4.583 3.957 5.622) 8.263 6.431 ( -11.325 1.990 -7.083) 13.505 7.026 ( -1.559 2.297 10.860) 11.209 7.480 ( -16.057 -3.132 44.994) 47.876 8.145 ( 5.576 -5.224 6.637) 10.121 8.663 ( -12.063 12.110 1.898) 17.198 9.572 ( -12.644 -16.333 0.276) 20.657 9.633 ( 8.659 17.437 1.136) 19.502 10.103 ( -5.793 -4.172 -3.381) 7.899 11.086 ( 12.701 -9.977 4.355) 16.727 11.320 ( -3.270 17.363 -9.343) 19.987 12.384 ( 12.067 0.531 -0.138) 12.079 12.649 ( 9.659 -6.038 4.484) 12.242 13.235 ( -3.023 -0.960 1.436) 3.482 13.626 ( -4.182 0.997 0.590) 4.339 14.017 ( -3.541 -2.953 -4.404) 6.376 14.696 ( 5.636 -2.087 2.853) 6.653 17.832 ( -10.787 -1.418 -25.478) 27.704 18.799 ( 8.595 3.067 -2.273) 9.405 19.079 ( 2.797 -1.411 1.645) 3.538 19.550 ( -10.971 -3.490 9.041) 14.639 21.065 ( 9.069 6.201 -14.384) 18.099 22.378 ( 2.145 -12.964 12.939) 18.441 23.923 ( 5.928 -1.597 -1.800) 6.398 24.266 ( -0.387 5.345 1.213) 5.495 ======================= Grid point 214 (92/361) ======================= q-point: (-0.50 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.061 ( -9.896 11.817 -5.187) 16.263 2.528 ( -18.882 12.285 0.426) 22.531 3.025 ( 2.592 -0.211 3.323) 4.220 3.222 ( 0.265 -3.196 -0.846) 3.316 3.493 ( 9.053 -9.192 4.208) 13.570 3.842 ( -0.148 -1.035 -7.042) 7.119 4.032 ( -4.639 2.461 -1.160) 5.378 4.423 ( -2.981 -8.509 -1.204) 9.096 4.805 ( -5.824 4.442 -11.843) 13.925 5.009 ( -1.025 0.087 4.337) 4.457 5.183 ( 0.654 -9.791 3.767) 10.511 5.825 ( -2.447 5.966 4.073) 7.627 6.165 ( -11.071 1.450 -7.060) 13.210 7.103 ( -5.254 0.782 11.370) 12.550 7.796 ( -19.982 -6.483 40.163) 45.325 8.310 ( 5.561 -2.325 -10.009) 11.684 8.469 ( -7.762 6.774 16.193) 19.193 9.556 ( -12.085 -18.451 0.236) 22.058 9.598 ( 7.218 16.796 0.065) 18.281 10.015 ( -6.827 -7.675 -3.720) 10.924 10.982 ( 3.599 25.371 -5.979) 26.313 11.411 ( 7.618 -10.310 1.544) 12.912 12.478 ( 6.482 3.045 -2.767) 7.677 12.839 ( -5.028 0.727 11.573) 12.639 13.143 ( 1.421 4.134 -5.659) 7.151 13.702 ( 5.570 -4.973 4.470) 8.703 13.877 ( -7.312 2.350 -1.510) 7.827 14.956 ( 13.492 -7.990 5.620) 16.657 17.344 ( -10.779 -1.475 -30.563) 32.442 18.929 ( 10.030 1.244 4.799) 11.189 19.167 ( 2.371 -4.269 0.714) 4.936 19.578 ( -3.434 -1.039 8.663) 9.376 20.946 ( 8.182 4.669 -17.175) 19.589 22.661 ( -5.612 -16.357 15.265) 23.067 23.997 ( 7.889 0.921 -3.021) 8.498 24.223 ( -1.013 7.426 3.764) 8.387 ======================= Grid point 215 (93/361) ======================= q-point: (-0.40 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.709 ( -16.130 12.861 -1.419) 20.678 2.113 ( -21.571 14.974 -0.084) 26.259 3.078 ( -2.850 4.360 -2.323) 5.704 3.264 ( -6.440 -3.550 3.206) 8.022 3.450 ( -16.170 -0.191 0.885) 16.195 3.686 ( -1.636 -7.984 -4.637) 9.377 4.151 ( 6.328 -2.474 4.407) 8.098 4.388 ( -2.851 0.458 -0.250) 2.898 4.679 ( 4.650 -5.500 -8.264) 10.962 5.047 ( -0.286 -0.293 3.112) 3.139 5.314 ( 1.370 -10.712 -1.462) 10.898 5.787 ( 0.011 6.979 2.618) 7.454 5.931 ( -8.774 2.219 -4.107) 9.938 7.129 ( -12.575 -3.256 12.221) 17.835 7.976 ( -21.868 -7.627 27.836) 36.211 8.152 ( -6.116 6.284 -1.780) 8.948 8.663 ( 8.220 -3.680 5.755) 10.687 9.532 ( 5.412 12.285 -3.743) 13.936 9.563 ( -11.713 -15.204 3.445) 19.499 10.014 ( -1.452 -8.707 2.751) 9.246 10.795 ( 5.293 19.375 -1.276) 20.125 11.544 ( 3.097 -3.842 -3.657) 6.142 12.462 ( 3.571 5.344 -5.024) 8.158 12.743 ( -18.047 5.173 10.766) 21.642 13.136 ( 5.358 -0.264 -4.714) 7.142 13.804 ( -2.020 3.949 6.764) 8.089 13.913 ( 9.037 -1.708 5.535) 10.734 15.312 ( 16.162 -9.797 3.017) 19.139 16.819 ( -10.695 -0.216 -30.297) 32.130 19.159 ( 11.410 0.767 7.844) 13.867 19.225 ( -1.346 -5.617 0.097) 5.777 19.660 ( 2.372 3.685 6.651) 7.965 20.803 ( 7.665 2.991 -18.495) 20.243 22.883 ( -13.670 -21.548 15.263) 29.735 24.049 ( 8.319 2.770 -5.497) 10.349 24.226 ( 0.940 8.396 10.226) 13.265 ======================= Grid point 216 (94/361) ======================= q-point: (-0.30 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.353 ( -20.653 11.876 5.531) 24.458 1.637 ( -24.928 14.866 -0.653) 29.032 2.582 ( -35.517 19.587 3.662) 40.725 3.265 ( -2.329 -4.225 2.845) 5.601 3.530 ( -1.026 -8.126 5.616) 9.931 3.634 ( -3.877 -6.058 -3.858) 8.162 4.145 ( -3.894 2.517 -2.431) 5.235 4.519 ( 9.888 -4.971 4.287) 11.869 4.756 ( 3.971 -9.045 -2.439) 10.175 5.080 ( 0.813 0.163 1.447) 1.668 5.348 ( -1.426 -8.680 -8.309) 12.100 5.770 ( 1.752 6.335 2.959) 7.208 5.803 ( -2.455 3.592 1.578) 4.628 7.122 ( -18.089 -11.501 13.180) 25.164 7.919 ( -20.345 4.784 11.767) 23.984 8.116 ( -4.031 -7.633 7.149) 11.208 8.836 ( 9.598 -2.611 -3.905) 10.686 9.459 ( 4.619 10.475 -1.860) 11.598 9.582 ( -9.929 -12.645 4.119) 16.596 10.163 ( 5.474 0.060 5.808) 7.982 10.759 ( 2.617 2.014 2.645) 4.231 11.479 ( -3.547 1.155 -7.978) 8.807 12.364 ( -0.259 6.725 -4.952) 8.356 12.589 ( -15.202 -1.650 6.686) 16.689 13.160 ( 1.664 -1.247 0.036) 2.080 13.866 ( 5.411 8.894 3.480) 10.977 14.098 ( 8.492 1.905 3.417) 9.350 15.639 ( 15.044 -9.759 -2.354) 18.086 16.377 ( -9.670 1.699 -9.253) 13.492 19.229 ( -1.783 -2.727 -2.386) 4.039 19.402 ( 9.999 1.436 6.980) 12.278 19.713 ( 2.748 7.719 4.339) 9.272 20.681 ( 8.535 0.436 -16.908) 18.945 23.041 ( -20.286 -29.403 12.815) 37.952 24.060 ( 7.227 3.192 -5.440) 9.593 24.346 ( 4.772 8.298 13.567) 16.604 ======================= Grid point 217 (95/361) ======================= q-point: (-0.20 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.041 ( -22.967 10.527 10.341) 27.299 1.131 ( -26.287 13.413 4.557) 29.861 2.042 ( -37.473 19.433 27.903) 50.601 3.296 ( -0.420 -2.264 0.739) 2.418 3.447 ( -11.630 -3.718 -2.353) 12.434 3.767 ( 5.971 -4.658 4.577) 8.849 4.054 ( -0.705 -0.312 -4.345) 4.413 4.701 ( -0.996 -6.162 3.214) 7.021 4.880 ( 5.584 -7.837 -3.450) 10.223 5.089 ( 0.773 2.120 -2.386) 3.284 5.284 ( 1.635 -3.853 -4.132) 5.881 5.799 ( 5.776 5.032 1.443) 7.796 5.827 ( -1.230 1.836 9.640) 9.890 7.170 ( -17.422 -21.647 11.987) 30.262 7.710 ( -17.858 4.921 8.027) 20.188 8.263 ( -3.455 -14.650 6.741) 16.492 8.880 ( 11.225 1.203 -15.305) 19.018 9.452 ( 4.239 5.003 2.700) 7.092 9.617 ( -3.126 -3.320 5.945) 7.492 10.217 ( 5.451 11.105 -1.629) 12.477 10.820 ( -11.716 -16.208 -4.882) 20.587 11.243 ( -7.228 9.262 -6.667) 13.509 12.267 ( -1.110 -0.193 -1.735) 2.069 12.486 ( -11.675 -5.181 2.137) 12.951 13.175 ( 0.707 3.036 -4.903) 5.810 13.664 ( -1.615 21.647 -19.838) 29.407 14.202 ( 4.725 -0.075 0.244) 4.732 15.852 ( 9.751 -8.299 -5.526) 13.946 16.623 ( 17.713 -7.437 47.953) 51.658 19.154 ( 1.583 5.405 -7.801) 9.621 19.555 ( 4.050 0.017 1.262) 4.242 19.724 ( 1.207 8.299 6.016) 10.321 20.640 ( 10.739 -1.178 -12.921) 16.842 23.162 ( -25.541 -40.613 8.199) 48.672 24.078 ( 6.842 2.069 -4.151) 8.266 24.450 ( 2.370 10.090 0.944) 10.407 ======================= Grid point 218 (96/361) ======================= q-point: (-0.10 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.857 ( -6.749 7.048 24.131) 26.030 0.920 ( -14.763 8.728 21.917) 27.829 1.869 ( -29.114 9.919 43.797) 53.518 3.292 ( -7.535 -1.718 -2.524) 8.130 3.350 ( 2.610 -0.263 4.057) 4.831 3.923 ( 7.644 -2.290 -1.205) 8.070 4.035 ( -1.429 -1.861 2.334) 3.309 4.662 ( -6.977 -3.180 -6.392) 9.982 4.890 ( -0.445 -2.535 -9.284) 9.634 5.034 ( 3.680 1.081 -2.660) 4.667 5.457 ( 10.895 -1.246 7.167) 13.100 5.875 ( 4.530 1.712 3.047) 5.722 5.948 ( -1.961 0.389 15.450) 15.579 7.300 ( -12.699 -27.521 6.840) 31.072 7.535 ( -15.382 1.806 7.695) 17.294 8.208 ( -22.741 -2.956 -18.194) 29.273 8.838 ( 8.842 1.334 -1.919) 9.146 9.533 ( -0.244 -3.023 2.944) 4.227 9.678 ( 1.002 8.806 3.271) 9.447 10.125 ( 2.230 12.330 -5.330) 13.616 10.378 ( -30.812 -11.159 -5.467) 33.223 11.093 ( 1.243 13.124 -0.382) 13.188 12.300 ( 4.091 -3.437 -4.445) 6.951 12.413 ( -11.079 -10.536 4.992) 16.083 12.802 ( -5.162 26.091 -11.826) 29.107 13.420 ( -2.899 2.442 4.380) 5.792 14.245 ( 1.315 -0.720 -1.220) 1.933 15.901 ( 3.502 -4.239 -11.920) 13.127 18.036 ( 59.044 -28.006 40.326) 76.790 19.006 ( 9.562 16.206 -10.931) 21.762 19.553 ( -3.765 -4.125 -3.946) 6.838 19.723 ( -1.484 7.673 3.910) 8.739 20.705 ( 13.805 -1.000 -6.277) 15.198 23.161 ( -46.400 -51.382 -6.495) 69.536 24.013 ( -18.909 33.797 -14.030) 41.190 24.116 ( 6.065 0.819 -2.762) 6.715 ======================= Grid point 220 (97/361) ======================= q-point: ( 0.10 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.801 ( 7.792 0.000 24.060) 25.291 2.008 ( 11.444 0.000 18.232) 21.526 3.214 ( 9.501 0.000 -5.274) 10.867 3.245 ( 10.088 0.000 16.965) 19.738 3.570 ( -5.049 -0.000 10.444) 11.600 3.865 ( -7.837 -0.000 -7.204) 10.645 3.974 ( 1.530 0.000 -9.273) 9.398 4.087 ( 5.311 0.000 -15.435) 16.323 4.814 ( 6.417 0.000 4.467) 7.818 4.881 ( -9.579 -0.000 2.322) 9.856 5.680 ( -2.474 -0.000 -2.673) 3.642 5.950 ( -8.647 -0.000 7.247) 11.282 6.770 ( -9.408 -0.000 39.932) 41.025 6.954 ( -8.763 -0.000 11.820) 14.714 7.011 ( -6.228 -0.000 -11.106) 12.733 7.741 ( -10.955 -0.000 23.877) 26.270 9.304 ( 0.674 0.000 -5.296) 5.339 9.364 ( -10.850 -0.000 10.303) 14.962 9.819 ( 9.803 0.000 4.003) 10.589 9.902 ( 7.521 0.000 2.697) 7.990 10.608 ( -7.502 -0.000 -7.619) 10.692 11.483 ( 28.091 0.000 4.451) 28.442 12.040 ( 6.155 0.000 -9.479) 11.302 12.465 ( 5.717 0.000 -12.054) 13.341 12.808 ( -5.825 -0.000 16.712) 17.698 13.697 ( 5.108 0.000 5.701) 7.654 14.022 ( -6.690 -0.000 -2.693) 7.211 15.121 ( -9.468 -0.000 -16.082) 18.662 18.669 ( -13.548 -0.000 -15.949) 20.927 18.752 ( 12.611 0.000 -11.867) 17.317 19.235 ( -10.975 -0.000 -3.789) 11.611 19.764 ( -15.612 -0.000 4.814) 16.337 21.387 ( 3.676 0.000 -8.383) 9.154 21.528 ( 11.955 0.000 11.899) 16.867 23.714 ( 1.184 0.000 2.150) 2.454 24.284 ( 3.668 0.000 -0.006) 3.668 ======================= Grid point 221 (98/361) ======================= q-point: ( 0.20 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.167 ( 8.216 3.797 18.322) 20.436 2.419 ( 10.547 -8.272 15.872) 20.775 3.242 ( 1.119 5.279 -4.654) 7.126 3.291 ( -4.833 0.972 -1.321) 5.104 3.654 ( 0.877 1.943 -7.993) 8.273 3.727 ( 3.350 11.122 -8.987) 14.687 3.874 ( 6.631 -4.163 4.584) 9.072 4.077 ( 2.127 -12.266 -9.243) 15.506 4.867 ( -4.751 -1.626 10.809) 11.919 4.931 ( 0.410 -0.130 4.602) 4.622 5.540 ( -6.594 1.260 -9.257) 11.435 5.922 ( -6.638 0.811 7.485) 10.037 6.760 ( -8.660 2.821 -9.365) 13.063 6.977 ( -3.351 0.580 8.307) 8.976 7.122 ( -15.631 -0.405 44.583) 47.245 7.887 ( -8.525 -2.374 20.674) 22.489 9.112 ( -8.763 10.767 -2.188) 14.054 9.336 ( -11.536 -13.988 -1.346) 18.181 9.943 ( 9.179 14.830 4.499) 18.012 10.163 ( 7.120 -2.518 4.695) 8.892 10.476 ( 2.331 -9.208 -2.676) 9.868 11.888 ( 15.708 9.142 -1.254) 18.218 12.045 ( 15.346 -4.024 -4.756) 16.562 12.423 ( 8.056 1.503 -6.173) 10.260 12.957 ( -5.323 -9.200 12.718) 16.575 13.820 ( 2.380 1.493 0.561) 2.865 13.895 ( -4.587 -1.855 -0.791) 5.011 14.814 ( -8.243 1.465 -10.255) 13.238 18.261 ( -12.126 0.507 -20.232) 23.593 18.801 ( 12.743 1.313 -9.605) 16.012 19.068 ( -7.072 -1.100 -1.800) 7.380 19.595 ( -17.037 -0.148 8.191) 18.904 21.318 ( 10.255 7.966 -12.927) 18.323 21.860 ( 6.868 -8.040 11.928) 15.940 23.786 ( 4.401 -1.903 1.146) 4.930 24.327 ( 2.172 1.044 0.726) 2.517 ======================= Grid point 222 (99/361) ======================= q-point: ( 0.30 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.374 ( 3.921 7.423 7.343) 11.153 2.779 ( 0.552 -9.097 9.386) 13.083 3.112 ( -0.727 4.175 -2.630) 4.988 3.166 ( -3.656 4.081 0.190) 5.483 3.423 ( -4.895 10.883 -9.645) 15.343 3.704 ( 11.946 -0.916 -6.581) 13.669 4.065 ( 0.897 -10.750 -3.995) 11.503 4.155 ( 5.548 -8.031 0.993) 9.811 4.927 ( -6.493 -1.570 2.744) 7.222 4.981 ( -1.932 -1.577 9.670) 9.986 5.250 ( -10.432 2.523 -13.566) 17.298 5.928 ( -2.583 2.873 6.313) 7.401 6.482 ( -10.633 3.382 -8.183) 13.837 7.041 ( -3.232 -0.572 9.321) 9.882 7.428 ( -20.199 -2.294 45.270) 49.625 8.045 ( -2.752 -4.717 13.152) 14.241 8.835 ( -14.157 6.651 -2.260) 15.804 9.290 ( -8.432 -11.982 -1.336) 14.712 9.889 ( -4.613 5.249 -2.393) 7.386 10.164 ( 5.797 13.415 -1.264) 14.669 10.825 ( 14.295 -15.521 7.915) 22.537 11.741 ( 6.677 23.359 -9.509) 26.089 12.381 ( 14.962 -0.802 2.886) 15.259 12.552 ( 12.357 -4.680 2.379) 13.426 13.113 ( -4.008 -10.157 8.215) 13.664 13.694 ( -5.922 5.024 -1.662) 7.942 13.931 ( 0.018 -5.378 -4.498) 7.011 14.668 ( 0.047 -1.079 -1.175) 1.596 17.813 ( -12.008 -0.646 -24.858) 27.614 18.844 ( 6.229 1.602 -2.467) 6.888 19.037 ( 3.790 -2.227 -2.493) 5.054 19.511 ( -9.505 -1.086 8.986) 13.125 21.212 ( 9.174 8.635 -14.914) 19.523 22.151 ( 0.681 -10.947 12.344) 16.513 23.893 ( 6.861 -1.439 0.244) 7.014 24.343 ( 0.593 2.926 1.637) 3.405 ======================= Grid point 223 (100/361) ======================= q-point: (-0.60 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.290 ( -4.540 12.560 -4.197) 13.999 2.686 ( -15.323 4.075 -1.901) 15.969 3.084 ( 1.263 5.396 4.588) 7.194 3.192 ( -2.825 1.400 -4.392) 5.406 3.327 ( 5.424 -8.116 6.192) 11.560 3.779 ( 2.660 -5.950 -6.320) 9.079 4.086 ( -2.480 0.927 0.890) 2.794 4.275 ( 2.809 -4.818 -0.373) 5.590 4.822 ( -9.067 -3.138 -9.905) 13.790 4.977 ( -3.960 -3.626 -4.558) 7.043 5.064 ( -2.747 -2.057 5.976) 6.892 5.933 ( -0.309 5.357 3.854) 6.607 6.207 ( -10.798 3.420 -5.936) 12.788 7.099 ( -8.184 -1.581 10.843) 13.677 7.681 ( -23.499 -5.705 40.784) 47.414 8.203 ( 4.323 -6.475 0.544) 7.804 8.565 ( -16.213 2.324 3.668) 16.784 9.281 ( -6.754 -10.503 0.482) 12.497 9.740 ( -7.171 -3.934 -4.502) 9.336 10.079 ( 4.174 16.333 -2.341) 17.019 11.228 ( 12.443 -9.643 5.531) 16.686 11.511 ( 8.611 30.207 -4.806) 31.775 12.520 ( 6.179 1.663 -0.813) 6.450 12.834 ( 6.410 -1.631 9.551) 11.617 13.171 ( -4.774 -2.354 0.191) 5.326 13.635 ( 3.191 -1.043 1.463) 3.662 13.865 ( -4.556 -3.328 -3.325) 6.549 14.806 ( 10.389 -7.717 2.229) 13.132 17.322 ( -12.221 -0.867 -27.625) 30.220 18.937 ( 5.216 -0.741 5.643) 7.720 19.107 ( 7.689 -1.443 -3.726) 8.666 19.562 ( 0.002 -0.942 8.406) 8.458 21.062 ( 7.032 7.545 -16.383) 19.359 22.377 ( -6.822 -14.130 12.750) 20.218 24.006 ( 8.056 0.095 -0.741) 8.090 24.336 ( -0.259 4.838 3.203) 5.808 ======================= Grid point 224 (101/361) ======================= q-point: (-0.50 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.982 ( -10.403 16.071 -4.461) 19.657 2.339 ( -18.646 9.558 -3.748) 21.286 3.132 ( 2.536 2.320 4.801) 5.904 3.183 ( -1.430 -4.785 2.985) 5.818 3.459 ( -4.436 -6.611 -1.406) 8.085 3.613 ( -17.913 4.997 -3.733) 18.967 4.091 ( 3.047 -2.152 5.620) 6.745 4.360 ( 0.722 -3.087 0.678) 3.241 4.605 ( -1.029 -3.280 -11.784) 12.275 5.003 ( 0.004 -6.146 -0.354) 6.156 5.115 ( -1.643 -8.708 0.334) 8.868 5.918 ( 1.631 6.530 1.311) 6.857 5.980 ( -8.823 3.651 -2.029) 9.762 7.075 ( -18.700 -3.319 12.657) 22.823 7.834 ( -23.555 -7.244 29.613) 38.527 8.196 ( -1.525 -1.342 -9.376) 9.593 8.542 ( -3.553 -7.684 10.126) 13.199 9.286 ( -7.156 -10.433 0.626) 12.667 9.679 ( -4.065 -8.929 -2.074) 10.027 9.963 ( 3.015 13.181 -0.143) 13.522 11.297 ( 8.236 31.235 -0.762) 32.312 11.493 ( 8.833 -1.020 0.779) 8.926 12.536 ( 1.972 2.674 -2.330) 4.058 12.868 ( -15.574 7.094 10.631) 20.147 13.128 ( 6.113 -0.809 -7.498) 9.708 13.721 ( -1.316 -8.222 -0.065) 8.327 13.945 ( 10.061 1.273 9.661) 14.006 15.101 ( 14.902 -12.508 -0.534) 19.464 16.820 ( -11.776 0.289 -25.671) 28.244 19.111 ( 3.506 -4.248 4.097) 6.864 19.207 ( 11.026 1.975 2.210) 11.418 19.708 ( 6.413 1.498 6.960) 9.582 20.881 ( 5.272 5.428 -17.716) 19.265 22.517 ( -15.321 -18.043 11.932) 26.508 24.094 ( 7.799 2.041 -2.505) 8.441 24.347 ( 0.691 5.107 6.824) 8.551 ======================= Grid point 225 (102/361) ======================= q-point: (-0.40 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.629 ( -13.863 17.281 1.176) 22.186 1.892 ( -21.926 13.007 -4.239) 25.844 3.004 ( -25.803 23.733 5.173) 35.437 3.209 ( 1.240 -0.766 2.974) 3.312 3.357 ( -3.921 -9.988 5.034) 11.852 3.481 ( -4.339 -10.342 -2.654) 11.525 4.181 ( -4.488 0.618 -0.367) 4.545 4.396 ( 3.795 -7.532 1.833) 8.631 4.615 ( 5.417 -6.319 -2.975) 8.838 5.046 ( 0.237 -4.060 0.328) 4.080 5.165 ( -1.078 -10.734 -5.102) 11.934 5.857 ( -4.739 3.382 3.675) 6.885 5.902 ( 3.750 6.596 -0.217) 7.591 6.946 ( -28.638 -8.262 14.773) 33.266 7.861 ( -24.846 -6.388 20.296) 32.712 8.081 ( 1.177 -1.031 -7.305) 7.471 8.706 ( 3.275 -8.884 1.932) 9.664 9.284 ( -7.274 -11.853 -0.433) 13.914 9.680 ( -1.404 -1.667 -0.717) 2.295 10.003 ( 3.292 -3.703 6.800) 8.414 11.118 ( 6.517 31.269 0.559) 31.945 11.544 ( 2.849 5.063 -3.019) 6.547 12.482 ( 0.163 4.013 -3.794) 5.525 12.651 ( -16.925 7.713 6.855) 19.823 13.139 ( 3.763 -0.787 -3.131) 4.958 13.810 ( 1.598 -9.679 -0.390) 9.818 14.212 ( 13.547 6.061 7.006) 16.412 15.413 ( 15.003 -14.459 -5.351) 21.513 16.410 ( -9.592 1.797 -9.737) 13.786 19.188 ( 5.127 -1.704 -3.400) 6.383 19.434 ( 10.084 1.963 8.520) 13.347 19.851 ( 7.117 6.840 5.401) 11.253 20.701 ( 5.499 1.840 -17.664) 18.591 22.556 ( -23.983 -23.151 10.065) 34.820 24.125 ( 6.259 3.727 -3.950) 8.286 24.442 ( 2.890 2.932 9.504) 10.357 ======================= Grid point 226 (103/361) ======================= q-point: (-0.30 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.308 ( -16.107 17.695 7.111) 24.962 1.412 ( -20.805 16.723 3.137) 26.877 2.494 ( -27.810 27.411 17.437) 42.765 3.262 ( 0.719 -0.752 2.050) 2.299 3.340 ( -8.561 -7.604 -2.034) 11.629 3.629 ( 2.625 -10.277 7.023) 12.721 4.057 ( -2.549 0.585 -6.210) 6.738 4.538 ( -2.216 -10.883 1.582) 11.218 4.748 ( 6.019 -6.497 -0.922) 8.904 5.093 ( 0.448 -1.596 -1.795) 2.443 5.180 ( 2.725 -7.547 -0.901) 8.075 5.866 ( -1.989 2.334 9.043) 9.549 5.903 ( 4.964 5.566 -0.579) 7.481 6.804 ( -33.678 -17.173 17.423) 41.625 7.720 ( -24.800 -2.105 11.751) 27.524 8.108 ( 4.127 -5.128 -1.613) 6.777 8.821 ( 7.025 -4.883 -6.159) 10.542 9.288 ( -6.213 -13.369 -1.438) 14.812 9.690 ( 0.640 -0.946 3.164) 3.364 10.178 ( -1.738 -11.254 2.730) 11.710 10.897 ( -0.259 26.168 -3.108) 26.353 11.459 ( 2.036 12.956 0.436) 13.123 12.366 ( -3.172 8.739 -1.479) 9.414 12.472 ( -10.239 1.891 3.938) 11.132 13.181 ( 3.353 -0.655 -0.374) 3.437 13.839 ( 1.544 -3.074 -14.559) 14.960 14.293 ( 7.413 9.428 -6.918) 13.846 15.646 ( 10.478 -13.658 -7.440) 18.753 16.484 ( 6.491 -6.759 30.327) 31.742 19.226 ( 9.045 1.938 -6.822) 11.494 19.593 ( 5.226 3.733 1.053) 6.508 19.906 ( 2.721 11.146 6.269) 13.074 20.611 ( 9.627 -1.824 -13.674) 16.822 22.504 ( -32.878 -29.861 8.590) 45.237 24.130 ( 5.680 3.429 -3.554) 7.527 24.549 ( 0.782 1.880 3.411) 3.973 ======================= Grid point 227 (104/361) ======================= q-point: (-0.20 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.092 ( -5.418 17.237 18.740) 26.031 1.160 ( -12.187 16.078 16.362) 25.976 2.194 ( -21.374 23.339 31.375) 44.564 3.231 ( -7.630 -4.871 -1.488) 9.174 3.346 ( 3.733 0.245 3.274) 4.971 3.829 ( 2.649 -8.045 4.413) 9.551 3.985 ( -0.426 -3.101 -3.141) 4.435 4.556 ( -4.552 -7.860 -4.766) 10.258 4.814 ( 1.113 -5.367 -6.309) 8.357 5.056 ( 1.620 1.016 -2.057) 2.808 5.403 ( 10.109 -5.046 7.358) 13.483 5.926 ( 3.217 3.391 1.405) 4.881 5.962 ( -1.841 1.101 13.478) 13.647 6.733 ( -36.436 -27.920 20.086) 50.105 7.538 ( -19.835 -0.290 10.514) 22.451 8.158 ( -3.233 -3.380 -3.840) 6.051 8.838 ( 8.560 -0.458 -11.172) 14.082 9.342 ( -3.198 -14.488 1.124) 14.879 9.814 ( 6.123 -3.466 4.658) 8.439 10.119 ( -16.495 -7.114 -4.868) 18.612 10.543 ( -3.367 28.201 -5.217) 28.877 11.420 ( 6.630 19.071 4.402) 20.664 12.267 ( -1.757 3.783 2.569) 4.899 12.374 ( -6.875 0.955 0.722) 6.978 13.159 ( 3.465 10.088 -11.618) 15.772 13.536 ( -4.175 9.216 -11.000) 14.946 14.238 ( 0.791 1.039 -2.096) 2.470 15.755 ( 4.243 -11.224 -11.907) 16.904 17.437 ( 29.192 -31.351 42.376) 60.256 19.257 ( 17.229 6.875 -11.063) 21.598 19.530 ( -1.962 3.719 -7.535) 8.629 19.891 ( -1.592 9.625 4.627) 10.797 20.678 ( 12.920 -1.573 -5.109) 13.982 22.350 ( -44.391 -34.485 6.976) 56.643 24.145 ( 5.310 2.220 -2.619) 6.323 24.401 ( -9.982 11.112 -9.724) 17.823 ======================= Grid point 228 (105/361) ======================= q-point: (-0.10 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.156 ( -3.939 10.130 22.630) 25.105 1.302 ( 9.065 9.447 23.773) 27.140 2.269 ( -3.877 14.707 40.121) 42.907 3.167 ( -1.526 -2.912 -3.533) 4.826 3.462 ( 0.819 -0.419 8.297) 8.348 3.934 ( 5.450 -6.464 -6.931) 10.933 4.031 ( -3.919 -5.220 7.087) 9.636 4.450 ( -2.593 -1.807 -10.499) 10.964 4.742 ( 1.023 -1.944 -10.683) 10.907 5.085 ( 3.457 0.900 -1.383) 3.831 5.635 ( 4.296 -2.871 4.892) 7.116 5.960 ( -0.657 0.956 4.009) 4.174 6.137 ( -3.272 -0.808 22.042) 22.298 6.768 ( -31.272 -31.283 21.210) 49.056 7.421 ( -14.521 0.137 9.114) 17.145 7.888 ( -12.741 14.646 -6.404) 20.442 8.916 ( 7.726 -7.103 0.256) 10.498 9.459 ( -0.794 -10.729 0.958) 10.801 9.740 ( -7.690 16.931 1.993) 18.702 10.041 ( -4.707 -2.565 0.420) 5.377 10.368 ( 11.896 1.948 0.483) 12.064 11.323 ( 6.343 26.711 -1.602) 27.501 12.232 ( -1.807 0.963 -8.343) 8.591 12.338 ( -2.623 -5.846 7.506) 9.869 12.881 ( 1.717 19.142 -5.888) 20.101 13.475 ( -0.021 1.465 5.727) 5.911 14.208 ( -2.284 -1.235 -2.203) 3.405 15.678 ( -2.057 -7.267 -16.613) 18.249 18.457 ( 16.000 -30.598 7.822) 35.404 19.322 ( -9.906 -3.706 -10.680) 15.031 19.400 ( 26.169 3.423 -9.533) 28.061 19.804 ( 1.839 9.758 -1.334) 10.020 20.871 ( 11.633 -2.659 4.276) 12.676 21.986 ( -50.412 -20.109 5.741) 54.577 23.952 ( -11.108 19.966 -4.667) 23.319 24.178 ( 4.951 0.965 -1.619) 5.298 ======================= Grid point 231 (106/361) ======================= q-point: ( 0.20 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.488 ( 5.467 0.000 11.194) 12.458 2.642 ( 2.718 0.000 9.128) 9.524 3.147 ( -2.444 -0.000 -2.971) 3.847 3.218 ( -5.841 -0.000 -2.188) 6.237 3.549 ( 0.310 0.000 -10.423) 10.427 3.763 ( -1.854 -0.000 -12.730) 12.864 3.859 ( 7.675 0.000 -2.284) 8.008 4.087 ( 9.090 0.000 5.845) 10.807 4.913 ( -8.520 -0.000 2.147) 8.786 4.971 ( -0.957 -0.000 10.498) 10.541 5.269 ( -10.906 -0.000 -14.522) 18.161 5.955 ( -1.777 -0.000 6.405) 6.647 6.524 ( -9.407 -0.000 -9.099) 13.088 7.027 ( -4.446 -0.000 8.711) 9.780 7.405 ( -21.802 -0.000 45.297) 50.271 7.999 ( -6.670 -0.000 17.265) 18.508 8.901 ( -17.659 -0.000 -6.611) 18.856 9.172 ( -2.702 -0.000 0.762) 2.807 9.913 ( -10.900 -0.000 -6.691) 12.790 10.414 ( 4.235 0.000 -2.209) 4.777 10.584 ( 21.744 0.000 12.665) 25.164 12.014 ( 11.940 0.000 -12.455) 17.253 12.361 ( 20.410 0.000 8.846) 22.245 12.495 ( 8.586 0.000 -2.489) 8.940 12.987 ( -6.413 -0.000 13.397) 14.853 13.759 ( -6.950 -0.000 -0.762) 6.992 13.863 ( 2.050 0.000 -6.251) 6.579 14.657 ( -2.103 -0.000 -2.584) 3.331 17.808 ( -12.515 -0.000 -24.692) 27.682 18.857 ( 3.698 0.000 -1.757) 4.094 19.016 ( 6.471 0.000 -4.253) 7.744 19.502 ( -9.197 -0.000 8.392) 12.450 21.310 ( 9.370 0.000 -17.053) 19.458 22.034 ( -0.328 -0.000 14.069) 14.073 23.879 ( 7.260 0.000 1.065) 7.338 24.370 ( 0.940 0.000 1.754) 1.990 ======================= Grid point 232 (107/361) ======================= q-point: (-0.70 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.505 ( -2.615 10.579 -2.162) 11.110 2.669 ( -8.604 -5.421 -2.640) 10.506 3.133 ( -3.314 0.929 2.170) 4.069 3.210 ( 3.194 -3.187 5.539) 7.144 3.340 ( -6.769 10.265 -4.121) 12.968 3.632 ( -1.750 -9.108 -8.047) 12.279 4.032 ( 10.787 -3.322 1.363) 11.369 4.278 ( 6.824 1.637 4.640) 8.413 4.763 ( -11.764 -1.293 -3.423) 12.320 4.905 ( -11.133 -3.558 -13.888) 18.152 5.059 ( -2.764 0.373 4.775) 5.529 5.999 ( 0.274 1.655 2.745) 3.217 6.281 ( -9.385 3.402 -5.181) 11.247 7.052 ( -10.697 -2.483 10.384) 15.114 7.604 ( -24.370 -2.303 39.999) 46.894 8.122 ( -2.289 -2.151 11.429) 11.853 8.568 ( -15.190 -0.796 -7.750) 17.072 9.171 ( -3.673 -2.380 3.479) 5.591 9.660 ( -11.218 -2.739 -7.942) 14.015 10.362 ( 2.467 10.566 -4.098) 11.598 11.069 ( 18.263 -6.344 10.300) 21.906 11.992 ( 13.632 18.093 -7.324) 23.808 12.560 ( 5.888 3.700 0.567) 6.977 12.752 ( 11.000 -7.647 7.315) 15.264 13.079 ( -6.956 -4.579 10.847) 13.675 13.675 ( 0.419 4.554 -2.014) 4.997 13.778 ( -2.472 -5.521 -5.512) 8.184 14.700 ( 7.435 -3.185 -0.148) 8.090 17.312 ( -12.904 -0.250 -25.925) 28.960 18.914 ( 1.904 -1.055 5.373) 5.797 19.107 ( 12.967 0.543 -5.356) 14.040 19.545 ( 0.859 -0.675 7.856) 7.931 21.185 ( 6.244 4.490 -17.757) 19.351 22.177 ( -7.627 -6.457 13.183) 16.543 24.005 ( 8.210 -0.099 0.681) 8.239 24.396 ( 0.046 1.677 2.788) 3.254 ======================= Grid point 233 (108/361) ======================= q-point: (-0.60 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.264 ( -7.032 13.612 -5.629) 16.322 2.461 ( -13.366 3.676 -5.158) 14.791 3.091 ( -5.177 -3.043 0.151) 6.007 3.213 ( -2.807 3.655 4.862) 6.699 3.293 ( -5.243 -7.740 0.469) 9.360 3.652 ( -1.143 -3.395 0.178) 3.587 4.157 ( -1.651 7.767 4.895) 9.328 4.322 ( 2.205 1.625 1.439) 3.094 4.534 ( -3.701 -4.192 -13.594) 14.699 4.796 ( -3.130 -14.116 -2.048) 14.603 5.043 ( -3.890 -1.174 0.407) 4.084 5.983 ( -1.754 1.495 -1.803) 2.926 6.093 ( -5.157 6.995 0.833) 8.731 6.993 ( -22.309 -5.222 12.155) 25.936 7.726 ( -22.572 -4.183 30.191) 37.927 8.173 ( -1.068 0.709 -6.612) 6.736 8.394 ( -8.508 -8.570 7.236) 14.078 9.177 ( -4.920 -2.418 3.305) 6.401 9.485 ( -8.611 -8.620 -5.016) 13.176 10.227 ( 1.860 11.783 -4.561) 12.771 11.440 ( 13.423 -1.711 6.425) 14.980 11.900 ( 11.771 28.648 -2.516) 31.074 12.576 ( 0.321 2.749 -0.561) 2.824 12.957 ( -6.092 0.423 9.266) 11.098 13.081 ( -1.579 -4.170 -1.391) 4.671 13.580 ( -4.002 -5.677 -5.772) 9.031 13.940 ( 13.532 -1.228 9.685) 16.686 14.892 ( 13.211 -9.217 -3.363) 16.456 16.827 ( -12.242 0.375 -22.790) 25.873 19.051 ( 6.491 -2.211 2.574) 7.324 19.246 ( 12.020 1.862 1.825) 12.300 19.718 ( 9.112 -0.170 7.089) 11.547 20.986 ( 3.217 5.344 -18.148) 19.190 22.242 ( -15.684 -11.364 11.048) 22.297 24.121 ( 7.469 0.918 0.014) 7.526 24.417 ( 0.130 2.559 4.212) 4.931 ======================= Grid point 234 (109/361) ======================= q-point: (-0.50 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.952 ( -9.270 17.094 -1.929) 19.541 2.115 ( -16.241 11.258 -4.362) 20.237 3.120 ( -5.752 -7.703 5.931) 11.296 3.197 ( -7.473 -2.330 2.688) 8.276 3.269 ( -7.269 -11.103 -0.014) 13.271 3.494 ( -6.438 20.538 0.599) 21.532 4.155 ( -2.588 -2.231 5.173) 6.199 4.293 ( -2.191 -3.123 -6.070) 7.169 4.514 ( 5.397 -4.768 -1.214) 7.303 4.893 ( -0.538 -12.684 -0.944) 12.731 5.015 ( -1.531 -4.848 -1.707) 5.363 5.908 ( -4.203 2.181 2.155) 5.202 6.021 ( 1.181 6.353 0.183) 6.464 6.802 ( -33.532 -7.644 13.772) 37.048 7.766 ( -19.893 -3.711 19.887) 28.373 8.037 ( 0.030 -2.369 -10.452) 10.717 8.538 ( -1.814 -9.465 9.734) 13.698 9.150 ( -5.830 -3.027 1.291) 6.695 9.446 ( -7.135 -14.840 -1.795) 16.564 10.128 ( 3.933 9.399 -1.299) 10.271 11.636 ( 8.147 5.208 3.183) 10.179 11.743 ( 8.632 33.581 -1.020) 34.688 12.514 ( -3.703 0.911 -1.899) 4.260 12.814 ( -15.561 8.440 7.564) 19.251 13.124 ( 6.101 -1.760 -5.564) 8.443 13.590 ( -1.519 -13.457 -1.456) 13.620 14.283 ( 15.176 2.223 8.932) 17.749 15.140 ( 14.773 -14.204 -7.480) 21.816 16.439 ( -9.513 1.348 -10.711) 14.389 19.165 ( 10.236 -0.893 -5.733) 11.766 19.469 ( 10.032 1.723 9.528) 13.943 19.951 ( 12.610 3.872 6.696) 14.793 20.751 ( 1.752 3.469 -18.569) 18.971 22.199 ( -23.942 -15.656 8.574) 29.864 24.189 ( 5.433 2.958 -1.522) 6.370 24.473 ( 1.135 0.731 5.897) 6.050 ======================= Grid point 235 (110/361) ======================= q-point: (-0.40 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.658 ( -10.491 19.784 4.768) 22.896 1.728 ( -14.171 17.398 1.575) 22.494 2.925 ( -19.452 15.414 5.254) 25.369 3.153 ( -10.381 -10.889 0.833) 15.068 3.354 ( 3.844 10.104 3.005) 11.220 3.409 ( 0.158 -11.304 9.438) 14.726 4.066 ( -3.911 0.139 -8.119) 9.012 4.337 ( -2.029 -10.194 1.617) 10.519 4.639 ( 3.865 -5.364 1.099) 6.702 5.003 ( 1.926 -11.725 1.750) 12.010 5.042 ( 1.287 -3.535 -0.828) 3.852 5.902 ( -3.003 1.417 7.749) 8.430 5.995 ( 2.437 4.478 -0.842) 5.167 6.548 ( -37.689 -11.185 15.969) 42.433 7.688 ( -20.009 -0.789 11.798) 23.241 8.008 ( 4.994 -5.799 -6.983) 10.360 8.715 ( 0.608 -7.772 7.247) 10.644 9.102 ( -5.238 -5.334 -2.344) 7.835 9.472 ( -8.414 -17.130 0.134) 19.086 10.138 ( 4.643 3.841 1.109) 6.127 11.487 ( 3.319 33.983 -4.421) 34.430 11.691 ( 5.622 12.808 4.866) 14.810 12.432 ( -3.463 -0.684 -2.503) 4.327 12.610 ( -11.967 10.924 7.001) 17.651 13.171 ( 5.663 -0.434 -1.317) 5.831 13.674 ( 0.372 -13.026 -6.612) 14.613 14.450 ( 8.781 6.825 -6.200) 12.733 15.370 ( 11.793 -15.864 -9.515) 21.938 16.390 ( 0.657 -3.560 16.988) 17.369 19.234 ( 12.036 -0.496 -9.915) 15.602 19.668 ( 6.832 3.968 4.724) 9.205 20.114 ( 6.039 11.049 5.689) 13.817 20.578 ( 7.693 -1.578 -14.976) 16.911 22.061 ( -30.544 -19.093 7.652) 36.824 24.198 ( 4.174 3.873 -2.338) 6.155 24.551 ( -0.402 -1.192 3.427) 3.651 ======================= Grid point 236 (111/361) ======================= q-point: (-0.30 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.444 ( -5.492 20.187 13.752) 25.036 1.490 ( -5.883 19.911 10.063) 23.072 2.622 ( -14.241 20.516 15.736) 29.518 3.113 ( -7.520 -7.969 -0.012) 10.957 3.389 ( 4.629 5.532 4.103) 8.298 3.642 ( -0.788 -11.606 9.878) 15.261 3.926 ( -2.920 -3.389 -7.790) 8.983 4.400 ( -0.663 -8.371 -2.192) 8.678 4.706 ( -0.012 -6.143 -3.410) 7.026 5.063 ( 1.541 -0.524 0.235) 1.644 5.259 ( 8.208 -10.604 7.768) 15.497 5.966 ( -2.778 0.163 8.037) 8.505 5.993 ( 0.100 2.349 4.980) 5.507 6.347 ( -35.992 -14.566 19.796) 43.583 7.543 ( -16.636 1.134 9.355) 19.120 8.060 ( 2.033 -6.920 -4.995) 8.773 8.844 ( 4.173 -0.093 -0.498) 4.204 9.067 ( -5.320 -13.374 -1.559) 14.477 9.548 ( -5.091 -18.272 3.298) 19.252 10.151 ( 0.147 4.946 -0.246) 4.954 11.125 ( 0.004 34.434 -5.856) 34.929 11.724 ( 5.921 13.841 7.106) 16.647 12.354 ( -1.893 0.791 -4.494) 4.940 12.455 ( -8.415 10.592 7.639) 15.536 13.250 ( 6.909 2.306 -1.282) 7.395 13.610 ( -1.720 -3.162 -14.739) 15.172 14.318 ( 0.172 7.431 -8.303) 11.144 15.509 ( 5.842 -15.099 -12.723) 20.591 16.966 ( 15.060 -19.857 36.412) 44.124 19.273 ( 11.111 -2.291 -13.952) 17.982 19.668 ( 3.421 8.714 -6.560) 11.431 20.053 ( -3.742 7.591 -0.336) 8.470 20.666 ( 14.215 0.748 -1.282) 14.292 21.877 ( -32.233 -18.874 8.322) 38.268 24.194 ( 3.870 3.078 -2.246) 5.431 24.506 ( -6.461 1.933 -4.051) 7.867 ======================= Grid point 237 (112/361) ======================= q-point: (-0.20 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.410 ( -0.587 17.040 14.177) 22.174 1.526 ( 7.739 14.473 19.265) 25.308 2.588 ( -2.215 17.426 27.125) 32.316 3.092 ( -2.178 -5.013 -1.407) 5.644 3.473 ( 1.146 2.298 7.749) 8.163 3.782 ( -1.435 -9.091 -2.591) 9.562 3.898 ( -2.023 -9.019 1.640) 9.387 4.410 ( 1.526 -2.373 -5.707) 6.367 4.682 ( -0.103 -4.459 -7.026) 8.322 5.108 ( 2.704 1.311 1.323) 3.283 5.542 ( 5.774 -7.756 4.982) 10.878 5.978 ( -2.490 0.501 3.707) 4.494 6.119 ( -4.548 -1.301 18.994) 19.574 6.312 ( -26.060 -18.040 25.834) 40.889 7.429 ( -13.612 0.971 8.451) 16.051 8.003 ( -5.628 -0.396 -6.474) 8.587 8.853 ( 6.092 0.135 -4.500) 7.575 9.175 ( -2.491 -17.719 2.015) 18.006 9.755 ( 1.767 -18.984 5.119) 19.741 10.047 ( -3.206 13.943 2.880) 14.594 10.756 ( 0.455 30.511 -4.478) 30.841 11.746 ( 5.674 17.038 3.503) 18.297 12.249 ( -2.721 0.579 -7.147) 7.669 12.350 ( -3.940 7.359 4.171) 9.332 13.186 ( 5.610 12.936 -12.298) 18.710 13.502 ( -0.050 0.847 3.867) 3.959 14.196 ( -3.397 0.726 -2.828) 4.479 15.493 ( -0.418 -12.490 -16.723) 20.877 17.866 ( 15.895 -30.668 26.723) 43.673 19.207 ( -2.517 -6.007 -15.413) 16.733 19.539 ( 9.175 8.139 -12.973) 17.852 19.922 ( -3.951 3.214 -2.142) 5.525 20.859 ( 7.692 2.293 7.631) 11.075 21.704 ( -22.421 -10.768 6.774) 25.779 24.202 ( 3.699 1.683 -1.762) 4.430 24.235 ( -10.936 10.409 -7.409) 16.817 ======================= Grid point 238 (113/361) ======================= q-point: (-0.10 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.513 ( 4.965 10.371 18.312) 21.623 1.809 ( 12.971 10.086 18.432) 24.692 2.866 ( 8.829 8.003 26.015) 28.614 3.115 ( 3.332 -2.693 -1.659) 4.594 3.549 ( -5.895 1.164 12.585) 13.946 3.775 ( 0.964 -12.128 -11.472) 16.722 3.955 ( -5.063 -6.962 -0.332) 8.615 4.345 ( 3.613 4.162 -9.136) 10.670 4.672 ( 3.796 -2.390 -1.651) 4.780 5.088 ( -2.607 4.157 -1.796) 5.226 5.666 ( -0.155 -3.559 1.493) 3.862 5.973 ( -5.176 0.012 4.470) 6.839 6.366 ( -9.174 -5.180 33.436) 35.057 6.550 ( -7.334 -16.992 21.478) 28.352 7.293 ( -12.836 1.359 0.249) 12.910 7.831 ( -7.442 6.822 3.738) 10.765 8.953 ( 6.740 -7.270 -0.804) 9.946 9.334 ( 0.797 -16.829 0.134) 16.849 9.887 ( -5.823 15.460 8.657) 18.651 10.000 ( 1.837 -4.523 2.871) 5.663 10.538 ( 5.192 12.745 -1.986) 13.905 11.650 ( 7.905 22.852 -1.915) 24.257 12.098 ( -2.622 -0.597 -8.657) 9.065 12.336 ( 2.169 -1.427 -1.129) 2.831 13.039 ( 2.949 14.223 -0.086) 14.526 13.597 ( 3.439 2.389 7.546) 8.630 14.107 ( -5.613 -1.757 -2.513) 6.396 15.329 ( -5.607 -8.848 -18.172) 20.975 18.474 ( 9.394 -18.868 4.942) 21.648 18.961 ( -11.457 -4.721 -13.687) 18.463 19.430 ( -1.118 0.477 -10.690) 10.759 19.855 ( -3.045 -0.091 -0.198) 3.053 21.022 ( 0.956 -3.727 8.980) 9.769 21.635 ( 0.328 2.834 2.747) 3.960 23.922 ( -6.685 11.864 -2.944) 13.933 24.230 ( 3.599 0.123 -1.075) 3.758 ======================= Grid point 242 (114/361) ======================= q-point: ( 0.30 -0.70 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.424 ( -9.487 -0.000 -5.637) 11.036 2.473 ( -5.931 -0.000 -5.216) 7.898 3.072 ( -5.036 -0.000 -2.003) 5.420 3.166 ( -10.246 -0.000 -0.486) 10.258 3.302 ( -9.596 -0.000 6.288) 11.472 3.588 ( 8.426 0.000 2.116) 8.688 4.213 ( 8.388 0.000 4.680) 9.606 4.455 ( 6.333 0.000 2.908) 6.969 4.517 ( -10.847 -0.000 -13.540) 17.349 4.548 ( -11.056 -0.000 -3.796) 11.689 5.036 ( -4.394 -0.000 -0.377) 4.410 5.996 ( -2.270 -0.000 -1.881) 2.948 6.169 ( -4.509 -0.000 0.217) 4.515 6.932 ( -23.618 -0.000 12.227) 26.595 7.687 ( -21.293 -0.000 29.806) 36.630 8.232 ( -1.096 -0.000 11.572) 11.624 8.259 ( -10.023 -0.000 -10.557) 14.558 9.161 ( -4.550 -0.000 4.972) 6.740 9.402 ( -9.757 -0.000 -6.309) 11.619 10.341 ( -0.083 -0.000 -6.757) 6.758 11.421 ( 15.791 0.000 9.023) 18.187 12.204 ( 13.117 0.000 -5.842) 14.359 12.662 ( 4.337 0.000 0.130) 4.339 12.850 ( 0.612 0.000 4.655) 4.695 13.058 ( -13.035 -0.000 10.214) 16.560 13.533 ( -5.293 -0.000 -10.356) 11.630 13.924 ( 15.733 0.000 9.973) 18.628 14.802 ( 12.318 0.000 -4.489) 13.110 16.831 ( -12.353 -0.000 -21.877) 25.124 19.031 ( 7.811 0.000 2.236) 8.125 19.265 ( 12.224 0.000 1.165) 12.280 19.714 ( 10.020 0.000 7.314) 12.405 21.042 ( 2.550 0.000 -18.961) 19.132 22.131 ( -15.813 -0.000 11.430) 19.511 24.129 ( 7.362 0.000 0.964) 7.425 24.441 ( -0.103 -0.000 3.291) 3.293 ======================= Grid point 244 (115/361) ======================= q-point: (-0.60 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.203 ( -7.891 8.356 -2.384) 11.737 2.286 ( -8.560 6.202 -4.499) 11.488 2.989 ( -8.799 -3.479 3.336) 10.033 3.047 ( -8.298 -9.034 -0.394) 12.273 3.221 ( -10.504 0.858 4.391) 11.417 3.739 ( 6.526 4.983 2.394) 8.553 4.189 ( -7.105 5.003 -4.926) 9.989 4.271 ( -4.834 1.272 -3.429) 6.062 4.449 ( 4.718 -1.716 0.978) 5.115 4.649 ( -0.723 -11.862 3.767) 12.467 4.959 ( -2.653 -1.474 -2.385) 3.860 5.935 ( -3.973 0.747 1.437) 4.291 6.120 ( -0.454 3.541 -0.657) 3.630 6.682 ( -34.607 -4.374 13.043) 37.241 7.724 ( -16.344 -1.078 19.335) 25.340 8.026 ( -3.448 0.743 -9.591) 10.219 8.385 ( -1.754 -5.688 11.145) 12.635 9.139 ( -5.724 0.741 3.472) 6.735 9.247 ( -7.471 -6.200 -3.106) 10.194 10.252 ( 1.371 3.599 -5.035) 6.339 11.703 ( 10.921 2.010 6.346) 12.790 12.223 ( 7.444 12.909 -3.747) 15.365 12.618 ( -0.741 14.429 -0.118) 14.449 12.912 ( -12.350 -0.833 7.710) 14.583 13.016 ( 1.509 -9.451 -0.589) 9.589 13.385 ( -3.720 -6.256 -6.040) 9.458 14.309 ( 16.474 0.725 10.874) 19.753 14.940 ( 14.585 -6.320 -9.389) 18.461 16.457 ( -9.440 0.503 -11.310) 14.740 19.154 ( 12.880 -0.276 -7.485) 14.900 19.492 ( 9.871 0.693 9.863) 13.971 19.994 ( 16.229 1.062 7.372) 17.857 20.809 ( -0.448 2.112 -19.445) 19.565 21.997 ( -23.568 -5.927 8.660) 25.799 24.227 ( 5.059 1.131 0.694) 5.230 24.478 ( 0.108 0.075 3.244) 3.247 ======================= Grid point 245 (116/361) ======================= q-point: (-0.50 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.999 ( -7.273 16.231 5.005) 18.476 2.028 ( -7.542 14.432 -0.535) 16.293 2.947 ( -10.038 -10.560 1.734) 14.672 3.023 ( -11.379 -3.860 -0.820) 12.044 3.182 ( -2.875 -6.898 9.544) 12.122 3.682 ( 2.038 16.828 0.256) 16.952 4.070 ( -3.130 1.223 -7.287) 8.024 4.195 ( -2.603 -4.504 2.711) 5.866 4.557 ( 1.909 -3.311 2.506) 4.570 4.760 ( -2.325 -13.936 2.249) 14.307 4.984 ( 3.186 -2.457 2.154) 4.564 5.918 ( -4.343 0.419 6.380) 7.730 6.072 ( 0.155 4.029 -1.159) 4.196 6.378 ( -35.815 -7.572 13.409) 38.985 7.692 ( -14.852 0.827 11.433) 18.761 7.924 ( 2.876 -2.678 -7.601) 8.557 8.548 ( -3.372 -8.772 10.472) 14.070 9.078 ( -5.207 0.996 1.131) 5.420 9.206 ( -6.240 -10.556 -0.714) 12.283 10.212 ( 3.385 3.228 -1.888) 5.044 11.840 ( 5.971 8.190 3.461) 10.710 12.113 ( 5.381 23.551 -2.501) 24.287 12.442 ( -5.481 7.011 -1.572) 9.037 12.783 ( -12.849 7.089 9.281) 17.363 13.144 ( 8.753 -4.593 -3.757) 10.575 13.399 ( -2.275 -15.158 -3.045) 15.628 14.548 ( 8.799 4.198 -0.959) 9.796 15.100 ( 13.257 -12.419 -11.899) 21.716 16.348 ( -1.498 -1.232 9.340) 9.539 19.221 ( 13.427 -0.697 -13.160) 18.814 19.727 ( 7.571 2.249 7.589) 10.953 20.286 ( 11.817 7.003 6.258) 15.094 20.559 ( 3.961 -0.448 -17.387) 17.838 21.793 ( -28.212 -10.267 8.006) 31.071 24.264 ( 2.771 3.009 -0.588) 4.133 24.520 ( -0.677 -1.796 2.048) 2.807 ======================= Grid point 246 (117/361) ======================= q-point: (-0.40 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.795 ( -5.789 17.691 7.173) 19.949 1.878 ( -0.385 21.525 9.490) 23.527 2.847 ( -10.066 2.218 2.234) 10.546 2.955 ( -5.578 -7.908 2.532) 10.003 3.377 ( -0.180 -11.014 7.349) 13.242 3.615 ( 2.867 10.905 5.851) 12.703 3.888 ( -7.663 2.060 -5.214) 9.495 4.272 ( 3.414 -5.246 -0.097) 6.260 4.599 ( -1.907 -5.178 -1.088) 5.624 4.952 ( 1.607 -14.773 5.090) 15.708 5.109 ( 5.169 -1.979 6.201) 8.312 5.947 ( -7.598 -1.609 9.598) 12.347 6.018 ( -9.815 -0.052 8.665) 13.093 6.175 ( -17.869 -5.090 8.199) 20.308 7.581 ( -13.509 2.792 7.780) 15.837 7.939 ( 3.691 -5.372 -5.919) 8.805 8.705 ( -4.700 -12.761 8.565) 16.072 8.990 ( -3.075 2.580 -3.110) 5.078 9.255 ( -3.116 -12.772 3.302) 13.555 10.229 ( 3.340 3.318 0.663) 4.754 11.743 ( 2.251 29.053 -5.138) 29.590 11.958 ( 2.372 14.506 3.522) 15.115 12.334 ( -4.471 -1.658 -2.126) 5.221 12.663 ( -8.368 10.294 9.139) 16.109 13.275 ( 10.105 -0.006 -0.569) 10.121 13.447 ( -2.069 -12.924 -6.625) 14.670 14.465 ( -0.121 7.735 -10.238) 12.832 15.226 ( 8.057 -15.011 -14.346) 22.272 16.698 ( 9.152 -9.964 28.586) 31.626 19.224 ( 10.198 -2.558 -17.495) 20.411 19.804 ( 3.096 5.815 -2.281) 6.972 20.157 ( -6.495 3.742 -10.589) 12.974 20.712 ( 18.169 4.046 4.570) 19.167 21.610 ( -24.306 -11.057 9.470) 28.332 24.253 ( 1.971 3.157 -1.542) 4.029 24.507 ( -4.292 -1.224 -1.985) 4.884 ======================= Grid point 247 (118/361) ======================= q-point: (-0.30 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( 4.815 16.431 8.630) 19.174 1.837 ( 2.974 20.085 13.277) 24.259 2.802 ( -1.881 3.574 9.490) 10.314 3.002 ( -1.235 -4.049 4.153) 5.930 3.498 ( 1.767 -4.988 -0.117) 5.293 3.712 ( -6.608 7.755 14.555) 17.767 3.718 ( -1.850 -9.858 -6.034) 11.705 4.370 ( 6.684 -1.876 -2.173) 7.274 4.592 ( -1.951 -4.957 -2.377) 5.834 5.106 ( 1.879 -3.495 3.243) 5.125 5.351 ( 5.424 -11.141 7.397) 14.432 5.942 ( -14.868 -4.498 16.550) 22.698 6.071 ( -9.167 -3.534 13.854) 16.984 6.141 ( -3.677 -1.880 8.782) 9.705 7.459 ( -12.770 2.146 6.636) 14.550 7.944 ( 0.306 -4.118 -5.881) 7.186 8.841 ( -6.447 -16.648 0.961) 17.879 8.903 ( 1.481 2.968 0.498) 3.354 9.443 ( 3.493 -14.367 6.163) 16.019 10.244 ( 1.380 7.873 4.292) 9.072 11.369 ( 0.033 35.026 -6.773) 35.675 11.946 ( 0.787 6.768 3.818) 7.810 12.242 ( -4.429 -1.335 -5.673) 7.320 12.564 ( -4.027 13.425 6.162) 15.311 13.320 ( 5.404 -0.090 -14.054) 15.058 13.493 ( 3.339 -0.349 7.520) 8.235 14.252 ( -5.045 5.215 -6.207) 9.548 15.240 ( 2.002 -14.599 -17.495) 22.874 17.394 ( 13.103 -20.429 31.310) 39.615 19.109 ( 0.490 -4.608 -19.443) 19.988 19.677 ( 2.307 6.747 -13.723) 15.465 19.939 ( -7.539 -0.747 -4.439) 8.780 20.955 ( 8.612 7.624 10.225) 15.390 21.554 ( -8.099 -6.622 7.006) 12.591 24.235 ( 1.896 1.870 -1.847) 3.241 24.355 ( -8.168 3.446 -5.985) 10.697 ======================= Grid point 248 (119/361) ======================= q-point: (-0.20 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.778 ( 7.874 17.878 9.720) 21.820 1.990 ( 12.361 9.616 15.074) 21.736 2.922 ( 4.552 -2.585 4.911) 7.177 3.098 ( 0.345 -0.133 9.084) 9.092 3.548 ( 0.664 -10.672 -8.673) 13.768 3.616 ( -7.348 2.892 9.709) 12.515 3.832 ( 0.151 -3.221 3.123) 4.489 4.417 ( 5.734 3.527 -3.968) 7.814 4.616 ( 1.983 -3.540 1.519) 4.332 5.154 ( -0.521 2.034 0.817) 2.253 5.555 ( 1.320 -8.736 1.559) 8.972 5.974 ( -4.687 -0.103 3.548) 5.880 6.198 ( -15.363 -10.699 32.536) 37.538 6.353 ( 2.236 -6.077 18.375) 19.483 7.316 ( -13.085 1.245 1.909) 13.282 7.891 ( -2.201 0.661 -1.352) 2.666 8.846 ( 0.056 -7.460 -3.327) 8.168 9.031 ( 0.815 -12.748 3.886) 13.352 9.725 ( 4.974 -14.487 5.654) 16.328 10.227 ( -1.362 14.439 9.315) 17.237 10.986 ( 0.491 31.077 -5.310) 31.531 11.909 ( -3.916 4.566 1.018) 6.101 12.098 ( -0.516 1.104 -10.546) 10.616 12.453 ( 1.717 13.531 0.031) 13.639 13.221 ( 3.293 4.050 -6.350) 8.220 13.655 ( 5.690 4.311 9.408) 11.810 14.088 ( -7.206 0.159 -2.627) 7.671 15.130 ( -3.277 -12.473 -18.527) 22.573 18.090 ( 9.825 -21.001 20.399) 30.882 18.878 ( -6.520 -4.210 -15.933) 17.723 19.445 ( -2.625 0.671 -16.828) 17.045 19.845 ( -5.398 -0.543 1.158) 5.548 21.050 ( -0.616 5.810 7.352) 9.391 21.671 ( 9.783 1.159 4.696) 10.913 24.106 ( -7.434 7.710 -5.647) 12.108 24.232 ( 1.940 0.111 -1.657) 2.554 ======================= Grid point 249 (120/361) ======================= q-point: (-0.10 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.902 ( 8.212 10.022 12.724) 18.160 2.308 ( 15.982 8.888 14.882) 23.578 3.053 ( 6.017 -6.232 -3.100) 9.200 3.199 ( -5.822 -4.683 8.379) 11.226 3.498 ( -1.980 -11.677 -10.618) 15.907 3.675 ( 0.497 -0.935 1.752) 2.047 3.886 ( 4.715 5.343 6.060) 9.355 4.383 ( 4.642 7.739 -4.764) 10.205 4.749 ( 3.303 -2.868 7.702) 8.858 5.073 ( -3.515 6.781 -1.303) 7.748 5.592 ( -3.510 -5.828 -3.312) 7.567 5.928 ( -7.710 -0.779 4.425) 8.924 6.537 ( -9.737 -12.027 29.677) 33.470 6.710 ( 1.678 -5.826 23.818) 24.578 7.109 ( -12.154 2.429 -0.950) 12.431 7.877 ( -2.732 2.918 8.273) 9.189 8.898 ( -1.429 -11.422 -2.751) 11.836 9.250 ( 6.718 -15.091 3.483) 16.882 9.895 ( -4.021 -2.424 1.696) 4.992 10.164 ( -3.592 13.007 9.671) 16.601 10.741 ( 5.799 20.368 -1.603) 21.239 11.772 ( -7.950 -1.455 -5.134) 9.575 12.018 ( 10.841 5.756 -7.289) 14.275 12.401 ( 6.881 7.540 -2.634) 10.543 13.186 ( 1.488 6.900 1.851) 7.297 13.780 ( 2.539 3.680 5.558) 7.133 13.978 ( -5.173 -0.228 0.251) 5.184 14.944 ( -6.307 -9.188 -15.841) 19.368 18.472 ( -1.691 -10.407 0.940) 10.585 18.669 ( 3.184 -2.675 -11.609) 12.331 19.216 ( -7.351 -3.524 -9.548) 12.554 19.762 ( -12.313 1.255 5.267) 13.451 21.075 ( 4.671 -1.292 -2.625) 5.512 21.877 ( 13.117 7.414 6.746) 16.509 23.910 ( -2.232 7.235 -2.773) 8.063 24.250 ( 1.732 -1.728 -0.908) 2.610 ======================= Grid point 254 (121/361) ======================= q-point: ( 0.40 -0.60 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.177 ( -3.396 -0.000 5.849) 6.763 2.181 ( -6.037 -0.000 -1.793) 6.298 2.832 ( -10.477 -0.000 1.988) 10.664 2.923 ( -9.971 -0.000 2.102) 10.190 3.150 ( -5.630 -0.000 6.544) 8.633 3.833 ( 2.965 0.000 -9.063) 9.535 4.095 ( 3.073 0.000 -0.075) 3.074 4.191 ( -5.766 -0.000 1.454) 5.946 4.530 ( 1.876 0.000 4.003) 4.421 4.581 ( -7.344 -0.000 2.229) 7.675 4.961 ( 3.798 0.000 3.539) 5.191 5.921 ( -4.828 -0.000 5.657) 7.437 6.122 ( 2.137 0.000 -3.034) 3.711 6.294 ( -37.543 -0.000 14.137) 40.116 7.701 ( -12.359 -0.000 11.041) 16.573 7.906 ( 1.153 0.000 -7.199) 7.290 8.456 ( -4.509 -0.000 10.973) 11.864 9.100 ( -5.306 -0.000 1.840) 5.616 9.100 ( -5.141 -0.000 -0.169) 5.144 10.243 ( 2.638 0.000 -2.926) 3.940 11.920 ( 6.972 0.000 5.773) 9.052 12.248 ( -0.458 -0.000 -4.187) 4.212 12.752 ( -8.633 -0.000 -0.197) 8.635 12.861 ( 8.494 0.000 0.412) 8.504 12.919 ( -7.927 -0.000 4.760) 9.247 13.266 ( 0.581 0.000 -3.191) 3.244 14.594 ( 8.207 0.000 2.925) 8.713 14.972 ( 14.408 0.000 -14.578) 20.497 16.338 ( -1.990 -0.000 6.930) 7.210 19.214 ( 13.890 0.000 -14.444) 20.038 19.748 ( 7.746 0.000 8.561) 11.545 20.352 ( 16.104 0.000 7.141) 17.616 20.558 ( 0.831 0.000 -19.207) 19.225 21.696 ( -27.665 -0.000 8.587) 28.967 24.294 ( 2.133 0.000 0.579) 2.210 24.500 ( -0.618 -0.000 0.955) 1.138 ======================= Grid point 256 (122/361) ======================= q-point: (-0.50 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.061 ( -4.192 9.488 2.336) 10.633 2.225 ( 1.711 13.635 12.149) 18.343 2.758 ( -8.376 -4.761 1.793) 9.801 2.827 ( -6.654 -8.590 0.875) 10.901 3.233 ( -0.467 -3.403 9.008) 9.640 3.692 ( -0.439 -0.385 -12.338) 12.352 4.096 ( -4.302 14.817 7.443) 17.130 4.210 ( 6.575 -1.637 0.063) 6.776 4.526 ( -4.407 -2.764 2.062) 5.596 4.651 ( -1.042 -14.321 5.233) 15.283 5.103 ( 5.019 0.176 7.356) 8.907 5.929 ( -7.061 -0.177 8.241) 10.854 5.992 ( -27.140 -1.897 15.904) 31.514 6.130 ( 1.354 -0.655 -1.822) 2.363 7.625 ( -11.770 1.401 5.956) 13.266 7.884 ( 4.845 -0.826 -4.975) 6.993 8.513 ( -8.501 -6.430 8.755) 13.794 9.038 ( -4.011 1.681 0.562) 4.385 9.096 ( -0.906 -4.416 3.358) 5.621 10.270 ( 4.099 1.113 0.425) 4.268 12.022 ( 2.461 6.531 4.241) 8.167 12.194 ( 0.865 0.147 -4.449) 4.535 12.481 ( -5.570 20.669 -6.457) 22.359 12.809 ( -8.627 6.498 10.274) 14.906 13.086 ( 2.324 -19.382 -4.968) 20.143 13.326 ( 6.753 -0.256 3.835) 7.770 14.584 ( -1.966 4.553 -6.711) 8.345 15.000 ( 11.105 -8.031 -17.443) 22.182 16.584 ( 7.111 -2.910 23.771) 24.982 19.189 ( 10.408 -1.027 -19.634) 22.246 19.876 ( 2.110 1.974 1.259) 3.152 20.197 ( -7.505 0.908 -17.730) 19.274 20.785 ( 22.176 2.810 6.995) 23.423 21.466 ( -22.481 -4.319 11.551) 25.642 24.300 ( 0.147 1.679 -0.634) 1.801 24.480 ( -2.554 -1.172 -1.926) 3.407 ======================= Grid point 257 (123/361) ======================= q-point: (-0.40 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.991 ( 3.203 11.523 5.449) 13.143 2.232 ( 3.158 21.668 9.603) 23.910 2.748 ( -2.874 -6.128 3.110) 7.449 2.913 ( -0.127 -8.134 5.551) 9.849 3.356 ( -0.818 -6.898 2.856) 7.510 3.563 ( -1.760 -6.306 -10.479) 12.356 3.995 ( -4.226 18.677 13.631) 23.506 4.343 ( 9.743 -1.308 -0.355) 9.837 4.518 ( -2.928 -2.411 1.380) 4.036 4.883 ( -0.092 -18.407 7.051) 19.711 5.260 ( 4.012 -0.119 7.699) 8.683 5.875 ( -18.329 -2.144 20.841) 27.837 6.003 ( -4.057 -3.861 8.291) 10.005 6.139 ( 0.441 0.579 1.716) 1.864 7.496 ( -12.340 1.494 3.824) 13.005 7.906 ( 4.698 0.447 -4.031) 6.206 8.551 ( -10.014 -13.376 4.781) 17.380 8.973 ( -2.191 3.399 0.810) 4.124 9.241 ( 4.337 -7.650 6.715) 11.065 10.346 ( 4.661 3.473 4.689) 7.468 11.968 ( 2.121 23.883 -3.278) 24.200 12.062 ( -3.119 10.510 -4.545) 11.868 12.207 ( -4.949 -1.611 -5.544) 7.605 12.772 ( -5.734 8.409 10.779) 14.825 13.162 ( -0.493 -14.689 -9.055) 17.263 13.527 ( 9.974 2.481 9.058) 13.699 14.362 ( -7.315 6.035 -8.012) 12.415 14.988 ( 5.183 -11.906 -19.323) 23.281 17.121 ( 11.593 -9.617 30.102) 33.660 19.041 ( 2.371 -2.679 -21.947) 22.236 19.783 ( -3.029 4.747 -14.462) 15.520 19.911 ( -6.754 -2.047 -5.738) 9.095 21.111 ( 11.901 8.614 10.919) 18.305 21.439 ( -4.122 -6.155 9.025) 11.675 24.267 ( -0.368 1.461 -1.711) 2.280 24.386 ( -5.245 0.437 -5.107) 7.334 ======================= Grid point 258 (124/361) ======================= q-point: (-0.30 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.101 ( 15.284 12.345 5.623) 20.436 2.194 ( 3.348 16.572 9.534) 19.409 2.841 ( 3.582 -4.879 1.804) 6.316 3.044 ( -3.255 -5.981 6.956) 9.734 3.369 ( -2.132 -7.749 -7.637) 11.087 3.536 ( -0.167 -9.304 -2.924) 9.754 3.984 ( 0.531 15.788 14.134) 21.197 4.466 ( 4.638 1.490 2.100) 5.305 4.554 ( 3.707 -2.647 1.569) 4.817 5.096 ( -1.018 -10.718 4.948) 11.849 5.404 ( 1.478 -4.590 4.774) 6.786 5.961 ( -5.716 -1.132 11.053) 12.495 6.068 ( -8.553 -3.841 17.844) 20.158 6.256 ( 1.376 -4.727 14.199) 15.028 7.338 ( -12.686 0.966 1.398) 12.799 7.905 ( 2.131 2.145 -1.620) 3.430 8.592 ( -7.931 -16.689 0.658) 18.489 8.958 ( 0.590 1.000 2.803) 3.034 9.498 ( 6.817 -9.864 7.575) 14.183 10.437 ( 2.697 8.432 9.170) 12.746 11.580 ( -0.376 31.633 -10.433) 33.311 11.927 ( -11.999 0.364 -0.083) 12.005 12.115 ( 4.263 0.481 -9.261) 10.207 12.724 ( -1.996 13.577 5.986) 14.972 13.162 ( 0.216 -9.810 -7.025) 12.068 13.754 ( 8.904 5.670 10.598) 14.958 14.117 ( -9.611 2.715 -4.332) 10.886 14.893 ( -0.403 -12.700 -19.704) 23.446 17.759 ( 10.803 -14.363 26.892) 32.344 18.810 ( -2.802 -3.068 -17.604) 18.087 19.450 ( -7.005 0.051 -20.083) 21.270 19.843 ( -3.017 0.216 0.681) 3.101 21.192 ( -1.867 8.665 6.767) 11.152 21.675 ( 14.367 -0.805 7.806) 16.370 24.204 ( -5.850 3.055 -5.422) 8.541 24.236 ( -0.284 0.544 -3.221) 3.279 ======================= Grid point 259 (125/361) ======================= q-point: (-0.20 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.145 ( 6.902 15.812 4.925) 17.942 2.441 ( 18.178 5.570 11.887) 22.423 2.954 ( 4.708 -4.102 -1.315) 6.381 3.075 ( -11.072 -8.462 5.042) 14.820 3.307 ( -1.442 -8.143 -8.517) 11.871 3.606 ( 5.375 -6.395 -5.631) 10.074 4.059 ( 5.939 12.045 11.371) 17.597 4.509 ( 1.371 5.710 3.055) 6.619 4.691 ( 5.604 -3.182 4.805) 8.039 5.151 ( -3.120 -0.036 1.385) 3.414 5.464 ( -3.887 -6.570 -1.529) 7.785 5.917 ( -6.762 -0.357 1.315) 6.898 6.347 ( -5.828 -7.920 28.145) 29.813 6.585 ( 2.895 -7.828 22.738) 24.221 7.152 ( -11.637 2.146 0.689) 11.853 7.914 ( 0.709 1.829 3.987) 4.443 8.643 ( -5.637 -16.133 -1.401) 17.147 9.055 ( 4.422 -5.954 3.749) 8.310 9.758 ( 4.885 -8.382 5.506) 11.155 10.446 ( -4.838 14.361 9.699) 17.992 11.198 ( 2.029 26.546 -8.172) 27.850 11.702 ( -14.579 -2.658 -5.279) 15.732 12.104 ( 10.248 2.591 -7.211) 12.796 12.627 ( 2.928 14.842 0.214) 15.130 13.194 ( 0.548 -5.972 -1.047) 6.087 13.845 ( -5.094 3.285 0.665) 6.098 14.013 ( 1.690 3.814 6.684) 7.879 14.750 ( -3.417 -11.559 -16.096) 20.109 18.266 ( 4.244 -11.238 13.648) 18.182 18.628 ( 1.117 -1.840 -11.395) 11.596 19.136 ( -7.438 -4.422 -15.374) 17.641 19.796 ( -6.448 1.991 3.152) 7.448 21.129 ( 1.017 6.156 -3.162) 6.994 21.985 ( 14.623 4.358 10.070) 18.283 24.024 ( -2.986 5.048 -5.135) 7.795 24.214 ( -0.113 -2.107 -1.988) 2.899 ======================= Grid point 260 (126/361) ======================= q-point: (-0.10 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.188 ( 4.208 5.655 4.697) 8.470 2.778 ( 12.495 6.896 12.077) 18.695 2.996 ( 0.163 -5.899 -3.146) 6.687 3.047 ( -8.645 -8.988 2.244) 12.671 3.285 ( 0.121 -6.747 -5.351) 8.612 3.660 ( 11.500 -1.074 -9.758) 15.120 4.175 ( 6.757 7.734 4.408) 11.176 4.474 ( 0.300 9.248 0.874) 9.294 4.864 ( 1.802 -2.653 8.344) 8.939 5.077 ( -3.411 5.026 0.912) 6.142 5.372 ( -9.468 -6.337 -6.868) 13.303 5.859 ( -7.537 -2.210 4.704) 9.155 6.579 ( -7.449 -5.602 7.174) 11.762 6.878 ( -1.852 -4.910 9.938) 11.238 7.152 ( -8.373 1.276 34.002) 35.041 8.006 ( 3.019 1.604 8.762) 9.406 8.676 ( -7.304 -14.614 -1.427) 16.400 9.291 ( 8.900 -14.021 3.921) 17.064 9.850 ( -4.464 3.889 0.901) 5.988 10.272 ( -9.346 13.144 3.934) 16.601 11.015 ( 8.659 15.056 -2.246) 17.513 11.457 ( -11.997 -5.498 -8.286) 15.582 12.202 ( 14.207 1.866 -2.301) 14.513 12.580 ( 7.245 10.610 -0.113) 12.849 13.238 ( -0.731 -2.153 1.478) 2.711 13.713 ( -8.451 -1.045 -0.924) 8.565 14.084 ( 2.255 5.804 2.734) 6.800 14.654 ( -1.053 -6.563 -6.164) 9.065 18.239 ( -8.463 -0.181 -14.872) 17.112 18.686 ( 10.854 -4.042 -5.717) 12.917 19.016 ( -3.197 -5.951 1.264) 6.873 19.682 ( -12.705 4.899 6.452) 15.068 21.069 ( 6.900 -0.290 -10.826) 12.841 22.238 ( 9.837 9.020 11.907) 17.886 23.922 ( 1.791 3.840 -3.268) 5.351 24.223 ( -0.278 -4.180 -0.696) 4.246 ======================= Grid point 266 (127/361) ======================= q-point: (-0.50 0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.111 ( 1.530 -0.000 2.816) 3.205 2.528 ( 4.285 0.000 15.233) 15.824 2.676 ( -3.241 -0.000 0.863) 3.354 2.738 ( 0.407 -0.000 2.089) 2.129 3.293 ( -1.504 -0.000 4.660) 4.897 3.503 ( -2.364 -0.000 -12.184) 12.411 4.274 ( 7.077 0.000 -3.844) 8.053 4.282 ( -1.003 -0.000 14.036) 14.071 4.564 ( -1.072 -0.000 -1.991) 2.261 4.581 ( -1.543 0.000 14.359) 14.442 5.266 ( 3.621 -0.000 7.841) 8.637 5.859 ( -18.920 -0.000 21.807) 28.870 5.959 ( -2.108 -0.000 6.063) 6.419 6.145 ( 1.137 -0.000 0.208) 1.155 7.508 ( -11.961 -0.000 2.190) 12.160 7.927 ( 7.625 -0.000 -3.156) 8.253 8.411 ( -13.257 0.000 6.111) 14.598 9.008 ( -3.187 -0.000 1.616) 3.573 9.168 ( 4.527 -0.000 6.795) 8.165 10.377 ( 5.820 -0.000 4.699) 7.480 12.091 ( -6.877 -0.000 4.026) 7.969 12.144 ( 2.822 0.000 -6.149) 6.765 12.383 ( -1.528 -0.000 -15.884) 15.957 12.872 ( -5.870 -0.000 9.492) 11.160 12.925 ( -3.190 0.000 -0.825) 3.295 13.552 ( 11.123 -0.000 9.271) 14.480 14.431 ( -9.926 -0.000 -6.778) 12.020 14.862 ( 8.145 -0.000 -21.548) 23.036 17.034 ( 11.193 -0.000 29.071) 31.152 19.016 ( 3.026 -0.000 -22.807) 23.007 19.841 ( -9.200 -0.000 -20.126) 22.130 19.878 ( -1.858 -0.000 -0.712) 1.990 21.222 ( 21.425 -0.000 9.462) 23.421 21.354 ( -11.509 0.000 11.548) 16.303 24.282 ( -1.701 -0.000 -1.517) 2.279 24.387 ( -3.706 -0.000 -5.007) 6.229 ======================= Grid point 268 (128/361) ======================= q-point: (-0.40 0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.227 ( 11.159 3.414 5.782) 13.024 2.553 ( 2.917 19.061 3.455) 19.590 2.769 ( 4.961 -2.424 4.109) 6.882 2.873 ( -1.455 -12.756 4.319) 13.546 3.284 ( -3.488 -1.504 -2.477) 4.534 3.380 ( 0.884 -5.954 -7.243) 9.418 4.283 ( 4.677 14.369 6.092) 16.293 4.463 ( -2.767 -0.986 10.986) 11.372 4.531 ( 7.682 -0.802 -2.570) 8.140 4.830 ( -1.467 -13.470 12.723) 18.587 5.382 ( 1.041 0.299 5.492) 5.598 5.957 ( -6.266 1.084 18.848) 19.891 6.009 ( -3.264 -3.113 8.085) 9.258 6.196 ( 0.246 -1.538 8.598) 8.738 7.349 ( -12.010 0.271 0.543) 12.025 7.984 ( 6.668 5.478 -1.928) 8.842 8.322 ( -13.229 -10.953 4.327) 17.712 8.986 ( -2.035 1.206 2.257) 3.270 9.373 ( 7.570 -3.584 8.695) 12.072 10.538 ( 5.646 2.749 8.958) 10.940 11.875 ( -15.846 0.981 -10.079) 18.805 12.113 ( 4.256 2.461 -8.179) 9.543 12.155 ( 3.819 17.435 -7.176) 19.237 12.900 ( -4.123 3.977 11.389) 12.749 12.923 ( -3.446 -11.957 -4.163) 13.122 13.832 ( 10.133 2.364 11.998) 15.881 14.170 ( -12.847 2.280 -5.661) 14.223 14.705 ( 2.883 -6.408 -21.869) 22.970 17.581 ( 11.501 -4.910 28.351) 30.986 18.770 ( -0.867 -1.157 -18.417) 18.474 19.450 ( -9.569 -0.044 -21.112) 23.179 19.848 ( -1.378 0.201 -0.039) 1.393 21.326 ( -3.915 4.724 5.417) 8.185 21.649 ( 17.760 -1.451 11.272) 21.085 24.225 ( -2.875 0.173 -2.425) 3.765 24.255 ( -3.370 0.790 -6.815) 7.644 ======================= Grid point 269 (129/361) ======================= q-point: (-0.30 0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.442 ( 0.860 14.929 0.219) 14.956 2.516 ( 19.728 3.241 8.006) 21.536 2.881 ( -1.968 -7.714 -0.516) 7.978 2.944 ( -2.969 -1.414 4.901) 5.902 3.209 ( -0.448 -2.652 -5.080) 5.748 3.458 ( 8.869 -9.111 -6.033) 14.074 4.285 ( 5.062 11.881 3.374) 13.348 4.564 ( -4.210 -0.912 14.935) 15.544 4.659 ( 10.498 0.770 -2.914) 10.922 5.036 ( -4.484 -10.221 8.838) 14.237 5.412 ( -2.706 0.155 1.111) 2.930 5.915 ( -5.586 0.071 -2.166) 5.992 6.260 ( -3.210 -1.673 26.735) 26.979 6.436 ( 4.054 -7.751 18.117) 20.118 7.184 ( -10.676 1.255 1.613) 10.870 7.972 ( -0.942 5.107 3.564) 6.298 8.350 ( -5.327 -14.910 0.933) 15.861 9.000 ( 0.568 -1.041 2.570) 2.830 9.634 ( 7.884 -4.794 8.277) 12.395 10.654 ( -0.771 8.069 9.492) 12.482 11.476 ( -12.535 1.346 -17.005) 21.169 11.876 ( -3.553 22.495 -2.482) 22.908 12.131 ( 9.317 0.909 -7.190) 11.804 12.859 ( -0.755 6.984 -0.506) 7.043 13.008 ( -2.827 -10.905 4.094) 11.987 13.897 ( -10.970 2.360 -2.962) 11.605 14.086 ( 5.458 3.337 10.336) 12.156 14.548 ( 0.052 -9.489 -17.111) 19.567 18.093 ( 7.671 -6.925 20.588) 23.036 18.602 ( 1.639 -1.009 -10.824) 10.994 19.073 ( -8.181 -2.345 -19.596) 21.365 19.825 ( -2.787 1.080 1.475) 3.333 21.254 ( -0.997 6.176 -3.329) 7.086 22.039 ( 15.051 1.652 13.732) 20.441 24.095 ( -2.717 2.860 -6.335) 7.463 24.176 ( -1.870 -1.990 -3.218) 4.220 ======================= Grid point 270 (130/361) ======================= q-point: (-0.20 0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.305 ( -2.929 6.232 -3.445) 7.699 2.791 ( -12.844 -7.143 6.241) 15.967 2.928 ( 12.541 -0.618 4.703) 13.408 2.968 ( 6.728 2.528 0.266) 7.192 3.226 ( 4.392 -0.384 -1.149) 4.556 3.602 ( 15.021 -5.131 -9.352) 18.423 4.297 ( 3.432 5.644 -0.242) 6.610 4.637 ( -3.609 8.216 9.677) 13.197 4.782 ( 6.182 -6.387 0.034) 8.889 5.086 ( -7.636 -3.976 3.152) 9.168 5.331 ( -5.993 2.194 -1.384) 6.531 5.817 ( -7.907 -2.285 1.909) 8.449 6.496 ( -3.899 -2.789 11.327) 12.300 6.763 ( 1.252 -7.569 10.796) 13.244 7.179 ( -6.086 1.530 27.506) 28.213 8.010 ( -1.213 -0.931 9.693) 9.813 8.415 ( -3.271 -12.386 -2.008) 12.967 9.102 ( 4.687 -6.834 2.548) 8.670 9.853 ( 4.905 -1.448 5.757) 7.701 10.549 ( -11.033 14.241 4.043) 18.463 11.116 ( -8.925 -3.447 -16.971) 19.482 11.611 ( -2.649 20.773 0.084) 20.942 12.216 ( 12.380 0.002 -3.858) 12.967 12.782 ( 2.626 9.728 -0.448) 10.086 13.101 ( -4.039 -10.880 2.180) 11.808 13.723 ( -7.263 1.334 -0.245) 7.388 14.140 ( -3.445 -0.503 -2.966) 4.573 14.550 ( 6.564 -3.800 0.797) 7.626 18.239 ( -5.516 0.079 -10.069) 11.481 18.618 ( 8.973 -3.172 -3.537) 10.153 18.897 ( -0.532 -6.057 0.680) 6.118 19.765 ( -7.740 3.639 3.973) 9.431 21.121 ( 3.254 4.957 -11.479) 12.920 22.375 ( 10.562 5.710 15.892) 19.917 23.980 ( 0.740 2.590 -5.393) 6.028 24.144 ( -1.850 -4.274 -2.139) 5.125 ======================= Grid point 271 (131/361) ======================= q-point: (-0.10 -0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.172 ( -7.303 -4.161 -4.536) 9.551 2.670 ( -18.568 -11.405 1.889) 21.872 2.975 ( 1.487 1.354 1.836) 2.723 3.230 ( 4.128 0.068 1.729) 4.477 3.299 ( 16.088 7.971 4.494) 18.508 3.758 ( 17.834 -0.572 -8.527) 19.776 4.212 ( -7.481 1.811 -4.176) 8.756 4.572 ( -2.043 10.081 0.025) 10.286 4.903 ( -0.361 -11.629 -2.998) 12.014 5.002 ( -9.033 -0.282 2.438) 9.361 5.219 ( -2.077 7.939 2.681) 8.633 5.787 ( -6.293 -4.219 4.772) 8.954 6.405 ( -10.604 -1.022 -6.271) 12.362 6.965 ( 1.601 -4.088 10.704) 11.570 7.534 ( -10.841 2.625 44.225) 45.610 8.192 ( 5.993 -2.153 10.363) 12.164 8.420 ( -7.698 -11.649 -1.681) 14.064 9.321 ( 8.133 -13.835 1.924) 16.163 9.862 ( -6.375 11.653 1.467) 13.364 10.258 ( -10.625 12.375 -1.207) 16.355 10.912 ( -3.770 -14.549 -12.869) 19.786 11.442 ( 2.563 17.007 1.357) 17.253 12.363 ( 10.638 -1.632 -2.063) 10.958 12.770 ( 2.837 6.941 4.949) 8.985 13.141 ( -3.973 -9.755 -1.300) 10.613 13.661 ( -0.509 3.553 2.619) 4.443 14.009 ( -7.857 -3.936 -5.785) 10.521 14.745 ( 10.904 3.061 7.454) 13.558 17.863 ( -9.436 1.818 -26.614) 28.296 18.743 ( 9.411 -2.786 -0.703) 9.840 19.069 ( 4.820 -2.289 7.727) 9.390 19.639 ( -11.414 5.646 6.598) 14.342 21.006 ( 7.664 -0.258 -16.033) 17.773 22.604 ( 3.594 11.269 16.742) 20.499 23.946 ( 4.702 0.765 -4.078) 6.271 24.155 ( -1.658 -6.506 0.147) 6.716 ======================= Grid point 278 (132/361) ======================= q-point: (-0.40 0.60 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.531 ( 14.851 0.000 9.700) 17.738 2.672 ( -8.271 -0.000 -6.629) 10.600 2.725 ( 3.177 0.000 -1.147) 3.378 2.960 ( 6.338 0.000 8.847) 10.883 3.196 ( -2.938 -0.000 -3.042) 4.229 3.342 ( 11.392 0.000 -7.089) 13.417 4.440 ( -0.817 -0.000 -2.672) 2.794 4.515 ( 9.333 0.000 1.335) 9.428 4.682 ( 0.954 0.000 12.964) 12.999 4.911 ( -3.341 -0.000 13.528) 13.934 5.419 ( -2.658 -0.000 2.218) 3.461 5.916 ( -4.915 -0.000 -4.031) 6.357 6.261 ( -2.858 -0.000 31.251) 31.382 6.345 ( 4.945 0.000 11.069) 12.123 7.196 ( -10.227 -0.000 1.918) 10.405 8.101 ( -18.614 -0.000 9.537) 20.915 8.128 ( 11.436 0.000 -3.852) 12.067 8.993 ( -0.947 -0.000 2.002) 2.215 9.589 ( 8.830 0.000 9.300) 12.824 10.731 ( 1.402 0.000 9.527) 9.629 11.468 ( -17.262 -0.000 -16.094) 23.600 12.118 ( 9.128 0.000 -7.986) 12.128 12.194 ( 1.604 0.000 -8.054) 8.212 12.767 ( -4.119 -0.000 -0.869) 4.210 13.000 ( -4.051 -0.000 10.196) 10.972 13.922 ( -13.475 -0.000 -3.594) 13.946 14.119 ( 5.709 0.000 10.840) 12.252 14.450 ( 2.609 0.000 -17.997) 18.185 18.028 ( 8.851 0.000 22.489) 24.168 18.592 ( 2.118 0.000 -10.568) 10.778 19.051 ( -8.574 -0.000 -20.946) 22.633 19.835 ( -1.722 -0.000 0.918) 1.951 21.317 ( -1.385 -0.000 -3.615) 3.871 22.052 ( 15.032 0.000 15.542) 21.622 24.130 ( -1.170 -0.000 -8.019) 8.104 24.148 ( -3.905 -0.000 -2.458) 4.614 ======================= Grid point 280 (133/361) ======================= q-point: (-0.30 -0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.396 ( -12.312 3.351 -6.982) 14.545 2.648 ( -13.573 -5.816 1.627) 14.856 2.930 ( 16.266 0.261 7.037) 17.725 3.086 ( 7.358 8.148 3.149) 11.421 3.218 ( 8.660 -2.264 -0.612) 8.972 3.498 ( 18.278 -4.563 -7.828) 20.401 4.388 ( 0.859 4.027 -2.213) 4.675 4.630 ( 0.356 -6.236 -0.567) 6.271 4.783 ( -0.485 4.794 5.907) 7.623 5.007 ( -5.913 -3.393 8.764) 11.103 5.381 ( -4.133 1.921 2.539) 5.217 5.783 ( -8.160 -1.122 -1.372) 8.350 6.494 ( -3.052 2.403 11.986) 12.600 6.620 ( 5.418 -7.012 10.758) 13.938 7.201 ( -5.110 0.706 23.888) 24.439 7.986 ( -16.325 -1.083 15.100) 22.264 8.261 ( 9.375 -4.160 -5.172) 11.486 9.025 ( 2.031 -1.890 1.341) 3.081 9.831 ( 8.189 -0.715 8.402) 11.754 10.749 ( -7.639 6.859 4.086) 11.049 11.030 ( -15.806 -4.028 -17.456) 23.890 12.006 ( -0.517 17.436 -5.977) 18.439 12.208 ( 11.705 -0.850 -4.557) 12.590 12.780 ( 0.827 -9.369 -1.956) 9.607 13.014 ( -8.748 2.641 8.658) 12.588 13.743 ( -6.642 0.676 0.128) 6.678 14.089 ( -6.699 -2.974 -10.253) 12.603 14.521 ( 11.063 -0.205 7.320) 13.267 18.239 ( -2.847 -0.008 -5.516) 6.207 18.578 ( 7.016 -1.124 -3.218) 7.800 18.817 ( 1.267 -2.337 -1.321) 2.968 19.809 ( -4.749 1.149 2.672) 5.569 21.204 ( 1.309 2.965 -11.890) 12.323 22.444 ( 10.670 1.886 19.234) 22.076 24.021 ( 0.470 2.034 -6.850) 7.161 24.075 ( -3.154 -3.013 -3.097) 5.350 ======================= Grid point 281 (134/361) ======================= q-point: (-0.20 -0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.115 ( -14.611 -1.665 -5.357) 15.651 2.467 ( -20.743 -9.737 0.033) 22.915 3.061 ( 4.889 7.076 2.389) 8.926 3.242 ( 4.678 0.279 3.154) 5.649 3.420 ( 20.098 4.560 2.616) 20.774 3.728 ( 20.901 -2.104 -6.738) 22.061 4.262 ( -10.155 4.377 -5.406) 12.309 4.628 ( -11.182 -12.901 -0.038) 17.073 4.746 ( 3.419 5.021 -5.561) 8.236 5.016 ( -5.763 0.553 5.733) 8.148 5.353 ( -0.495 6.096 4.633) 7.673 5.708 ( -7.494 -4.158 3.907) 9.419 6.397 ( -9.739 0.187 -6.137) 11.513 6.884 ( 7.022 -4.335 9.150) 12.322 7.568 ( -5.803 0.966 41.767) 42.179 8.035 ( -15.558 -10.163 21.827) 28.667 8.333 ( 9.757 -0.650 -8.746) 13.119 9.135 ( 6.465 -6.567 0.592) 9.235 9.998 ( 2.747 4.211 5.766) 7.650 10.483 ( -14.483 9.267 -5.447) 18.036 10.723 ( -8.219 -5.608 -11.065) 14.881 11.770 ( -0.260 17.359 -3.799) 17.772 12.333 ( 9.524 -1.420 -3.433) 10.223 12.879 ( 2.980 1.227 2.583) 4.130 12.941 ( -10.635 -7.584 4.806) 13.919 13.721 ( 1.584 2.542 2.963) 4.213 13.898 ( -9.298 -6.825 -7.745) 13.893 14.796 ( 12.761 2.197 10.092) 16.417 17.893 ( -8.445 1.303 -27.881) 29.162 18.703 ( 9.979 -1.507 1.042) 10.146 19.018 ( 6.369 -2.581 11.919) 13.758 19.729 ( -9.477 3.671 4.494) 11.112 21.036 ( 5.260 2.570 -17.860) 18.795 22.774 ( 4.961 6.869 21.764) 23.355 23.954 ( 2.364 0.376 -5.064) 5.601 24.043 ( -1.785 -5.264 -2.358) 6.037 ======================= Grid point 282 (135/361) ======================= q-point: (-0.10 -0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.881 ( -16.073 -7.188 -3.366) 17.926 2.273 ( -22.075 -14.540 1.194) 26.460 3.083 ( 2.833 5.294 1.513) 6.192 3.286 ( 2.677 3.287 0.324) 4.252 3.647 ( 10.512 7.347 1.273) 12.888 3.854 ( -10.558 1.614 -8.349) 13.556 3.999 ( 5.494 -1.942 -1.542) 6.028 4.504 ( -14.912 -2.333 1.804) 15.201 4.729 ( 9.213 -0.845 -11.814) 15.005 5.009 ( -3.703 0.592 6.494) 7.499 5.356 ( 2.086 8.252 3.467) 9.191 5.720 ( -4.465 -5.468 4.328) 8.281 6.148 ( -10.948 -0.401 -8.286) 13.736 7.086 ( 0.417 -0.697 10.022) 10.055 7.899 ( -14.162 3.487 36.520) 39.325 8.175 ( -15.471 -12.141 13.140) 23.652 8.423 ( 13.604 -0.864 1.306) 13.694 9.331 ( 8.484 -10.810 -0.755) 13.763 9.896 ( -10.193 16.471 1.583) 19.435 10.155 ( -9.354 4.939 -5.358) 11.858 10.648 ( 1.880 -9.454 -4.986) 10.852 11.611 ( 2.231 11.351 -2.914) 11.929 12.413 ( 5.987 -3.699 -4.952) 8.605 12.817 ( -16.443 -1.012 12.190) 20.494 13.060 ( 8.673 -4.610 -2.551) 10.147 13.746 ( -4.485 -4.839 0.868) 6.654 13.819 ( 1.238 0.861 2.528) 2.944 15.079 ( 15.002 5.222 8.401) 17.969 17.373 ( -8.944 1.480 -33.614) 34.815 18.907 ( 11.528 -0.981 4.703) 12.489 19.228 ( 3.807 1.946 6.830) 8.057 19.611 ( -8.829 2.588 6.098) 11.038 20.896 ( 8.272 -0.931 -19.431) 21.139 22.955 ( -3.365 15.056 20.609) 25.744 23.972 ( 6.971 -1.921 -4.381) 8.454 24.074 ( -1.898 -8.339 2.490) 8.907 ======================= Grid point 290 (136/361) ======================= q-point: (-0.30 -0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.106 ( -18.020 -0.000 -3.929) 18.443 2.365 ( -20.783 -0.000 -1.903) 20.870 3.168 ( 8.981 0.000 3.307) 9.570 3.219 ( 0.349 0.000 1.705) 1.741 3.458 ( 22.780 0.000 1.245) 22.814 3.706 ( 22.237 0.000 -4.298) 22.649 4.392 ( -17.436 -0.000 -10.450) 20.328 4.400 ( -1.685 -0.000 1.004) 1.962 4.808 ( -1.514 -0.000 -2.678) 3.076 5.018 ( -4.053 -0.000 6.577) 7.725 5.417 ( -0.244 -0.000 5.682) 5.687 5.661 ( -8.294 -0.000 3.071) 8.845 6.403 ( -9.750 -0.000 -6.592) 11.769 6.836 ( 10.555 0.000 8.499) 13.551 7.574 ( -3.812 -0.000 39.163) 39.348 7.936 ( -21.485 -0.000 25.425) 33.287 8.330 ( 11.888 0.000 -8.291) 14.493 9.076 ( 5.969 0.000 -0.196) 5.973 10.035 ( 5.616 0.000 7.697) 9.528 10.553 ( -15.736 -0.000 -17.422) 23.477 10.693 ( -8.070 -0.000 0.182) 8.072 11.966 ( -2.558 -0.000 -8.721) 9.088 12.318 ( 8.986 0.000 -3.958) 9.819 12.779 ( 4.897 0.000 2.938) 5.711 12.958 ( -14.929 -0.000 9.662) 17.783 13.747 ( 2.496 0.000 3.478) 4.281 13.822 ( -9.092 -0.000 -9.789) 13.360 14.817 ( 12.973 0.000 10.866) 16.923 17.906 ( -8.087 -0.000 -28.468) 29.595 18.689 ( 10.245 0.000 1.824) 10.406 18.992 ( 6.895 0.000 13.192) 14.885 19.763 ( -8.286 -0.000 3.812) 9.120 21.065 ( 4.133 0.000 -18.646) 19.099 22.840 ( 5.628 0.000 24.384) 25.025 23.967 ( -5.853 -0.000 -0.166) 5.856 23.981 ( 5.262 0.000 -9.021) 10.443 ======================= Grid point 291 (137/361) ======================= q-point: (-0.20 -0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.812 ( -20.499 -0.664 0.737) 20.523 2.046 ( -24.674 -8.360 -1.030) 26.072 3.180 ( -0.674 3.917 -2.256) 4.570 3.325 ( 7.169 0.806 1.573) 7.383 3.746 ( 14.364 3.048 0.108) 14.684 3.893 ( -28.549 0.552 -9.162) 29.988 3.983 ( 20.757 1.816 -1.661) 20.902 4.378 ( -12.318 -7.142 2.782) 14.508 4.762 ( 9.574 1.893 -8.977) 13.260 5.028 ( -4.910 0.921 6.098) 7.883 5.470 ( 1.920 3.926 3.320) 5.488 5.631 ( -6.054 -3.622 5.522) 8.959 6.149 ( -10.484 0.248 -9.382) 14.072 7.081 ( 8.686 -0.003 7.171) 11.263 7.845 ( -12.290 -6.040 18.708) 23.185 8.083 ( -21.061 0.974 45.376) 50.035 8.391 ( 11.428 -1.752 -7.580) 13.825 9.205 ( 10.975 -3.266 -1.598) 11.561 10.106 ( -4.459 6.139 3.214) 8.240 10.170 ( -11.714 -1.502 -11.576) 16.537 10.615 ( 1.065 1.959 -0.132) 2.233 11.788 ( -2.248 6.135 -7.780) 10.160 12.357 ( 4.744 -1.963 -6.202) 8.051 12.842 ( -13.683 4.485 12.251) 18.906 12.960 ( 3.580 -6.648 5.711) 9.467 13.620 ( -9.766 -5.140 -3.623) 11.615 13.858 ( 6.343 1.419 3.954) 7.608 15.143 ( 15.379 1.738 9.868) 18.355 17.393 ( -7.648 0.623 -35.499) 36.319 18.895 ( 11.963 -0.286 4.797) 12.892 19.243 ( 5.641 0.089 11.341) 12.666 19.655 ( -11.467 1.598 3.371) 12.059 20.896 ( 7.522 0.329 -21.359) 22.647 23.176 ( 0.054 7.575 27.454) 28.480 23.909 ( -4.604 -4.308 2.013) 6.619 23.972 ( 6.662 -1.781 -8.208) 10.721 ======================= Grid point 292 (138/361) ======================= q-point: (-0.10 -0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.544 ( -22.319 -4.313 2.819) 22.906 1.817 ( -24.703 -15.931 3.072) 29.554 2.987 ( -19.953 -4.236 -10.908) 23.131 3.351 ( -8.418 6.105 3.493) 10.970 3.494 ( -4.112 1.960 3.037) 5.474 3.814 ( 0.677 5.489 -4.904) 7.391 4.168 ( 1.225 0.319 2.623) 2.913 4.348 ( 5.399 -3.670 0.539) 6.551 4.797 ( 9.352 6.452 -5.785) 12.750 5.036 ( -1.882 -1.189 4.405) 4.936 5.473 ( 2.038 6.409 -0.904) 6.786 5.672 ( -1.674 -5.403 3.451) 6.626 5.901 ( -9.613 -0.982 -6.101) 11.428 7.211 ( -2.132 5.749 9.112) 10.983 7.923 ( -13.893 -12.224 11.806) 21.951 8.178 ( -13.973 9.619 20.632) 26.711 8.607 ( 7.135 -9.450 10.140) 15.589 9.347 ( 8.209 -4.379 -5.977) 11.058 9.891 ( -13.104 15.383 1.066) 20.236 10.022 ( 0.364 -5.848 -1.360) 6.015 10.675 ( 6.113 2.932 2.207) 7.130 11.625 ( -1.493 4.232 -6.953) 8.275 12.362 ( 3.235 -4.663 -6.920) 8.949 12.738 ( -15.972 5.999 12.984) 21.440 13.120 ( 3.402 -3.304 1.591) 5.002 13.607 ( -4.986 -13.700 8.318) 16.785 13.979 ( 7.097 3.159 3.067) 8.352 15.447 ( 16.548 4.852 5.975) 18.250 16.826 ( -9.253 0.436 -34.879) 36.088 19.143 ( 11.816 -0.672 6.529) 13.517 19.346 ( -3.313 6.823 3.250) 8.252 19.579 ( -2.669 -4.924 4.835) 7.399 20.768 ( 9.078 -0.946 -19.601) 21.622 23.287 ( -8.983 21.804 20.755) 31.415 24.002 ( 8.523 -2.195 -7.605) 11.631 24.031 ( -0.512 -12.864 11.909) 17.538 ======================= Grid point 301 (139/361) ======================= q-point: (-0.20 -0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.554 ( -24.410 -0.000 9.196) 26.085 1.609 ( -27.505 -0.000 -0.149) 27.505 2.947 ( -24.937 -0.000 -13.270) 28.248 3.443 ( -18.013 -0.000 2.614) 18.202 3.486 ( 8.232 0.000 3.333) 8.881 3.868 ( 1.307 0.000 -4.688) 4.866 4.183 ( -11.133 -0.000 1.997) 11.311 4.291 ( 19.664 0.000 1.287) 19.706 4.869 ( 14.624 0.000 -5.534) 15.636 5.018 ( -6.171 -0.000 4.827) 7.835 5.541 ( 2.833 0.000 -0.942) 2.986 5.609 ( -3.428 -0.000 5.089) 6.136 5.893 ( -9.918 -0.000 -7.508) 12.440 7.290 ( 9.063 0.000 4.485) 10.112 7.769 ( -19.353 -0.000 15.452) 24.765 8.349 ( -22.413 -0.000 43.168) 48.639 8.426 ( 10.716 0.000 -8.183) 13.483 9.319 ( 11.240 0.000 -7.262) 13.382 9.951 ( -0.824 -0.000 -3.882) 3.968 10.045 ( -12.007 -0.000 0.967) 12.045 10.722 ( 7.952 0.000 3.066) 8.523 11.666 ( -3.407 -0.000 -8.148) 8.832 12.317 ( 3.804 0.000 -7.560) 8.463 12.949 ( -12.426 -0.000 26.619) 29.377 12.957 ( 0.066 0.000 -1.426) 1.428 13.450 ( -7.930 -0.000 1.821) 8.137 14.009 ( 7.160 0.000 3.124) 7.812 15.491 ( 16.522 0.000 7.086) 17.978 16.831 ( -8.544 -0.000 -36.792) 37.771 19.137 ( 11.720 0.000 6.353) 13.331 19.442 ( 3.951 0.000 8.993) 9.822 19.502 ( -12.164 -0.000 -1.027) 12.207 20.761 ( 9.440 0.000 -20.134) 22.237 23.584 ( -1.082 -0.000 32.343) 32.361 23.820 ( -7.286 -0.000 3.520) 8.092 23.981 ( 9.302 0.000 -8.249) 12.432 ======================= Grid point 302 (140/361) ======================= q-point: (-0.10 -0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.229 ( -26.851 -1.201 6.875) 27.744 1.378 ( -27.058 -11.273 7.431) 30.240 2.337 ( -43.527 -6.697 0.667) 44.044 3.337 ( -4.373 2.716 2.713) 5.819 3.632 ( 4.019 2.650 5.260) 7.130 3.703 ( -8.625 1.789 -4.942) 10.100 4.110 ( -1.666 -1.037 -2.533) 3.204 4.574 ( 14.321 1.301 4.061) 14.942 4.922 ( 2.461 8.334 -0.500) 8.704 5.040 ( 1.872 -4.288 0.739) 4.737 5.470 ( -1.505 4.229 -10.821) 11.715 5.667 ( 2.631 -3.964 2.275) 5.274 5.755 ( -4.759 -1.510 4.107) 6.465 7.363 ( -2.286 13.407 6.539) 15.091 7.729 ( -14.551 -12.519 9.397) 21.372 8.354 ( -5.782 16.843 13.519) 22.358 8.692 ( 3.483 -17.072 11.609) 20.937 9.321 ( 6.213 -1.836 -9.763) 11.717 9.823 ( -12.539 8.494 -0.040) 15.145 10.037 ( 6.855 -6.140 1.729) 9.364 10.860 ( 7.033 4.603 3.842) 9.242 11.498 ( -5.948 1.594 -9.195) 11.067 12.294 ( 4.203 -1.201 -6.962) 8.220 12.764 ( -11.901 17.174 3.426) 21.174 13.164 ( -1.201 -2.113 7.621) 7.999 13.517 ( -1.998 -21.559 7.410) 22.884 14.126 ( 6.131 1.719 1.304) 6.500 15.759 ( 14.662 3.291 1.098) 15.067 16.353 ( -9.826 -0.762 -9.977) 14.024 19.280 ( -8.292 2.255 -3.851) 9.416 19.384 ( 9.882 -0.499 5.590) 11.365 19.594 ( 1.471 -4.331 5.146) 6.885 20.678 ( 9.959 -0.020 -16.515) 19.285 23.589 ( -10.247 27.738 12.084) 31.944 24.009 ( 6.883 -3.651 -3.049) 8.367 24.120 ( 5.070 -14.853 17.113) 23.220 ======================= Grid point 312 (141/361) ======================= q-point: (-0.10 -0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.950 ( -24.979 -0.000 13.316) 28.306 0.979 ( -30.692 -0.000 3.782) 30.924 1.855 ( -43.217 -0.000 33.265) 54.537 3.321 ( -1.624 -0.000 0.447) 1.684 3.479 ( -12.494 -0.000 -2.486) 12.739 3.807 ( 7.736 0.000 3.000) 8.298 4.060 ( 0.002 0.000 -3.147) 3.147 4.757 ( 0.653 0.000 3.610) 3.668 5.005 ( 1.252 0.000 -5.941) 6.072 5.021 ( 4.004 0.000 -0.850) 4.094 5.320 ( 0.674 0.000 -6.057) 6.094 5.747 ( 6.499 0.000 2.255) 6.879 5.809 ( -1.497 -0.000 10.686) 10.790 7.519 ( 3.608 0.000 -1.846) 4.053 7.527 ( -18.473 -0.000 13.261) 22.740 8.643 ( 10.144 0.000 1.586) 10.267 8.654 ( -2.453 -0.000 -1.821) 3.055 9.331 ( 6.626 0.000 3.992) 7.736 9.704 ( -9.056 -0.000 1.078) 9.120 10.087 ( 5.177 0.000 -3.906) 6.485 10.999 ( 4.126 0.000 1.478) 4.383 11.169 ( -23.565 -0.000 -19.776) 30.764 12.298 ( 7.226 0.000 -6.292) 9.582 12.726 ( -6.541 -0.000 -5.754) 8.712 12.967 ( -18.920 -0.000 -18.596) 26.529 13.394 ( -4.285 -0.000 5.369) 6.869 14.215 ( 4.302 0.000 -0.141) 4.304 15.931 ( 9.712 0.000 -5.196) 11.015 16.704 ( 26.224 0.000 58.591) 64.192 19.088 ( -5.091 -0.000 -9.926) 11.156 19.579 ( 5.672 0.000 6.713) 8.788 19.624 ( -0.967 -0.000 1.720) 1.974 20.651 ( 11.155 0.000 -12.643) 16.861 23.719 ( -7.615 -0.000 5.992) 9.690 24.056 ( 7.463 0.000 -4.091) 8.511 24.238 ( -1.754 -0.000 -2.657) 3.184 ======================= Grid point 313 (142/361) ======================= q-point: ( 0.00 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.595 ( -1.848 -0.000 26.699) 26.763 1.677 ( 4.166 0.000 20.711) 21.126 2.887 ( -0.322 -0.000 29.357) 29.359 3.098 ( -1.474 -0.000 -5.246) 5.449 3.656 ( 3.706 0.000 10.077) 10.737 3.823 ( 9.478 0.000 -9.827) 13.653 4.157 ( -7.845 -0.000 -17.192) 18.897 4.190 ( -9.597 -0.000 -1.856) 9.775 4.601 ( 5.538 0.000 0.119) 5.539 5.057 ( -2.096 -0.000 1.179) 2.404 5.710 ( 3.655 0.000 0.403) 3.677 6.053 ( 1.386 0.000 4.783) 4.980 6.715 ( -0.288 -0.000 31.786) 31.787 7.204 ( -4.001 -0.000 -9.150) 9.987 7.406 ( -19.066 -0.000 5.506) 19.845 8.044 ( -18.847 -0.000 29.688) 35.165 9.321 ( 6.965 0.000 14.460) 16.050 9.360 ( -9.793 -0.000 -0.187) 9.795 9.778 ( 2.082 0.000 2.356) 3.144 9.813 ( -6.975 -0.000 -3.040) 7.609 10.706 ( 20.458 0.000 8.524) 22.163 10.843 ( -5.831 -0.000 -6.917) 9.047 12.013 ( 1.066 0.000 -12.487) 12.532 12.393 ( 0.724 0.000 -7.543) 7.578 12.864 ( -3.690 -0.000 15.234) 15.675 13.561 ( 2.483 0.000 3.591) 4.366 14.173 ( -2.615 -0.000 -2.314) 3.492 15.377 ( -2.021 -0.000 -19.462) 19.566 18.505 ( 8.583 0.000 -15.693) 17.887 19.084 ( -4.623 -0.000 -11.627) 12.513 19.456 ( 26.951 0.000 -2.756) 27.091 19.563 ( -9.878 -0.000 -3.859) 10.605 20.999 ( 20.903 0.000 7.214) 22.113 22.208 ( -51.118 -0.000 -3.065) 51.210 23.778 ( -6.428 -0.000 4.322) 7.746 24.123 ( 7.949 0.000 -3.088) 8.528 ======================= Grid point 314 (143/361) ======================= q-point: ( 0.10 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.906 ( 2.302 2.692 23.447) 23.713 2.026 ( 8.659 -6.221 17.921) 20.853 3.052 ( 5.307 2.220 -4.574) 7.349 3.272 ( 7.565 -1.860 17.558) 19.208 3.720 ( -6.738 6.658 -10.089) 13.839 3.766 ( 1.872 3.692 1.815) 4.520 3.945 ( -6.099 0.943 -9.075) 10.974 3.968 ( 2.302 -9.205 -11.271) 14.733 4.763 ( 7.080 0.811 8.427) 11.037 5.030 ( -6.244 -2.579 4.111) 7.909 5.698 ( -2.388 0.962 -2.206) 3.390 6.088 ( -3.901 0.896 4.732) 6.198 6.985 ( -3.894 6.094 0.438) 7.245 7.076 ( -5.407 -1.415 14.465) 15.507 7.342 ( -14.110 0.507 27.306) 30.740 8.146 ( -16.441 1.088 27.477) 32.039 9.200 ( -0.951 13.985 2.147) 14.181 9.597 ( 1.192 3.630 7.201) 8.152 9.725 ( -3.225 -8.940 3.870) 10.262 9.914 ( 4.045 -13.158 1.674) 13.867 10.593 ( -2.562 11.131 -5.225) 12.561 11.233 ( 20.766 -16.292 5.678) 26.998 11.897 ( 2.985 -0.369 -11.326) 11.719 12.275 ( 3.030 3.982 -11.900) 12.909 13.021 ( -3.126 -5.329 13.336) 14.698 13.665 ( 5.016 -1.630 3.009) 6.072 14.086 ( -5.222 0.747 -1.944) 5.622 15.084 ( -4.919 3.005 -16.921) 17.876 18.473 ( 12.073 1.424 -12.355) 17.333 18.728 ( -13.894 1.391 -17.196) 22.151 19.350 ( -8.881 2.552 -3.834) 10.004 19.749 ( 13.596 -1.814 -5.369) 14.730 21.361 ( 8.151 7.042 10.548) 15.076 21.618 ( -21.089 -4.008 1.704) 21.534 23.765 ( -3.822 -4.091 1.749) 5.865 24.198 ( 6.869 0.069 -2.157) 7.200 ======================= Grid point 315 (144/361) ======================= q-point: ( 0.20 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.180 ( 4.533 3.633 17.219) 18.172 2.445 ( 11.987 -8.000 14.352) 20.339 3.077 ( 7.336 4.227 -2.922) 8.956 3.400 ( -10.197 0.239 -3.859) 10.906 3.459 ( 5.829 11.014 -6.094) 13.872 3.620 ( -6.050 6.422 -9.559) 13.008 3.895 ( 4.358 -8.947 2.851) 10.353 4.064 ( 5.661 -10.736 -6.379) 13.711 4.938 ( 3.886 1.523 7.928) 8.959 5.061 ( -5.895 -4.063 9.981) 12.284 5.569 ( -7.488 1.938 -5.580) 9.538 6.052 ( -6.115 1.679 3.929) 7.460 6.800 ( -8.571 1.849 -6.314) 10.805 7.111 ( -6.189 1.718 9.492) 11.461 7.650 ( -8.977 2.499 43.709) 44.691 8.198 ( -12.910 4.698 19.661) 23.985 9.079 ( -3.848 9.931 1.765) 10.796 9.651 ( 2.333 7.862 8.301) 11.669 9.706 ( -8.377 -7.897 -2.989) 11.895 10.189 ( 2.091 -5.237 5.650) 7.982 10.491 ( 4.959 -8.258 -2.127) 9.865 11.668 ( 6.835 -0.512 -1.213) 6.961 11.825 ( 13.765 -2.700 -5.257) 14.980 12.207 ( 11.937 -0.006 -10.079) 15.624 13.178 ( -3.060 -7.028 9.789) 12.433 13.788 ( 3.690 -3.224 0.946) 4.991 13.972 ( -5.913 0.576 -0.883) 6.006 14.799 ( -4.706 4.271 -11.404) 13.056 18.286 ( -13.957 0.977 -19.667) 24.135 18.525 ( 13.728 1.143 -8.191) 16.026 19.171 ( -8.017 0.560 -2.537) 8.427 19.782 ( -2.071 -0.522 -1.949) 2.891 21.163 ( -10.043 8.952 -1.534) 13.541 21.881 ( 13.552 -8.769 10.862) 19.456 23.781 ( -0.107 -3.613 -0.364) 3.633 24.260 ( 5.197 1.271 -1.069) 5.456 ======================= Grid point 316 (145/361) ======================= q-point: ( 0.30 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.340 ( 0.486 5.543 7.619) 9.434 2.840 ( 12.294 -7.136 7.814) 16.221 3.071 ( -0.299 3.539 0.888) 3.661 3.191 ( -7.762 4.148 -4.157) 9.733 3.320 ( -1.890 8.704 -5.593) 10.517 3.498 ( 8.763 1.520 -3.838) 9.687 4.092 ( 5.196 -9.426 -0.440) 10.772 4.152 ( 5.302 -10.312 -6.477) 13.282 5.033 ( -1.962 -0.065 6.019) 6.331 5.133 ( -5.034 -2.245 7.527) 9.329 5.314 ( -13.803 2.319 -6.093) 15.265 5.994 ( -4.787 2.610 2.738) 6.101 6.563 ( -11.469 1.972 -5.636) 12.931 7.155 ( -2.599 1.136 9.970) 10.365 8.016 ( -9.853 1.541 38.993) 40.248 8.185 ( -5.983 5.242 10.047) 12.814 8.959 ( -10.495 6.966 8.019) 14.932 9.588 ( -14.028 -17.153 -3.645) 22.456 9.730 ( 6.930 18.278 8.160) 21.182 10.132 ( -7.036 -3.160 -4.354) 8.857 10.829 ( 13.630 -13.884 6.587) 20.541 11.429 ( -2.235 15.373 -12.286) 19.806 12.161 ( 18.210 -0.465 -0.254) 18.218 12.391 ( 18.008 -7.444 -0.446) 19.491 13.292 ( -3.432 -5.021 7.067) 9.323 13.743 ( -7.595 3.091 -0.668) 8.227 13.964 ( 0.023 -6.451 -2.181) 6.810 14.642 ( 1.227 1.153 -3.764) 4.124 17.822 ( -14.431 -0.213 -22.551) 26.774 18.643 ( 13.290 1.580 -2.424) 13.601 19.069 ( -3.377 -1.908 -0.871) 3.976 19.713 ( -7.629 -2.255 1.861) 8.170 20.960 ( -0.114 7.915 -8.485) 11.604 22.285 ( 9.136 -10.951 13.133) 19.387 23.817 ( 3.961 -1.646 -2.338) 4.885 24.295 ( 3.053 3.224 0.544) 4.474 ======================= Grid point 317 (146/361) ======================= q-point: (-0.60 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.266 ( -7.852 8.006 0.785) 11.241 2.864 ( -16.240 4.102 -1.979) 16.866 3.028 ( 3.182 4.063 1.900) 5.499 3.184 ( 0.789 -1.170 -1.742) 2.241 3.306 ( 11.406 -3.732 4.844) 12.941 3.649 ( 13.114 -1.015 -0.191) 13.155 4.162 ( -3.654 -4.436 -1.110) 5.853 4.246 ( 6.682 -6.755 -5.605) 11.032 4.919 ( -14.416 2.685 -9.834) 17.656 5.050 ( -3.938 -1.392 2.641) 4.942 5.220 ( -7.120 -5.137 7.320) 11.431 5.932 ( -2.880 4.088 0.976) 5.095 6.311 ( -12.446 2.350 -3.569) 13.159 7.242 ( -1.458 1.062 9.837) 10.001 8.110 ( 2.417 3.029 -3.900) 5.497 8.351 ( -13.521 -1.884 33.783) 36.437 8.847 ( -16.319 4.150 14.110) 21.969 9.532 ( -9.486 -14.090 -1.417) 17.044 9.716 ( 0.030 11.711 4.781) 12.649 10.023 ( -6.546 -5.507 -3.487) 9.238 11.083 ( 8.801 23.406 -6.221) 25.768 11.232 ( 4.992 -10.509 2.650) 11.932 12.320 ( 13.905 2.946 -7.398) 16.024 12.757 ( 15.970 -5.236 5.785) 17.774 13.303 ( -10.438 3.155 6.846) 12.876 13.650 ( -0.881 -2.160 1.263) 2.653 13.940 ( -4.208 -3.289 -2.769) 6.015 14.737 ( 9.813 -6.898 0.063) 11.995 17.324 ( -15.371 0.231 -23.233) 27.858 18.821 ( 12.302 1.822 4.237) 13.138 19.084 ( 1.326 -5.871 -1.182) 6.134 19.674 ( -5.421 -3.097 3.468) 7.142 20.785 ( 4.013 7.900 -13.260) 15.948 22.654 ( 2.095 -14.744 14.220) 20.591 23.861 ( 7.654 1.312 -4.662) 9.058 24.310 ( 1.238 4.919 3.429) 6.122 ======================= Grid point 318 (147/361) ======================= q-point: (-0.50 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.042 ( -14.771 8.634 3.462) 17.456 2.511 ( -19.860 8.190 -2.792) 21.663 3.079 ( 3.907 2.376 1.660) 4.864 3.240 ( 2.934 -4.195 3.201) 6.038 3.517 ( 5.143 -6.572 -1.167) 8.427 3.793 ( -6.756 -0.504 1.748) 6.997 4.064 ( 0.147 3.661 4.142) 5.530 4.367 ( 8.938 -7.634 -4.538) 12.600 4.592 ( -11.710 1.839 -8.001) 14.301 5.055 ( -0.954 -2.886 0.535) 3.086 5.251 ( -5.249 -8.485 1.609) 10.106 5.859 ( -1.121 5.112 -1.072) 5.342 6.091 ( -11.495 3.055 0.542) 11.906 7.318 ( -3.541 0.781 9.338) 10.018 8.062 ( 3.451 -1.213 -8.821) 9.549 8.478 ( -17.754 -0.332 20.343) 27.003 8.785 ( -13.793 -1.102 13.608) 19.407 9.516 ( -5.877 -7.631 -0.440) 9.642 9.669 ( -3.662 3.365 4.128) 6.463 9.991 ( -3.895 -8.154 2.307) 9.326 10.890 ( 8.499 25.826 -3.022) 27.356 11.439 ( 4.270 -6.319 1.481) 7.769 12.346 ( 11.173 5.841 -10.751) 16.570 13.003 ( 7.090 -1.560 -3.070) 7.882 13.146 ( -16.793 5.236 13.653) 22.267 13.772 ( 4.690 -6.248 1.660) 7.987 13.910 ( 0.819 1.229 4.062) 4.322 14.993 ( 14.102 -11.792 -1.952) 18.486 16.838 ( -15.180 1.377 -17.342) 23.088 19.061 ( 12.329 1.710 7.726) 14.650 19.153 ( 1.121 -8.560 -2.305) 8.935 19.697 ( -0.098 -0.796 3.446) 3.538 20.605 ( 5.901 7.375 -16.236) 18.783 22.946 ( -6.639 -19.332 12.703) 24.066 23.896 ( 10.431 4.267 -6.695) 13.109 24.345 ( 1.199 5.316 7.977) 9.661 ======================= Grid point 319 (148/361) ======================= q-point: (-0.40 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.792 ( -19.380 8.409 8.775) 22.876 2.086 ( -22.937 10.028 -2.518) 25.160 3.079 ( -2.956 9.223 2.983) 10.134 3.364 ( -7.157 -2.058 5.634) 9.338 3.521 ( -9.156 -3.354 5.173) 11.039 3.599 ( -4.958 -6.247 -3.222) 8.602 4.240 ( 0.132 1.585 2.866) 3.278 4.378 ( 2.001 -2.262 1.015) 3.186 4.530 ( 10.510 -7.887 -6.427) 14.628 5.079 ( 0.077 -2.050 0.197) 2.060 5.246 ( -3.754 -8.484 -5.333) 10.700 5.788 ( 1.612 5.381 -2.796) 6.275 5.963 ( -8.076 3.460 7.306) 11.427 7.347 ( -8.283 -1.510 8.855) 12.219 8.034 ( 1.190 -5.196 -5.821) 7.893 8.382 ( -19.345 1.333 11.649) 22.621 8.758 ( -6.223 -2.180 1.909) 6.865 9.487 ( -4.034 -1.538 1.050) 4.443 9.658 ( -5.155 -2.921 4.419) 7.392 10.117 ( 2.708 -6.087 5.838) 8.858 10.798 ( 6.745 16.283 1.965) 17.733 11.484 ( -1.586 -0.523 -2.302) 2.844 12.285 ( 9.435 7.880 -12.562) 17.576 12.862 ( -12.488 3.711 0.438) 13.035 13.178 ( -4.720 -2.792 8.641) 10.234 13.841 ( 0.486 -4.036 -3.504) 5.367 14.038 ( 8.779 5.548 4.578) 11.349 15.285 ( 15.270 -13.347 -4.442) 20.762 16.518 ( -10.846 0.849 2.217) 11.103 19.174 ( -1.101 -7.636 -5.847) 9.680 19.324 ( 11.318 2.365 7.680) 13.881 19.754 ( 3.871 3.868 3.306) 6.394 20.440 ( 7.648 4.528 -16.739) 18.953 23.123 ( -14.295 -24.313 8.796) 29.544 23.920 ( 10.770 5.327 -7.008) 13.910 24.445 ( 2.719 5.000 10.504) 11.947 ======================= Grid point 320 (149/361) ======================= q-point: (-0.30 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.538 ( -22.342 9.366 10.455) 26.385 1.637 ( -23.431 11.353 3.712) 26.300 2.882 ( -26.176 15.205 23.154) 38.112 3.276 ( -4.097 -4.450 -1.647) 6.269 3.524 ( -7.586 -6.232 -3.304) 10.359 3.665 ( 6.012 -3.130 2.186) 7.122 4.101 ( -8.225 0.073 0.369) 8.234 4.635 ( 5.564 -8.568 2.832) 10.601 4.663 ( 11.218 -5.696 -3.042) 12.944 5.078 ( -1.181 0.452 -3.235) 3.473 5.187 ( 0.798 -4.599 -5.505) 7.217 5.758 ( 5.660 5.019 -2.051) 7.838 5.977 ( -4.207 2.161 13.150) 13.975 7.338 ( -11.405 -6.365 7.570) 15.096 7.995 ( -8.168 -0.755 -0.483) 8.217 8.292 ( -10.903 -8.977 7.559) 16.019 8.693 ( 1.148 2.910 -5.378) 6.222 9.473 ( -3.950 -3.760 2.684) 6.078 9.678 ( -1.843 -0.610 4.662) 5.050 10.216 ( 5.451 7.297 -0.862) 9.149 10.823 ( -2.510 -3.487 2.949) 5.212 11.365 ( -5.420 5.776 -3.501) 8.660 12.187 ( 8.449 6.997 -12.118) 16.346 12.675 ( -12.907 0.504 2.614) 13.179 13.203 ( -4.868 -0.289 2.051) 5.290 13.712 ( -3.704 6.712 -11.710) 13.996 14.134 ( 6.189 2.270 0.663) 6.625 15.541 ( 13.062 -11.815 -7.581) 19.175 16.698 ( 5.976 -6.452 32.128) 33.310 19.093 ( -0.237 -0.632 -11.910) 11.929 19.502 ( 5.829 0.984 2.437) 6.394 19.821 ( 4.190 8.006 7.133) 11.513 20.354 ( 11.022 0.117 -15.114) 18.707 23.213 ( -19.427 -30.420 5.076) 36.450 23.945 ( 10.053 4.274 -6.001) 12.464 24.529 ( 0.674 6.909 4.402) 8.219 ======================= Grid point 321 (150/361) ======================= q-point: (-0.20 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.266 ( -16.278 9.765 15.569) 24.550 1.397 ( -16.897 10.661 17.705) 26.696 2.704 ( -32.035 7.745 33.534) 47.019 3.298 ( 5.164 -1.994 -0.070) 5.536 3.389 ( -10.828 -2.988 -3.023) 11.632 3.748 ( 8.651 0.549 -6.792) 11.012 4.095 ( -3.748 -3.982 8.517) 10.122 4.642 ( -3.497 -9.069 -10.825) 14.549 4.818 ( -2.314 -2.672 -2.499) 4.328 4.986 ( 3.882 3.292 -2.880) 5.848 5.313 ( 12.192 -1.978 3.588) 12.862 5.816 ( 8.306 2.731 0.614) 8.765 6.112 ( -2.321 0.116 18.249) 18.396 7.328 ( -9.899 -10.573 3.043) 14.800 7.842 ( -13.460 0.197 3.723) 13.967 8.283 ( -11.253 -4.880 -3.171) 12.669 8.703 ( 6.116 -2.103 5.119) 8.248 9.514 ( -3.058 -8.892 2.830) 9.820 9.732 ( 3.355 5.726 4.785) 8.182 10.143 ( 5.248 13.597 -4.644) 15.296 10.680 ( -27.113 -11.573 -6.236) 30.132 11.209 ( 1.132 15.467 0.247) 15.510 12.136 ( 9.279 1.538 -10.295) 13.944 12.548 ( -10.652 -1.807 2.885) 11.183 13.007 ( -8.467 13.035 -5.598) 16.521 13.517 ( -4.077 2.675 0.962) 4.970 14.196 ( 3.530 -0.173 -0.760) 3.615 15.657 ( 8.211 -8.151 -13.853) 18.049 17.532 ( 29.145 -17.465 37.075) 50.289 18.911 ( 5.054 8.180 -15.940) 18.616 19.531 ( -2.520 -4.157 -3.316) 5.884 19.861 ( -0.663 9.880 6.101) 11.630 20.409 ( 17.327 -0.868 -8.853) 19.477 23.233 ( -26.722 -37.078 -0.345) 45.705 23.987 ( 9.536 2.512 -4.991) 11.052 24.351 ( -9.948 16.988 -6.607) 20.766 ======================= Grid point 322 (151/361) ======================= q-point: (-0.10 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.362 ( -1.276 3.616 24.714) 25.010 1.386 ( -7.761 5.684 24.118) 25.965 2.663 ( -20.974 3.443 33.145) 39.375 3.222 ( -7.722 -0.947 -4.289) 8.883 3.457 ( 7.733 -1.156 6.737) 10.321 3.786 ( 10.426 -0.261 -8.724) 13.597 4.202 ( -3.988 -3.267 9.978) 11.231 4.458 ( -8.229 -2.284 -13.030) 15.579 4.667 ( -1.718 0.109 -11.888) 12.013 5.038 ( 2.301 1.276 2.579) 3.684 5.566 ( 11.849 -1.200 3.551) 12.428 5.941 ( 6.542 0.266 3.409) 7.381 6.359 ( -1.007 -1.423 25.354) 25.414 7.304 ( -6.098 -9.779 -4.203) 12.267 7.682 ( -13.003 0.126 -3.694) 13.518 8.051 ( -21.482 4.628 14.876) 26.537 8.980 ( 5.807 -11.159 11.948) 17.349 9.579 ( -6.085 -1.247 1.586) 6.411 9.694 ( -1.104 3.259 -0.845) 3.543 10.047 ( -1.378 17.289 -1.728) 17.429 10.386 ( -9.096 -14.610 3.759) 17.616 11.058 ( -0.503 16.326 -3.088) 16.623 12.126 ( 5.878 -0.313 -11.792) 13.179 12.459 ( -5.568 -3.264 -1.882) 6.723 12.804 ( -5.745 9.287 9.601) 14.540 13.508 ( -0.929 0.490 3.715) 3.861 14.212 ( 0.493 -0.409 -1.876) 1.982 15.591 ( 2.728 -3.944 -18.361) 18.977 18.460 ( 20.240 -21.502 2.283) 29.618 18.811 ( 27.349 14.975 -3.309) 31.355 19.433 ( -7.761 -6.555 -8.077) 12.978 19.757 ( -5.884 7.905 -0.883) 9.894 20.645 ( 20.865 0.240 0.885) 20.885 22.963 ( -47.654 -25.568 -10.741) 55.136 23.921 ( -11.445 18.347 1.248) 21.661 24.049 ( 8.798 0.967 -4.002) 9.714 ======================= Grid point 324 (152/361) ======================= q-point: ( 0.10 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.263 ( 3.884 0.000 20.931) 21.288 2.321 ( 11.766 0.000 13.551) 17.946 3.120 ( 9.450 0.000 -3.254) 9.995 3.397 ( -10.760 -0.000 -4.613) 11.707 3.623 ( 10.529 0.000 -2.020) 10.721 3.691 ( -8.680 -0.000 -10.106) 13.322 3.766 ( 4.215 0.000 -9.369) 10.273 3.938 ( 2.375 0.000 0.432) 2.414 4.959 ( 3.565 0.000 8.389) 9.115 5.017 ( -5.365 -0.000 10.371) 11.677 5.586 ( -7.265 -0.000 -5.940) 9.384 6.068 ( -6.262 -0.000 4.092) 7.480 6.818 ( -8.184 -0.000 -7.528) 11.120 7.124 ( -6.847 -0.000 8.700) 11.071 7.673 ( -10.281 -0.000 44.379) 45.554 8.244 ( -15.988 -0.000 24.853) 29.552 9.244 ( -3.144 -0.000 0.412) 3.171 9.437 ( -16.197 -0.000 -3.733) 16.621 9.979 ( 14.120 0.000 12.007) 18.535 9.986 ( 9.045 0.000 5.705) 10.694 10.440 ( -6.980 -0.000 -9.563) 11.839 11.632 ( 25.505 0.000 10.208) 27.472 11.823 ( 5.477 0.000 -12.321) 13.483 12.223 ( 9.441 0.000 -12.031) 15.293 13.097 ( -4.654 -0.000 12.171) 13.031 13.754 ( 5.296 0.000 0.122) 5.297 13.983 ( -6.951 -0.000 -1.064) 7.032 14.838 ( -5.685 -0.000 -11.970) 13.251 18.296 ( -14.508 -0.000 -20.494) 25.110 18.536 ( 14.175 0.000 -8.917) 16.747 19.171 ( -9.598 -0.000 -2.736) 9.980 19.777 ( -2.250 -0.000 -2.148) 3.110 21.273 ( -11.234 -0.000 -4.362) 12.051 21.780 ( 13.564 0.000 13.357) 19.036 23.744 ( 0.731 0.000 0.755) 1.050 24.272 ( 5.855 0.000 -1.011) 5.942 ======================= Grid point 325 (153/361) ======================= q-point: ( 0.20 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.468 ( 2.901 7.506 10.119) 12.928 2.684 ( 9.450 -8.501 10.228) 16.315 3.141 ( -3.834 2.997 -6.654) 8.244 3.223 ( 1.607 -0.054 -1.780) 2.399 3.478 ( -3.206 3.995 -7.104) 8.758 3.578 ( 4.144 10.787 -5.091) 12.627 3.845 ( 4.547 -14.894 -7.686) 17.366 4.035 ( 6.222 -3.596 3.945) 8.198 5.037 ( -4.114 0.490 5.198) 6.647 5.100 ( -3.569 -1.133 10.201) 10.867 5.341 ( -13.168 0.559 -9.169) 16.056 6.029 ( -4.008 1.041 2.761) 4.977 6.598 ( -10.341 1.412 -5.662) 11.874 7.151 ( -3.755 -0.754 8.222) 9.070 8.033 ( -13.889 0.402 41.880) 44.125 8.278 ( -13.865 3.638 18.726) 23.583 9.065 ( -13.504 4.862 -3.316) 14.731 9.292 ( -8.428 -11.803 -0.265) 14.506 9.997 ( -5.548 5.153 -1.941) 7.816 10.204 ( 6.046 14.009 0.879) 15.283 10.532 ( 14.287 -17.425 8.623) 24.127 11.704 ( 7.520 10.803 -12.888) 18.421 12.135 ( 22.271 -1.963 9.128) 24.149 12.295 ( 15.791 -2.755 -6.220) 17.194 13.185 ( -4.590 -4.499 9.836) 11.750 13.786 ( -0.403 0.979 -3.272) 3.439 13.876 ( -5.428 -2.303 -0.812) 5.952 14.658 ( -2.414 0.472 -6.302) 6.765 17.821 ( -14.813 0.014 -22.458) 26.903 18.663 ( 14.450 0.597 -3.543) 14.890 19.034 ( -5.858 -1.300 -1.738) 6.247 19.684 ( -8.448 -0.799 1.485) 8.614 21.094 ( 0.511 4.986 -9.806) 11.013 22.126 ( 7.027 -5.275 14.375) 16.847 23.793 ( 5.005 -0.821 -0.643) 5.112 24.336 ( 4.153 1.138 0.380) 4.323 ======================= Grid point 326 (154/361) ======================= q-point: (-0.70 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.434 ( -3.398 9.968 -0.770) 10.559 2.831 ( -8.914 -6.792 -4.190) 11.965 3.118 ( 8.117 3.470 3.594) 9.532 3.192 ( -1.082 1.717 0.198) 2.039 3.320 ( -1.965 6.389 0.372) 6.694 3.613 ( 7.023 -3.200 -1.541) 7.870 3.960 ( 7.306 -11.985 -4.977) 14.893 4.217 ( 6.170 -1.228 4.069) 7.493 4.927 ( -15.295 0.269 -5.586) 16.285 5.029 ( -9.706 -1.585 -4.575) 10.847 5.162 ( -6.244 -1.668 6.900) 9.454 5.998 ( -1.128 2.727 0.535) 2.999 6.365 ( -11.347 3.250 -2.875) 12.148 7.222 ( -2.663 -2.420 7.778) 8.570 8.203 ( -5.335 6.152 7.515) 11.080 8.315 ( -20.039 -1.051 34.697) 40.082 8.818 ( -18.792 -7.580 0.739) 20.276 9.305 ( -6.110 -6.310 4.659) 9.942 9.792 ( -10.244 -3.351 -6.529) 12.602 10.158 ( 4.463 16.066 -0.182) 16.676 10.997 ( 14.154 -11.396 9.178) 20.358 11.555 ( 11.612 22.002 -8.557) 26.309 12.367 ( 14.357 2.506 -5.711) 15.653 12.660 ( 17.864 -5.575 8.233) 20.445 13.285 ( -4.818 -4.064 9.765) 11.623 13.661 ( -5.399 2.867 -1.980) 6.425 13.843 ( -3.123 -6.195 -3.197) 7.638 14.633 ( 5.076 -4.131 -3.475) 7.410 17.329 ( -15.336 0.196 -22.003) 26.821 18.852 ( 13.300 1.328 3.159) 13.734 18.989 ( -0.520 -3.957 -2.367) 4.640 19.626 ( -4.435 -1.951 3.023) 5.711 20.933 ( 3.661 7.153 -12.962) 15.251 22.420 ( -0.459 -9.946 14.200) 17.343 23.877 ( 8.373 0.469 -1.999) 8.621 24.380 ( 2.265 2.635 2.228) 4.128 ======================= Grid point 327 (155/361) ======================= q-point: (-0.60 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.227 ( -8.845 10.950 -1.179) 14.125 2.599 ( -14.933 1.328 -6.503) 16.342 3.156 ( 1.148 2.559 0.399) 2.833 3.193 ( 1.405 2.737 5.344) 6.166 3.394 ( 1.758 -6.421 1.099) 6.747 3.724 ( 0.886 -7.140 0.139) 7.196 4.124 ( 5.216 -0.431 2.742) 5.909 4.293 ( 2.696 2.408 2.472) 4.379 4.585 ( -13.636 -2.050 -10.850) 17.546 4.949 ( -5.097 -8.135 -0.346) 9.606 5.142 ( -6.400 -3.199 1.539) 7.319 5.950 ( 0.197 4.242 -2.065) 4.722 6.160 ( -10.288 4.575 1.432) 11.350 7.287 ( -5.634 -3.845 7.100) 9.846 8.095 ( -1.943 5.016 -5.845) 7.944 8.410 ( -24.085 -4.977 25.730) 35.593 8.706 ( -15.491 -9.577 8.404) 20.058 9.327 ( -7.260 -5.193 5.508) 10.488 9.659 ( -7.472 -9.202 -2.861) 12.194 10.049 ( 1.728 13.212 -0.848) 13.351 11.336 ( 10.303 -2.015 5.337) 11.777 11.430 ( 13.226 27.234 -3.141) 30.439 12.435 ( 11.045 3.804 -8.294) 14.327 12.955 ( 8.844 -3.242 0.084) 9.420 13.257 ( -16.006 5.580 10.885) 20.145 13.649 ( 0.884 -6.666 -0.347) 6.734 13.879 ( 5.306 -3.947 4.041) 7.750 14.775 ( 11.302 -11.072 -5.137) 16.635 16.861 ( -14.931 1.077 -16.524) 22.297 19.015 ( 3.114 -5.916 -4.901) 8.289 19.097 ( 12.166 1.769 8.995) 15.233 19.672 ( 3.099 -1.664 3.024) 4.639 20.747 ( 3.474 7.557 -14.835) 17.007 22.628 ( -8.867 -14.654 11.906) 20.860 23.965 ( 10.136 3.047 -3.191) 11.054 24.419 ( 1.225 2.940 5.128) 6.037 ======================= Grid point 328 (156/361) ======================= q-point: (-0.50 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.980 ( -13.062 11.683 4.257) 18.034 2.246 ( -18.305 7.344 -4.899) 20.323 3.186 ( 3.887 1.895 -0.316) 4.336 3.305 ( 1.663 -4.313 8.548) 9.718 3.437 ( -4.021 -7.333 0.051) 8.363 3.595 ( -20.471 6.542 1.549) 21.547 4.240 ( 3.527 -0.706 8.535) 9.261 4.321 ( -8.072 -3.242 -6.888) 11.096 4.424 ( 9.844 -3.845 -3.158) 11.030 4.993 ( -0.400 -8.081 -0.293) 8.096 5.095 ( -5.000 -6.499 -2.354) 8.532 5.887 ( 2.269 5.022 -3.442) 6.498 6.036 ( -7.541 4.576 6.548) 10.985 7.285 ( -13.575 -5.450 7.700) 16.531 7.965 ( -0.633 -1.579 -7.718) 7.903 8.331 ( -25.769 -5.263 13.310) 29.477 8.723 ( -6.332 -4.272 7.995) 11.057 9.319 ( -9.281 -6.473 4.074) 12.026 9.663 ( -4.354 -10.182 0.719) 11.097 10.004 ( 2.272 3.592 3.367) 5.422 11.287 ( 10.891 32.161 -0.577) 33.959 11.514 ( 5.843 3.050 1.549) 6.771 12.415 ( 8.302 5.663 -10.294) 14.386 12.940 ( -5.720 3.815 -4.774) 8.370 13.154 ( -10.044 0.581 11.528) 15.301 13.700 ( -0.975 -9.931 -2.793) 10.362 14.119 ( 12.020 2.463 6.095) 13.701 15.012 ( 14.264 -15.719 -6.881) 22.313 16.532 ( -11.424 0.688 -1.540) 11.548 19.048 ( 3.910 -5.887 -7.233) 10.112 19.370 ( 11.516 2.520 9.583) 15.192 19.801 ( 9.051 1.320 2.650) 9.523 20.539 ( 2.759 5.981 -15.699) 17.025 22.719 ( -16.849 -19.261 7.998) 26.811 24.022 ( 9.450 5.533 -4.271) 11.754 24.500 ( 1.492 1.347 7.809) 8.064 ======================= Grid point 329 (157/361) ======================= q-point: (-0.40 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.747 ( -16.117 12.988 9.654) 22.840 1.853 ( -18.731 12.034 1.563) 22.318 3.199 ( -24.822 7.610 8.083) 27.192 3.222 ( 3.134 8.069 1.959) 8.875 3.391 ( -7.942 -7.076 0.411) 10.645 3.555 ( 3.545 -8.488 7.567) 11.911 4.096 ( -8.602 -1.146 -5.426) 10.235 4.440 ( 1.932 -9.715 -1.822) 10.071 4.601 ( 9.853 -3.135 4.300) 11.198 5.046 ( -0.322 -3.750 -1.928) 4.229 5.078 ( 0.569 -7.038 -1.554) 7.230 5.855 ( 5.860 5.234 -3.380) 8.554 6.023 ( -4.931 2.735 11.470) 12.781 7.196 ( -21.872 -9.121 9.718) 25.612 7.923 ( 0.413 -5.459 -7.043) 8.920 8.154 ( -20.493 -6.109 8.279) 22.931 8.764 ( -0.522 3.120 4.749) 5.706 9.289 ( -9.982 -9.789 2.279) 14.165 9.702 ( -2.672 -5.511 2.657) 6.676 10.113 ( 1.001 -8.188 3.256) 8.868 11.106 ( 4.305 29.299 -1.933) 29.676 11.529 ( 4.365 10.806 1.536) 11.755 12.330 ( 7.191 7.260 -11.803) 15.612 12.739 ( -11.382 5.800 1.981) 12.927 13.177 ( -3.980 -1.967 5.815) 7.316 13.704 ( -1.181 -6.478 -8.959) 11.118 14.231 ( 6.936 6.880 -2.253) 10.026 15.277 ( 12.973 -16.440 -7.847) 22.364 16.583 ( 0.088 -5.660 22.844) 23.535 19.050 ( 5.429 -3.605 -10.781) 12.598 19.560 ( 6.720 4.534 2.708) 8.547 19.961 ( 10.223 6.837 6.273) 13.806 20.363 ( 5.374 1.055 -15.239) 16.193 22.705 ( -23.413 -24.238 5.055) 34.076 24.040 ( 8.201 5.899 -4.481) 11.052 24.594 ( -0.217 0.791 5.294) 5.357 ======================= Grid point 330 (158/361) ======================= q-point: (-0.30 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.511 ( -12.786 16.248 13.634) 24.766 1.612 ( -14.864 12.175 14.761) 24.229 2.890 ( -24.674 10.598 18.098) 32.383 3.268 ( 1.694 -3.432 -2.626) 4.642 3.330 ( -5.170 0.166 3.830) 6.436 3.736 ( 5.086 -2.336 0.642) 5.633 3.996 ( -5.692 -6.463 2.788) 9.052 4.467 ( -0.781 -9.302 -8.138) 12.384 4.746 ( -2.081 -4.723 0.043) 5.161 5.032 ( 2.729 1.661 -0.955) 3.334 5.244 ( 10.396 -5.906 4.387) 12.736 5.878 ( 7.454 3.773 -1.794) 8.545 6.118 ( -3.108 0.486 15.740) 16.051 7.092 ( -24.383 -14.373 11.110) 30.407 7.816 ( -10.974 -2.461 -1.391) 11.332 8.140 ( -5.611 -9.471 3.591) 11.580 8.759 ( 0.430 6.933 3.550) 7.800 9.295 ( -7.118 -13.033 2.477) 15.055 9.777 ( -0.409 -5.919 5.352) 7.991 10.167 ( -4.971 -6.412 -2.840) 8.595 10.814 ( -3.939 25.630 -4.382) 26.298 11.521 ( 7.327 17.205 3.898) 19.102 12.215 ( 7.050 6.772 -12.253) 15.675 12.575 ( -10.304 4.155 3.695) 11.709 13.162 ( -3.026 3.971 -1.651) 5.258 13.568 ( -3.465 1.143 -6.443) 7.404 14.218 ( 2.523 3.138 -1.559) 4.318 15.447 ( 8.224 -14.308 -13.134) 21.092 17.189 ( 16.364 -18.149 34.441) 42.230 19.007 ( 9.610 1.023 -15.192) 18.005 19.533 ( -0.450 4.718 -5.942) 7.601 20.034 ( -1.669 8.434 4.005) 9.484 20.392 ( 18.454 -0.630 -6.225) 19.486 22.618 ( -30.030 -28.879 3.443) 41.805 24.052 ( 7.775 4.486 -4.201) 9.911 24.545 ( -6.731 5.331 -2.511) 8.946 ======================= Grid point 331 (159/361) ======================= q-point: (-0.20 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.509 ( -0.185 11.733 21.321) 24.337 1.535 ( -11.243 9.844 20.629) 25.472 2.775 ( -13.612 7.854 23.214) 28.033 3.186 ( -7.418 -3.146 -2.688) 8.494 3.438 ( 7.416 -0.052 5.439) 9.197 3.777 ( 4.619 -0.377 -4.149) 6.220 4.084 ( -4.668 -9.439 7.070) 12.684 4.393 ( -2.934 -4.209 -9.959) 11.203 4.659 ( -3.085 -1.223 -8.279) 8.919 5.077 ( 2.069 2.767 3.872) 5.189 5.515 ( 10.977 -4.656 3.717) 12.490 5.952 ( 5.837 0.937 1.353) 6.065 6.319 ( -1.329 -2.570 21.608) 21.801 7.042 ( -20.962 -16.683 11.029) 28.972 7.674 ( -11.050 -0.783 0.440) 11.086 8.112 ( -11.777 -1.000 4.484) 12.641 8.815 ( 0.853 -2.986 8.611) 9.154 9.378 ( -3.483 -13.840 2.295) 14.455 9.906 ( 3.445 5.165 4.343) 7.577 10.065 ( -10.002 -11.732 -0.215) 15.418 10.468 ( -2.515 26.584 -2.397) 26.810 11.462 ( 6.394 24.303 -0.642) 25.138 12.130 ( 6.522 1.763 -11.925) 13.705 12.432 ( -9.106 0.986 -0.396) 9.168 13.013 ( -3.095 11.051 1.796) 11.615 13.522 ( -0.333 0.796 3.191) 3.306 14.205 ( -0.320 -0.019 -1.466) 1.501 15.453 ( 2.960 -10.871 -17.664) 20.951 18.030 ( 19.528 -24.315 18.132) 36.073 18.991 ( 19.374 2.768 -13.728) 23.905 19.353 ( -6.520 1.193 -10.038) 12.029 19.912 ( -5.020 7.092 -2.487) 9.038 20.663 ( 20.429 2.213 3.488) 20.842 22.426 ( -38.489 -27.814 1.519) 47.511 24.081 ( 7.590 2.600 -3.804) 8.880 24.248 ( -12.851 13.853 -5.175) 19.592 ======================= Grid point 332 (160/361) ======================= q-point: (-0.10 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.629 ( -4.607 3.792 23.979) 24.710 1.741 ( 6.246 6.545 20.243) 22.173 2.921 ( 1.287 2.550 20.208) 20.409 3.104 ( -1.701 1.031 0.246) 2.004 3.620 ( 6.344 -3.803 4.102) 8.458 3.791 ( 0.728 -2.204 -2.720) 3.575 4.102 ( -5.580 -6.606 -6.851) 11.032 4.214 ( -5.995 2.803 -9.561) 11.627 4.601 ( 4.847 0.061 -0.125) 4.849 5.091 ( -1.986 3.369 2.107) 4.442 5.686 ( 3.812 -2.744 0.571) 4.732 6.043 ( 1.352 -0.982 3.983) 4.320 6.661 ( 0.801 -5.299 27.936) 28.446 7.061 ( -12.788 -12.061 9.052) 19.772 7.467 ( -14.116 3.561 -1.431) 14.629 8.060 ( -15.874 0.379 21.893) 27.045 9.006 ( 0.260 -13.066 7.309) 14.974 9.476 ( -2.087 -11.972 1.052) 12.197 9.811 ( 0.498 19.434 5.186) 20.120 10.065 ( -8.143 7.828 1.673) 11.419 10.400 ( 9.849 -7.963 2.430) 12.896 11.269 ( 6.672 27.764 -3.295) 28.744 12.027 ( 1.696 1.579 -12.318) 12.534 12.330 ( -2.066 -4.845 -5.767) 7.810 12.970 ( -1.826 9.299 10.909) 14.450 13.578 ( 2.851 1.702 4.132) 5.301 14.163 ( -3.042 -0.834 -2.065) 3.770 15.313 ( -1.742 -6.872 -19.113) 20.386 18.424 ( 10.098 -8.579 -8.906) 15.966 19.082 ( -12.144 -3.304 -13.439) 18.412 19.265 ( 21.756 -8.191 -3.415) 23.496 19.736 ( -0.118 9.283 -5.083) 10.585 21.003 ( 18.224 0.767 8.520) 20.132 22.046 ( -41.435 -14.147 0.985) 43.795 23.916 ( -9.346 12.072 -0.083) 15.267 24.131 ( 7.286 0.915 -3.062) 7.956 ======================= Grid point 335 (161/361) ======================= q-point: ( 0.20 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.581 ( -0.621 -0.000 -2.016) 2.110 2.707 ( -6.760 -0.000 -2.686) 7.274 3.142 ( 9.513 0.000 3.586) 10.166 3.216 ( -4.560 -0.000 0.686) 4.612 3.461 ( -1.703 -0.000 2.994) 3.445 3.530 ( -2.975 -0.000 -11.054) 11.447 3.829 ( 13.515 0.000 -0.031) 13.515 4.197 ( 9.094 0.000 4.624) 10.202 4.951 ( -12.756 -0.000 1.476) 12.841 4.992 ( -16.035 -0.000 -11.775) 19.894 5.149 ( -4.821 -0.000 6.325) 7.953 6.023 ( -0.728 -0.000 0.381) 0.822 6.402 ( -10.231 -0.000 -2.884) 10.630 7.192 ( -3.311 -0.000 6.990) 7.734 8.258 ( -15.491 -0.000 28.980) 32.861 8.336 ( -17.594 -0.000 25.000) 30.570 8.700 ( -16.278 -0.000 -13.046) 20.860 9.264 ( -4.573 -0.000 8.991) 10.087 9.752 ( -12.037 -0.000 -8.674) 14.837 10.351 ( 2.274 0.000 -4.847) 5.354 10.860 ( 18.851 0.000 14.418) 23.732 11.784 ( 15.474 0.000 -10.109) 18.483 12.408 ( 14.685 0.000 -7.054) 16.291 12.580 ( 17.387 0.000 12.064) 21.162 13.232 ( -3.546 -0.000 11.959) 12.474 13.714 ( -2.714 -0.000 -7.546) 8.019 13.759 ( -6.296 -0.000 0.604) 6.325 14.594 ( 2.912 0.000 -4.847) 5.654 17.331 ( -15.306 -0.000 -21.589) 26.464 18.864 ( 14.095 0.000 2.349) 14.289 18.952 ( -1.359 -0.000 -2.037) 2.449 19.608 ( -4.185 -0.000 2.715) 4.988 21.006 ( 3.538 0.000 -13.756) 14.203 22.323 ( -1.432 -0.000 14.778) 14.847 23.881 ( 8.606 0.000 -0.913) 8.654 24.404 ( 2.613 0.000 1.781) 3.162 ======================= Grid point 336 (162/361) ======================= q-point: (-0.70 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.420 ( -5.139 9.420 -5.240) 11.941 2.564 ( -9.075 -4.866 -6.859) 12.373 3.155 ( -4.905 0.258 2.069) 5.330 3.291 ( -5.292 -2.411 -1.343) 5.968 3.356 ( 4.929 9.530 4.778) 11.745 3.554 ( 1.139 -10.678 0.878) 10.775 4.082 ( 14.048 -1.776 4.228) 14.778 4.355 ( 6.231 0.771 0.399) 6.291 4.599 ( -17.445 5.341 -6.511) 19.371 4.789 ( -12.659 -8.600 -1.103) 15.343 5.112 ( -6.193 -0.590 0.439) 6.236 6.000 ( -0.392 1.271 -1.917) 2.333 6.241 ( -8.158 3.149 0.645) 8.769 7.212 ( -6.977 -3.052 5.405) 9.339 8.239 ( -7.894 10.198 -3.245) 13.299 8.340 ( -27.480 -2.164 27.864) 39.195 8.477 ( -11.085 -13.242 5.642) 18.168 9.301 ( -7.208 0.280 10.261) 12.543 9.518 ( -10.019 -4.438 -5.797) 12.397 10.252 ( 0.715 6.617 -6.705) 9.447 11.281 ( 15.294 -1.943 10.644) 18.735 11.863 ( 16.907 14.693 -5.566) 23.081 12.497 ( 11.584 3.101 -7.419) 14.101 12.876 ( 6.432 -4.766 3.588) 8.772 13.325 ( -11.514 1.630 14.132) 18.302 13.559 ( -4.909 -2.396 -6.185) 8.252 13.803 ( 9.586 -3.027 4.859) 11.166 14.625 ( 8.642 -4.516 -7.171) 12.104 16.875 ( -14.753 0.404 -16.207) 21.920 18.940 ( 4.098 -2.090 -5.163) 6.915 19.123 ( 12.509 0.839 8.839) 15.339 19.646 ( 4.487 -0.887 2.712) 5.317 20.854 ( 2.390 3.435 -15.388) 15.947 22.435 ( -9.912 -5.730 12.283) 16.791 24.003 ( 9.872 1.060 -0.607) 9.947 24.455 ( 1.163 0.967 3.110) 3.458 ======================= Grid point 337 (163/361) ======================= q-point: (-0.60 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( -7.414 10.985 -0.770) 13.275 2.347 ( -11.348 3.296 -5.323) 12.960 3.144 ( -2.434 -3.858 1.096) 4.692 3.228 ( -5.065 -6.623 2.396) 8.675 3.369 ( -5.594 2.189 4.689) 7.620 3.664 ( 0.151 -0.417 0.528) 0.689 4.253 ( -8.476 -3.880 -10.263) 13.865 4.293 ( -1.097 5.648 8.188) 10.007 4.385 ( 4.372 0.887 1.208) 4.621 4.803 ( -1.622 -11.518 2.638) 11.927 5.016 ( -5.919 -2.605 -2.656) 6.991 5.957 ( 0.725 2.457 -1.882) 3.178 6.126 ( -6.278 4.743 3.538) 8.627 7.163 ( -15.329 -6.737 4.898) 17.446 7.982 ( -5.065 2.874 -9.229) 10.913 8.245 ( -27.691 -3.443 17.570) 32.975 8.589 ( -4.646 -8.375 11.344) 14.846 9.289 ( -9.617 1.185 8.523) 12.905 9.420 ( -8.278 -11.504 -0.781) 14.195 10.137 ( 2.387 6.786 -4.384) 8.425 11.572 ( 10.812 2.799 6.391) 12.868 11.849 ( 13.738 25.926 -2.420) 29.440 12.496 ( 6.246 4.286 -8.167) 11.138 12.965 ( 3.740 -2.238 -5.711) 7.184 13.200 ( -17.211 4.287 10.816) 20.775 13.504 ( -4.607 -10.678 -2.504) 11.896 14.139 ( 16.338 0.227 8.879) 18.596 14.749 ( 12.792 -11.664 -9.613) 19.801 16.542 ( -11.730 0.409 -4.135) 12.444 18.964 ( 7.041 -3.151 -8.524) 11.496 19.410 ( 11.386 1.697 10.920) 15.867 19.810 ( 12.721 -0.094 2.342) 12.935 20.641 ( 0.099 4.588 -16.035) 16.678 22.438 ( -17.716 -10.957 8.263) 22.410 24.110 ( 8.505 3.703 -0.865) 9.316 24.507 ( 0.439 -0.184 4.636) 4.660 ======================= Grid point 338 (164/361) ======================= q-point: (-0.50 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.996 ( -9.076 13.508 6.057) 17.365 2.071 ( -12.567 11.457 0.728) 17.021 3.138 ( -3.701 -6.968 -2.369) 8.237 3.259 ( -14.802 -2.512 1.329) 15.072 3.352 ( -1.041 -9.997 6.597) 12.023 3.574 ( -3.293 13.692 7.467) 15.940 4.060 ( -5.696 -1.810 -9.247) 11.011 4.307 ( -3.133 -4.414 2.725) 6.060 4.548 ( 7.020 -2.547 4.401) 8.669 4.921 ( -1.758 -9.075 3.436) 9.862 4.977 ( 1.487 -3.857 -1.303) 4.334 5.941 ( 4.791 3.876 -2.796) 6.767 6.072 ( -6.099 2.541 8.499) 10.765 7.014 ( -25.630 -10.022 7.338) 28.481 7.846 ( 0.545 -2.346 -7.992) 8.347 8.071 ( -21.741 -2.997 9.478) 23.906 8.741 ( -2.072 -5.271 10.588) 12.007 9.212 ( -11.420 0.957 5.559) 12.737 9.446 ( -8.698 -16.551 2.399) 18.851 10.108 ( 4.515 3.656 -0.886) 5.877 11.646 ( 5.896 20.073 -3.269) 21.175 11.771 ( 9.752 21.355 4.356) 23.877 12.419 ( 2.655 2.963 -8.191) 9.106 12.876 ( -3.170 8.376 -2.978) 9.438 13.133 ( -7.001 -3.173 7.473) 10.720 13.528 ( -2.236 -11.830 -4.305) 12.786 14.347 ( 9.359 5.644 -1.999) 11.110 14.966 ( 13.200 -16.739 -8.831) 23.074 16.500 ( -3.379 -3.311 15.614) 16.315 18.981 ( 8.653 -3.411 -12.278) 15.403 19.642 ( 7.855 3.974 6.161) 10.745 20.056 ( 17.745 3.360 3.981) 18.494 20.397 ( -1.079 2.608 -15.948) 16.196 22.341 ( -23.777 -15.359 5.665) 28.868 24.151 ( 6.155 5.922 -2.070) 8.789 24.577 ( -0.932 -2.164 4.236) 4.847 ======================= Grid point 339 (165/361) ======================= q-point: (-0.40 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.834 ( -10.221 16.673 10.154) 22.036 1.843 ( -8.964 14.888 11.578) 20.882 3.022 ( -15.240 3.729 3.996) 16.191 3.136 ( -6.205 -9.152 -2.019) 11.240 3.421 ( 0.795 3.194 2.400) 4.074 3.673 ( 0.286 -2.773 15.248) 15.501 3.901 ( -3.498 -0.994 -7.308) 8.163 4.319 ( -2.155 -6.845 -2.608) 7.635 4.659 ( -1.667 -4.418 0.436) 4.742 5.050 ( 2.174 -0.284 3.602) 4.216 5.092 ( 8.081 -9.807 5.021) 13.664 5.947 ( 6.263 3.585 -3.533) 8.035 6.122 ( -4.586 -0.230 13.644) 14.396 6.830 ( -29.737 -13.537 11.952) 34.791 7.775 ( -5.915 -1.597 -2.662) 6.680 7.981 ( -7.156 -7.152 3.557) 10.724 8.866 ( -0.443 1.130 8.130) 8.220 9.105 ( -12.292 -4.565 4.553) 13.880 9.514 ( -8.729 -17.704 3.929) 20.126 10.150 ( 4.111 2.309 0.542) 4.746 11.374 ( 1.892 32.215 -6.546) 32.927 11.804 ( 7.077 13.819 5.092) 16.339 12.331 ( 3.136 4.129 -8.130) 9.642 12.707 ( -5.960 10.609 0.688) 12.188 13.179 ( 0.087 -1.815 1.684) 2.477 13.517 ( -2.290 -6.534 -5.261) 8.696 14.311 ( 2.533 6.535 -5.129) 8.685 15.154 ( 8.541 -17.036 -12.557) 22.822 16.904 ( 8.544 -12.570 30.289) 33.889 18.971 ( 9.925 -3.642 -16.558) 19.645 19.667 ( 2.110 8.498 -4.745) 9.959 20.146 ( -4.759 3.298 -5.127) 7.734 20.401 ( 22.596 1.914 0.184) 22.677 22.190 ( -27.593 -18.063 5.477) 33.432 24.146 ( 5.235 5.562 -2.870) 8.159 24.580 ( -5.319 -0.778 -0.234) 5.381 ======================= Grid point 340 (166/361) ======================= q-point: (-0.30 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.726 ( -8.526 11.572 14.711) 20.567 1.781 ( -2.503 16.885 17.202) 24.234 2.898 ( -7.200 4.294 9.401) 12.596 3.106 ( -4.668 -5.254 -0.171) 7.030 3.457 ( 4.011 0.651 1.033) 4.192 3.804 ( -2.347 2.299 0.426) 3.313 3.878 ( -2.785 -9.563 8.601) 13.160 4.313 ( 0.354 -4.623 -5.335) 7.068 4.624 ( -2.595 -2.401 -4.107) 5.419 5.126 ( 1.272 2.108 5.933) 6.424 5.386 ( 9.557 -9.374 4.717) 14.193 5.974 ( 4.730 1.389 -1.128) 5.057 6.272 ( -2.321 -2.601 17.423) 17.769 6.737 ( -26.274 -15.790 17.962) 35.529 7.664 ( -9.361 -0.068 1.543) 9.488 8.006 ( -5.254 -8.560 0.450) 10.053 8.873 ( -3.432 7.151 7.009) 10.585 9.120 ( -7.392 -13.853 5.509) 16.641 9.639 ( -3.911 -18.298 5.652) 19.546 10.171 ( 2.533 7.981 2.626) 8.776 11.007 ( 0.080 32.013 -5.954) 32.562 11.827 ( 5.968 13.133 2.132) 14.582 12.223 ( 3.578 7.304 -8.903) 12.059 12.509 ( -6.670 9.018 -4.391) 12.045 13.160 ( 0.005 4.331 -1.608) 4.620 13.522 ( 0.706 -1.233 3.542) 3.816 14.228 ( -1.450 2.838 -2.326) 3.946 15.209 ( 3.495 -15.283 -16.733) 22.930 17.610 ( 14.783 -20.704 26.967) 37.073 18.937 ( 9.953 -5.921 -18.758) 22.045 19.474 ( -0.899 9.389 -12.075) 15.322 19.989 ( -5.394 1.319 -4.880) 7.392 20.733 ( 21.294 5.246 6.209) 22.792 22.012 ( -29.110 -17.201 5.498) 34.257 24.140 ( 5.267 3.738 -3.195) 7.205 24.414 ( -10.563 4.807 -4.697) 12.520 ======================= Grid point 341 (167/361) ======================= q-point: (-0.20 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.738 ( -4.225 8.141 17.837) 20.057 1.898 ( 5.548 10.360 18.067) 21.553 2.930 ( 0.317 -1.758 2.931) 3.432 3.139 ( 1.761 1.734 8.105) 8.473 3.532 ( 3.989 -5.379 -2.928) 7.308 3.770 ( -5.487 -1.693 3.007) 6.482 3.961 ( -5.378 -5.585 2.292) 8.085 4.262 ( 2.144 2.022 -8.526) 9.021 4.602 ( 3.030 -0.077 1.150) 3.242 5.164 ( -1.657 4.095 4.178) 6.080 5.601 ( 4.215 -6.655 1.272) 7.980 6.023 ( 1.171 -0.980 1.968) 2.491 6.547 ( 0.949 -6.773 21.555) 22.614 6.815 ( -17.246 -14.148 23.277) 32.240 7.510 ( -12.675 1.353 -1.041) 12.789 8.012 ( -8.776 -5.576 9.057) 13.789 8.888 ( -2.728 -0.620 7.961) 8.438 9.221 ( -4.197 -14.396 3.187) 15.330 9.868 ( 1.097 -17.342 5.956) 18.369 10.151 ( 2.208 15.875 6.903) 17.451 10.679 ( 0.496 26.658 -3.105) 26.843 11.745 ( 5.248 20.260 -3.819) 21.274 12.084 ( 0.430 5.435 -9.470) 10.927 12.284 ( -2.653 2.318 -9.005) 9.669 13.130 ( 0.094 6.719 5.509) 8.689 13.617 ( 4.085 2.492 6.072) 7.731 14.153 ( -4.152 -0.007 -1.711) 4.491 15.135 ( -0.970 -12.270 -18.329) 22.079 18.205 ( 11.863 -14.773 7.180) 20.262 18.906 ( -2.087 -11.609 -12.938) 17.508 19.266 ( 7.008 4.131 -13.110) 15.429 19.850 ( -1.814 3.214 -5.062) 6.265 21.048 ( 13.567 4.545 10.359) 17.664 21.806 ( -24.061 -10.683 3.610) 26.572 24.123 ( -10.834 9.280 -4.170) 14.862 24.155 ( 5.375 1.601 -2.997) 6.359 ======================= Grid point 342 (168/361) ======================= q-point: (-0.10 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.899 ( 1.596 2.523 19.167) 19.398 2.157 ( 10.674 7.336 16.712) 21.143 2.988 ( 4.952 -4.243 -3.425) 7.366 3.297 ( 4.803 -0.623 8.156) 9.486 3.555 ( -2.688 -8.156 -7.463) 11.378 3.727 ( -4.328 -4.385 -3.733) 7.203 3.917 ( -6.243 0.910 3.480) 7.205 4.153 ( 7.072 9.765 -9.419) 15.300 4.743 ( 6.441 -1.141 7.742) 10.135 5.110 ( -5.695 5.642 4.510) 9.198 5.658 ( -2.098 -3.705 -1.868) 4.650 6.059 ( -3.484 -2.072 3.852) 5.592 6.842 ( -2.133 -9.089 8.981) 12.954 7.044 ( -6.851 -5.271 20.822) 22.545 7.335 ( -13.561 0.108 16.603) 21.438 8.092 ( -11.494 -5.011 18.556) 22.396 8.987 ( -0.658 -7.914 4.503) 9.129 9.362 ( 1.161 -14.565 3.696) 15.071 10.001 ( -7.288 0.847 1.731) 7.539 10.127 ( 2.740 15.443 9.537) 18.356 10.507 ( 4.331 9.891 -1.431) 10.893 11.610 ( 11.138 20.926 -1.477) 23.751 11.905 ( -3.023 0.110 -10.635) 11.057 12.197 ( 6.396 -1.684 -11.033) 12.863 13.155 ( -0.856 7.288 9.047) 11.649 13.722 ( 5.211 4.472 4.738) 8.342 14.065 ( -5.847 -1.221 -1.657) 6.198 14.977 ( -3.949 -8.514 -16.337) 18.841 18.422 ( 11.653 -4.098 -7.900) 14.662 18.679 ( -12.822 -3.889 -15.098) 20.186 19.267 ( -1.019 -6.041 -4.859) 7.819 19.792 ( 6.157 2.179 -5.309) 8.417 21.223 ( -10.178 -5.504 9.907) 15.232 21.698 ( 3.361 4.162 3.645) 6.473 23.884 ( -5.969 7.623 -1.386) 9.780 24.195 ( 5.559 -0.230 -2.279) 6.013 ======================= Grid point 346 (169/361) ======================= q-point: ( 0.30 -0.70 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.341 ( -3.612 -0.000 -6.798) 7.698 2.346 ( -8.215 -0.000 -1.583) 8.366 3.125 ( -7.992 -0.000 -3.684) 8.800 3.127 ( -6.344 -0.000 6.851) 9.337 3.413 ( -10.321 -0.000 4.340) 11.197 3.639 ( 10.628 0.000 2.336) 10.882 4.210 ( -7.351 -0.000 -11.841) 13.937 4.324 ( 9.710 0.000 6.325) 11.589 4.488 ( -13.732 -0.000 -1.994) 13.876 4.633 ( 1.438 0.000 9.965) 10.068 4.993 ( -6.370 -0.000 -3.350) 7.198 5.979 ( -0.138 -0.000 -0.882) 0.892 6.177 ( -5.652 -0.000 1.620) 5.879 7.091 ( -16.026 -0.000 4.249) 16.579 8.023 ( -6.731 -0.000 -12.636) 14.317 8.212 ( -28.408 -0.000 20.024) 34.756 8.497 ( -3.399 -0.000 14.980) 15.361 9.307 ( -10.368 -0.000 10.559) 14.798 9.308 ( -8.274 -0.000 -3.040) 8.815 10.202 ( 1.523 0.000 -6.803) 6.972 11.600 ( 12.606 0.000 8.537) 15.225 12.103 ( 13.745 0.000 -4.210) 14.375 12.580 ( 11.512 0.000 -8.797) 14.488 12.892 ( -1.115 -0.000 -0.627) 1.279 13.275 ( -17.234 -0.000 11.362) 20.642 13.369 ( -5.807 -0.000 -6.166) 8.470 14.140 ( 18.951 0.000 10.740) 21.782 14.633 ( 11.594 0.000 -11.425) 16.278 16.546 ( -11.806 -0.000 -5.033) 12.835 18.935 ( 8.074 0.000 -9.029) 12.113 19.427 ( 11.227 0.000 11.385) 15.989 19.808 ( 14.009 0.000 2.284) 14.194 20.687 ( -0.586 -0.000 -16.557) 16.568 22.335 ( -17.937 -0.000 8.692) 19.932 24.146 ( 8.207 0.000 0.965) 8.263 24.504 ( 0.001 0.000 2.931) 2.931 ======================= Grid point 348 (170/361) ======================= q-point: (-0.60 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.199 ( -4.076 6.944 -0.704) 8.083 2.244 ( -5.793 6.131 4.093) 9.375 3.004 ( -7.447 -5.205 -1.319) 9.181 3.157 ( -9.552 -6.330 8.731) 14.407 3.281 ( -9.132 0.603 1.607) 9.292 3.721 ( 2.153 2.620 -4.269) 5.452 4.049 ( -0.166 -0.153 -4.675) 4.680 4.296 ( -8.594 2.469 2.907) 9.403 4.514 ( 5.463 -0.984 4.421) 7.096 4.764 ( -6.345 -6.428 6.790) 11.300 4.929 ( 3.357 -1.285 0.830) 3.689 5.988 ( 3.059 1.223 -0.305) 3.308 6.113 ( -6.345 1.570 4.049) 7.689 6.867 ( -25.865 -4.808 5.899) 26.962 7.832 ( -0.370 0.121 -9.455) 9.463 8.038 ( -21.736 -0.798 10.719) 24.249 8.646 ( -4.258 -3.363 14.706) 15.675 9.213 ( -6.416 -6.119 -0.266) 8.870 9.256 ( -12.670 0.970 9.243) 15.713 10.164 ( 3.638 1.779 -3.581) 5.406 11.825 ( 9.131 4.595 5.041) 11.398 12.149 ( 6.581 9.385 -3.758) 12.062 12.553 ( 5.791 15.232 -6.509) 17.548 12.907 ( 4.677 -10.101 -6.773) 13.030 13.124 ( -15.128 5.609 9.459) 18.703 13.313 ( -4.169 -10.070 -0.925) 10.938 14.447 ( 11.691 5.126 1.775) 12.888 14.704 ( 13.179 -10.351 -12.199) 20.728 16.461 ( -4.783 -1.031 11.797) 12.772 18.936 ( 10.044 -1.331 -13.570) 16.935 19.694 ( 8.383 1.500 8.741) 12.204 20.091 ( 21.513 0.719 2.108) 21.628 20.441 ( -3.705 1.577 -16.807) 17.283 22.149 ( -23.460 -5.344 6.695) 24.975 24.239 ( 4.791 3.061 0.623) 5.719 24.534 ( -1.185 -1.820 2.144) 3.052 ======================= Grid point 349 (171/361) ======================= q-point: (-0.50 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.064 ( -6.256 10.808 4.356) 13.226 2.174 ( -3.221 16.829 11.612) 20.699 2.962 ( -7.329 -8.843 -0.014) 11.485 3.039 ( -13.813 -2.466 2.230) 14.208 3.337 ( 0.414 -7.215 4.476) 8.500 3.637 ( -1.840 -2.293 -5.566) 6.295 4.029 ( 4.181 10.280 3.021) 11.502 4.227 ( -6.001 -1.463 2.201) 6.557 4.597 ( -1.395 -2.097 1.242) 2.808 4.857 ( -0.863 -13.354 6.806) 15.013 5.070 ( 6.147 0.786 6.641) 9.083 6.005 ( 5.259 2.641 -4.845) 7.623 6.110 ( -6.492 -0.959 12.282) 13.925 6.621 ( -29.259 -8.680 10.586) 32.303 7.762 ( 0.980 -0.012 -5.046) 5.140 7.889 ( -12.454 -3.006 4.036) 13.433 8.782 ( -6.571 -6.092 13.041) 15.823 9.137 ( -10.868 3.740 5.400) 12.698 9.240 ( -6.639 -10.768 4.682) 13.489 10.192 ( 5.213 1.727 0.106) 5.493 11.864 ( 5.873 17.146 -2.569) 18.305 12.060 ( 3.051 13.420 -3.147) 14.117 12.394 ( -2.079 7.353 -2.569) 8.061 12.925 ( 0.991 10.641 -1.889) 10.853 13.080 ( -1.247 -9.229 2.191) 9.567 13.363 ( -1.577 -8.864 1.220) 9.085 14.441 ( 4.197 7.686 -7.488) 11.523 14.851 ( 8.796 -15.328 -12.218) 21.485 16.733 ( 4.738 -6.094 26.397) 27.503 18.907 ( 10.095 -2.806 -18.240) 21.035 19.807 ( 3.089 6.015 -0.211) 6.766 20.164 ( -5.793 -0.510 -14.668) 15.778 20.450 ( 25.155 2.622 3.597) 25.545 21.948 ( -24.892 -8.613 7.564) 27.405 24.247 ( 2.525 5.052 -1.105) 5.755 24.540 ( -3.935 -3.047 -0.131) 4.978 ======================= Grid point 350 (172/361) ======================= q-point: (-0.40 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.945 ( -5.808 11.877 8.575) 15.758 2.119 ( -1.820 19.632 13.151) 23.699 2.900 ( -8.290 -4.361 1.662) 9.513 3.019 ( -1.178 -4.129 4.428) 6.168 3.416 ( 0.475 -4.809 -2.111) 5.273 3.612 ( -2.340 -11.608 -4.706) 12.742 4.041 ( -2.691 15.798 15.529) 22.315 4.222 ( 3.617 -5.104 -4.354) 7.622 4.583 ( -2.405 -1.852 -0.276) 3.048 5.080 ( 0.097 -11.071 8.009) 13.665 5.246 ( 7.140 -1.602 7.014) 10.136 5.998 ( 3.193 1.103 -2.740) 4.350 6.221 ( -3.509 -2.864 14.430) 15.125 6.488 ( -24.810 -11.020 17.840) 32.484 7.676 ( -8.255 1.215 0.790) 8.381 7.862 ( -1.148 -6.304 -1.625) 6.610 8.884 ( -10.547 -10.817 10.463) 18.377 9.015 ( -8.172 6.799 6.661) 12.545 9.354 ( -1.234 -12.375 6.334) 13.956 10.274 ( 5.661 3.541 3.967) 7.767 11.603 ( 2.150 31.446 -8.893) 32.750 11.978 ( 2.533 5.517 -3.261) 6.891 12.296 ( -5.735 0.914 -0.889) 5.875 12.775 ( -0.037 16.868 -3.077) 17.146 13.150 ( 1.193 -5.759 -3.491) 6.840 13.482 ( 4.049 -2.612 7.081) 8.564 14.309 ( -1.607 5.866 -5.433) 8.156 14.915 ( 4.036 -16.074 -15.835) 22.922 17.296 ( 10.981 -13.208 29.589) 34.214 18.830 ( 7.950 -5.087 -21.194) 23.201 19.645 ( -2.280 8.769 -13.421) 16.193 19.974 ( -5.370 -2.489 -6.158) 8.541 20.835 ( 24.308 5.133 6.068) 25.575 21.782 ( -22.247 -8.460 7.757) 25.033 24.214 ( 2.256 4.127 -2.393) 5.277 24.449 ( -7.966 -0.371 -3.649) 8.770 ======================= Grid point 351 (173/361) ======================= q-point: (-0.30 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.918 ( 0.727 10.816 10.359) 14.994 2.120 ( 1.353 14.063 14.623) 20.333 2.873 ( -1.813 -4.091 -0.532) 4.506 3.135 ( 3.162 -2.172 5.464) 6.677 3.423 ( -1.705 -6.794 -2.969) 7.608 3.627 ( -2.647 -11.392 -5.312) 12.845 4.024 ( -7.092 9.410 12.355) 17.073 4.289 ( 10.251 1.511 -5.649) 11.801 4.597 ( 0.452 -0.358 4.734) 4.769 5.210 ( -1.832 -0.717 6.648) 6.933 5.454 ( 4.394 -7.862 3.548) 9.680 6.009 ( 0.805 -0.668 -0.292) 1.085 6.422 ( -1.331 -6.653 16.603) 17.935 6.569 ( -15.542 -12.019 26.620) 33.085 7.526 ( -12.189 0.443 -0.470) 12.206 7.900 ( -0.828 -5.249 1.902) 5.644 8.887 ( -13.532 -5.576 8.385) 16.868 9.014 ( -2.831 -3.080 7.703) 8.766 9.582 ( 3.857 -13.240 7.475) 15.686 10.373 ( 4.959 8.588 8.240) 12.894 11.219 ( 0.432 30.878 -8.288) 31.974 11.927 ( 4.000 3.453 -6.742) 8.566 12.141 ( -12.118 -0.087 -3.470) 12.605 12.542 ( 5.040 21.736 -10.032) 24.464 13.176 ( -0.282 -2.166 2.082) 3.018 13.669 ( 7.213 3.071 9.049) 11.973 14.173 ( -5.380 2.339 -2.442) 6.355 14.880 ( 0.027 -15.050 -17.571) 23.136 17.922 ( 11.655 -14.904 20.817) 28.130 18.725 ( 2.575 -7.929 -17.691) 19.557 19.347 ( -2.188 4.212 -17.478) 18.111 19.870 ( -2.685 -0.437 -3.865) 4.727 21.165 ( 13.122 7.721 10.153) 18.300 21.661 ( -11.275 -5.569 3.950) 13.181 24.188 ( 2.696 1.947 -2.928) 4.431 24.242 ( -9.747 3.904 -5.181) 11.709 ======================= Grid point 352 (174/361) ======================= q-point: (-0.20 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.004 ( 3.971 8.854 12.334) 15.694 2.285 ( 9.616 6.718 14.405) 18.577 2.911 ( 3.887 -3.752 -1.798) 5.693 3.235 ( 2.543 -5.053 -1.936) 5.979 3.417 ( -8.166 -8.333 1.488) 11.762 3.597 ( -2.044 -8.335 -9.362) 12.700 4.004 ( -0.900 7.297 7.853) 10.757 4.320 ( 10.030 8.302 -6.255) 14.445 4.724 ( 3.407 -0.901 9.625) 10.250 5.212 ( -4.726 4.657 5.165) 8.408 5.560 ( -1.785 -6.590 -0.555) 6.850 6.019 ( -3.053 -2.181 2.268) 4.384 6.663 ( -3.067 -10.020 13.837) 17.358 6.895 ( -4.277 -10.325 26.107) 28.398 7.346 ( -12.710 0.885 7.906) 14.995 7.986 ( -2.936 -5.413 8.177) 10.237 8.875 ( -9.111 -6.666 7.408) 13.503 9.131 ( -0.529 -8.800 6.947) 11.224 9.835 ( 2.594 -11.516 5.127) 12.870 10.431 ( 0.459 14.482 10.107) 17.666 10.879 ( 0.985 25.675 -5.340) 26.243 11.865 ( 7.603 4.787 -10.200) 13.593 11.889 ( -13.801 -0.437 -4.919) 14.658 12.341 ( 10.829 17.666 -10.280) 23.131 13.231 ( -0.513 0.180 5.731) 5.757 13.822 ( 5.170 6.245 7.018) 10.723 14.055 ( -5.867 0.403 -0.898) 5.949 14.781 ( -2.377 -12.588 -15.559) 20.154 18.323 ( 10.181 -6.634 2.180) 12.345 18.592 ( -6.779 -5.272 -12.177) 14.901 19.150 ( -0.695 -6.065 -10.502) 12.147 19.816 ( 1.953 0.531 -3.979) 4.464 21.202 ( -13.795 2.995 7.027) 15.769 21.768 ( 15.468 3.464 5.237) 16.694 24.010 ( -7.076 5.716 -4.091) 9.974 24.190 ( 3.165 -0.382 -2.459) 4.026 ======================= Grid point 353 (175/361) ======================= q-point: (-0.10 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.163 ( 3.362 2.028 12.530) 13.130 2.575 ( 14.747 5.932 11.660) 19.713 2.993 ( 4.255 -4.153 -1.095) 6.046 3.275 ( 3.960 -8.412 -8.518) 12.609 3.356 ( -14.288 -6.078 4.234) 16.094 3.508 ( 0.338 -4.961 -11.153) 12.211 4.048 ( 5.323 7.563 3.902) 10.038 4.274 ( 7.942 11.603 -7.574) 15.971 4.910 ( 3.472 -1.641 9.098) 9.876 5.153 ( -6.544 5.638 7.916) 11.717 5.509 ( -8.231 -4.511 -4.136) 10.257 6.012 ( -5.787 -2.577 3.449) 7.213 6.750 ( -8.034 -3.797 -1.746) 9.056 7.050 ( -5.139 -5.196 9.302) 11.829 7.586 ( -5.497 -4.263 40.979) 41.566 8.095 ( -4.719 -5.680 9.716) 12.204 8.916 ( -7.694 -8.807 6.750) 13.502 9.359 ( 5.523 -14.517 8.004) 17.473 9.907 ( -6.832 2.134 -0.249) 7.162 10.316 ( -8.704 13.638 4.236) 16.724 10.728 ( 10.224 15.721 0.574) 18.762 11.606 ( -12.213 -4.559 -10.944) 17.021 11.927 ( 16.795 5.104 -2.042) 17.672 12.291 ( 14.641 10.166 -7.463) 19.324 13.281 ( -1.674 2.791 6.735) 7.480 13.832 ( -5.247 0.698 0.741) 5.345 14.007 ( 1.405 5.176 1.292) 5.517 14.685 ( -1.995 -8.002 -9.629) 12.678 18.268 ( -12.473 -0.812 -17.480) 21.489 18.497 ( 12.557 -1.774 -6.512) 14.256 19.122 ( -4.212 -5.218 -0.876) 6.763 19.794 ( -0.925 0.770 -1.735) 2.111 21.039 ( -10.425 -3.143 -1.297) 10.966 22.048 ( 16.208 8.886 9.981) 21.007 23.858 ( -1.692 4.310 -2.687) 5.353 24.227 ( 3.344 -2.339 -1.217) 4.258 ======================= Grid point 358 (176/361) ======================= q-point: ( 0.40 -0.60 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.178 ( -4.006 -0.000 2.055) 4.502 2.363 ( 1.477 0.000 11.865) 11.957 2.866 ( -7.773 -0.000 1.264) 7.875 2.974 ( -17.258 -0.000 2.938) 17.506 3.276 ( 0.158 0.000 4.757) 4.760 3.612 ( -1.666 -0.000 -10.958) 11.084 4.093 ( 6.221 0.000 -2.270) 6.623 4.290 ( -3.658 -0.000 8.946) 9.664 4.588 ( 0.696 0.000 1.243) 1.425 4.681 ( -8.207 -0.000 8.015) 11.471 5.079 ( 6.439 0.000 8.151) 10.388 6.032 ( 5.022 0.000 -5.675) 7.578 6.099 ( -7.391 -0.000 11.705) 13.843 6.537 ( -28.661 -0.000 10.297) 30.455 7.764 ( 4.642 0.000 -6.750) 8.192 7.863 ( -15.322 -0.000 4.480) 15.963 8.721 ( -9.626 -0.000 15.317) 18.091 9.128 ( -3.195 -0.000 2.864) 4.291 9.186 ( -11.964 -0.000 7.823) 14.295 10.208 ( 5.173 0.000 -0.333) 5.184 12.018 ( 7.167 0.000 2.686) 7.653 12.143 ( 0.413 0.000 -6.881) 6.894 12.646 ( -8.481 -0.000 -8.515) 12.018 12.822 ( 14.372 0.000 -4.587) 15.086 13.095 ( -12.961 -0.000 11.421) 17.275 13.250 ( 4.098 0.000 1.427) 4.339 14.587 ( 1.612 0.000 -2.033) 2.595 14.630 ( 12.447 0.000 -18.234) 22.077 16.678 ( 3.641 0.000 24.832) 25.097 18.880 ( 10.192 0.000 -18.894) 21.468 19.866 ( 3.460 0.000 3.306) 4.785 20.155 ( -5.925 -0.000 -18.703) 19.619 20.476 ( 25.908 0.000 3.178) 26.102 21.870 ( -23.955 -0.000 8.712) 25.490 24.303 ( 1.003 0.000 0.252) 1.034 24.501 ( -2.955 -0.000 -0.928) 3.098 ======================= Grid point 360 (177/361) ======================= q-point: (-0.50 0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.124 ( -4.125 6.233 4.154) 8.551 2.473 ( 1.376 17.189 11.518) 20.737 2.801 ( -7.572 -4.073 2.350) 8.913 2.879 ( -5.697 -11.592 4.224) 13.589 3.341 ( 0.196 -1.768 1.841) 2.560 3.473 ( -2.117 -3.713 -8.639) 9.639 4.144 ( 6.119 -2.577 -5.336) 8.518 4.335 ( -0.812 13.570 13.494) 19.154 4.563 ( -2.691 0.086 0.560) 2.750 4.816 ( -1.737 -13.804 11.679) 18.165 5.262 ( 4.773 1.124 8.629) 9.924 6.010 ( 1.324 0.204 -3.208) 3.477 6.181 ( -3.379 -1.163 11.994) 12.515 6.346 ( -22.630 -4.181 17.026) 28.626 7.695 ( -11.325 0.493 0.548) 11.349 7.791 ( 5.745 -1.483 -4.198) 7.268 8.737 ( -15.917 -4.448 14.521) 22.000 9.110 ( -8.570 3.168 7.158) 11.607 9.196 ( 0.941 -4.779 6.502) 8.124 10.312 ( 6.993 0.946 3.938) 8.082 12.033 ( 4.012 7.654 -5.996) 10.518 12.076 ( 3.503 7.823 -8.299) 11.931 12.331 ( -12.042 5.309 -5.594) 14.300 12.957 ( 5.687 -7.197 -7.922) 12.120 13.043 ( -9.559 5.399 12.676) 16.769 13.437 ( 11.373 -1.962 6.752) 13.371 14.440 ( -1.236 8.507 -8.258) 11.920 14.645 ( 4.558 -12.765 -15.282) 20.427 17.134 ( 9.154 -4.459 29.566) 31.270 18.764 ( 7.750 -1.917 -22.239) 23.628 19.783 ( -6.167 5.839 -15.937) 18.059 19.912 ( -3.244 -3.790 -4.603) 6.788 20.903 ( 27.588 2.004 4.365) 28.003 21.686 ( -19.655 -2.457 10.006) 22.192 24.281 ( -0.679 2.636 -1.380) 3.052 24.423 ( -5.453 -1.604 -3.668) 6.765 ======================= Grid point 361 (178/361) ======================= q-point: (-0.40 0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.098 ( 3.165 7.943 5.498) 10.165 2.417 ( -0.986 18.139 9.462) 20.483 2.793 ( -1.626 -4.194 0.859) 4.580 3.037 ( 0.744 -10.244 5.774) 11.783 3.310 ( -3.691 -3.420 -4.738) 6.912 3.441 ( -2.110 -8.122 -2.617) 8.790 4.169 ( 1.634 4.043 0.184) 4.365 4.360 ( 8.347 6.954 -1.262) 10.937 4.597 ( -1.934 0.900 11.300) 11.499 5.070 ( -1.076 -12.631 10.471) 16.442 5.399 ( 2.324 0.841 6.767) 7.204 5.996 ( 0.370 -0.757 -1.929) 2.105 6.317 ( -2.900 -4.316 13.442) 14.412 6.394 ( -12.524 -6.755 24.774) 28.569 7.526 ( -12.035 -0.295 -0.601) 12.054 7.847 ( 6.002 -0.636 -2.259) 6.444 8.716 ( -18.758 -8.602 13.648) 24.741 9.060 ( -6.210 3.653 7.731) 10.568 9.394 ( 5.361 -7.213 8.404) 12.304 10.480 ( 7.838 3.439 8.433) 12.016 11.746 ( -0.783 24.031 -15.844) 28.795 11.968 ( 4.469 1.635 -9.018) 10.196 12.134 ( -12.231 0.351 -0.739) 12.258 12.880 ( 2.210 10.691 -7.985) 13.525 13.079 ( -4.896 -4.857 8.370) 10.846 13.720 ( 12.453 2.102 9.704) 15.927 14.238 ( -6.493 4.844 -4.822) 9.427 14.607 ( 0.981 -13.927 -17.071) 22.053 17.698 ( 10.922 -8.848 26.765) 30.231 18.616 ( 4.601 -3.997 -19.850) 20.765 19.409 ( -8.097 2.427 -19.827) 21.554 19.855 ( -1.604 -0.855 -2.958) 3.472 21.304 ( 18.830 6.681 8.223) 21.606 21.583 ( -8.709 -3.320 5.405) 10.774 24.223 ( -0.401 1.867 -2.772) 3.366 24.278 ( -7.523 0.394 -5.301) 9.212 ======================= Grid point 362 (179/361) ======================= q-point: (-0.30 0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.199 ( 10.104 10.895 5.248) 15.759 2.414 ( 3.055 8.132 11.322) 14.271 2.858 ( 4.616 -2.170 1.113) 5.221 3.148 ( -0.851 -4.924 -0.171) 5.000 3.236 ( -8.232 -9.643 -2.159) 12.862 3.447 ( -1.236 -8.075 -5.006) 9.581 4.145 ( 3.266 7.693 1.315) 8.460 4.433 ( 13.063 2.837 -6.790) 14.993 4.725 ( -1.792 1.888 15.136) 15.359 5.225 ( -3.587 -4.823 6.692) 8.995 5.469 ( -1.888 -1.290 3.340) 4.048 5.981 ( -2.725 -1.963 0.219) 3.366 6.499 ( -3.009 -7.293 14.713) 16.695 6.698 ( -2.283 -10.276 24.722) 26.870 7.361 ( -11.402 0.679 4.981) 12.461 7.923 ( 4.353 -1.217 1.182) 4.672 8.704 ( -17.323 -10.434 13.084) 24.086 9.065 ( -3.590 0.038 7.888) 8.667 9.653 ( 6.025 -7.906 7.772) 12.618 10.639 ( 3.587 8.352 10.264) 13.711 11.327 ( -2.033 19.958 -14.463) 24.731 11.881 ( -10.287 3.337 -6.899) 12.828 11.935 ( 4.225 2.916 -5.971) 7.875 12.689 ( 5.333 16.279 -10.019) 19.845 13.169 ( -3.274 -5.432 7.750) 10.014 13.936 ( 3.776 5.908 6.366) 9.471 14.079 ( -3.792 1.963 1.025) 4.392 14.532 ( -0.634 -14.049 -15.239) 20.737 18.190 ( 8.749 -7.288 14.651) 18.556 18.503 ( 1.322 -4.003 -12.255) 12.959 19.064 ( -6.147 -3.186 -17.071) 18.422 19.819 ( 1.356 -0.064 -3.208) 3.484 21.299 ( -12.997 6.348 3.438) 14.867 21.822 ( 22.002 2.301 7.104) 23.235 24.086 ( -6.486 2.648 -5.688) 9.024 24.183 ( 0.059 -0.310 -2.486) 2.506 ======================= Grid point 363 (180/361) ======================= q-point: (-0.20 0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.254 ( 1.716 7.589 5.918) 9.775 2.659 ( 16.633 3.284 9.433) 19.402 2.949 ( 1.812 -0.303 2.111) 2.799 3.161 ( 3.615 -4.033 -6.268) 8.284 3.183 ( -13.967 -11.515 5.274) 18.855 3.429 ( 3.542 -4.781 -9.669) 11.353 4.167 ( 6.084 5.389 -0.102) 8.128 4.465 ( 10.490 8.258 -8.398) 15.772 4.877 ( -0.693 -1.631 12.467) 12.592 5.231 ( -6.368 1.084 4.507) 7.877 5.437 ( -8.114 -1.490 0.830) 8.291 5.961 ( -5.609 -2.959 2.711) 6.897 6.662 ( -5.309 -5.408 5.218) 9.200 6.921 ( -3.588 -8.598 6.393) 11.299 7.509 ( -2.233 -3.605 34.833) 35.090 8.018 ( 3.152 -2.336 2.461) 4.631 8.733 ( -14.792 -10.934 13.363) 22.736 9.164 ( 0.256 -6.740 7.843) 10.345 9.862 ( 3.002 -4.118 4.867) 7.047 10.602 ( -9.165 14.443 4.934) 17.803 11.006 ( 1.233 11.841 -10.945) 16.171 11.593 ( -11.981 5.895 -4.677) 14.148 11.979 ( 14.152 1.318 -5.494) 15.238 12.540 ( 10.497 14.625 -8.129) 19.753 13.260 ( -3.374 -4.454 7.018) 8.970 13.838 ( -9.678 0.688 -0.348) 9.709 14.120 ( 2.564 5.366 1.649) 6.172 14.520 ( 3.099 -9.161 -5.509) 11.130 18.258 ( -10.174 -0.293 -13.981) 17.294 18.465 ( 10.876 -1.569 -4.978) 12.064 18.987 ( -0.563 -8.740 1.483) 8.882 19.807 ( 1.136 0.597 -2.103) 2.464 21.057 ( -11.078 4.317 -4.148) 12.592 22.196 ( 19.548 7.058 10.817) 23.430 23.926 ( -2.803 2.952 -4.765) 6.267 24.178 ( 0.657 -2.849 -1.387) 3.236 ======================= Grid point 364 (181/361) ======================= q-point: (-0.10 -0.60 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( -3.770 -1.456 4.269) 5.879 2.911 ( 4.837 0.919 2.319) 5.443 3.050 ( 10.380 1.268 7.440) 12.834 3.076 ( -12.025 -7.987 -0.653) 14.451 3.220 ( -0.546 -1.959 -1.281) 2.403 3.469 ( 14.124 -2.103 -6.875) 15.849 4.192 ( 3.124 3.333 -0.513) 4.596 4.377 ( 6.580 11.838 -10.511) 17.144 5.013 ( -1.227 -3.518 6.807) 7.760 5.150 ( -9.056 -1.268 -1.178) 9.219 5.306 ( -11.280 3.495 4.870) 12.774 5.940 ( -5.759 -3.126 2.821) 7.134 6.531 ( -11.635 -1.580 -5.425) 12.934 7.088 ( -0.170 -6.350 10.869) 12.589 7.976 ( -3.395 -2.818 34.079) 34.363 8.113 ( 3.018 -2.529 4.144) 5.716 8.801 ( -14.105 -10.158 15.351) 23.190 9.392 ( 4.159 -15.184 7.067) 17.257 9.870 ( -6.580 9.435 1.476) 11.597 10.290 ( -12.403 14.283 -2.144) 19.038 10.921 ( 5.748 -6.341 -7.548) 11.411 11.337 ( -6.079 9.325 -2.716) 11.458 12.155 ( 16.380 -0.938 -4.160) 16.926 12.554 ( 15.348 9.775 -1.102) 18.230 13.313 ( -5.777 -3.174 6.261) 9.092 13.710 ( -7.113 0.091 0.316) 7.121 14.060 ( -2.755 2.501 -3.469) 5.087 14.628 ( 7.684 0.211 1.545) 7.841 17.830 ( -14.030 0.649 -23.163) 27.088 18.610 ( 11.829 -1.910 -0.839) 12.011 19.082 ( 0.818 -0.850 3.205) 3.415 19.762 ( -5.059 2.826 1.333) 5.946 20.857 ( -2.200 -2.552 -10.155) 10.699 22.495 ( 12.529 11.440 13.436) 21.642 23.845 ( 2.371 1.236 -4.625) 5.342 24.221 ( 1.014 -4.722 0.830) 4.900 ======================= Grid point 370 (182/361) ======================= q-point: (-0.50 0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.177 ( 2.633 -0.000 3.773) 4.601 2.737 ( -4.909 0.000 4.575) 6.710 2.743 ( -1.485 -0.000 -0.369) 1.531 2.788 ( 4.887 -0.000 9.758) 10.913 3.310 ( -4.078 0.000 -6.782) 7.914 3.343 ( -3.202 -0.000 1.511) 3.541 4.195 ( 11.031 -0.000 -4.186) 11.799 4.447 ( 0.553 -0.000 -8.048) 8.067 4.634 ( -1.798 0.000 17.993) 18.082 4.902 ( -0.908 -0.000 15.539) 15.565 5.414 ( 1.481 0.000 7.712) 7.853 5.986 ( 0.204 -0.000 -2.496) 2.505 6.276 ( -2.617 -0.000 11.900) 12.185 6.331 ( -11.898 -0.000 23.949) 26.742 7.522 ( -11.763 -0.000 -0.572) 11.777 7.849 ( 9.202 -0.000 -4.668) 10.318 8.630 ( -21.646 0.000 16.836) 27.422 9.099 ( -7.708 -0.000 7.540) 10.782 9.325 ( 6.122 -0.000 8.695) 10.634 10.510 ( 8.991 -0.000 8.360) 12.278 11.973 ( -8.982 -0.000 -21.796) 23.574 11.981 ( 3.904 -0.000 -10.187) 10.909 12.173 ( -2.028 -0.000 1.615) 2.593 12.877 ( -1.110 0.000 -4.901) 5.025 13.105 ( -7.694 -0.000 12.952) 15.065 13.739 ( 15.962 0.000 8.848) 18.250 14.329 ( -11.794 -0.000 -3.556) 12.319 14.427 ( 6.124 -0.000 -19.901) 20.821 17.615 ( 10.647 -0.000 28.134) 30.082 18.579 ( 5.221 -0.000 -20.291) 20.952 19.432 ( -10.393 -0.000 -20.613) 23.085 19.846 ( -0.731 -0.000 -2.667) 2.765 21.376 ( 27.638 -0.000 6.110) 28.306 21.546 ( -14.681 0.000 7.401) 16.441 24.246 ( -2.437 -0.000 -2.039) 3.178 24.275 ( -5.800 0.000 -5.970) 8.324 ======================= Grid point 372 (183/361) ======================= q-point: (-0.40 0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.335 ( 14.248 3.433 4.770) 15.413 2.614 ( -3.008 13.014 3.091) 13.710 2.809 ( 3.023 -5.086 2.097) 6.277 2.991 ( -0.906 -8.225 5.762) 10.083 3.180 ( -1.470 1.608 -5.794) 6.190 3.308 ( -5.327 -6.284 -0.977) 8.296 4.282 ( 7.175 7.234 -4.181) 11.013 4.403 ( 9.806 -5.155 -7.652) 13.465 4.799 ( -2.498 4.559 16.720) 17.510 5.091 ( -2.112 -6.628 10.691) 12.755 5.487 ( -2.636 1.369 6.547) 7.189 5.951 ( -2.293 -1.032 -1.665) 3.016 6.410 ( -0.830 -2.362 12.524) 12.772 6.555 ( -3.221 -4.432 23.946) 24.564 7.370 ( -10.328 0.235 4.285) 11.184 7.927 ( 9.757 0.782 -4.385) 10.725 8.552 ( -22.901 -4.939 19.725) 30.626 9.079 ( -6.623 0.735 7.256) 9.852 9.554 ( 7.733 -2.793 9.256) 12.380 10.740 ( 6.415 2.706 10.489) 12.589 11.526 ( -11.587 3.334 -21.538) 24.683 11.927 ( 6.763 0.665 -10.392) 12.416 12.095 ( -2.818 11.044 -0.989) 11.440 12.800 ( 0.056 -3.305 -9.135) 9.715 13.145 ( -6.135 3.038 12.714) 14.440 14.040 ( 3.853 5.442 4.846) 8.243 14.106 ( -3.754 0.079 2.564) 4.547 14.303 ( 1.494 -9.144 -16.543) 18.961 18.087 ( 8.664 -3.188 21.229) 23.149 18.453 ( 5.259 -1.381 -12.939) 14.035 19.029 ( -9.730 -0.847 -20.107) 22.354 19.817 ( 1.697 -0.060 -3.148) 3.576 21.393 ( -12.158 3.060 1.015) 12.578 21.850 ( 25.267 0.743 8.849) 26.783 24.114 ( -5.166 0.582 -6.638) 8.432 24.180 ( -2.645 -0.055 -2.278) 3.491 ======================= Grid point 373 (184/361) ======================= q-point: (-0.30 0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.425 ( -2.332 10.579 0.568) 10.848 2.697 ( 17.710 0.711 7.750) 19.345 2.924 ( -4.686 -9.199 4.776) 11.375 3.026 ( -7.429 2.158 3.211) 8.376 3.129 ( 7.694 -0.131 -2.722) 8.162 3.316 ( 3.599 -7.539 -6.644) 10.674 4.251 ( 6.245 4.031 -5.476) 9.232 4.529 ( 12.156 -1.632 -7.754) 14.511 4.886 ( -5.386 3.141 12.937) 14.361 5.178 ( -5.573 -4.892 3.370) 8.145 5.476 ( -6.595 3.802 6.735) 10.164 5.907 ( -5.734 -2.740 1.555) 6.542 6.581 ( -0.934 -2.738 9.111) 9.560 6.756 ( -3.221 -8.425 4.929) 10.279 7.463 ( -1.111 -1.423 27.938) 27.996 8.007 ( 8.686 0.683 -3.046) 9.230 8.549 ( -20.962 -8.087 21.500) 31.098 9.090 ( -4.363 -2.090 7.076) 8.572 9.798 ( 7.138 -2.492 8.129) 11.102 10.811 ( -5.331 8.399 4.799) 11.046 11.096 ( -10.322 -0.399 -19.490) 22.058 11.840 ( -2.421 16.709 -1.338) 16.936 11.999 ( 10.724 1.735 -6.054) 12.437 12.721 ( 5.811 2.167 -10.569) 12.255 13.190 ( -6.636 -0.518 11.139) 12.976 13.859 ( -10.583 1.377 -0.889) 10.709 14.136 ( -4.023 -4.330 -7.083) 9.225 14.408 ( 12.243 -1.847 5.216) 13.435 18.255 ( -7.362 -0.162 -9.403) 11.943 18.444 ( 9.015 -0.717 -4.565) 10.131 18.841 ( 1.451 -6.261 1.787) 6.671 19.815 ( 2.634 0.241 -2.620) 3.723 21.154 ( -10.586 5.000 -6.800) 13.539 22.299 ( 22.033 3.996 11.983) 25.398 23.965 ( -2.997 1.387 -6.113) 6.949 24.130 ( -2.195 -2.190 -1.461) 3.428 ======================= Grid point 374 (185/361) ======================= q-point: (-0.20 -0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.285 ( -10.131 2.337 2.170) 10.621 2.869 ( -19.002 -9.447 2.934) 21.422 2.970 ( 4.014 1.945 0.321) 4.472 3.081 ( 18.534 1.829 7.375) 20.031 3.239 ( 3.453 2.571 1.840) 4.681 3.413 ( 17.585 -3.905 -7.549) 19.531 4.238 ( 2.915 2.177 -4.470) 5.763 4.540 ( 7.466 4.336 -11.646) 14.498 4.910 ( -9.306 -5.009 6.098) 12.201 5.123 ( -7.063 -1.487 0.014) 7.217 5.413 ( -7.489 6.728 8.438) 13.136 5.879 ( -6.620 -3.550 3.402) 8.246 6.505 ( -10.894 -1.034 -4.943) 12.007 6.938 ( 3.835 -9.253 8.966) 13.443 7.916 ( 1.532 -3.537 33.165) 33.388 8.089 ( 9.319 -0.176 -3.510) 9.960 8.618 ( -19.322 -8.704 24.390) 32.310 9.181 ( -0.865 -8.137 6.748) 10.606 9.968 ( 2.989 2.891 5.934) 7.246 10.561 ( -14.493 11.456 -3.686) 18.838 10.778 ( -6.923 -5.116 -15.262) 17.522 11.624 ( -3.116 18.681 1.419) 18.992 12.133 ( 14.916 -1.337 -5.953) 16.115 12.711 ( 12.141 5.498 -4.822) 14.173 13.218 ( -10.326 -4.723 8.981) 14.477 13.735 ( -4.510 1.972 1.178) 5.061 14.027 ( -6.353 -5.737 -5.264) 10.049 14.658 ( 12.338 2.644 6.632) 14.255 17.844 ( -13.824 0.742 -24.316) 27.981 18.577 ( 10.835 -1.482 0.643) 10.955 19.044 ( 4.803 -2.832 9.130) 10.698 19.806 ( -1.226 1.800 -0.069) 2.179 20.866 ( -4.957 2.873 -13.779) 14.922 22.685 ( 16.374 8.763 14.551) 23.593 23.862 ( 0.726 0.770 -6.106) 6.197 24.130 ( -1.597 -4.986 0.928) 5.317 ======================= Grid point 375 (186/361) ======================= q-point: (-0.10 -0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.152 ( -13.819 -4.151 3.003) 14.738 2.712 ( -20.017 -11.027 1.764) 22.921 3.011 ( 3.607 1.989 1.063) 4.254 3.224 ( 2.007 2.758 -0.829) 3.510 3.399 ( 16.715 5.254 2.967) 17.771 3.654 ( 17.198 -0.181 -0.072) 17.199 4.153 ( -9.785 -1.245 -0.858) 9.902 4.426 ( 7.632 8.330 -12.105) 16.559 4.813 ( -14.262 -7.661 -3.620) 16.590 5.071 ( -2.515 0.652 2.346) 3.501 5.349 ( -5.626 8.114 6.938) 12.067 5.859 ( -5.052 -3.750 1.872) 6.564 6.277 ( -12.632 -1.454 -4.650) 13.539 7.174 ( 2.147 -6.016 9.676) 11.595 8.097 ( 7.629 1.157 -7.621) 10.845 8.344 ( -6.206 -3.706 26.868) 27.823 8.739 ( -15.969 -5.406 24.508) 29.747 9.374 ( 2.301 -14.541 5.177) 15.606 9.906 ( -9.203 15.432 3.025) 18.220 10.192 ( -11.098 10.475 -4.867) 16.018 10.685 ( 2.009 -16.570 -9.109) 19.015 11.473 ( 0.863 14.357 2.088) 14.534 12.258 ( 12.578 -3.643 -9.496) 16.176 12.852 ( 13.972 4.512 2.561) 14.904 13.197 ( -14.439 -6.613 8.358) 17.946 13.716 ( 2.206 4.039 2.594) 5.283 13.938 ( -6.050 -3.670 -1.497) 7.233 14.866 ( 13.254 6.687 3.801) 15.325 17.321 ( -15.282 -0.149 -25.020) 29.318 18.790 ( 11.835 -1.450 5.045) 12.947 19.183 ( 3.860 4.380 3.420) 6.767 19.735 ( -6.430 3.399 2.841) 7.808 20.672 ( 3.764 -4.049 -16.880) 17.762 22.932 ( 6.272 14.983 15.570) 22.500 23.831 ( 6.139 -1.687 -7.231) 9.634 24.203 ( -0.481 -6.670 4.702) 8.175 ======================= Grid point 382 (187/361) ======================= q-point: (-0.40 -0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.586 ( -12.378 -0.000 -1.292) 12.446 2.671 ( 19.031 0.000 2.692) 19.220 2.790 ( -1.634 -0.000 8.937) 9.085 3.113 ( 8.244 0.000 6.116) 10.265 3.142 ( -7.280 -0.000 -1.710) 7.478 3.187 ( 9.108 0.000 -7.463) 11.775 4.300 ( 6.285 0.000 -9.782) 11.627 4.485 ( 10.042 0.000 -3.363) 10.590 4.937 ( -5.044 -0.000 10.205) 11.384 5.117 ( -4.354 -0.000 4.909) 6.561 5.518 ( -6.259 -0.000 8.456) 10.520 5.877 ( -5.827 -0.000 0.608) 5.859 6.564 ( 4.028 0.000 10.505) 11.250 6.663 ( -6.463 -0.000 4.131) 7.671 7.452 ( -0.944 -0.000 25.216) 25.234 8.019 ( 11.726 0.000 -6.765) 13.537 8.469 ( -24.383 -0.000 26.614) 36.095 9.072 ( -6.069 -0.000 6.639) 8.995 9.775 ( 8.421 0.000 9.268) 12.522 10.896 ( -2.850 -0.000 6.120) 6.751 11.075 ( -14.147 -0.000 -21.737) 25.935 11.967 ( 13.588 0.000 -7.174) 15.365 12.092 ( -3.251 -0.000 -2.690) 4.220 12.682 ( 2.221 0.000 -7.809) 8.119 13.216 ( -6.974 -0.000 11.224) 13.214 13.878 ( -11.747 -0.000 -1.000) 11.789 14.063 ( -3.726 -0.000 -11.072) 11.682 14.405 ( 13.813 0.000 9.097) 16.540 18.253 ( -5.895 -0.000 -6.897) 9.073 18.438 ( 8.127 0.000 -4.738) 9.407 18.781 ( 1.942 0.000 1.228) 2.297 19.817 ( 3.114 0.000 -2.823) 4.203 21.205 ( -10.110 -0.000 -7.799) 12.768 22.336 ( 22.944 0.000 12.526) 26.141 23.978 ( -2.717 -0.000 -6.650) 7.183 24.108 ( -3.686 -0.000 -1.406) 3.945 ======================= Grid point 383 (188/361) ======================= q-point: (-0.30 -0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.348 ( -16.472 3.585 2.340) 17.020 2.688 ( -17.889 -7.477 2.767) 19.586 3.059 ( 4.344 5.126 1.240) 6.832 3.118 ( 21.399 2.618 5.671) 22.292 3.235 ( 3.634 -4.241 -2.129) 5.977 3.365 ( 20.315 -0.194 -1.763) 20.392 4.282 ( 6.727 2.416 -7.704) 10.509 4.511 ( -0.638 -4.449 -7.711) 8.925 4.900 ( -9.953 2.074 3.542) 10.766 5.091 ( -3.733 -1.605 0.774) 4.137 5.516 ( -6.434 3.565 8.595) 11.313 5.820 ( -7.411 -2.279 4.192) 8.814 6.500 ( -10.751 0.369 -5.566) 12.112 6.791 ( 7.095 -5.301 8.049) 11.968 7.863 ( 3.596 -1.755 30.914) 31.172 8.095 ( 11.393 0.422 -7.555) 13.677 8.508 ( -21.741 -3.056 31.910) 38.733 9.084 ( -4.279 -2.579 6.284) 8.028 10.001 ( 7.133 0.878 8.861) 11.409 10.616 ( -13.566 -1.318 -19.697) 23.953 10.805 ( -10.138 3.653 -1.960) 10.953 11.935 ( -5.102 12.178 -1.061) 13.247 12.112 ( 14.179 -0.864 -6.620) 15.672 12.703 ( 8.716 -4.234 -4.888) 10.853 13.209 ( -11.031 2.363 10.937) 15.713 13.766 ( -3.374 1.178 1.769) 3.988 13.904 ( -7.030 -5.512 -6.173) 10.859 14.700 ( 13.117 1.420 8.572) 15.734 17.854 ( -13.764 0.316 -25.306) 28.809 18.558 ( 10.465 -0.546 1.559) 10.594 19.000 ( 7.087 -1.438 12.936) 14.820 19.826 ( 1.160 0.518 -1.022) 1.631 20.922 ( -6.322 2.119 -16.359) 17.666 22.799 ( 19.292 3.356 15.296) 24.848 23.876 ( -0.183 0.599 -6.139) 6.171 24.055 ( -3.967 -2.600 0.517) 4.771 ======================= Grid point 384 (189/361) ======================= q-point: (-0.20 -0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.123 ( -18.729 1.023 5.628) 19.583 2.497 ( -23.104 -11.471 2.647) 25.930 3.088 ( 4.860 5.879 -0.093) 7.628 3.258 ( 3.201 -0.063 -0.601) 3.257 3.477 ( 19.357 3.157 1.762) 19.691 3.658 ( 20.732 0.665 0.687) 20.754 4.158 ( -13.696 2.269 -3.494) 14.315 4.459 ( 7.619 -5.927 -12.176) 15.538 4.728 ( -14.838 0.173 0.729) 14.857 5.079 ( -0.724 0.301 0.999) 1.270 5.482 ( -4.561 5.717 5.800) 9.334 5.796 ( -6.688 -3.038 3.788) 8.265 6.258 ( -12.491 -0.602 -5.655) 13.724 7.049 ( 7.444 -6.548 7.134) 12.214 8.132 ( 9.666 2.104 -6.938) 12.082 8.230 ( -6.431 -6.692 20.988) 22.949 8.687 ( -13.312 -0.779 33.922) 36.449 9.165 ( -0.979 -8.046 5.428) 9.755 10.105 ( -1.903 6.832 1.949) 7.355 10.273 ( -10.724 -3.322 -9.194) 14.510 10.582 ( -3.807 4.816 -5.201) 8.046 11.734 ( -5.105 12.829 0.400) 13.814 12.198 ( 10.968 -2.583 -10.933) 15.701 12.863 ( 11.342 -3.996 -1.364) 12.102 13.152 ( -13.597 2.898 13.824) 19.606 13.768 ( -0.581 -0.079 1.695) 1.794 13.831 ( -3.915 -5.390 0.485) 6.680 14.966 ( 14.378 3.864 6.230) 16.139 17.319 ( -15.065 -0.064 -26.653) 30.616 18.770 ( 11.764 -0.729 5.462) 12.990 19.237 ( 5.653 1.635 9.403) 11.092 19.789 ( -5.787 2.209 1.446) 6.361 20.636 ( 2.421 -0.369 -21.913) 22.050 23.173 ( 12.507 10.321 16.669) 23.255 23.812 ( 3.303 0.012 -7.119) 7.848 24.074 ( -3.021 -6.953 4.525) 8.829 ======================= Grid point 385 (190/361) ======================= q-point: (-0.10 -0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.929 ( -20.385 -3.270 7.355) 21.916 2.314 ( -22.622 -12.672 1.906) 25.999 3.070 ( -0.061 0.709 -2.242) 2.352 3.318 ( 5.005 3.974 3.479) 7.277 3.627 ( 6.477 5.390 -2.795) 8.878 3.796 ( -16.561 1.241 2.290) 16.765 4.015 ( 11.789 -2.451 2.610) 12.321 4.503 ( 13.486 5.609 -9.128) 17.224 4.524 ( -14.484 -4.533 -0.785) 15.197 5.081 ( -0.218 0.739 1.147) 1.381 5.407 ( -3.200 7.546 0.082) 8.197 5.776 ( -3.751 -3.819 0.688) 5.397 6.045 ( -11.993 -1.983 -0.855) 12.186 7.268 ( 2.403 -4.121 7.690) 9.050 8.118 ( 5.720 4.123 -8.230) 10.838 8.382 ( -14.326 -8.992 17.391) 24.260 8.836 ( -10.501 4.212 16.653) 20.133 9.333 ( 1.243 -13.207 5.210) 14.252 9.932 ( -11.850 16.460 1.299) 20.323 10.067 ( -3.220 -2.167 -2.168) 4.446 10.596 ( 6.688 -4.331 0.129) 7.969 11.579 ( -3.019 8.557 -0.205) 9.076 12.236 ( 10.008 -5.650 -12.707) 17.133 12.965 ( -2.846 -4.203 -1.920) 5.427 13.141 ( -6.574 4.027 14.450) 16.378 13.819 ( -1.918 -8.175 5.280) 9.919 13.870 ( 5.070 3.998 1.583) 6.648 15.180 ( 15.763 8.117 1.317) 17.779 16.814 ( -15.367 -1.156 -18.644) 24.189 19.034 ( 12.192 -1.167 7.704) 14.469 19.315 ( 0.658 8.472 1.209) 8.583 19.698 ( -5.319 -0.715 2.680) 5.999 20.492 ( 9.104 -4.709 -20.158) 22.614 23.312 ( -2.140 19.919 14.612) 24.796 23.820 ( 10.003 -3.594 -9.143) 14.021 24.219 ( 0.392 -8.645 10.131) 13.324 ======================= Grid point 393 (191/361) ======================= q-point: (-0.30 -0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.156 ( -20.264 -0.000 8.006) 21.788 2.362 ( -24.610 -0.000 1.540) 24.659 3.185 ( 0.650 0.000 -4.761) 4.805 3.219 ( 8.776 0.000 2.549) 9.139 3.509 ( 20.229 0.000 2.675) 20.405 3.667 ( 21.828 0.000 0.375) 21.831 4.216 ( -21.584 -0.000 -5.839) 22.359 4.344 ( 10.618 0.000 -6.164) 12.278 4.746 ( -12.375 -0.000 -2.336) 12.593 5.082 ( 0.830 0.000 0.729) 1.105 5.539 ( -4.320 -0.000 4.657) 6.352 5.763 ( -7.440 -0.000 5.405) 9.196 6.253 ( -12.409 -0.000 -6.233) 13.886 6.980 ( 9.801 0.000 5.955) 11.468 8.156 ( 10.786 0.000 -8.368) 13.652 8.160 ( -8.720 -0.000 22.654) 24.274 8.683 ( -11.416 -0.000 36.051) 37.815 9.089 ( -2.554 -0.000 5.199) 5.792 10.182 ( -10.523 -0.000 -18.648) 21.412 10.208 ( 2.832 0.000 9.952) 10.347 10.652 ( -6.873 -0.000 -4.443) 8.184 11.870 ( -8.617 -0.000 -0.982) 8.673 12.173 ( 10.105 0.000 -11.443) 15.266 12.802 ( 10.211 0.000 0.137) 10.211 13.208 ( -11.630 -0.000 14.946) 18.938 13.710 ( -8.870 -0.000 -1.532) 9.001 13.816 ( 3.848 0.000 3.060) 4.916 15.002 ( 14.532 0.000 7.048) 16.151 17.318 ( -14.940 -0.000 -27.315) 31.134 18.764 ( 11.790 0.000 5.564) 13.037 19.250 ( 6.143 0.000 11.998) 13.479 19.810 ( -4.983 -0.000 0.842) 5.054 20.637 ( 1.578 0.000 -24.227) 24.278 23.274 ( 16.852 0.000 16.347) 23.478 23.824 ( 1.627 0.000 -4.381) 4.673 23.991 ( -5.325 -0.000 2.718) 5.978 ======================= Grid point 394 (192/361) ======================= q-point: (-0.20 -0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.935 ( -23.541 4.103 9.064) 25.557 2.086 ( -24.873 -10.998 5.042) 27.660 3.083 ( -5.598 0.459 -5.522) 7.876 3.376 ( 8.184 1.991 3.479) 9.113 3.713 ( 7.680 3.843 -3.195) 9.164 3.815 ( -24.218 -0.839 1.049) 24.255 3.992 ( 21.479 0.817 2.002) 21.588 4.414 ( -7.375 -4.797 0.943) 8.848 4.592 ( 8.541 2.568 -7.201) 11.463 5.093 ( -0.759 0.535 0.979) 1.349 5.504 ( -1.782 2.753 -1.581) 3.640 5.725 ( -5.996 -1.513 2.941) 6.848 6.020 ( -12.247 -0.672 -1.973) 12.423 7.197 ( 8.894 -2.635 4.383) 10.260 8.185 ( -0.658 2.535 0.481) 2.662 8.240 ( -8.422 -4.881 12.054) 15.494 8.898 ( -10.886 1.853 20.689) 23.452 9.154 ( 1.154 -5.341 3.358) 6.413 9.932 ( -0.856 -4.387 -8.595) 9.688 10.205 ( -12.753 7.523 3.887) 15.308 10.611 ( 7.768 1.998 0.559) 8.040 11.711 ( -8.487 4.385 -0.225) 9.555 12.158 ( 8.623 -2.497 -13.536) 16.242 12.917 ( 2.897 -0.841 -0.847) 3.133 13.240 ( -8.197 5.479 16.631) 19.333 13.639 ( -7.378 -8.867 4.121) 12.249 13.922 ( 6.628 1.484 2.136) 7.120 15.281 ( 16.411 2.812 3.475) 17.009 16.798 ( -15.441 -0.452 -19.752) 25.076 19.019 ( 12.147 -0.395 7.383) 14.220 19.437 ( 3.151 4.043 7.724) 9.270 19.678 ( -11.708 -1.037 -1.123) 11.807 20.435 ( 11.452 -1.512 -23.995) 26.630 23.626 ( 10.827 11.104 12.260) 19.769 23.797 ( 3.089 3.262 -4.019) 6.028 24.029 ( -3.034 -11.403 9.037) 14.863 ======================= Grid point 395 (193/361) ======================= q-point: (-0.10 -0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.685 ( -24.510 -3.070 9.656) 26.521 1.893 ( -25.160 -10.148 2.690) 27.262 2.914 ( -18.320 -7.084 5.220) 20.323 3.432 ( -8.719 5.276 3.870) 10.901 3.574 ( -1.339 0.914 4.142) 4.448 3.705 ( -0.916 4.652 -5.416) 7.198 4.211 ( -5.283 -0.696 1.820) 5.631 4.381 ( 11.131 -1.757 3.230) 11.723 4.685 ( 13.866 7.742 -5.463) 16.795 5.087 ( -1.160 -0.769 0.851) 1.631 5.372 ( -2.447 4.902 -9.352) 10.838 5.704 ( -1.193 -3.449 -0.732) 3.723 5.911 ( -8.324 -2.029 7.430) 11.341 7.354 ( 1.845 -0.352 4.710) 5.071 8.108 ( -10.588 1.221 4.649) 11.628 8.320 ( -2.650 -2.187 6.820) 7.636 8.826 ( -7.018 3.782 -3.198) 8.590 9.313 ( 0.322 -11.073 8.744) 14.113 9.895 ( -11.236 12.385 -1.363) 16.778 10.033 ( 4.408 -8.399 1.157) 9.556 10.748 ( 7.465 3.913 5.254) 9.932 11.540 ( -8.350 4.602 -2.191) 9.782 12.156 ( 8.922 -5.516 -13.137) 16.811 12.848 ( -9.142 2.831 -0.068) 9.571 13.245 ( -5.659 4.576 7.830) 10.689 13.739 ( -2.200 -13.524 0.728) 13.721 14.018 ( 7.133 2.326 1.006) 7.570 15.480 ( 16.076 7.538 -2.325) 17.908 16.503 ( -10.312 -0.733 5.758) 11.833 19.288 ( 10.185 -1.355 4.557) 11.240 19.316 ( -6.379 7.344 -4.098) 10.556 19.666 ( 0.342 -5.410 4.331) 6.938 20.378 ( 12.530 -2.197 -18.400) 22.370 23.580 ( -9.334 24.501 9.764) 27.978 23.839 ( 11.939 -3.272 -8.502) 15.018 24.302 ( 3.236 -11.054 12.503) 17.000 ======================= Grid point 404 (194/361) ======================= q-point: (-0.20 -0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( -27.022 -0.000 5.933) 27.666 1.777 ( -25.575 -0.000 8.833) 27.058 2.847 ( -23.285 -0.000 5.730) 23.980 3.517 ( -17.557 -0.000 4.567) 18.141 3.550 ( 8.885 0.000 1.945) 9.095 3.750 ( 0.576 0.000 -6.570) 6.595 4.215 ( -13.809 -0.000 1.959) 13.947 4.349 ( 21.065 0.000 4.310) 21.502 4.766 ( 17.325 0.000 -4.866) 17.995 5.073 ( -3.723 -0.000 0.940) 3.840 5.418 ( -1.443 -0.000 -11.668) 11.757 5.671 ( -3.105 -0.000 0.788) 3.203 5.892 ( -8.454 -0.000 7.566) 11.345 7.348 ( 8.220 0.000 1.091) 8.292 8.098 ( -23.891 -0.000 16.347) 28.948 8.321 ( 11.415 0.000 -1.642) 11.533 8.862 ( -9.123 -0.000 -2.180) 9.380 9.199 ( -0.435 -0.000 8.490) 8.501 9.912 ( 6.354 0.000 -1.318) 6.489 10.054 ( -14.162 -0.000 -0.773) 14.183 10.788 ( 9.060 0.000 4.108) 9.948 11.591 ( -10.209 -0.000 -0.509) 10.221 12.103 ( 9.091 0.000 -13.193) 16.022 12.905 ( -2.334 -0.000 -2.883) 3.709 13.330 ( -8.083 -0.000 6.377) 10.296 13.535 ( -7.016 -0.000 5.197) 8.732 14.045 ( 7.000 0.000 0.135) 7.002 15.550 ( 16.458 0.000 -1.399) 16.518 16.495 ( -10.148 -0.000 7.235) 12.463 19.275 ( 10.474 0.000 4.538) 11.415 19.404 ( -12.111 -0.000 -6.473) 13.732 19.596 ( 1.707 0.000 6.412) 6.636 20.358 ( 14.506 0.000 -19.189) 24.055 23.807 ( 12.094 0.000 -9.022) 15.089 23.924 ( -7.826 -0.000 6.805) 10.371 24.089 ( 5.125 0.000 16.713) 17.481 ======================= Grid point 405 (195/361) ======================= q-point: (-0.10 -0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.418 ( -24.833 -3.434 11.029) 27.388 1.465 ( -27.743 -5.954 3.747) 28.621 2.692 ( -31.360 -5.186 30.322) 43.929 3.353 ( -6.683 2.965 -0.951) 7.373 3.604 ( -7.863 2.313 -4.851) 9.524 3.680 ( 8.092 -0.586 -2.395) 8.459 4.103 ( -6.423 0.264 3.799) 7.467 4.685 ( 14.913 0.997 6.685) 16.373 4.843 ( 6.060 8.649 -6.847) 12.586 5.029 ( -2.738 -4.347 -4.540) 6.856 5.243 ( 0.972 1.507 -8.615) 8.800 5.688 ( 4.301 -2.227 -0.108) 4.845 5.950 ( -3.922 -0.764 14.217) 14.768 7.425 ( 2.364 2.798 -0.453) 3.691 7.958 ( -19.927 -2.675 11.752) 23.288 8.465 ( 5.531 8.090 4.933) 10.972 8.657 ( -2.493 -1.965 -13.063) 13.443 9.374 ( 1.838 -6.663 12.737) 14.491 9.813 ( -10.014 7.494 -1.524) 12.600 10.015 ( 5.340 -8.427 -3.731) 10.651 10.933 ( 4.883 2.501 3.453) 6.483 11.355 ( -17.151 2.759 -6.246) 18.460 12.105 ( 10.337 -1.888 -11.282) 15.418 12.748 ( -9.906 7.455 -2.047) 12.566 13.150 ( -11.969 -6.319 -8.080) 15.763 13.541 ( -5.974 -7.213 1.034) 9.422 14.133 ( 6.159 0.689 -0.210) 6.201 15.692 ( 13.361 4.329 -7.845) 16.087 16.793 ( 11.847 3.139 39.649) 41.500 19.080 ( -5.858 -1.079 -15.426) 16.536 19.529 ( 6.463 3.015 7.460) 10.321 19.688 ( 0.382 -5.744 4.683) 7.420 20.354 ( 13.883 0.017 -15.365) 20.708 23.751 ( -10.471 24.650 5.579) 27.357 23.890 ( 10.594 -1.492 -6.293) 12.412 24.329 ( -0.198 -13.713 1.282) 13.774 ======================= Grid point 415 (196/361) ======================= q-point: (-0.10 -0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.175 ( -17.655 -0.000 16.670) 24.281 1.282 ( -17.910 -0.000 18.888) 26.029 2.634 ( -35.027 -0.000 39.088) 52.486 3.322 ( 3.556 0.000 0.102) 3.557 3.416 ( -11.122 -0.000 -3.662) 11.710 3.738 ( 10.834 0.000 -8.868) 14.000 4.133 ( -2.640 -0.000 9.212) 9.583 4.750 ( -10.096 -0.000 -8.709) 13.333 4.835 ( -0.185 -0.000 -10.839) 10.841 4.942 ( 7.310 0.000 0.847) 7.358 5.329 ( 12.636 0.000 3.263) 13.051 5.789 ( 8.630 0.000 1.965) 8.851 6.112 ( -2.053 -0.000 19.499) 19.606 7.437 ( 1.866 0.000 -5.931) 6.218 7.828 ( -16.341 -0.000 11.562) 20.017 8.321 ( -14.434 -0.000 -12.974) 19.408 8.761 ( 10.464 0.000 10.045) 14.505 9.545 ( 3.044 0.000 10.898) 11.315 9.724 ( -5.243 -0.000 0.361) 5.256 9.964 ( 4.612 0.000 -7.188) 8.540 10.874 ( -34.121 -0.000 -9.402) 35.392 11.012 ( 1.289 0.000 -0.191) 1.303 12.132 ( 11.072 0.000 -10.051) 14.953 12.627 ( -8.517 -0.000 -4.141) 9.470 12.799 ( -14.154 -0.000 1.916) 14.283 13.494 ( -3.899 -0.000 4.270) 5.782 14.201 ( 3.900 0.000 -1.155) 4.068 15.733 ( 8.287 0.000 -14.217) 16.456 17.720 ( 39.130 0.000 38.601) 54.965 18.809 ( -1.232 -0.000 -17.548) 17.591 19.620 ( -4.491 -0.000 -2.339) 5.064 19.723 ( 0.867 0.000 6.718) 6.774 20.417 ( 17.405 0.000 -9.499) 19.829 23.859 ( -9.067 -0.000 7.621) 11.844 23.923 ( -17.943 -0.000 -17.311) 24.933 23.972 ( 2.619 0.000 -8.196) 8.604 ======================= Grid point 416 (197/361) ======================= q-point: ( 0.00 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( 1.916 0.000 16.178) 16.291 2.110 ( -0.464 -0.000 24.188) 24.192 2.999 ( -1.356 -0.000 -4.129) 4.346 3.255 ( 8.274 0.000 7.669) 11.282 3.610 ( 9.557 0.000 -11.207) 14.728 3.787 ( -3.574 -0.000 -9.344) 10.004 3.886 ( -6.118 -0.000 2.351) 6.554 4.028 ( -10.318 -0.000 -10.511) 14.729 4.748 ( 6.088 0.000 10.829) 12.423 5.126 ( -3.703 -0.000 5.268) 6.439 5.702 ( 1.242 0.000 -0.196) 1.257 6.126 ( 3.400 0.000 2.169) 4.033 7.052 ( -5.994 -0.000 -5.546) 8.166 7.222 ( 0.508 0.000 11.317) 11.329 7.678 ( -2.038 -0.000 27.446) 27.521 8.660 ( -21.690 -0.000 30.127) 37.122 9.397 ( -7.636 -0.000 4.179) 8.705 9.574 ( 10.503 0.000 9.658) 14.268 9.781 ( -1.262 -0.000 -2.317) 2.638 9.837 ( -9.830 -0.000 6.520) 11.796 10.682 ( -6.010 -0.000 -9.211) 10.998 10.904 ( 19.377 0.000 11.443) 22.503 11.723 ( 6.302 0.000 -16.301) 17.477 12.239 ( -7.216 -0.000 -8.146) 10.883 13.141 ( -2.495 -0.000 12.332) 12.582 13.599 ( 4.533 0.000 0.295) 4.543 14.137 ( -3.197 -0.000 -0.951) 3.335 15.000 ( -0.067 -0.000 -17.741) 17.741 18.201 ( 12.314 0.000 -13.825) 18.514 18.800 ( -13.374 -0.000 -16.307) 21.090 19.412 ( 22.663 0.000 -1.646) 22.723 19.486 ( -10.414 -0.000 -3.562) 11.007 21.179 ( 23.226 0.000 10.410) 25.452 22.138 ( -40.789 -0.000 -4.171) 41.002 23.849 ( -8.030 -0.000 2.740) 8.484 24.050 ( 10.194 0.000 -3.934) 10.927 ======================= Grid point 417 (198/361) ======================= q-point: ( 0.10 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.272 ( 5.311 2.235 13.777) 14.934 2.403 ( 2.626 -3.189 17.603) 18.081 2.990 ( 5.104 1.468 -0.100) 5.312 3.376 ( 5.552 8.029 -12.214) 15.635 3.519 ( -6.575 0.859 -2.446) 7.068 3.622 ( 6.097 -4.403 -7.432) 10.573 3.778 ( -7.117 -2.797 -7.919) 11.008 3.943 ( 0.870 -2.863 0.793) 3.096 4.957 ( 5.173 1.030 9.743) 11.080 5.161 ( -3.168 -2.471 6.827) 7.921 5.656 ( -6.249 0.690 -0.523) 6.309 6.146 ( -2.033 1.083 0.768) 2.428 6.891 ( -8.200 0.495 -3.367) 8.878 7.262 ( -3.998 0.774 3.955) 5.677 8.067 ( -1.601 3.491 37.533) 37.729 8.666 ( -19.063 7.280 22.698) 30.522 9.283 ( -7.398 10.815 6.989) 14.851 9.707 ( -10.058 -14.501 -5.439) 18.467 9.768 ( 3.971 9.243 10.138) 14.282 10.039 ( 10.062 -14.563 10.350) 20.505 10.447 ( -5.320 3.466 -9.667) 11.566 11.405 ( 22.139 -7.716 11.277) 26.016 11.646 ( 6.904 -0.236 -13.825) 15.455 12.021 ( 0.122 3.195 -13.392) 13.768 13.254 ( -3.095 -3.324 9.763) 10.768 13.686 ( 5.572 -2.872 -0.607) 6.298 14.066 ( -5.627 0.779 0.218) 5.685 14.782 ( -1.584 2.474 -13.314) 13.634 18.262 ( 14.532 0.264 -7.770) 16.481 18.360 ( -15.852 0.466 -19.032) 24.773 19.287 ( -9.508 1.532 -2.566) 9.966 19.649 ( 13.292 -0.725 -4.371) 14.011 21.523 ( -20.337 8.250 2.310) 22.068 21.684 ( 10.034 -6.667 8.037) 14.482 23.788 ( -4.856 -2.263 0.472) 5.378 24.149 ( 8.961 0.087 -2.506) 9.305 ======================= Grid point 418 (199/361) ======================= q-point: ( 0.20 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.444 ( 2.004 5.565 8.652) 10.481 2.674 ( 9.288 -5.425 7.751) 13.258 3.100 ( 4.268 2.804 4.673) 6.922 3.158 ( 0.673 1.741 -11.832) 11.978 3.383 ( -1.422 7.120 -5.167) 8.911 3.533 ( -7.056 3.165 -0.101) 7.734 3.827 ( 7.085 -12.684 -8.767) 16.969 4.013 ( 5.415 -4.420 0.912) 7.050 5.097 ( 0.898 0.729 6.953) 7.049 5.209 ( -3.011 -2.237 1.625) 4.088 5.510 ( -13.577 0.389 2.174) 13.755 6.084 ( -3.962 1.633 -0.988) 4.398 6.713 ( -11.344 1.318 -1.722) 11.549 7.256 ( -2.296 -0.045 4.246) 4.827 8.363 ( -6.818 10.345 18.840) 22.549 8.570 ( -9.960 12.117 23.109) 27.930 9.220 ( -10.095 1.698 11.816) 15.634 9.611 ( -15.485 -19.069 -2.679) 24.710 9.876 ( 5.546 14.869 11.583) 19.647 10.173 ( -7.319 -1.237 -7.366) 10.458 10.541 ( 14.896 -15.268 7.366) 22.567 11.472 ( -2.556 7.407 -13.412) 15.533 11.875 ( 19.666 1.003 -1.144) 19.725 12.031 ( 20.926 -6.098 -1.220) 21.830 13.349 ( -3.277 -5.063 7.195) 9.388 13.775 ( 2.105 -5.460 -1.935) 6.164 13.971 ( -6.739 1.269 1.153) 6.954 14.607 ( -0.056 2.408 -8.459) 8.795 17.884 ( -16.658 0.139 -19.392) 25.565 18.426 ( 15.464 0.125 -1.112) 15.505 19.127 ( -7.582 -0.407 -2.154) 7.892 19.722 ( 3.807 -0.266 -3.325) 5.061 21.112 ( -17.936 6.159 -3.921) 19.365 22.128 ( 16.021 -6.329 13.669) 21.990 23.758 ( -0.685 -1.710 -1.914) 2.657 24.241 ( 7.180 1.108 -0.665) 7.295 ======================= Grid point 419 (200/361) ======================= q-point: (-0.70 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.433 ( -4.852 4.778 2.842) 7.379 2.938 ( 3.408 -7.146 -1.135) 7.998 2.998 ( 2.499 1.861 -3.284) 4.527 3.164 ( 1.654 2.699 -1.781) 3.632 3.275 ( -0.973 7.286 2.680) 7.824 3.534 ( 5.754 1.949 6.742) 9.075 3.907 ( 8.079 -12.293 -11.702) 18.797 4.180 ( 6.243 -3.035 3.620) 7.830 5.070 ( -11.319 1.314 -7.585) 13.689 5.136 ( -5.332 -1.210 3.867) 6.697 5.380 ( -12.668 -2.488 6.573) 14.487 5.993 ( -2.714 2.273 -2.975) 4.624 6.506 ( -13.174 2.558 0.208) 13.422 7.303 ( 0.507 -1.181 4.123) 4.318 8.183 ( -5.209 14.835 -1.350) 15.781 8.732 ( -5.462 5.199 22.416) 23.650 9.199 ( -16.629 -3.381 13.639) 21.771 9.575 ( -12.908 -14.250 4.930) 19.849 9.863 ( -4.637 6.126 1.382) 7.806 10.052 ( -3.077 0.146 0.163) 3.084 10.963 ( 15.002 -6.134 6.140) 17.332 11.201 ( 0.298 11.553 -9.274) 14.818 12.019 ( 19.952 2.555 -13.176) 24.046 12.491 ( 20.953 -4.912 8.469) 23.128 13.446 ( -2.128 -5.233 8.336) 10.070 13.737 ( -8.165 1.012 0.093) 8.228 13.915 ( -2.674 -4.355 -2.068) 5.513 14.563 ( 5.267 -3.271 -4.782) 7.830 17.410 ( -17.473 0.397 -17.130) 24.472 18.668 ( 14.884 0.284 4.800) 15.641 19.035 ( -3.120 -3.309 -2.725) 5.302 19.714 ( -1.694 -2.056 -0.994) 2.844 20.798 ( -7.638 7.518 -7.995) 13.371 22.566 ( 9.902 -9.808 14.792) 20.324 23.746 ( 3.878 0.776 -4.771) 6.197 24.320 ( 5.017 2.253 2.043) 5.867 ======================= Grid point 420 (201/361) ======================= q-point: (-0.60 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.327 ( -11.563 3.150 5.767) 13.300 2.751 ( -13.442 -1.320 -8.360) 15.884 3.060 ( 3.829 4.971 -0.238) 6.280 3.193 ( 3.964 -0.027 2.626) 4.755 3.372 ( 8.417 -2.110 3.136) 9.226 3.719 ( 8.080 -2.791 4.643) 9.728 4.027 ( 12.030 -7.368 -8.024) 16.230 4.277 ( -1.051 3.382 5.108) 6.216 4.761 ( -16.620 0.077 -5.283) 17.440 5.083 ( -6.651 -2.360 0.465) 7.073 5.311 ( -9.645 -5.146 1.843) 11.087 5.891 ( -1.172 3.218 -5.107) 6.149 6.312 ( -12.659 3.295 3.677) 13.588 7.376 ( 1.470 -1.552 2.848) 3.561 8.001 ( 0.542 8.685 -4.708) 9.893 8.791 ( -8.170 2.806 8.708) 12.266 9.128 ( -20.383 -3.962 12.609) 24.294 9.591 ( -11.745 -9.461 7.642) 16.907 9.765 ( -5.034 -0.576 0.115) 5.068 10.031 ( -4.614 -1.640 4.650) 6.753 10.963 ( 10.520 25.601 -4.557) 28.051 11.319 ( 6.231 -9.226 5.004) 12.205 12.081 ( 18.063 4.999 -16.200) 24.773 12.839 ( 12.218 -2.519 1.903) 12.620 13.534 ( -14.460 4.866 14.377) 20.964 13.663 ( 3.895 -5.334 0.518) 6.625 13.901 ( -0.247 -4.252 -1.458) 4.502 14.685 ( 9.899 -10.784 -4.881) 15.431 16.982 ( -17.145 1.098 -9.348) 19.558 18.944 ( 11.817 -1.364 5.590) 13.143 19.032 ( 2.824 -4.792 -2.546) 6.117 19.705 ( -1.786 -3.021 0.278) 3.521 20.544 ( -1.271 9.419 -10.731) 14.335 22.933 ( 0.553 -14.744 13.419) 19.944 23.738 ( 9.042 4.768 -7.413) 12.627 24.404 ( 3.438 2.592 5.792) 7.217 ======================= Grid point 421 (202/361) ======================= q-point: (-0.50 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( -17.158 3.753 10.644) 20.537 2.421 ( -18.342 3.616 -5.628) 19.524 3.081 ( 5.223 2.928 -1.654) 6.212 3.322 ( 6.764 -2.315 3.484) 7.953 3.509 ( 2.366 -4.450 1.698) 5.318 3.841 ( -8.814 -5.178 1.060) 10.277 4.158 ( 12.195 3.656 2.699) 13.014 4.287 ( 4.417 0.033 0.454) 4.441 4.510 ( -15.114 -2.424 -0.312) 15.310 5.043 ( -0.635 -2.713 -1.466) 3.149 5.232 ( -7.960 -6.586 -3.218) 10.821 5.780 ( 0.506 3.735 -6.554) 7.560 6.190 ( -10.090 3.439 8.758) 13.796 7.433 ( 0.552 -1.363 1.549) 2.136 7.926 ( 2.403 0.447 -4.490) 5.112 8.669 ( -11.166 3.520 0.184) 11.709 9.000 ( -20.031 -2.619 10.026) 22.553 9.588 ( -10.924 -6.177 7.023) 14.381 9.727 ( -3.817 -1.341 1.958) 4.494 10.089 ( -0.903 -5.476 5.556) 7.853 10.870 ( 10.336 22.461 1.085) 24.749 11.470 ( 0.813 -3.390 1.382) 3.750 12.055 ( 15.819 7.464 -18.018) 25.112 12.933 ( 0.771 -0.719 -3.039) 3.217 13.421 ( -13.987 3.101 11.244) 18.213 13.756 ( -0.021 -5.852 -2.737) 6.461 13.997 ( 7.326 2.099 3.945) 8.582 14.906 ( 13.195 -14.745 -5.686) 20.588 16.727 ( -12.935 -0.134 6.592) 14.518 19.024 ( 1.459 -10.227 -10.228) 14.537 19.239 ( 12.481 3.181 8.261) 15.302 19.727 ( 2.163 -0.983 -0.052) 2.376 20.331 ( 1.868 9.260 -10.231) 13.925 23.159 ( -10.088 -20.180 8.575) 24.135 23.747 ( 13.381 7.956 -7.773) 17.401 24.517 ( 2.843 2.476 8.570) 9.363 ======================= Grid point 422 (203/361) ======================= q-point: (-0.40 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.013 ( -21.372 7.403 10.399) 24.893 2.052 ( -18.939 6.777 2.097) 20.224 3.113 ( 5.154 2.092 -0.806) 5.620 3.454 ( 4.243 -0.780 0.651) 4.363 3.589 ( -2.361 -3.720 1.919) 4.806 3.641 ( -22.249 -2.067 7.773) 23.658 4.253 ( -8.752 -3.392 -0.071) 9.387 4.420 ( 4.082 -3.967 -3.478) 6.670 4.478 ( 15.255 -1.587 7.670) 17.148 5.066 ( 1.849 -1.540 -0.993) 2.603 5.117 ( -5.187 -3.765 -7.122) 9.582 5.696 ( 4.163 3.662 -6.204) 8.320 6.182 ( -6.484 2.358 13.781) 15.412 7.447 ( -2.319 -0.593 1.151) 2.656 7.932 ( 1.831 -6.848 -6.318) 9.496 8.469 ( -11.812 0.912 0.998) 11.889 8.873 ( -14.936 1.725 10.663) 18.433 9.565 ( -11.746 -6.486 6.498) 14.908 9.725 ( -0.480 0.829 2.707) 2.871 10.183 ( 3.616 1.125 0.377) 3.805 10.870 ( 3.709 8.505 4.532) 10.326 11.447 ( -3.564 2.250 -1.580) 4.501 11.975 ( 13.978 7.598 -18.082) 24.085 12.845 ( -7.022 1.660 -1.147) 7.306 13.350 ( -9.950 1.173 6.429) 11.904 13.709 ( -3.362 -1.937 -6.752) 7.788 14.088 ( 5.755 4.741 1.595) 7.626 15.161 ( 13.955 -13.971 -8.399) 21.458 16.837 ( -1.777 -5.464 25.740) 26.374 18.949 ( 0.906 -5.551 -17.024) 17.929 19.444 ( 7.862 2.409 3.928) 9.112 19.805 ( 9.262 1.877 1.503) 9.569 20.184 ( 2.430 6.132 -7.692) 10.133 23.245 ( -15.799 -24.724 3.782) 29.584 23.781 ( 13.113 7.479 -6.618) 16.483 24.615 ( 0.590 4.092 6.190) 7.444 ======================= Grid point 423 (204/361) ======================= q-point: (-0.30 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.712 ( -18.167 10.004 10.079) 23.059 1.859 ( -16.600 9.717 14.865) 24.310 3.181 ( 5.848 -1.897 -2.487) 6.632 3.392 ( -27.486 -2.091 14.792) 31.284 3.483 ( -5.758 -0.580 4.688) 7.448 3.606 ( 3.909 2.195 -7.276) 8.546 4.209 ( -8.233 -5.268 9.045) 13.317 4.448 ( 3.360 -8.549 -11.552) 14.759 4.818 ( 8.098 -2.959 9.249) 12.645 4.934 ( -1.184 3.478 -8.736) 9.477 5.159 ( 8.114 -1.236 0.565) 8.227 5.701 ( 9.281 2.602 -3.594) 10.287 6.295 ( -3.286 -0.035 18.030) 18.327 7.406 ( -5.002 -0.468 0.221) 5.029 7.872 ( -1.079 -3.761 -13.300) 13.863 8.424 ( -11.141 -10.196 11.075) 18.728 8.824 ( -8.064 5.258 15.216) 18.005 9.539 ( -9.497 -8.216 3.993) 13.178 9.772 ( 2.738 3.862 5.517) 7.270 10.150 ( 4.176 10.832 -4.928) 12.611 10.853 ( -12.646 -6.295 0.133) 14.127 11.330 ( -0.833 10.970 -0.889) 11.038 11.901 ( 12.909 3.946 -15.801) 20.781 12.708 ( -9.001 1.662 0.440) 9.164 13.211 ( -9.541 7.610 0.333) 12.209 13.597 ( -4.892 0.074 -0.201) 4.897 14.142 ( 4.397 2.042 0.345) 4.860 15.317 ( 10.997 -10.718 -14.419) 21.064 17.371 ( 12.880 -12.212 31.590) 36.235 18.753 ( 4.060 2.676 -21.213) 21.763 19.503 ( -0.874 -2.627 -2.101) 3.475 19.988 ( 7.355 7.877 8.915) 13.986 20.097 ( 9.849 0.842 -10.537) 14.448 23.266 ( -20.068 -29.354 0.834) 35.568 23.822 ( 11.907 5.428 -6.350) 14.545 24.556 ( -6.000 9.795 -0.554) 11.500 ======================= Grid point 424 (205/361) ======================= q-point: (-0.20 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.636 ( -6.553 7.054 19.722) 21.947 1.778 ( -11.487 8.908 19.965) 24.697 3.132 ( -14.175 -3.132 4.171) 15.105 3.296 ( -7.668 -3.866 -3.594) 9.309 3.453 ( -5.288 0.064 12.227) 13.321 3.602 ( 9.265 5.386 -2.418) 10.986 4.286 ( -5.442 -8.500 3.624) 10.723 4.394 ( -0.753 -4.316 -6.788) 8.079 4.663 ( -7.219 3.348 -10.650) 13.295 5.056 ( 3.318 2.232 6.981) 8.045 5.374 ( 15.587 -1.747 2.536) 15.888 5.824 ( 11.734 0.251 0.144) 11.738 6.534 ( -0.134 -3.491 22.722) 22.989 7.325 ( -5.517 -0.108 -1.336) 5.677 7.699 ( -1.129 -0.067 -13.190) 13.239 8.499 ( -20.028 -9.115 21.799) 30.974 8.959 ( 0.790 -2.624 16.375) 16.602 9.564 ( -3.855 -9.594 3.134) 10.804 9.793 ( -0.540 10.852 0.638) 10.884 10.085 ( 9.433 10.728 0.587) 14.298 10.605 ( -26.425 -8.714 -1.544) 27.868 11.189 ( 1.191 17.177 -3.042) 17.485 11.890 ( 11.219 -0.674 -13.839) 17.828 12.560 ( -9.862 0.382 -1.070) 9.927 13.043 ( -6.712 9.081 7.491) 13.551 13.558 ( -2.761 0.185 1.992) 3.409 14.178 ( 2.431 0.518 -0.816) 2.617 15.322 ( 6.978 -7.045 -18.895) 21.339 18.063 ( 17.997 -15.966 14.132) 27.902 18.575 ( 14.203 8.696 -13.570) 21.483 19.426 ( -7.713 -6.527 -7.198) 12.406 19.901 ( -5.189 7.496 -2.754) 9.523 20.347 ( 22.877 1.995 3.151) 23.179 23.176 ( -29.515 -29.082 -4.512) 41.681 23.875 ( 11.883 3.203 -6.251) 13.804 24.266 ( -12.557 16.245 -1.762) 20.608 ======================= Grid point 425 (206/361) ======================= q-point: (-0.10 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.818 ( 0.330 1.918 20.175) 20.268 1.864 ( -5.590 3.940 23.762) 24.727 3.077 ( -6.313 -3.810 4.590) 8.686 3.144 ( -5.267 2.245 -0.219) 5.730 3.566 ( 8.988 -3.441 -5.632) 11.151 3.699 ( 4.016 4.467 9.612) 11.335 4.148 ( -8.793 -6.051 -15.081) 18.477 4.310 ( -11.040 1.999 -6.791) 13.115 4.553 ( 4.394 0.386 6.305) 7.695 5.116 ( -1.288 2.026 4.886) 5.444 5.610 ( 9.961 -1.216 1.513) 10.148 6.000 ( 9.144 -0.772 2.241) 9.446 6.899 ( 2.793 -6.397 24.195) 25.182 7.217 ( -4.557 3.400 -2.436) 6.185 7.565 ( -2.687 -0.236 -1.524) 3.098 8.576 ( -22.417 -4.422 30.878) 38.413 9.224 ( 1.986 -12.496 10.776) 16.619 9.591 ( -5.212 9.018 -0.298) 10.420 9.698 ( 2.445 -3.644 2.811) 5.211 10.064 ( -7.498 17.948 3.438) 19.753 10.488 ( -0.984 -18.027 5.734) 18.943 10.972 ( -0.696 18.646 -5.245) 19.382 11.842 ( 6.677 -0.284 -16.413) 17.722 12.408 ( -8.743 -1.345 -2.641) 9.232 13.043 ( -3.116 4.470 12.602) 13.729 13.556 ( 0.886 0.880 1.022) 1.613 14.178 ( -0.376 -0.031 -1.346) 1.398 15.199 ( 3.044 -3.333 -20.071) 20.573 18.236 ( 8.898 -2.758 -17.133) 19.502 18.887 ( 25.391 0.698 4.859) 25.862 19.238 ( -8.470 -7.633 -10.731) 15.657 19.699 ( -7.745 5.901 -4.222) 10.613 20.735 ( 23.849 1.328 7.410) 25.009 22.773 ( -41.268 -12.878 -8.288) 44.017 23.948 ( 7.234 1.636 -3.761) 8.316 23.983 ( -6.775 8.054 1.801) 10.678 ======================= Grid point 427 (207/361) ======================= q-point: ( 0.10 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.559 ( 10.715 0.000 10.190) 14.787 2.562 ( 0.551 0.000 7.100) 7.121 3.136 ( 8.426 0.000 5.144) 9.872 3.162 ( -6.457 -0.000 -13.368) 14.845 3.507 ( -2.102 -0.000 -5.863) 6.228 3.591 ( 2.660 0.000 -3.952) 4.764 3.628 ( 0.921 0.000 -4.605) 4.697 3.963 ( 4.631 0.000 1.188) 4.781 5.111 ( 0.761 0.000 6.373) 6.419 5.183 ( -1.860 -0.000 2.580) 3.181 5.513 ( -13.999 -0.000 1.330) 14.062 6.100 ( -3.990 -0.000 -1.119) 4.144 6.727 ( -10.722 -0.000 -1.470) 10.822 7.251 ( -3.303 -0.000 3.466) 4.788 8.455 ( -7.958 -0.000 29.847) 30.890 8.730 ( -16.490 -0.000 25.637) 30.482 9.252 ( -16.668 -0.000 -13.547) 21.479 9.364 ( -6.744 -0.000 12.348) 14.069 10.071 ( 1.685 0.000 0.357) 1.722 10.226 ( -0.011 -0.000 -10.575) 10.575 10.286 ( 13.918 0.000 17.924) 22.693 11.555 ( 4.187 0.000 -14.083) 14.693 11.884 ( 24.211 0.000 14.640) 28.293 11.975 ( 14.778 0.000 -13.458) 19.987 13.294 ( -3.623 -0.000 7.526) 8.352 13.718 ( 3.628 0.000 -3.251) 4.872 13.988 ( -7.651 -0.000 1.896) 7.882 14.629 ( -1.376 -0.000 -9.539) 9.638 17.886 ( -16.779 -0.000 -19.538) 25.754 18.427 ( 15.693 0.000 -1.410) 15.757 19.121 ( -8.786 -0.000 -2.357) 9.097 19.719 ( 2.843 0.000 -3.064) 4.179 21.178 ( -17.438 -0.000 -5.629) 18.324 22.064 ( 14.738 0.000 15.095) 21.096 23.741 ( 0.069 0.000 -1.064) 1.066 24.251 ( 7.861 0.000 -0.908) 7.914 ======================= Grid point 428 (208/361) ======================= q-point: ( 0.20 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.542 ( -2.208 6.011 -1.591) 6.599 2.790 ( 0.396 -7.367 -1.374) 7.504 3.020 ( 6.235 0.520 -1.052) 6.345 3.235 ( 1.073 3.347 -0.884) 3.625 3.424 ( -1.772 8.602 -1.596) 8.926 3.542 ( 1.361 -1.927 4.438) 5.026 3.700 ( 7.883 -8.408 -4.502) 12.374 4.112 ( 8.579 -3.121 3.064) 9.630 5.087 ( -8.861 0.581 -8.008) 11.957 5.122 ( -6.974 -0.278 2.957) 7.580 5.349 ( -14.260 -0.959 6.920) 15.880 6.025 ( -1.818 0.985 -3.193) 3.804 6.547 ( -12.342 1.490 0.540) 12.444 7.269 ( -0.768 -1.512 3.097) 3.531 8.472 ( -11.220 14.438 7.865) 19.905 8.798 ( -13.122 2.698 16.111) 20.953 8.975 ( -18.508 -16.412 4.914) 25.220 9.455 ( -7.876 -0.833 16.594) 18.387 9.859 ( -10.686 -2.023 -9.468) 14.419 10.213 ( 5.127 9.754 -1.627) 11.139 10.769 ( 15.655 -8.962 13.816) 22.721 11.455 ( 10.491 9.241 -11.295) 17.973 12.063 ( 20.092 1.940 -13.206) 24.122 12.415 ( 21.586 -2.979 13.108) 25.430 13.356 ( -1.298 -3.269 7.668) 8.436 13.702 ( -1.181 -2.822 -4.856) 5.740 13.890 ( -9.168 0.536 2.661) 9.562 14.525 ( 1.337 -0.988 -7.461) 7.644 17.415 ( -17.208 0.147 -16.794) 24.046 18.670 ( 15.269 -0.006 4.011) 15.787 18.995 ( -5.000 -1.067 -2.174) 5.556 19.684 ( -3.382 -0.931 -0.846) 3.609 20.907 ( -6.052 3.517 -9.303) 11.642 22.432 ( 6.612 -4.129 16.161) 17.943 23.757 ( 5.467 0.330 -2.852) 6.175 24.348 ( 6.017 0.758 0.857) 6.124 ======================= Grid point 429 (209/361) ======================= q-point: (-0.70 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.401 ( -6.198 4.776 -1.389) 7.947 2.684 ( -9.080 -5.289 -8.531) 13.535 3.152 ( 3.154 5.323 -3.583) 7.150 3.229 ( 6.852 2.599 5.495) 9.160 3.346 ( -0.517 -1.040 1.821) 2.160 3.633 ( 1.106 -5.472 1.071) 5.685 3.929 ( 14.658 -3.043 3.646) 15.408 4.286 ( 5.702 -2.406 2.212) 6.572 4.782 ( -17.416 2.481 -5.057) 18.304 5.016 ( -11.224 -4.009 -0.006) 11.919 5.251 ( -10.528 -1.852 2.390) 10.953 5.948 ( 0.554 2.606 -5.468) 6.082 6.373 ( -11.783 3.091 3.629) 12.711 7.317 ( -0.291 -3.602 1.487) 3.908 8.203 ( -6.824 12.620 -5.110) 15.230 8.768 ( -12.722 -7.988 7.587) 16.829 8.958 ( -21.217 -8.273 13.719) 26.586 9.523 ( -10.354 1.148 14.529) 17.878 9.680 ( -8.807 -7.002 -1.661) 11.374 10.125 ( -0.129 8.124 -3.220) 8.739 11.189 ( 12.849 -5.077 9.734) 16.900 11.409 ( 15.962 20.468 -6.119) 26.668 12.156 ( 19.329 3.107 -15.201) 24.786 12.799 ( 11.925 -1.795 4.061) 12.725 13.545 ( 3.304 -3.306 14.406) 15.145 13.609 ( -8.791 -1.242 -1.064) 8.941 13.809 ( -3.310 -3.793 -0.573) 5.067 14.519 ( 5.786 -6.701 -7.480) 11.590 16.998 ( -16.885 0.604 -9.635) 19.450 18.874 ( 4.110 -3.756 -4.293) 7.031 19.021 ( 9.564 1.076 8.179) 12.630 19.654 ( -1.545 -2.277 0.321) 2.770 20.690 ( -1.004 6.033 -11.490) 13.017 22.706 ( -3.369 -9.224 14.080) 17.166 23.817 ( 10.478 3.358 -3.731) 11.618 24.434 ( 3.950 0.895 3.163) 5.139 ======================= Grid point 430 (210/361) ======================= q-point: (-0.60 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.262 ( -10.214 3.936 4.391) 11.794 2.456 ( -12.411 0.599 -6.444) 13.997 3.113 ( 4.334 0.369 -5.267) 6.831 3.330 ( 2.038 2.031 8.257) 8.744 3.424 ( -0.046 -3.398 1.913) 3.899 3.718 ( 0.352 -7.238 -1.544) 7.409 4.199 ( 13.968 1.112 4.447) 14.701 4.317 ( -4.402 -0.866 -2.008) 4.915 4.490 ( -15.457 3.184 3.548) 16.175 4.944 ( -4.512 -7.841 -0.157) 9.048 5.136 ( -8.916 -3.415 -1.620) 9.684 5.858 ( 2.305 4.265 -7.206) 8.685 6.256 ( -9.723 3.625 7.978) 13.089 7.352 ( -1.902 -5.942 -0.472) 6.257 7.971 ( -4.939 3.308 -6.626) 8.902 8.710 ( -16.964 1.261 7.524) 18.600 8.866 ( -15.436 -10.172 6.470) 19.585 9.505 ( -10.428 -2.037 8.449) 13.575 9.673 ( -8.162 -7.096 6.750) 12.749 10.038 ( -0.639 2.780 -0.205) 2.860 11.364 ( 15.450 27.713 -2.619) 31.837 11.454 ( 8.535 0.988 5.117) 10.000 12.178 ( 16.810 5.465 -17.427) 24.822 12.907 ( 2.426 -1.523 -3.275) 4.351 13.474 ( -12.963 1.019 5.514) 14.124 13.648 ( -6.501 -4.722 2.697) 8.476 13.995 ( 12.964 -1.958 7.049) 14.886 14.634 ( 10.433 -13.896 -7.727) 19.017 16.724 ( -13.868 -0.114 3.596) 14.327 18.869 ( 2.901 -6.421 -9.713) 12.000 19.299 ( 12.512 3.117 10.178) 16.427 19.699 ( 4.637 -1.869 0.082) 5.000 20.480 ( -0.244 6.746 -11.573) 13.398 22.837 ( -12.620 -14.324 8.802) 21.022 23.892 ( 12.452 7.359 -3.697) 14.929 24.532 ( 2.457 -0.445 5.783) 6.299 ======================= Grid point 431 (211/361) ======================= q-point: (-0.50 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.137 ( -13.078 5.151 9.108) 16.749 2.178 ( -14.803 7.907 0.544) 16.791 3.129 ( 4.609 -1.362 -4.284) 6.438 3.424 ( -2.782 -1.826 0.488) 3.363 3.495 ( 2.029 -6.109 6.122) 8.883 3.648 ( -12.323 1.953 2.926) 12.815 4.156 ( -10.252 -5.301 -7.025) 13.511 4.397 ( -4.807 0.532 4.083) 6.329 4.464 ( 13.086 -0.127 8.582) 15.649 5.002 ( 0.962 -6.183 0.464) 6.274 5.034 ( -5.375 -3.698 -2.452) 6.970 5.777 ( 5.562 4.846 -7.573) 10.572 6.230 ( -7.123 2.700 12.321) 14.485 7.356 ( -6.304 -8.246 -0.269) 10.382 7.842 ( -2.794 -3.527 -5.517) 7.119 8.462 ( -21.905 -1.109 2.650) 22.093 8.879 ( -4.721 -1.492 7.940) 9.357 9.466 ( -13.924 -2.651 9.916) 17.298 9.713 ( -4.338 -6.286 4.460) 8.844 10.064 ( -0.220 -5.532 2.395) 6.032 11.261 ( 9.378 28.478 -2.359) 30.075 11.555 ( 6.467 8.576 2.349) 10.995 12.119 ( 14.720 7.379 -19.236) 25.321 12.861 ( -3.580 0.056 -2.796) 4.543 13.369 ( -11.810 0.596 7.824) 14.179 13.622 ( -4.058 -6.455 -2.980) 8.186 14.178 ( 7.062 4.380 1.007) 8.372 14.871 ( 13.161 -16.991 -7.259) 22.685 16.744 ( -5.626 -4.406 20.783) 21.977 18.834 ( 4.250 -6.216 -14.469) 16.311 19.522 ( 8.880 5.176 4.754) 11.325 19.824 ( 12.723 0.318 -0.249) 12.730 20.288 ( -1.425 4.883 -8.670) 10.052 22.840 ( -18.508 -18.833 4.536) 26.792 23.937 ( 10.911 9.120 -4.075) 14.793 24.638 ( 0.299 -1.129 5.646) 5.765 ======================= Grid point 432 (212/361) ======================= q-point: (-0.40 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.930 ( -12.485 13.055 8.701) 20.050 2.023 ( -14.210 8.211 14.384) 21.823 3.152 ( 1.845 -1.557 -2.739) 3.651 3.320 ( -14.920 -5.290 -0.556) 15.840 3.493 ( -9.705 -0.274 5.964) 11.394 3.667 ( 7.023 5.721 3.094) 9.572 4.030 ( -8.341 -12.467 -1.996) 15.132 4.370 ( -2.404 -1.106 -0.518) 2.696 4.745 ( 2.402 -4.865 7.124) 8.955 4.967 ( 4.861 0.451 -3.228) 5.853 5.117 ( 4.258 -3.259 3.660) 6.492 5.761 ( 9.333 3.733 -5.892) 11.652 6.302 ( -4.567 0.625 15.623) 16.288 7.311 ( -12.668 -9.626 2.110) 16.050 7.794 ( -0.145 -4.574 -7.648) 8.912 8.259 ( -15.946 -7.244 5.785) 18.445 8.924 ( -2.792 4.839 10.514) 11.907 9.410 ( -14.831 -4.760 10.357) 18.706 9.781 ( -1.926 -6.019 5.276) 8.232 10.135 ( -1.629 -6.691 -0.337) 6.894 11.041 ( -0.074 24.541 -4.358) 24.925 11.581 ( 8.483 15.107 2.713) 17.537 12.009 ( 13.450 7.606 -19.963) 25.244 12.749 ( -7.454 2.284 -0.741) 7.831 13.296 ( -8.723 1.843 4.537) 10.004 13.573 ( -3.980 -2.996 -1.428) 5.182 14.203 ( 3.177 4.259 -0.426) 5.331 15.075 ( 10.162 -15.224 -12.229) 22.013 17.146 ( 6.040 -11.547 30.247) 32.934 18.747 ( 6.693 -3.094 -19.219) 20.584 19.538 ( 1.047 5.992 -4.176) 7.378 20.065 ( 20.602 0.546 -1.980) 20.704 20.146 ( -3.088 4.176 -1.034) 5.296 22.779 ( -22.851 -22.997 2.986) 32.557 23.948 ( 9.555 8.121 -4.693) 13.390 24.655 ( -4.717 1.578 1.095) 5.093 ======================= Grid point 433 (213/361) ======================= q-point: (-0.30 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( -6.463 12.994 16.519) 21.989 1.950 ( -12.233 9.111 18.534) 24.004 3.087 ( -11.051 -1.336 2.949) 11.516 3.207 ( -5.429 -5.601 -3.370) 8.498 3.457 ( -3.181 -0.315 4.070) 5.175 3.717 ( 6.818 7.500 1.894) 10.311 4.060 ( -3.535 -14.508 -4.777) 15.678 4.356 ( -3.222 -1.064 3.965) 5.219 4.680 ( -7.966 -1.293 -6.161) 10.153 5.112 ( 4.711 3.679 7.972) 9.964 5.316 ( 12.885 -4.838 2.652) 14.016 5.835 ( 10.863 1.060 -2.303) 11.155 6.472 ( -1.819 -2.920 18.554) 18.871 7.241 ( -14.026 -9.316 4.792) 17.506 7.700 ( -0.322 -0.129 -9.760) 9.766 8.280 ( -12.244 -13.267 12.102) 21.735 8.978 ( -4.653 4.266 14.851) 16.137 9.405 ( -10.689 -7.394 10.179) 16.508 9.904 ( -0.290 -7.450 7.355) 10.473 10.102 ( -3.265 0.680 -3.104) 4.556 10.735 ( -5.239 21.531 -3.443) 22.425 11.560 ( 8.694 21.770 -1.223) 23.474 11.902 ( 11.769 3.133 -18.018) 21.748 12.584 ( -10.561 1.957 -1.885) 10.905 13.197 ( -6.638 6.441 5.737) 10.884 13.557 ( -1.758 -0.463 2.788) 3.328 14.200 ( 1.041 1.953 -0.405) 2.250 15.139 ( 6.209 -12.506 -16.887) 21.912 17.766 ( 13.088 -15.923 21.871) 30.053 18.654 ( 12.666 -0.528 -17.840) 21.886 19.382 ( -5.300 2.651 -8.949) 10.733 20.000 ( -4.077 2.779 -5.857) 7.659 20.405 ( 22.801 4.077 5.388) 23.781 22.667 ( -28.377 -24.949 1.925) 37.834 23.959 ( 9.456 5.810 -5.204) 12.258 24.484 ( -10.922 7.444 -3.188) 13.596 ======================= Grid point 434 (214/361) ======================= q-point: (-0.20 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.899 ( -1.242 6.502 17.300) 18.523 1.972 ( -8.144 7.320 22.514) 25.036 3.012 ( -6.615 -3.013 1.176) 7.364 3.153 ( -0.098 -1.242 -0.399) 1.308 3.510 ( 3.490 -2.384 0.394) 4.245 3.796 ( 5.082 5.066 5.788) 9.219 3.998 ( -3.176 -9.016 -15.069) 17.845 4.318 ( -11.716 -1.356 -1.792) 11.930 4.576 ( 1.906 2.083 4.476) 5.292 5.180 ( -0.808 4.591 5.700) 7.364 5.562 ( 9.653 -4.183 1.657) 10.651 5.978 ( 8.648 -1.474 1.066) 8.837 6.757 ( 1.719 -7.737 18.461) 20.090 7.220 ( -9.647 -4.994 9.391) 14.360 7.573 ( -1.594 1.325 -6.042) 6.387 8.401 ( -15.548 -14.079 20.046) 29.014 9.077 ( -6.230 -2.154 14.546) 15.970 9.465 ( -8.913 -9.283 8.547) 15.449 9.969 ( 5.020 18.543 1.957) 19.310 10.118 ( -4.248 -20.514 4.986) 21.534 10.450 ( -2.538 22.304 0.709) 22.459 11.390 ( 6.511 25.962 -6.318) 27.501 11.835 ( 9.118 -0.010 -17.064) 19.347 12.381 ( -11.851 -1.059 -3.246) 12.333 13.163 ( -3.367 7.075 10.432) 13.047 13.585 ( 1.797 2.153 2.725) 3.910 14.180 ( -1.351 0.425 -0.876) 1.666 15.081 ( 2.634 -9.300 -18.737) 21.083 18.144 ( 10.024 -6.874 -6.849) 13.952 18.835 ( 21.762 -9.235 0.547) 23.647 19.128 ( -9.870 0.102 -12.473) 15.906 19.818 ( -5.516 5.393 -6.198) 9.896 20.783 ( 23.676 3.901 7.675) 25.192 22.435 ( -34.896 -20.361 -0.242) 40.403 23.992 ( 9.597 3.271 -5.056) 11.330 24.181 ( -12.694 10.581 -2.092) 16.658 ======================= Grid point 435 (215/361) ======================= q-point: (-0.10 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.047 ( -1.265 0.644 16.535) 16.596 2.156 ( 1.430 4.572 21.932) 22.449 2.964 ( -1.077 -3.170 -3.156) 4.601 3.245 ( 7.884 -1.810 1.647) 8.255 3.575 ( 3.501 -1.972 -2.162) 4.563 3.789 ( -6.027 -4.841 -15.918) 17.696 3.893 ( 5.241 5.094 2.758) 7.812 4.061 ( -11.833 2.450 -7.228) 14.081 4.739 ( 5.220 -0.405 11.133) 12.303 5.169 ( -3.374 4.316 5.250) 7.588 5.683 ( 1.468 -2.246 0.040) 2.683 6.105 ( 3.395 -2.063 1.957) 4.429 6.981 ( -2.349 -6.165 1.796) 6.837 7.248 ( -4.031 0.947 6.831) 7.988 7.635 ( -1.396 -4.317 23.651) 24.083 8.562 ( -18.070 -11.676 24.454) 32.571 9.181 ( -6.610 -8.711 10.124) 14.902 9.533 ( -3.700 -9.712 6.006) 12.003 9.939 ( 7.224 19.202 7.281) 21.770 10.094 ( -11.147 12.318 0.880) 16.636 10.442 ( 4.104 -9.568 0.885) 10.448 11.221 ( 11.746 22.673 -0.479) 25.539 11.736 ( 7.629 1.559 -16.685) 18.412 12.190 ( -9.097 -4.544 -7.869) 12.858 13.203 ( -2.277 5.652 11.321) 12.857 13.633 ( 4.856 3.653 1.475) 6.253 14.132 ( -3.737 -0.477 -0.874) 3.868 14.945 ( -0.090 -5.880 -17.166) 18.145 18.189 ( 12.239 -1.187 -12.508) 17.540 18.785 ( -14.336 -1.991 -16.192) 21.718 19.248 ( 14.072 -10.535 0.921) 17.602 19.620 ( -0.590 7.515 -6.070) 9.678 21.197 ( 21.720 2.002 10.592) 24.248 22.039 ( -36.045 -9.459 -1.697) 37.304 23.922 ( -9.036 6.912 0.371) 11.383 24.060 ( 9.167 1.035 -3.854) 9.998 ======================= Grid point 438 (216/361) ======================= q-point: ( 0.20 -0.80 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.468 ( -3.238 -0.000 -7.561) 8.225 2.609 ( -8.157 -0.000 -5.022) 9.579 3.241 ( -2.322 -0.000 2.048) 3.096 3.246 ( 14.488 0.000 3.072) 14.810 3.314 ( -3.626 -0.000 -8.382) 9.133 3.579 ( -2.854 -0.000 6.044) 6.684 3.905 ( 14.452 0.000 8.320) 16.676 4.247 ( 7.654 0.000 0.132) 7.655 4.820 ( -14.006 -0.000 -5.060) 14.892 4.969 ( -15.587 -0.000 0.279) 15.589 5.234 ( -10.644 -0.000 2.653) 10.969 5.974 ( 1.041 0.000 -5.379) 5.479 6.406 ( -11.126 -0.000 3.241) 11.588 7.279 ( -1.271 -0.000 1.567) 2.017 8.396 ( -13.943 -0.000 -17.004) 21.989 8.582 ( -8.614 -0.000 14.831) 17.151 8.908 ( -21.582 -0.000 20.045) 29.454 9.556 ( -11.056 -0.000 20.137) 22.972 9.593 ( -9.752 -0.000 -6.787) 11.882 10.213 ( 0.787 0.000 -8.698) 8.734 11.139 ( 15.587 0.000 13.123) 20.375 11.614 ( 18.868 0.000 -7.152) 20.178 12.188 ( 19.939 0.000 -15.314) 25.141 12.778 ( 10.994 0.000 6.192) 12.618 13.512 ( 6.126 0.000 16.317) 17.429 13.574 ( -4.595 -0.000 -6.591) 8.035 13.784 ( -9.373 -0.000 2.500) 9.701 14.456 ( 3.841 0.000 -8.499) 9.327 17.004 ( -16.785 -0.000 -9.754) 19.413 18.838 ( 2.848 0.000 -5.010) 5.763 19.034 ( 10.469 0.000 9.561) 14.178 19.632 ( -1.477 -0.000 0.205) 1.491 20.748 ( -0.835 -0.000 -12.327) 12.356 22.618 ( -4.557 -0.000 14.501) 15.200 23.849 ( 10.728 0.000 -1.888) 10.893 24.442 ( 4.130 0.000 1.882) 4.539 ======================= Grid point 440 (217/361) ======================= q-point: (-0.70 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.321 ( -3.771 2.012 -4.728) 6.373 2.454 ( -8.324 -0.442 -2.350) 8.660 3.129 ( -0.365 1.824 -8.331) 8.536 3.271 ( -3.346 -5.141 3.462) 7.043 3.477 ( 6.687 5.171 6.162) 10.460 3.609 ( -2.412 -4.318 3.990) 6.355 4.210 ( 12.788 0.283 8.251) 15.221 4.247 ( -5.194 -3.780 -7.266) 9.698 4.622 ( -11.354 8.992 4.366) 15.127 4.787 ( -8.296 -8.814 1.053) 12.150 5.098 ( -10.027 -1.030 -1.001) 10.129 5.917 ( 2.793 1.798 -7.004) 7.751 6.311 ( -9.286 1.895 6.737) 11.628 7.260 ( -4.619 -3.128 -0.229) 5.583 8.020 ( -8.557 1.573 -14.015) 16.496 8.693 ( -6.234 -3.636 15.224) 16.848 8.748 ( -25.464 -0.593 9.881) 27.320 9.428 ( -7.949 -4.587 -2.120) 9.419 9.610 ( -14.963 -0.033 18.731) 23.973 10.107 ( 1.688 2.721 -7.328) 7.997 11.478 ( 12.603 0.991 8.515) 15.242 11.766 ( 19.165 13.009 -4.258) 23.551 12.250 ( 17.684 2.406 -17.470) 24.974 12.885 ( 2.139 -0.816 -1.970) 3.020 13.431 ( -6.600 -3.396 -4.840) 8.861 13.619 ( -16.728 0.271 10.732) 19.877 13.953 ( 18.439 -1.689 10.987) 21.531 14.444 ( 7.174 -5.773 -9.919) 13.535 16.723 ( -14.355 -0.039 1.972) 14.490 18.791 ( 3.271 -2.133 -9.419) 10.197 19.343 ( 12.268 1.406 11.866) 17.125 19.669 ( 6.093 -1.042 -0.006) 6.182 20.568 ( -0.848 2.539 -13.361) 13.626 22.655 ( -13.656 -5.220 9.467) 17.418 23.995 ( 11.767 3.239 0.156) 12.205 24.516 ( 2.099 -0.802 2.773) 3.570 ======================= Grid point 441 (218/361) ======================= q-point: (-0.60 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.213 ( -5.025 3.309 0.765) 6.065 2.318 ( -8.692 6.430 4.896) 11.869 3.064 ( 1.788 -4.474 -6.302) 7.933 3.334 ( -1.814 -6.966 2.140) 7.510 3.470 ( -10.447 2.664 7.278) 13.008 3.667 ( 1.667 0.068 -0.151) 1.675 4.078 ( -9.249 -3.549 -6.568) 11.886 4.430 ( -5.396 2.753 3.229) 6.865 4.466 ( 4.556 0.205 8.459) 9.610 4.893 ( 3.605 -4.722 4.265) 7.313 4.970 ( -7.933 -3.214 0.373) 8.567 5.858 ( 5.599 3.495 -8.123) 10.467 6.274 ( -8.107 1.997 10.905) 13.734 7.199 ( -9.905 -7.511 -0.597) 12.445 7.790 ( -3.548 -2.129 -9.743) 10.585 8.450 ( -25.327 0.024 3.743) 25.602 8.839 ( -3.203 -2.079 13.991) 14.503 9.382 ( -7.514 -8.460 1.428) 11.405 9.594 ( -17.454 -1.622 16.565) 24.118 10.059 ( 3.842 2.075 -3.126) 5.370 11.657 ( 8.748 9.251 0.570) 12.745 11.820 ( 15.107 21.298 0.229) 26.113 12.226 ( 15.107 4.623 -19.106) 24.792 12.856 ( -0.265 -0.679 -4.669) 4.725 13.341 ( -8.112 -4.217 0.958) 9.193 13.519 ( -11.898 -3.490 6.024) 13.785 14.250 ( 9.805 3.963 1.623) 10.699 14.573 ( 12.133 -14.538 -6.338) 19.968 16.682 ( -7.978 -2.306 17.317) 19.205 18.742 ( 5.598 -3.611 -13.847) 15.366 19.608 ( 9.466 3.748 7.954) 12.920 19.821 ( 14.743 -0.412 -0.921) 14.778 20.357 ( -2.846 2.599 -12.134) 12.731 22.574 ( -19.327 -10.010 5.676) 22.493 24.096 ( 8.847 7.592 -0.394) 11.664 24.591 ( 0.051 -3.408 3.392) 4.808 ======================= Grid point 442 (219/361) ======================= q-point: (-0.50 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.127 ( -6.486 7.334 6.825) 11.935 2.210 ( -9.066 12.833 12.613) 20.149 3.082 ( 0.131 -6.646 -2.647) 7.155 3.262 ( -13.035 0.044 -0.468) 13.044 3.432 ( -4.471 -5.998 1.007) 7.548 3.715 ( 0.016 -6.250 2.863) 6.875 3.907 ( -2.273 4.164 -4.754) 6.716 4.366 ( -7.176 0.554 5.313) 8.947 4.652 ( 0.624 -4.661 4.466) 6.485 4.945 ( 5.383 -3.717 0.239) 6.546 5.062 ( 1.689 -1.495 8.741) 9.027 5.829 ( 8.539 3.451 -7.572) 11.924 6.312 ( -6.414 0.413 14.173) 15.563 7.103 ( -16.409 -11.461 2.158) 20.131 7.711 ( 1.104 -4.127 -6.255) 7.575 8.168 ( -18.389 -2.820 1.849) 18.695 8.971 ( -2.566 0.383 12.785) 13.046 9.355 ( -12.185 -3.715 7.472) 14.769 9.579 ( -15.397 -9.851 12.029) 21.881 10.097 ( 5.380 1.001 0.143) 5.474 11.537 ( 4.954 25.349 -7.486) 26.892 11.853 ( 8.412 14.371 2.524) 16.842 12.158 ( 16.062 8.302 -18.019) 25.526 12.785 ( -2.034 1.474 -4.618) 5.257 13.286 ( -8.930 -2.634 5.138) 10.634 13.493 ( -5.566 -5.151 3.272) 8.260 14.280 ( 4.043 3.895 -3.476) 6.603 14.789 ( 9.058 -14.978 -8.529) 19.471 16.968 ( 1.356 -7.637 28.628) 29.660 18.672 ( 7.358 -4.187 -18.593) 20.429 19.682 ( 2.909 8.545 -2.540) 9.377 20.055 ( 16.361 -1.077 -6.603) 17.676 20.199 ( 1.838 1.208 -1.002) 2.417 22.442 ( -22.667 -13.679 4.974) 26.937 24.108 ( 6.342 8.929 -2.273) 11.186 24.633 ( -3.784 -3.431 1.307) 5.272 ======================= Grid point 443 (220/361) ======================= q-point: (-0.40 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.062 ( -8.356 9.900 12.650) 18.106 2.136 ( -8.096 13.839 16.174) 22.774 3.081 ( -11.521 -2.926 0.174) 11.888 3.099 ( -2.760 -2.704 0.578) 3.907 3.426 ( -0.320 -3.081 -1.639) 3.505 3.748 ( -4.823 -13.968 -6.564) 16.170 3.913 ( 9.902 7.862 2.454) 12.879 4.336 ( -8.226 -0.898 7.255) 11.005 4.640 ( -5.139 -2.192 -1.462) 5.775 5.179 ( 11.202 -0.162 7.141) 13.285 5.195 ( 2.354 -4.861 6.313) 8.308 5.861 ( 9.548 1.580 -4.664) 10.743 6.428 ( -4.118 -2.119 15.990) 16.647 7.019 ( -17.742 -13.397 7.170) 23.360 7.686 ( 0.967 -1.312 -6.348) 6.554 8.059 ( -11.185 -10.115 5.232) 15.962 9.063 ( -3.212 3.264 11.670) 12.536 9.309 ( -16.212 -2.646 15.331) 22.469 9.628 ( -10.933 -15.824 7.849) 20.773 10.179 ( 6.113 3.829 2.633) 7.678 11.223 ( 1.659 29.166 -8.699) 30.480 11.840 ( 4.839 6.961 -3.894) 9.329 12.094 ( 17.808 17.435 -14.320) 28.743 12.630 ( -7.997 3.448 -5.761) 10.441 13.256 ( -6.598 -0.025 6.140) 9.012 13.533 ( -0.919 -2.323 5.358) 5.912 14.246 ( 0.608 2.798 -2.053) 3.523 14.886 ( 4.731 -14.347 -13.375) 20.177 17.499 ( 8.591 -12.757 27.706) 31.689 18.588 ( 9.525 -5.174 -20.582) 23.262 19.502 ( -3.080 9.097 -10.971) 14.581 20.008 ( -3.043 -1.519 -6.747) 7.556 20.475 ( 24.150 2.963 4.432) 24.732 22.295 ( -25.394 -15.398 5.317) 30.170 24.081 ( 5.903 7.319 -3.698) 10.104 24.551 ( -8.944 0.280 -2.545) 9.303 ======================= Grid point 444 (221/361) ======================= q-point: (-0.30 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.024 ( -8.157 6.450 13.955) 17.404 2.140 ( -4.535 11.473 18.934) 22.598 2.962 ( -7.394 -2.833 -1.415) 8.044 3.122 ( 2.472 -1.244 0.978) 2.936 3.463 ( 1.877 -3.207 1.096) 3.874 3.728 ( -3.355 -12.271 -7.980) 15.017 3.985 ( 9.618 7.433 -2.538) 12.418 4.273 ( -11.296 -3.040 0.470) 11.708 4.621 ( 0.324 2.777 7.074) 7.607 5.265 ( -0.762 3.935 6.714) 7.819 5.456 ( 8.855 -7.009 3.077) 11.705 5.954 ( 7.671 -1.066 -0.716) 7.777 6.630 ( -0.653 -6.112 16.210) 17.336 7.045 ( -11.984 -12.733 13.390) 22.023 7.600 ( -1.805 1.315 -6.189) 6.580 8.119 ( -10.428 -15.249 9.969) 20.992 9.111 ( -6.406 4.274 13.707) 15.722 9.318 ( -16.769 -6.608 16.836) 24.664 9.765 ( -2.977 -17.262 6.729) 18.765 10.254 ( 6.762 11.228 5.260) 14.123 10.887 ( 0.785 26.141 -5.958) 26.823 11.772 ( 3.345 5.476 -8.553) 10.692 11.969 ( 16.867 23.260 -16.067) 32.919 12.374 ( -13.805 0.579 -5.652) 14.928 13.258 ( -4.083 2.577 8.850) 10.081 13.627 ( 3.539 2.101 5.955) 7.239 14.197 ( -2.347 1.428 -0.949) 2.907 14.872 ( 1.570 -12.975 -16.169) 20.791 17.996 ( 10.149 -9.040 8.542) 16.053 18.612 ( 11.101 -12.513 -9.274) 19.127 19.211 ( -4.589 6.676 -13.810) 16.011 19.876 ( -4.277 1.087 -6.381) 7.758 20.866 ( 25.185 4.636 6.599) 26.444 22.108 ( -28.159 -14.340 4.249) 31.885 24.065 ( 6.540 4.627 -4.288) 9.087 24.325 ( -12.063 4.959 -4.165) 13.692 ======================= Grid point 445 (222/361) ======================= q-point: (-0.20 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.072 ( -3.541 2.200 14.568) 15.152 2.265 ( 1.534 7.191 18.671) 20.067 2.903 ( -1.050 -3.250 -2.172) 4.048 3.189 ( 4.722 -3.550 -3.625) 6.931 3.549 ( 0.747 -1.640 4.696) 5.030 3.648 ( -4.030 -9.724 -12.285) 16.178 4.015 ( 8.547 7.166 -2.587) 11.450 4.097 ( -8.311 1.446 -5.760) 10.215 4.753 ( 3.105 2.188 12.481) 13.046 5.264 ( -2.911 5.426 5.176) 8.044 5.616 ( 1.795 -4.924 1.212) 5.380 6.059 ( 3.194 -2.734 1.369) 4.421 6.855 ( -0.712 -7.391 8.093) 10.983 7.198 ( -6.288 -7.357 10.246) 14.094 7.555 ( -1.445 -3.135 12.074) 12.558 8.269 ( -10.552 -17.907 13.125) 24.582 9.138 ( -10.382 2.064 15.302) 18.607 9.363 ( -11.080 -8.544 13.619) 19.525 9.980 ( -0.890 -14.683 4.847) 15.488 10.291 ( 7.714 17.793 6.292) 20.388 10.637 ( -0.697 20.839 -1.147) 20.882 11.614 ( 5.417 14.401 -8.273) 17.469 11.829 ( 15.037 13.949 -16.049) 26.043 12.108 ( -13.069 -3.586 -7.761) 15.617 13.299 ( -2.545 3.740 9.841) 10.831 13.726 ( 5.954 6.128 4.597) 9.703 14.127 ( -4.919 0.103 -0.785) 4.983 14.791 ( -0.299 -10.685 -15.600) 18.911 18.162 ( 11.938 -1.718 -8.810) 14.936 18.703 ( -10.779 -7.682 -10.432) 16.853 19.085 ( 10.355 -6.164 -2.772) 12.366 19.725 ( -0.744 3.840 -7.247) 8.235 21.256 ( 18.904 4.448 10.301) 21.983 21.854 ( -25.488 -9.414 1.197) 27.197 24.055 ( -9.729 6.721 -2.847) 12.163 24.086 ( 6.323 1.713 -3.704) 7.526 ======================= Grid point 446 (223/361) ======================= q-point: (-0.10 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.233 ( 1.809 -1.274 13.680) 13.858 2.477 ( 5.824 4.236 14.143) 15.871 2.948 ( 4.784 -2.496 1.084) 5.504 3.220 ( 3.416 -7.737 -9.556) 12.761 3.484 ( -4.722 -3.536 -9.516) 11.196 3.616 ( -5.916 -3.593 2.194) 7.261 3.915 ( 3.524 9.569 -7.082) 12.415 4.020 ( 4.573 5.117 -3.470) 7.691 4.943 ( 3.777 0.121 10.984) 11.616 5.233 ( -3.374 4.859 5.669) 8.194 5.628 ( -5.988 -2.465 0.354) 6.486 6.111 ( -1.711 -2.623 0.894) 3.257 6.871 ( -7.667 -1.846 -1.818) 8.093 7.226 ( -4.070 -3.581 4.681) 7.162 7.948 ( 2.474 -8.921 31.580) 32.909 8.421 ( -12.933 -17.377 12.046) 24.785 9.169 ( -9.663 -1.838 14.003) 17.112 9.531 ( -0.855 -11.086 14.299) 18.114 9.997 ( -10.389 4.404 -1.549) 11.390 10.301 ( 1.291 15.301 6.537) 16.689 10.466 ( 5.125 10.768 -2.601) 12.205 11.607 ( 16.730 7.689 -1.306) 18.459 11.675 ( -2.089 6.866 -9.668) 12.040 11.948 ( 7.340 -2.175 -13.046) 15.127 13.341 ( -2.695 4.752 8.927) 10.466 13.785 ( 5.196 7.422 1.581) 9.197 14.044 ( -6.054 -1.195 -0.232) 6.176 14.693 ( -0.725 -7.085 -12.061) 14.007 18.254 ( 13.457 -0.539 -7.100) 15.225 18.346 ( -14.491 -0.893 -17.640) 22.846 19.223 ( -3.517 -5.659 -0.422) 6.676 19.672 ( 9.282 1.626 -6.144) 11.249 21.376 ( -22.636 -6.677 4.446) 24.016 21.797 ( 15.868 5.561 6.869) 18.163 23.856 ( -6.150 4.616 -1.469) 7.829 24.146 ( 7.499 -0.227 -2.396) 7.876 ======================= Grid point 450 (224/361) ======================= q-point: ( 0.30 -0.70 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.247 ( -1.179 -0.000 -1.789) 2.143 2.383 ( -5.096 -0.000 5.533) 7.522 3.015 ( -0.958 -0.000 -7.066) 7.131 3.258 ( -1.601 -0.000 3.238) 3.612 3.506 ( -15.664 -0.000 6.686) 17.032 3.665 ( 4.063 0.000 0.059) 4.063 4.038 ( -5.263 -0.000 -5.337) 7.495 4.456 ( 6.432 0.000 5.902) 8.730 4.477 ( -11.133 -0.000 1.874) 11.290 4.847 ( 6.025 0.000 8.757) 10.629 4.936 ( -10.078 -0.000 0.387) 10.085 5.892 ( 5.488 0.000 -8.176) 9.847 6.294 ( -8.636 -0.000 10.086) 13.278 7.124 ( -11.521 -0.000 -0.329) 11.526 7.769 ( -2.725 -0.000 -12.349) 12.646 8.454 ( -26.113 -0.000 4.407) 26.482 8.819 ( -4.187 -0.000 17.481) 17.976 9.280 ( -6.964 -0.000 0.162) 6.966 9.596 ( -18.359 -0.000 17.723) 25.518 10.083 ( 4.218 0.000 -4.873) 6.445 11.737 ( 10.882 0.000 4.223) 11.673 12.033 ( 12.923 0.000 -2.945) 13.255 12.295 ( 20.767 0.000 -19.849) 28.727 12.839 ( -2.616 -0.000 -4.014) 4.792 13.280 ( -4.222 -0.000 -2.864) 5.101 13.493 ( -16.925 -0.000 9.920) 19.618 14.329 ( 14.437 0.000 8.291) 16.648 14.387 ( 8.287 0.000 -12.205) 14.752 16.661 ( -8.739 -0.000 16.090) 18.310 18.708 ( 5.882 0.000 -13.735) 14.941 19.645 ( 9.443 0.000 9.643) 13.497 19.816 ( 15.632 0.000 -1.121) 15.672 20.381 ( -3.153 -0.000 -14.074) 14.423 22.481 ( -19.449 -0.000 6.297) 20.443 24.177 ( 8.083 0.000 2.173) 8.370 24.549 ( -0.094 -0.000 1.342) 1.345 ======================= Grid point 452 (225/361) ======================= q-point: (-0.60 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.230 ( -2.582 3.519 4.707) 6.419 2.412 ( -2.092 7.142 11.302) 13.532 2.963 ( -1.377 -4.481 -2.309) 5.226 3.285 ( -6.630 0.854 -0.917) 6.747 3.309 ( -12.529 -4.968 5.197) 14.445 3.602 ( -5.556 -3.456 -6.663) 9.338 3.993 ( 3.643 2.349 -2.049) 4.795 4.400 ( -5.776 2.432 7.851) 10.046 4.594 ( 1.568 -1.523 3.266) 3.930 4.852 ( -3.376 -4.397 2.174) 5.954 5.062 ( 4.809 0.521 11.748) 12.705 5.877 ( 7.887 1.489 -8.702) 11.838 6.316 ( -8.186 0.036 13.563) 15.842 6.943 ( -17.500 -4.971 2.276) 18.334 7.657 ( 2.865 -1.584 -7.805) 8.464 8.143 ( -20.136 -0.382 0.455) 20.144 8.966 ( -5.800 -0.353 17.297) 18.247 9.236 ( -5.385 -5.555 2.489) 8.127 9.522 ( -20.678 0.400 17.151) 26.868 10.118 ( 6.121 0.738 -0.869) 6.227 11.856 ( 8.740 8.912 -3.306) 12.912 12.041 ( 3.977 3.400 -9.289) 10.661 12.367 ( 20.882 14.562 -10.475) 27.529 12.753 ( -1.355 -6.159 -7.059) 9.466 13.239 ( -3.415 -0.970 2.520) 4.354 13.407 ( -12.310 -3.479 9.532) 15.953 14.340 ( 7.335 2.368 -10.573) 13.084 14.571 ( 6.454 -7.450 -0.850) 9.894 16.873 ( -0.941 -2.621 27.403) 27.545 18.615 ( 7.422 -1.707 -18.562) 20.064 19.813 ( 4.418 4.651 2.583) 6.915 20.033 ( 12.122 -1.046 -9.355) 15.348 20.199 ( 6.022 -0.523 -5.226) 7.991 22.277 ( -21.848 -4.407 6.491) 23.214 24.252 ( 3.620 5.608 0.538) 6.697 24.556 ( -2.668 -3.799 -0.112) 4.643 ======================= Grid point 453 (226/361) ======================= q-point: (-0.50 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.200 ( -7.296 6.117 8.902) 13.035 2.425 ( -2.936 15.575 12.688) 20.303 2.962 ( -5.704 -6.108 0.365) 8.365 3.106 ( -10.941 -1.476 4.373) 11.875 3.353 ( 1.127 -4.282 -2.064) 4.885 3.500 ( -3.130 -9.813 -7.269) 12.607 4.020 ( 7.860 0.972 -4.581) 9.149 4.379 ( -7.557 6.994 9.655) 14.115 4.615 ( -2.251 -0.585 2.638) 3.517 4.998 ( 3.894 -11.127 6.363) 13.396 5.251 ( 4.116 3.086 11.209) 12.333 5.886 ( 8.347 1.054 -6.605) 10.696 6.392 ( -6.595 -1.655 15.091) 16.553 6.803 ( -17.934 -9.038 7.687) 21.504 7.659 ( 4.467 -1.409 -5.007) 6.856 7.924 ( -13.192 -4.603 0.158) 13.973 9.075 ( -8.253 -0.901 16.378) 18.362 9.270 ( -5.229 -4.138 6.955) 9.635 9.439 ( -19.184 -3.103 15.991) 25.167 10.223 ( 7.791 1.231 2.989) 8.435 11.717 ( 5.604 22.198 -11.794) 25.753 11.924 ( 3.439 3.219 -12.285) 13.157 12.361 ( 5.636 10.690 -1.209) 12.145 12.710 ( 6.432 3.061 -12.955) 14.784 13.233 ( -7.039 0.083 8.811) 11.278 13.463 ( -0.978 -5.666 7.940) 9.804 14.288 ( 3.537 1.419 -7.828) 8.706 14.653 ( 1.031 -9.853 -6.604) 11.906 17.315 ( 5.431 -7.054 30.291) 31.572 18.502 ( 8.236 -3.633 -21.736) 23.526 19.675 ( -4.167 9.133 -12.530) 16.056 19.955 ( -2.669 -4.086 -5.950) 7.696 20.506 ( 27.236 0.580 1.662) 27.293 22.098 ( -22.267 -6.490 7.535) 24.387 24.217 ( 1.958 7.066 -2.021) 7.606 24.514 ( -6.642 -3.638 -2.361) 7.932 ======================= Grid point 454 (227/361) ======================= q-point: (-0.40 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( -8.747 5.822 9.874) 14.418 2.386 ( -3.237 15.015 13.703) 20.584 2.897 ( -7.352 -4.132 -1.615) 8.587 3.113 ( -0.013 -1.030 3.927) 4.060 3.381 ( -0.377 -5.925 0.185) 5.940 3.500 ( -0.221 -10.197 -6.392) 12.037 4.080 ( 10.807 -0.710 -7.871) 13.389 4.266 ( -9.115 4.974 1.512) 10.493 4.677 ( 0.085 3.432 12.005) 12.486 5.227 ( 2.370 -9.498 5.139) 11.056 5.402 ( 3.691 2.698 9.062) 10.150 5.937 ( 6.498 -0.858 -2.655) 7.072 6.530 ( -3.859 -4.843 15.013) 16.240 6.811 ( -11.627 -11.473 13.672) 21.301 7.622 ( -1.759 1.296 -4.974) 5.433 7.877 ( -6.233 -10.731 3.097) 12.790 9.151 ( -9.622 -1.891 15.416) 18.271 9.265 ( -18.695 2.136 18.842) 26.629 9.503 ( -1.631 -11.081 8.621) 14.134 10.384 ( 9.019 3.782 6.681) 11.845 11.383 ( 2.368 26.368 -13.007) 29.497 11.806 ( 5.175 1.065 -13.803) 14.780 12.290 ( -6.033 3.669 -0.735) 7.100 12.519 ( 7.193 18.542 -16.704) 25.972 13.262 ( -5.926 -0.916 10.326) 11.941 13.645 ( 6.622 -0.835 8.536) 10.835 14.224 ( -1.144 1.093 -3.712) 4.035 14.635 ( -1.588 -11.845 -11.321) 16.462 17.831 ( 8.716 -8.249 22.019) 25.077 18.422 ( 8.688 -7.842 -17.302) 20.889 19.334 ( -6.987 6.238 -16.429) 18.911 19.869 ( -3.290 -1.413 -5.394) 6.474 20.935 ( 28.909 2.644 4.081) 29.315 21.922 ( -22.722 -6.232 6.278) 24.383 24.155 ( 2.488 5.067 -3.445) 6.613 24.368 ( -9.953 -0.014 -4.347) 10.861 ======================= Grid point 455 (228/361) ======================= q-point: (-0.30 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.131 ( -1.925 4.240 10.396) 11.392 2.418 ( -0.906 9.419 14.749) 17.523 2.846 ( -0.358 -2.991 -1.275) 3.271 3.140 ( 0.389 -1.485 -2.601) 3.021 3.436 ( -3.941 -11.926 -4.206) 13.246 3.511 ( -0.575 -3.703 0.948) 3.866 4.109 ( -4.340 0.548 -2.877) 5.236 4.141 ( 12.086 5.427 -8.879) 15.949 4.816 ( 0.780 4.328 14.587) 15.236 5.328 ( -1.608 -0.448 3.805) 4.155 5.530 ( 0.937 -2.432 5.392) 5.988 6.010 ( 2.652 -2.591 0.565) 3.750 6.716 ( -2.125 -7.651 11.298) 13.810 6.999 ( -4.216 -12.563 13.700) 19.060 7.531 ( -4.164 -0.141 4.048) 5.809 7.975 ( -2.989 -13.206 4.398) 14.236 9.199 ( -18.891 2.343 19.180) 27.023 9.228 ( -11.248 -4.716 17.258) 21.133 9.733 ( 3.196 -11.513 7.365) 14.036 10.547 ( 7.968 9.695 8.262) 15.025 11.042 ( 1.084 22.300 -9.073) 24.099 11.709 ( 6.570 1.403 -14.110) 15.628 12.070 ( -16.537 0.317 -4.700) 17.195 12.252 ( 13.588 24.720 -16.059) 32.459 13.324 ( -4.332 -0.660 10.363) 11.251 13.839 ( 8.331 5.547 7.720) 12.640 14.138 ( -5.331 0.977 -1.264) 5.565 14.569 ( -1.613 -12.912 -13.139) 18.492 18.132 ( 11.174 -1.295 -2.764) 11.583 18.514 ( -0.063 -11.748 -1.045) 11.795 19.027 ( -1.995 -0.913 -12.520) 12.710 19.765 ( -0.666 0.825 -6.691) 6.774 21.352 ( 19.517 5.599 8.477) 22.003 21.719 ( -16.336 -5.194 1.887) 17.245 24.119 ( 1.576 1.805 -3.774) 4.471 24.151 ( -8.091 3.622 -3.986) 9.719 ======================= Grid point 456 (229/361) ======================= q-point: (-0.20 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.240 ( 1.979 2.239 10.602) 11.015 2.550 ( 5.554 3.646 10.983) 12.836 2.918 ( 5.401 -0.588 3.456) 6.439 3.108 ( 0.397 -4.351 -6.829) 8.107 3.377 ( -2.053 -8.102 -10.220) 13.202 3.531 ( -10.807 -5.235 5.529) 13.220 4.045 ( 3.493 3.967 -1.660) 5.540 4.138 ( 12.235 7.530 -12.013) 18.727 4.967 ( 1.128 2.265 12.522) 12.775 5.315 ( -3.583 2.958 2.974) 5.517 5.575 ( -5.776 -2.343 3.706) 7.252 6.058 ( -1.500 -2.988 1.156) 3.537 6.817 ( -6.019 -4.204 1.815) 7.563 7.115 ( -4.792 -8.651 4.845) 11.013 7.776 ( 5.944 -8.732 23.715) 25.961 8.110 ( -3.947 -14.994 4.062) 16.029 9.161 ( -16.974 -0.325 18.920) 25.420 9.363 ( -6.987 -6.821 18.463) 20.886 9.923 ( 0.124 -7.303 3.500) 8.099 10.594 ( -0.245 14.072 5.411) 15.078 10.773 ( 0.546 18.792 -5.358) 19.549 11.643 ( 4.452 1.200 -11.112) 12.030 11.780 ( -6.888 1.190 -7.026) 9.911 12.104 ( 17.890 17.840 -11.350) 27.697 13.392 ( -3.587 0.579 9.595) 10.260 13.926 ( 0.001 6.479 3.243) 7.245 14.045 ( -2.156 2.345 -0.341) 3.204 14.529 ( 0.934 -10.568 -9.565) 14.284 18.246 ( 12.377 -0.313 -5.796) 13.670 18.331 ( -12.637 -0.711 -15.415) 19.946 19.081 ( 1.436 -9.352 2.461) 9.776 19.700 ( 5.820 1.214 -7.238) 9.367 21.303 ( -23.657 -1.092 2.739) 23.840 21.889 ( 23.461 4.530 6.959) 24.887 23.937 ( -7.237 3.745 -3.348) 8.810 24.142 ( 4.721 -0.235 -2.097) 5.171 ======================= Grid point 457 (230/361) ======================= q-point: (-0.10 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.372 ( -0.483 -1.968 8.097) 8.347 2.755 ( 11.529 3.603 6.652) 13.790 3.054 ( 1.113 -2.343 4.650) 5.325 3.092 ( 6.219 -3.662 -7.312) 10.274 3.306 ( -1.278 -2.448 -6.583) 7.139 3.447 ( -10.632 -6.318 3.100) 12.750 4.054 ( 9.545 11.095 -13.157) 19.681 4.087 ( 6.691 3.706 1.025) 7.717 5.096 ( 0.010 0.289 8.027) 8.033 5.247 ( -5.443 1.347 -1.084) 5.711 5.504 ( -12.185 0.383 5.295) 13.291 6.046 ( -3.953 -2.368 -0.465) 4.632 6.685 ( -11.938 -1.677 -2.252) 12.264 7.222 ( -0.534 -4.628 6.336) 7.864 8.125 ( -2.645 -12.998 2.318) 13.466 8.357 ( 1.881 -11.793 24.957) 27.667 9.184 ( -13.267 -2.382 17.858) 22.374 9.606 ( -2.883 -12.038 17.134) 21.137 9.902 ( -7.761 7.589 0.364) 10.861 10.308 ( -11.980 15.181 -4.721) 19.906 10.758 ( 12.433 6.624 1.760) 14.197 11.379 ( -11.358 0.362 -10.598) 15.538 11.854 ( 19.054 -1.085 -8.580) 20.925 12.185 ( 21.236 10.282 -0.063) 23.595 13.434 ( -3.612 3.161 8.258) 9.552 13.841 ( -7.671 0.075 0.432) 7.684 14.001 ( 0.598 5.471 -1.704) 5.761 14.548 ( 4.063 -3.562 -4.872) 7.275 17.883 ( -16.491 0.103 -19.346) 25.421 18.422 ( 14.772 -0.296 -0.317) 14.778 19.124 ( -3.982 -1.064 0.023) 4.122 19.725 ( 5.987 0.021 -4.278) 7.359 21.002 ( -19.352 -4.753 -2.928) 20.141 22.266 ( 19.760 8.045 11.590) 24.280 23.796 ( -2.464 2.242 -3.485) 4.821 24.212 ( 5.226 -2.029 -0.025) 5.606 ======================= Grid point 462 (231/361) ======================= q-point: ( 0.40 -0.60 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.265 ( -5.639 -0.000 6.244) 8.414 2.607 ( 2.766 0.000 11.462) 11.791 2.903 ( -5.875 -0.000 3.245) 6.712 3.041 ( -18.419 -0.000 3.612) 18.770 3.316 ( 3.801 0.000 -0.457) 3.828 3.418 ( -2.404 -0.000 -8.329) 8.669 4.008 ( 3.502 0.000 -5.584) 6.591 4.490 ( -1.744 -0.000 4.926) 5.226 4.615 ( -1.341 -0.000 6.633) 6.767 4.858 ( -0.265 -0.000 8.262) 8.266 5.283 ( 4.118 0.000 12.047) 12.732 5.896 ( 7.831 0.000 -7.588) 10.904 6.375 ( -7.742 -0.000 14.991) 16.872 6.717 ( -17.601 -0.000 7.833) 19.265 7.645 ( 6.380 0.000 -4.861) 8.020 7.883 ( -14.407 -0.000 -1.730) 14.511 9.065 ( -11.381 -0.000 18.998) 22.146 9.211 ( -1.006 -0.000 5.413) 5.505 9.432 ( -20.596 -0.000 16.828) 26.597 10.233 ( 8.073 0.000 2.707) 8.515 11.939 ( 3.707 0.000 -14.590) 15.054 11.950 ( 8.216 0.000 -10.956) 13.694 12.503 ( -12.479 -0.000 -3.955) 13.091 12.683 ( 20.363 0.000 -8.597) 22.103 13.315 ( 6.575 0.000 4.794) 8.137 13.337 ( -12.170 -0.000 12.159) 17.203 14.298 ( 7.305 0.000 -13.863) 15.670 14.560 ( -2.925 -0.000 -0.135) 2.929 17.249 ( 4.319 0.000 30.885) 31.186 18.468 ( 7.930 0.000 -22.011) 23.396 19.793 ( -8.031 -0.000 -17.401) 19.165 19.886 ( 0.142 0.000 -1.122) 1.130 20.508 ( 28.966 0.000 0.253) 28.967 22.042 ( -20.964 -0.000 8.429) 22.595 24.301 ( -0.511 -0.000 -0.535) 0.740 24.460 ( -4.858 -0.000 -3.161) 5.796 ======================= Grid point 464 (232/361) ======================= q-point: (-0.50 0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.223 ( -6.544 3.025 5.580) 9.116 2.671 ( -1.553 15.137 8.618) 17.488 2.833 ( -7.526 -1.738 0.901) 7.777 2.986 ( -5.242 -12.904 5.249) 14.884 3.320 ( -1.713 0.605 -2.270) 2.907 3.387 ( 2.039 -3.360 -0.361) 3.947 4.019 ( 8.157 -3.016 -6.922) 11.115 4.382 ( -4.059 4.542 -6.635) 9.007 4.751 ( 0.553 4.250 15.550) 16.130 5.038 ( 2.488 -8.572 8.780) 12.520 5.457 ( 1.639 2.120 11.020) 11.341 5.922 ( 5.708 -0.662 -4.457) 7.272 6.463 ( -6.279 -2.109 14.469) 15.913 6.661 ( -10.664 -4.306 13.507) 17.740 7.655 ( -3.004 2.554 -3.606) 5.343 7.729 ( -1.587 -5.650 -1.622) 6.089 9.107 ( -18.089 -1.573 22.009) 28.532 9.313 ( -4.526 1.364 11.239) 12.193 9.369 ( -9.527 -3.289 12.828) 16.314 10.421 ( 10.615 0.750 6.443) 12.440 11.768 ( 3.032 12.748 -19.500) 23.494 11.822 ( 4.750 0.682 -15.550) 16.273 12.301 ( -11.349 -0.202 0.213) 11.352 12.759 ( 9.376 4.810 -11.829) 15.842 13.299 ( -7.825 5.522 12.560) 15.794 13.582 ( 12.581 -5.249 7.486) 15.553 14.228 ( 3.536 -0.445 -10.405) 10.998 14.482 ( -7.911 -4.166 -2.795) 9.367 17.720 ( 7.327 -3.360 28.220) 29.348 18.327 ( 8.470 -2.536 -20.679) 22.490 19.420 ( -10.426 2.687 -18.359) 21.283 19.842 ( -1.906 -1.084 -4.279) 4.808 20.963 ( 32.060 0.614 2.004) 32.129 21.859 ( -19.744 -1.324 7.321) 21.099 24.242 ( -1.346 3.897 -2.604) 4.876 24.340 ( -7.330 -2.369 -4.474) 8.908 ======================= Grid point 465 (233/361) ======================= q-point: (-0.40 0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.216 ( 1.386 4.339 6.244) 7.729 2.605 ( -4.187 10.427 8.156) 13.885 2.798 ( 1.106 -1.624 0.787) 2.116 3.101 ( -0.060 -6.013 1.181) 6.128 3.244 ( -6.923 -5.543 -2.715) 9.275 3.438 ( -2.720 -3.970 3.086) 5.717 4.108 ( 8.487 -0.256 -4.583) 9.649 4.217 ( 4.232 2.647 -10.653) 11.764 4.901 ( -0.220 4.757 14.771) 15.520 5.229 ( 0.772 -7.828 4.687) 9.156 5.558 ( -1.273 3.482 9.328) 10.038 5.964 ( 2.173 -2.428 -0.549) 3.304 6.590 ( -4.082 -5.523 12.509) 14.270 6.799 ( -3.072 -8.157 13.205) 15.822 7.534 ( -6.855 0.229 2.891) 7.443 7.800 ( 4.674 -5.962 -2.205) 7.890 9.125 ( -24.131 -3.758 26.737) 36.212 9.277 ( -12.184 3.195 13.787) 18.674 9.569 ( 5.450 -6.307 8.905) 12.198 10.661 ( 10.818 3.455 8.989) 14.484 11.389 ( -2.828 13.649 -18.750) 23.363 11.724 ( 7.877 0.487 -15.100) 17.037 12.119 ( -11.638 5.032 -1.295) 12.745 12.613 ( 7.045 12.218 -15.828) 21.200 13.319 ( -6.694 1.701 12.811) 14.555 13.901 ( 13.430 0.455 8.120) 15.700 14.151 ( -2.312 0.174 -4.089) 4.701 14.357 ( -7.464 -8.726 -7.685) 13.817 18.120 ( 9.441 0.127 7.512) 12.066 18.317 ( 6.325 -8.780 -2.347) 11.073 19.027 ( -9.631 0.371 -17.390) 19.882 19.767 ( -0.068 -0.258 -5.944) 5.950 21.441 ( 26.953 3.631 5.645) 27.776 21.659 ( -15.672 -1.590 2.314) 15.921 24.148 ( -3.778 1.257 -4.425) 5.953 24.192 ( -4.969 1.104 -3.382) 6.112 ======================= Grid point 466 (234/361) ======================= q-point: (-0.30 0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.317 ( 5.773 5.903 6.420) 10.459 2.609 ( 2.550 2.929 7.420) 8.375 2.918 ( 8.885 -0.176 4.263) 9.856 3.070 ( -4.040 0.446 -2.669) 4.863 3.204 ( -3.518 -9.842 -4.292) 11.299 3.432 ( -10.719 -5.584 3.784) 12.665 4.090 ( 5.092 1.623 -6.363) 8.310 4.249 ( 14.783 3.787 -9.886) 18.183 5.013 ( -1.932 2.592 11.769) 12.205 5.300 ( -3.109 -4.293 0.574) 5.331 5.588 ( -5.213 3.613 8.427) 10.547 6.002 ( -1.620 -3.073 1.581) 3.817 6.724 ( -3.855 -5.485 6.717) 9.491 6.930 ( -4.822 -10.284 3.360) 11.845 7.653 ( 4.824 -4.673 18.190) 19.390 7.902 ( 4.397 -7.637 -2.484) 9.156 9.128 ( -24.831 -3.045 26.321) 36.313 9.294 ( -9.010 -1.066 16.493) 18.824 9.803 ( 5.085 -5.259 7.095) 10.191 10.802 ( 1.397 8.844 4.390) 9.972 11.036 ( -4.499 8.206 -13.285) 16.250 11.680 ( 10.174 1.847 -11.619) 15.554 11.860 ( -8.073 9.690 -3.216) 13.016 12.422 ( 10.971 14.067 -14.237) 22.824 13.378 ( -5.853 -0.934 11.812) 13.215 13.991 ( -9.047 1.768 0.775) 9.251 14.128 ( 3.368 4.043 0.145) 5.264 14.328 ( 5.265 -10.072 -3.789) 11.980 18.245 ( 11.712 0.240 -4.695) 12.620 18.319 ( -10.371 -0.658 -11.923) 15.816 18.908 ( 2.296 -8.718 3.928) 9.834 19.714 ( 4.441 0.397 -7.211) 8.479 21.323 ( -21.454 2.495 -0.921) 21.618 21.961 ( 28.849 3.132 6.610) 29.762 23.987 ( -7.129 1.726 -4.074) 8.390 24.139 ( 1.023 -0.062 -1.781) 2.055 ======================= Grid point 467 (235/361) ======================= q-point: (-0.20 0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.381 ( -2.007 3.181 7.002) 7.949 2.809 ( 13.421 2.160 6.176) 14.931 2.998 ( 0.010 -2.443 -3.362) 4.156 3.086 ( 4.076 1.952 2.944) 5.394 3.230 ( 5.907 -7.459 -2.826) 9.926 3.328 ( -14.484 -5.132 2.878) 15.634 4.102 ( 8.092 -0.186 -7.395) 10.964 4.259 ( 10.659 9.219 -8.559) 16.488 5.087 ( -3.833 -1.517 7.325) 8.406 5.241 ( -7.113 -1.936 -2.221) 7.699 5.549 ( -9.098 4.506 8.326) 13.130 6.002 ( -4.102 -2.436 0.738) 4.828 6.651 ( -11.413 -2.008 -2.432) 11.841 7.072 ( 0.721 -11.253 7.385) 13.479 7.948 ( 4.227 -5.964 -4.092) 8.377 8.139 ( 9.484 -11.303 20.412) 25.186 9.132 ( -18.803 -3.140 21.779) 28.944 9.433 ( -9.224 -6.794 20.822) 23.765 9.956 ( 2.129 0.617 4.609) 5.114 10.622 ( -13.356 14.491 -2.925) 19.922 10.777 ( -2.589 -1.486 -11.328) 11.715 11.536 ( -6.064 15.136 -0.962) 16.334 11.838 ( 18.040 -0.590 -10.472) 20.867 12.384 ( 17.110 10.386 -4.954) 20.619 13.445 ( -6.156 -1.574 10.968) 12.676 13.835 ( -9.942 0.421 -0.195) 9.953 14.077 ( -1.691 0.334 -4.376) 4.703 14.506 ( 10.953 -0.053 1.760) 11.094 17.888 ( -16.571 0.369 -19.892) 25.893 18.416 ( 13.757 -0.370 0.656) 13.778 19.083 ( 1.151 -3.242 5.564) 6.542 19.722 ( 7.550 -0.259 -5.831) 9.543 20.959 ( -20.044 0.105 -5.664) 20.829 22.404 ( 24.605 6.599 9.543) 27.204 23.837 ( -4.249 2.135 -3.908) 6.154 24.169 ( 2.334 -2.636 0.621) 3.575 ======================= Grid point 468 (236/361) ======================= q-point: (-0.10 -0.60 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.380 ( -8.555 -0.963 6.804) 10.973 2.956 ( 3.628 -1.529 -0.286) 3.947 3.017 ( -6.743 0.064 -2.909) 7.345 3.167 ( 9.988 -3.055 4.235) 11.270 3.169 ( -0.215 2.001 -3.259) 3.830 3.482 ( 10.728 -3.499 6.875) 13.214 4.097 ( 10.923 6.201 -13.616) 18.525 4.225 ( 1.742 3.883 1.499) 4.512 5.028 ( -12.483 -3.373 -4.735) 13.770 5.149 ( -5.271 -0.245 3.109) 6.125 5.453 ( -10.163 5.616 6.407) 13.262 5.952 ( -4.074 -2.006 -2.012) 4.966 6.462 ( -13.503 -2.215 -0.731) 13.703 7.268 ( 2.375 -5.982 6.413) 9.086 7.974 ( 2.300 -7.140 -6.781) 10.112 8.597 ( 4.650 -9.399 17.409) 20.324 9.170 ( -16.154 -3.838 18.965) 25.207 9.620 ( -8.004 -9.250 14.902) 19.279 9.927 ( -7.378 12.232 4.519) 14.983 10.204 ( -11.710 14.191 -5.594) 19.230 10.745 ( 2.547 -17.870 -8.649) 20.016 11.344 ( -0.019 16.732 2.776) 16.961 11.969 ( 18.645 -2.879 -14.485) 23.785 12.588 ( 19.250 5.336 4.121) 20.396 13.494 ( -7.892 -1.192 11.796) 14.243 13.713 ( -5.812 0.603 -0.261) 5.849 13.988 ( -2.419 1.679 -3.571) 4.629 14.647 ( 10.623 5.795 -0.473) 12.110 17.401 ( -17.921 -0.563 -17.874) 25.317 18.659 ( 13.848 -0.652 5.596) 14.950 19.111 ( 0.569 4.693 -0.830) 4.800 19.749 ( 1.803 1.544 -1.817) 2.989 20.665 ( -10.686 -6.259 -9.018) 15.319 22.760 ( 15.984 10.496 12.540) 22.867 23.737 ( 0.615 0.041 -5.966) 5.997 24.265 ( 3.187 -3.751 3.606) 6.102 ======================= Grid point 474 (237/361) ======================= q-point: (-0.50 0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.261 ( 2.845 0.000 4.618) 5.424 2.713 ( -2.672 -0.000 -2.126) 3.414 2.834 ( -4.738 -0.000 4.659) 6.645 2.956 ( 3.587 0.000 7.341) 8.171 3.226 ( -7.539 0.000 -2.148) 7.840 3.392 ( -4.440 -0.000 3.973) 5.958 4.105 ( 14.781 -0.000 -4.723) 15.517 4.240 ( -0.697 -0.000 -11.841) 11.861 4.963 ( -0.416 0.000 13.548) 13.554 5.132 ( 1.593 -0.000 7.021) 7.200 5.599 ( -1.861 0.000 10.580) 10.742 5.936 ( 2.156 -0.000 -1.487) 2.619 6.535 ( -4.775 -0.000 12.661) 13.532 6.723 ( -2.907 -0.000 12.819) 13.144 7.536 ( -8.353 -0.000 3.309) 8.984 7.747 ( 8.349 -0.000 -5.055) 9.761 9.089 ( -25.452 -0.000 28.477) 38.194 9.310 ( -13.699 -0.000 13.418) 19.176 9.508 ( 6.771 -0.000 9.455) 11.629 10.691 ( 12.210 -0.000 9.027) 15.184 11.511 ( -7.311 -0.000 -22.995) 24.129 11.729 ( 8.015 -0.000 -15.400) 17.361 12.191 ( -5.221 -0.000 -0.221) 5.225 12.701 ( 1.400 0.000 -12.496) 12.574 13.365 ( -7.843 -0.000 12.550) 14.799 13.881 ( 18.676 0.000 4.516) 19.214 14.149 ( 1.347 -0.000 -6.521) 6.659 14.282 ( -13.575 -0.000 -1.339) 13.641 18.130 ( 6.835 -0.000 22.587) 23.598 18.225 ( 9.991 -0.000 -14.665) 17.745 19.031 ( -11.989 -0.000 -18.675) 22.192 19.764 ( 0.321 -0.000 -5.694) 5.703 21.474 ( 33.086 -0.000 3.979) 33.324 21.648 ( -18.715 0.000 2.911) 18.940 24.161 ( -7.193 -0.000 -5.137) 8.840 24.200 ( -2.396 -0.000 -2.559) 3.506 ======================= Grid point 476 (238/361) ======================= q-point: (-0.40 0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.423 ( 12.512 4.199 4.348) 13.896 2.662 ( -0.568 2.716 1.356) 3.088 2.882 ( 3.356 -3.559 4.644) 6.745 3.054 ( -4.387 -3.387 -2.367) 6.027 3.125 ( -0.031 2.442 3.940) 4.635 3.338 ( -12.104 -3.847 3.959) 13.303 4.115 ( 5.457 0.938 -11.804) 13.038 4.276 ( 14.961 -0.072 -5.067) 15.796 5.062 ( -3.179 2.397 9.022) 9.861 5.211 ( -2.124 -3.984 2.161) 5.005 5.660 ( -4.939 2.909 9.615) 11.194 5.952 ( -1.659 -1.980 1.761) 3.126 6.642 ( -1.875 -2.662 10.003) 10.520 6.788 ( -5.179 -4.288 1.568) 6.904 7.599 ( 2.767 -1.373 15.102) 15.414 7.818 ( 9.242 -1.982 -5.797) 11.088 9.080 ( -27.352 -1.563 30.726) 41.166 9.292 ( -11.665 0.180 14.665) 18.739 9.738 ( 7.557 -1.802 9.020) 11.905 10.918 ( 4.203 3.634 5.887) 8.095 11.096 ( -10.837 0.286 -19.754) 22.533 11.696 ( 13.232 0.293 -13.009) 18.558 12.078 ( -4.330 9.847 -0.682) 10.778 12.557 ( 4.183 1.203 -13.912) 14.577 13.396 ( -7.005 2.266 12.156) 14.212 14.010 ( -4.378 0.154 -3.474) 5.591 14.084 ( -9.023 -5.280 -5.032) 11.603 14.264 ( 14.021 1.104 7.959) 16.160 18.253 ( 11.521 0.487 -5.376) 12.722 18.306 ( -8.119 -0.618 -6.931) 10.693 18.791 ( 0.923 -3.452 3.137) 4.755 19.717 ( 4.168 0.038 -6.993) 8.141 21.366 ( -19.226 1.538 -3.510) 19.604 22.000 ( 31.644 1.128 6.073) 32.241 24.004 ( -6.437 0.369 -3.914) 7.542 24.139 ( -1.879 0.027 -1.729) 2.553 ======================= Grid point 477 (239/361) ======================= q-point: (-0.30 -0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.486 ( -3.812 7.873 5.332) 10.244 2.814 ( 13.880 -2.792 4.625) 14.894 2.986 ( 2.195 0.806 -3.713) 4.388 3.060 ( -1.848 -7.250 3.689) 8.342 3.137 ( 2.301 1.388 3.033) 4.052 3.263 ( -4.897 -2.213 2.322) 5.854 4.088 ( 9.083 -0.991 -10.489) 13.911 4.378 ( 10.200 3.601 -6.406) 12.572 5.059 ( -7.466 -0.565 4.776) 8.881 5.189 ( -5.907 -3.351 -0.904) 6.851 5.643 ( -7.299 4.892 8.250) 12.053 5.957 ( -4.466 -2.320 2.587) 5.659 6.621 ( -10.323 -0.839 -2.560) 10.668 6.861 ( 1.652 -10.264 6.776) 12.409 7.888 ( 8.959 -1.394 -5.947) 10.843 7.971 ( 12.076 -6.506 16.736) 21.639 9.079 ( -22.849 -2.317 25.612) 34.401 9.349 ( -12.453 -2.691 21.223) 24.753 9.960 ( 6.926 0.093 8.004) 10.585 10.677 ( -12.190 -2.463 -16.521) 20.679 10.878 ( -9.373 7.339 -3.147) 12.313 11.786 ( 15.248 3.862 -7.863) 17.585 11.897 ( -1.124 13.076 -1.570) 13.218 12.512 ( 11.928 2.294 -8.215) 14.664 13.422 ( -8.235 0.362 11.979) 14.541 13.854 ( -9.327 1.279 0.126) 9.415 14.002 ( -4.001 -6.809 -5.080) 9.390 14.542 ( 14.108 2.776 6.064) 15.605 17.895 ( -16.863 0.288 -20.799) 26.778 18.410 ( 12.813 -0.258 1.425) 12.894 19.021 ( 5.544 -2.920 11.454) 13.056 19.718 ( 7.923 -0.191 -7.081) 10.628 20.986 ( -19.306 2.021 -9.668) 21.685 22.498 ( 28.603 3.500 7.310) 29.729 23.874 ( -5.000 1.813 -2.457) 5.859 24.120 ( -0.786 -2.375 0.636) 2.581 ======================= Grid point 478 (240/361) ======================= q-point: (-0.20 -0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.397 ( -12.851 2.749 8.799) 15.815 2.923 ( -19.355 -8.489 2.140) 21.243 2.963 ( 5.371 2.020 -1.721) 5.991 3.175 ( 20.133 2.641 1.767) 20.382 3.204 ( 2.354 0.542 -2.605) 3.552 3.427 ( 14.290 -1.781 6.523) 15.809 4.119 ( 9.903 -1.135 -8.668) 13.209 4.335 ( 0.507 5.466 -5.984) 8.121 4.961 ( -13.059 -3.135 -0.013) 13.430 5.124 ( -4.757 -2.291 0.031) 5.280 5.566 ( -8.119 5.964 5.418) 11.439 5.921 ( -5.312 -1.417 0.196) 5.501 6.426 ( -13.244 -1.669 -1.782) 13.467 7.096 ( 5.026 -11.194 6.304) 13.795 7.920 ( 7.547 0.217 -8.213) 11.156 8.413 ( 10.819 -9.624 12.843) 19.355 9.099 ( -17.449 -3.560 20.301) 27.005 9.481 ( -12.750 -5.345 22.618) 26.508 10.080 ( 0.409 5.521 3.525) 6.563 10.399 ( -10.905 -4.995 -7.887) 14.355 10.560 ( -8.353 7.545 -8.397) 14.043 11.676 ( -3.668 18.447 3.817) 19.191 11.919 ( 16.570 -2.411 -15.604) 22.888 12.662 ( 16.583 1.759 0.190) 16.677 13.440 ( -11.683 -2.388 12.696) 17.418 13.757 ( -2.007 3.021 0.771) 3.708 13.954 ( -3.881 -5.106 -2.572) 6.910 14.758 ( 13.338 5.619 2.851) 14.752 17.390 ( -18.349 -0.562 -18.825) 26.294 18.647 ( 12.870 -0.610 6.047) 14.233 19.194 ( 4.202 3.986 5.058) 7.690 19.764 ( 6.218 0.086 -3.689) 7.231 20.585 ( -14.223 -2.382 -13.689) 19.883 22.922 ( 23.140 6.633 8.075) 25.390 23.762 ( -3.033 2.935 -3.067) 5.217 24.184 ( 0.670 -5.042 4.434) 6.748 ======================= Grid point 479 (241/361) ======================= q-point: (-0.10 -0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.289 ( -16.920 -0.856 10.297) 19.825 2.709 ( -19.539 -6.200 -2.657) 20.671 3.005 ( 5.135 -0.103 -1.417) 5.328 3.230 ( 5.374 3.247 1.323) 6.416 3.418 ( 13.313 2.784 0.660) 13.617 3.735 ( 14.880 -0.513 6.015) 16.057 4.161 ( 7.961 6.158 -12.890) 16.355 4.201 ( -5.939 -3.845 5.070) 8.704 4.759 ( -15.177 -0.531 -1.721) 15.284 5.088 ( -2.727 -1.248 -0.665) 3.071 5.430 ( -8.054 6.738 0.585) 10.517 5.845 ( -3.686 -1.618 -3.551) 5.367 6.257 ( -13.083 -2.647 3.040) 13.690 7.327 ( 4.181 -7.257 5.072) 9.791 7.920 ( 6.937 0.204 -7.658) 10.335 8.692 ( -0.771 -7.696 5.243) 9.344 9.111 ( -17.643 -3.094 16.073) 24.066 9.592 ( -9.950 -5.792 13.008) 17.371 9.965 ( -11.084 14.305 1.889) 18.195 10.106 ( -6.115 4.502 -2.687) 8.054 10.575 ( 6.791 -13.567 -0.947) 15.201 11.529 ( -1.843 13.552 3.392) 14.091 11.983 ( 16.009 -5.332 -17.461) 24.282 12.875 ( 11.332 0.674 0.086) 11.353 13.441 ( -14.407 -3.792 13.543) 20.134 13.759 ( 4.658 4.718 1.582) 6.816 13.923 ( -1.770 -2.104 -0.527) 2.799 14.883 ( 13.032 10.028 -1.957) 16.559 16.960 ( -17.468 -1.278 -9.058) 19.719 18.930 ( 12.728 -1.405 8.422) 15.327 19.187 ( 3.073 10.383 -3.859) 11.495 19.757 ( -1.986 2.405 -0.296) 3.133 20.362 ( -1.527 -10.057 -13.124) 16.604 23.204 ( 9.988 13.192 10.940) 19.836 23.672 ( 3.243 -1.024 -7.992) 8.685 24.334 ( 2.447 -5.224 7.985) 9.851 ======================= Grid point 486 (242/361) ======================= q-point: (-0.40 -0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.617 ( -10.883 -0.000 3.965) 11.583 2.722 ( 14.120 0.000 3.310) 14.503 2.984 ( 5.218 0.000 9.229) 10.602 3.016 ( 9.531 0.000 -7.710) 12.259 3.140 ( -14.101 -0.000 1.444) 14.174 3.250 ( 4.358 0.000 5.782) 7.241 4.077 ( 9.607 0.000 -11.958) 15.339 4.405 ( 8.876 0.000 -4.190) 9.815 5.066 ( -7.808 -0.000 3.212) 8.443 5.145 ( -5.162 -0.000 -0.626) 5.199 5.695 ( -6.916 -0.000 7.630) 10.298 5.931 ( -4.633 -0.000 3.767) 5.972 6.621 ( -10.705 -0.000 -4.054) 11.447 6.751 ( 2.854 0.000 7.864) 8.366 7.878 ( 10.553 0.000 -6.801) 12.554 7.911 ( 12.422 0.000 15.862) 20.147 9.057 ( -24.159 -0.000 27.092) 36.299 9.325 ( -13.484 -0.000 21.079) 25.023 9.961 ( 8.536 0.000 9.293) 12.618 10.652 ( -14.809 -0.000 -19.521) 24.502 10.946 ( -7.458 -0.000 -1.409) 7.589 11.798 ( 18.750 0.000 -11.251) 21.866 12.078 ( -4.615 -0.000 1.358) 4.811 12.501 ( 9.053 0.000 -8.101) 12.148 13.443 ( -8.032 -0.000 11.310) 13.872 13.872 ( -9.459 -0.000 0.092) 9.460 13.914 ( -3.792 -0.000 -4.206) 5.663 14.572 ( 14.219 0.000 6.868) 15.791 17.897 ( -17.028 -0.000 -21.254) 27.234 18.407 ( 12.422 0.000 1.714) 12.539 18.992 ( 7.222 0.000 13.842) 15.612 19.716 ( 7.932 0.000 -7.492) 10.911 21.008 ( -18.727 -0.000 -11.431) 21.940 22.530 ( 30.128 0.000 6.208) 30.761 23.893 ( -4.828 -0.000 -1.146) 4.962 24.095 ( -2.443 -0.000 0.240) 2.455 ======================= Grid point 487 (243/361) ======================= q-point: (-0.30 -0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.469 ( -16.038 4.150 8.984) 18.845 2.759 ( -20.586 -7.229 4.057) 22.192 3.036 ( 8.134 5.174 -3.419) 10.228 3.143 ( 9.824 -4.681 -2.565) 11.180 3.246 ( 15.979 2.288 4.987) 16.894 3.419 ( 13.166 0.239 3.801) 13.706 4.101 ( 11.833 -0.543 -9.818) 15.385 4.388 ( -4.685 0.745 -3.584) 5.945 4.935 ( -12.729 -0.035 0.528) 12.740 5.080 ( -2.409 -1.876 -1.584) 3.440 5.648 ( -7.484 2.503 3.747) 8.736 5.901 ( -6.078 -0.675 2.796) 6.724 6.405 ( -12.959 -0.531 -2.705) 13.249 6.928 ( 6.647 -5.504 5.416) 10.188 7.940 ( 9.989 1.084 -6.805) 12.135 8.281 ( 12.695 -4.093 9.933) 16.630 9.050 ( -18.323 -1.486 20.812) 27.768 9.420 ( -14.867 -1.549 25.871) 29.879 10.163 ( -0.254 4.233 -0.683) 4.295 10.257 ( -5.499 -6.523 -7.038) 11.060 10.726 ( -11.836 5.443 -6.006) 14.346 11.885 ( 15.648 -0.771 -16.027) 22.413 11.964 ( -7.910 10.212 3.465) 13.374 12.639 ( 13.887 -2.887 -0.980) 14.217 13.447 ( -9.515 2.246 12.357) 15.756 13.799 ( -1.652 1.324 1.361) 2.516 13.840 ( -4.866 -5.379 -1.193) 7.351 14.833 ( 13.859 2.219 4.345) 14.693 17.382 ( -18.578 -0.249 -19.494) 26.930 18.639 ( 12.377 -0.237 6.238) 13.863 19.246 ( 6.161 1.529 11.229) 12.899 19.760 ( 9.069 -0.303 -5.995) 10.876 20.566 ( -16.197 -0.204 -18.276) 24.421 22.997 ( 27.292 1.834 3.239) 27.545 23.831 ( -3.559 3.508 2.711) 5.685 24.094 ( -2.293 -3.818 3.469) 5.645 ======================= Grid point 488 (244/361) ======================= q-point: (-0.20 -0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.302 ( -20.276 2.477 11.150) 23.272 2.554 ( -22.473 -9.476 2.601) 24.528 3.039 ( 3.795 2.806 -4.119) 6.264 3.277 ( 6.992 1.163 2.369) 7.473 3.477 ( 15.409 3.785 -1.252) 15.917 3.715 ( 19.255 -1.593 3.352) 19.610 4.162 ( -9.500 0.084 4.048) 10.327 4.227 ( 7.291 0.801 -9.674) 12.140 4.738 ( -15.857 -1.550 0.399) 15.938 5.066 ( 1.409 -0.607 -2.146) 2.638 5.528 ( -7.029 3.601 -1.962) 8.137 5.830 ( -5.822 -0.180 -0.787) 5.877 6.218 ( -13.205 -1.589 2.350) 13.506 7.161 ( 7.891 -8.742 3.870) 12.396 7.974 ( 9.488 4.276 -6.266) 12.148 8.542 ( 2.999 -7.480 3.660) 8.851 9.056 ( -15.187 -2.566 15.173) 21.620 9.513 ( -16.218 -2.474 20.632) 26.359 9.937 ( -2.873 -7.709 -10.227) 13.125 10.337 ( -13.840 12.711 4.532) 19.330 10.483 ( 7.655 0.367 -0.971) 7.725 11.780 ( -8.646 12.115 3.554) 15.303 11.900 ( 14.004 -3.313 -18.093) 23.118 12.846 ( 9.650 -3.352 -0.531) 10.229 13.434 ( -10.208 3.214 12.579) 16.515 13.816 ( -0.184 -2.539 3.092) 4.005 13.842 ( 0.618 -2.119 -0.704) 2.317 15.031 ( 14.547 5.728 0.195) 15.636 16.939 ( -17.750 -0.897 -8.892) 19.873 18.908 ( 12.322 -0.870 7.629) 14.518 19.374 ( 4.286 9.033 3.236) 10.508 19.790 ( -1.363 1.198 -1.180) 2.165 20.192 ( -2.351 -7.818 -20.558) 22.120 23.344 ( 21.916 2.119 -1.397) 22.063 23.761 ( -4.076 10.380 3.812) 11.785 24.209 ( 0.311 -8.323 8.620) 11.987 ======================= Grid point 489 (245/361) ======================= q-point: (-0.10 -0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.131 ( -22.094 -2.565 11.680) 25.122 2.322 ( -22.393 -6.788 -1.152) 23.428 3.039 ( 2.680 -1.260 -0.713) 3.045 3.381 ( 7.474 3.128 0.545) 8.120 3.580 ( 5.673 3.472 -0.250) 6.656 3.908 ( -21.018 2.800 7.744) 22.573 4.078 ( 16.406 -4.158 3.239) 17.232 4.349 ( 15.864 5.268 -4.502) 17.312 4.527 ( -15.708 -1.011 0.846) 15.763 5.067 ( 2.324 0.626 -2.324) 3.346 5.335 ( -6.837 3.847 -7.032) 10.535 5.735 ( -2.703 -1.111 -4.546) 5.404 6.135 ( -10.390 -2.486 9.210) 14.105 7.373 ( 4.608 -6.987 2.553) 8.750 7.986 ( 8.174 6.637 -4.939) 11.630 8.574 ( -6.536 -6.693 -3.063) 9.844 8.995 ( -20.063 -1.504 13.083) 23.999 9.552 ( -8.277 -5.806 11.376) 15.220 9.913 ( -7.999 8.244 -3.465) 11.998 10.063 ( 0.249 -2.883 0.300) 2.909 10.672 ( 7.393 -0.535 7.522) 10.560 11.591 ( -7.652 9.163 0.693) 11.958 11.925 ( 14.121 -6.211 -17.865) 23.603 12.918 ( -0.775 -1.981 -2.199) 3.059 13.400 ( -10.472 1.193 9.583) 14.245 13.825 ( -0.995 -0.665 -4.727) 4.876 13.930 ( 5.633 -2.964 3.799) 7.413 15.142 ( 14.953 10.464 -4.499) 18.797 16.729 ( -11.842 0.056 10.167) 15.608 19.172 ( 9.945 -0.833 -1.788) 10.139 19.251 ( 0.216 11.130 -1.681) 11.258 19.728 ( -1.442 -1.149 0.499) 1.910 20.154 ( 7.024 -9.674 -11.625) 16.675 23.537 ( 1.613 16.512 7.369) 18.153 23.629 ( 6.579 -0.617 -8.691) 10.918 24.431 ( 2.755 -7.221 10.033) 12.665 ======================= Grid point 497 (246/361) ======================= q-point: (-0.30 -0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.368 ( -18.911 -0.000 11.582) 22.175 2.417 ( -26.034 -0.000 3.734) 26.301 3.072 ( 2.084 0.000 -5.593) 5.968 3.281 ( 9.402 0.000 3.228) 9.941 3.526 ( 14.937 0.000 -1.439) 15.006 3.691 ( 20.649 0.000 1.431) 20.698 4.192 ( -20.599 -0.000 3.901) 20.965 4.206 ( 17.315 0.000 -6.242) 18.406 4.720 ( -16.067 -0.000 -0.637) 16.080 5.063 ( 3.248 0.000 -2.439) 4.062 5.560 ( -6.824 -0.000 -3.301) 7.580 5.830 ( -6.590 -0.000 0.685) 6.625 6.203 ( -13.215 -0.000 2.009) 13.366 7.072 ( 9.195 0.000 3.058) 9.690 8.024 ( 10.157 0.000 -4.149) 10.971 8.464 ( 4.220 0.000 2.043) 4.689 9.030 ( -14.773 -0.000 15.308) 21.274 9.493 ( -18.389 -0.000 22.774) 29.272 9.857 ( -4.053 -0.000 -12.535) 13.174 10.445 ( -1.284 -0.000 13.791) 13.851 10.510 ( -2.545 -0.000 -9.740) 10.067 11.867 ( 13.022 0.000 -18.465) 22.595 11.906 ( -12.019 -0.000 3.772) 12.597 12.803 ( 10.148 0.000 -0.010) 10.148 13.498 ( -7.137 -0.000 11.611) 13.629 13.725 ( -6.558 -0.000 2.046) 6.870 13.856 ( 4.648 0.000 0.800) 4.717 15.084 ( 14.986 0.000 0.983) 15.018 16.930 ( -17.866 -0.000 -8.850) 19.937 18.900 ( 12.198 0.000 7.309) 14.220 19.469 ( 4.558 0.000 9.924) 10.921 19.801 ( -0.083 -0.000 -1.758) 1.760 20.111 ( -3.546 -0.000 -27.308) 27.537 23.352 ( 22.951 0.000 -6.690) 23.906 23.927 ( 0.525 0.000 12.413) 12.424 24.075 ( -4.273 -0.000 5.529) 6.987 ======================= Grid point 498 (247/361) ======================= q-point: (-0.20 -0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.100 ( -25.310 -0.748 7.491) 26.406 2.210 ( -23.462 -4.081 5.176) 24.371 3.031 ( -1.143 -0.017 0.419) 1.217 3.420 ( 8.181 1.086 -1.405) 8.371 3.636 ( 7.159 2.174 -2.763) 7.975 3.922 ( -22.606 -1.378 9.686) 24.633 4.058 ( 19.130 1.819 4.710) 19.785 4.420 ( 15.579 1.220 -1.287) 15.679 4.492 ( -11.897 -1.221 -1.642) 12.071 5.077 ( 2.700 0.389 -2.544) 3.730 5.373 ( -6.143 0.766 -10.825) 12.470 5.730 ( -5.154 0.121 -2.553) 5.753 6.103 ( -10.525 -0.923 9.582) 14.263 7.250 ( 8.548 -4.508 0.797) 9.696 8.122 ( 10.463 6.258 -0.896) 12.225 8.448 ( -5.121 -5.671 -5.689) 9.527 8.972 ( -18.115 -0.763 12.472) 22.007 9.457 ( -13.027 -3.432 13.205) 18.864 9.839 ( 4.796 -4.456 -1.506) 6.717 10.202 ( -12.950 6.722 -5.205) 15.492 10.699 ( 8.121 1.451 9.144) 12.315 11.742 ( -11.462 5.504 1.776) 12.839 11.841 ( 12.318 -2.839 -17.182) 21.331 12.890 ( 1.823 -0.668 -1.665) 2.558 13.457 ( -8.845 4.070 3.704) 10.417 13.710 ( -5.510 -7.434 1.677) 9.404 13.937 ( 6.624 1.130 0.032) 6.719 15.275 ( 15.937 3.741 -4.027) 16.858 16.729 ( -11.110 -0.003 12.752) 16.913 19.147 ( 11.433 -0.869 1.319) 11.541 19.476 ( -8.548 11.424 -5.170) 15.176 19.668 ( -3.888 -5.812 3.036) 7.623 20.009 ( 15.143 -4.846 -15.774) 22.396 23.529 ( 17.038 -2.135 -10.400) 20.076 23.941 ( -3.959 18.846 8.698) 21.130 24.245 ( 1.557 -13.148 10.342) 16.800 ======================= Grid point 499 (248/361) ======================= q-point: (-0.10 -0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.895 ( -24.235 -5.429 10.117) 26.817 1.922 ( -24.007 -6.225 2.635) 24.940 3.082 ( 1.595 -0.964 5.968) 6.252 3.464 ( 4.717 0.759 -3.835) 6.127 3.649 ( -2.529 2.659 -0.174) 3.674 3.681 ( -24.729 1.525 11.665) 27.385 4.275 ( -9.351 0.399 5.399) 10.805 4.460 ( 17.173 -0.393 2.496) 17.358 4.579 ( 13.030 7.894 -3.714) 15.681 5.072 ( -1.038 -1.068 -2.638) 3.029 5.149 ( -1.805 0.297 -11.231) 11.379 5.651 ( 1.020 -1.252 -4.282) 4.577 6.148 ( -6.176 -1.205 15.211) 16.462 7.390 ( 3.784 -5.097 -0.726) 6.390 8.084 ( 1.248 8.723 -9.419) 12.899 8.426 ( 1.172 -3.425 2.095) 4.183 8.843 ( -22.589 -1.163 14.996) 27.138 9.549 ( -4.088 -5.606 11.932) 13.802 9.827 ( -6.145 7.278 -5.136) 10.822 10.023 ( 2.317 -8.531 -2.595) 9.213 10.881 ( 4.707 2.816 7.722) 9.472 11.501 ( -13.636 6.924 -2.492) 15.495 11.860 ( 13.438 -4.636 -15.944) 21.361 12.826 ( -6.721 0.497 -1.409) 6.885 13.315 ( -10.494 -3.234 -1.371) 11.067 13.678 ( -5.803 -4.156 -2.295) 7.498 14.038 ( 6.589 -0.698 0.979) 6.698 15.363 ( 14.721 7.695 -9.495) 19.133 16.929 ( 2.460 4.082 30.550) 30.919 19.010 ( -3.170 0.978 -21.642) 21.895 19.461 ( 6.509 4.043 7.591) 10.785 19.752 ( 3.531 -3.780 3.975) 6.524 20.079 ( 9.401 -4.765 -10.621) 14.963 23.647 ( 8.813 2.090 -7.554) 11.794 23.740 ( -4.952 19.032 3.588) 19.990 24.475 ( 0.072 -11.426 4.981) 12.465 ======================= Grid point 508 (249/361) ======================= q-point: (-0.20 -0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.831 ( -23.617 -0.000 9.890) 25.605 1.867 ( -27.545 -0.000 2.537) 27.661 3.075 ( -1.021 -0.000 10.120) 10.171 3.474 ( 8.998 0.000 -9.648) 13.193 3.675 ( -1.023 -0.000 -0.976) 1.414 3.694 ( -30.217 -0.000 16.204) 34.288 4.282 ( -12.306 -0.000 4.543) 13.117 4.449 ( 23.086 0.000 5.124) 23.648 4.667 ( 15.962 0.000 -5.060) 16.745 5.049 ( -5.307 -0.000 -4.570) 7.004 5.150 ( 0.847 0.000 -12.127) 12.157 5.642 ( -0.658 -0.000 -3.433) 3.496 6.138 ( -6.062 -0.000 15.906) 17.022 7.331 ( 6.693 0.000 -2.493) 7.142 8.188 ( -6.380 -0.000 -14.206) 15.573 8.377 ( 12.776 0.000 7.240) 14.685 8.833 ( -24.121 -0.000 15.584) 28.717 9.480 ( -4.127 -0.000 13.499) 14.116 9.863 ( 3.956 0.000 -3.487) 5.274 9.986 ( -10.589 -0.000 -6.411) 12.379 10.904 ( 4.513 0.000 7.308) 8.590 11.587 ( -15.781 -0.000 -1.019) 15.814 11.815 ( 14.128 0.000 -15.200) 20.752 12.849 ( -3.823 -0.000 -2.743) 4.705 13.262 ( -14.175 -0.000 -7.576) 16.073 13.630 ( -6.171 -0.000 4.024) 7.368 14.037 ( 6.854 0.000 -0.337) 6.862 15.434 ( 15.060 0.000 -9.985) 18.070 16.969 ( 4.459 0.000 32.653) 32.956 19.012 ( -4.669 -0.000 -23.416) 23.877 19.527 ( 6.112 0.000 11.405) 12.940 19.697 ( -0.997 -0.000 3.524) 3.662 20.032 ( 13.896 0.000 -13.006) 19.033 23.623 ( 15.099 0.000 -9.317) 17.742 24.081 ( -7.961 -0.000 8.512) 11.654 24.253 ( -0.250 -0.000 0.785) 0.824 ======================= Grid point 509 (250/361) ======================= q-point: (-0.10 -0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.583 ( -21.124 -3.702 10.688) 23.962 1.704 ( -18.284 -5.508 15.213) 24.415 3.218 ( 5.944 1.623 4.868) 7.852 3.431 ( -32.695 2.345 22.155) 39.564 3.489 ( 3.557 -0.984 -7.395) 8.265 3.569 ( -5.544 -1.229 -5.733) 8.069 4.252 ( -4.682 0.739 9.587) 10.695 4.641 ( 3.592 10.901 -12.161) 16.722 4.815 ( 9.338 -6.663 -4.966) 12.500 4.869 ( -1.759 -0.221 1.658) 2.427 5.169 ( 9.663 0.153 -1.090) 9.725 5.669 ( 8.464 -0.858 -1.566) 8.651 6.301 ( -2.536 0.359 20.398) 20.558 7.369 ( 2.226 -2.430 -4.108) 5.266 7.921 ( -2.759 1.411 -16.371) 16.662 8.607 ( -7.876 9.009 15.211) 19.354 8.735 ( -8.389 -5.125 17.707) 20.253 9.631 ( -1.334 -0.214 11.862) 11.939 9.751 ( -4.072 4.418 -3.797) 7.107 9.909 ( 3.188 -11.031 -6.372) 13.132 10.990 ( -2.160 2.923 1.631) 3.983 11.237 ( -21.923 0.729 -5.140) 22.529 11.862 ( 14.283 -0.705 -12.632) 19.081 12.712 ( -8.495 1.990 -1.735) 8.896 13.044 ( -11.924 -8.141 -0.259) 14.440 13.591 ( -5.380 -0.247 2.731) 6.038 14.124 ( 5.534 -0.275 -0.520) 5.565 15.453 ( 11.599 3.814 -15.614) 19.821 17.551 ( 19.679 5.966 32.958) 38.847 18.684 ( -0.301 -3.137 -23.479) 23.690 19.615 ( -2.464 8.268 0.295) 8.633 19.820 ( 1.955 -9.464 8.424) 12.820 20.089 ( 16.013 -0.210 -10.375) 19.081 23.729 ( 10.620 3.316 -6.705) 12.990 23.836 ( -11.466 23.437 -1.424) 26.130 24.282 ( -9.350 -20.300 -2.491) 22.488 ======================= Grid point 519 (251/361) ======================= q-point: (-0.10 -0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.574 ( -5.994 -0.000 21.234) 22.063 1.681 ( -11.474 -0.000 20.696) 23.664 3.170 ( -16.794 -0.000 5.737) 17.747 3.330 ( -11.388 -0.000 -5.010) 12.441 3.469 ( -4.524 -0.000 22.056) 22.515 3.533 ( 12.704 0.000 -10.740) 16.635 4.347 ( -2.286 -0.000 11.317) 11.546 4.492 ( -7.818 -0.000 -14.793) 16.732 4.592 ( -2.074 -0.000 -12.799) 12.966 5.035 ( 2.270 0.000 6.358) 6.751 5.389 ( 16.401 0.000 2.727) 16.626 5.822 ( 12.012 0.000 1.255) 12.077 6.573 ( 0.491 0.000 25.695) 25.699 7.308 ( -0.414 -0.000 -6.379) 6.392 7.702 ( -2.050 -0.000 -13.688) 13.841 8.581 ( -27.181 -0.000 28.634) 39.481 9.012 ( 10.283 0.000 13.821) 17.227 9.669 ( -7.316 -0.000 -1.162) 7.407 9.709 ( 0.575 0.000 -1.741) 1.834 9.897 ( 7.904 0.000 4.754) 9.223 10.771 ( -28.241 -0.000 -1.567) 28.285 10.981 ( -2.156 -0.000 -3.352) 3.985 11.900 ( 11.274 0.000 -13.081) 17.269 12.564 ( -9.232 -0.000 -2.060) 9.459 12.939 ( -6.451 -0.000 10.122) 12.003 13.556 ( -3.195 -0.000 1.823) 3.679 14.175 ( 3.039 0.000 -1.243) 3.283 15.388 ( 7.264 0.000 -19.605) 20.907 18.295 ( 30.041 0.000 20.900) 36.596 18.407 ( 4.027 0.000 -22.044) 22.409 19.525 ( -8.400 -0.000 -7.233) 11.085 19.797 ( -5.059 -0.000 -0.236) 5.065 20.330 ( 22.861 0.000 1.694) 22.923 23.561 ( -32.574 -0.000 -16.072) 36.323 23.846 ( 12.920 0.000 -6.396) 14.417 24.008 ( -10.307 -0.000 6.887) 12.396 ======================= Grid point 520 (252/361) ======================= q-point: ( 0.00 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.330 ( 0.926 0.000 12.510) 12.544 2.508 ( -0.185 -0.000 13.385) 13.387 2.973 ( -0.110 -0.000 2.750) 2.753 3.231 ( 7.587 0.000 -8.014) 11.036 3.403 ( 8.182 0.000 -8.047) 11.476 3.603 ( -6.880 -0.000 -4.772) 8.373 3.843 ( -9.486 -0.000 -7.378) 12.018 3.931 ( -0.941 -0.000 -2.362) 2.542 4.959 ( 5.248 0.000 9.620) 10.958 5.221 ( -1.970 -0.000 2.794) 3.419 5.745 ( -2.638 -0.000 5.264) 5.888 6.129 ( 4.717 0.000 -1.976) 5.114 6.996 ( -7.660 -0.000 0.072) 7.660 7.264 ( 4.738 0.000 -3.045) 5.632 8.342 ( 4.967 0.000 33.783) 34.146 9.173 ( -21.062 -0.000 20.162) 29.157 9.539 ( -5.602 -0.000 10.143) 11.587 9.624 ( 6.789 0.000 -7.606) 10.195 9.727 ( 2.092 0.000 -0.418) 2.133 10.106 ( -12.237 -0.000 20.084) 23.519 10.463 ( -5.329 -0.000 -13.229) 14.262 11.166 ( 19.271 0.000 14.664) 24.216 11.376 ( 11.103 0.000 -18.079) 21.216 12.054 ( -13.920 -0.000 -10.718) 17.568 13.351 ( -2.591 -0.000 8.532) 8.917 13.584 ( 5.294 0.000 -1.518) 5.507 14.146 ( -3.863 -0.000 2.127) 4.409 14.678 ( 2.499 0.000 -14.429) 14.643 17.990 ( 15.670 0.000 -6.470) 16.953 18.457 ( -16.719 -0.000 -17.284) 24.047 19.389 ( 17.495 0.000 -0.701) 17.509 19.427 ( -10.696 -0.000 -2.259) 10.932 21.404 ( 25.102 0.000 11.845) 27.757 22.031 ( -35.186 -0.000 -6.764) 35.830 23.888 ( -9.375 -0.000 1.319) 9.467 23.976 ( 11.509 0.000 -3.187) 11.942 ======================= Grid point 521 (253/361) ======================= q-point: ( 0.10 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.500 ( 4.214 2.602 8.976) 10.252 2.611 ( 1.284 -2.311 3.578) 4.449 3.066 ( 4.918 2.188 2.377) 5.884 3.120 ( -1.498 0.968 -8.578) 8.762 3.411 ( 2.304 4.932 -1.050) 5.544 3.584 ( 2.800 -6.676 -3.131) 7.887 3.658 ( -7.004 -0.329 -3.053) 7.648 3.908 ( 3.892 -2.104 -2.934) 5.309 5.125 ( 3.216 0.228 6.714) 7.448 5.216 ( -1.552 -1.854 -1.645) 2.924 5.725 ( -10.091 0.390 6.907) 12.234 6.112 ( -0.715 0.896 -4.150) 4.306 6.882 ( -10.408 0.449 2.280) 10.665 7.268 ( 1.877 0.141 -2.661) 3.260 8.712 ( -2.689 10.320 24.691) 26.896 8.999 ( -12.169 20.980 9.460) 26.033 9.435 ( -12.377 -8.887 3.553) 15.646 9.655 ( -10.549 -13.530 8.033) 18.944 9.932 ( 10.843 -0.741 4.143) 11.631 10.191 ( -6.638 0.416 -13.970) 15.472 10.334 ( 5.600 -5.808 17.569) 19.333 11.347 ( 11.415 0.137 -16.096) 19.734 11.665 ( 18.292 -0.349 11.386) 21.549 11.743 ( 1.390 0.841 -11.792) 11.903 13.408 ( -3.408 -3.195 5.611) 7.301 13.653 ( 4.695 -4.068 -2.487) 6.692 14.107 ( -6.368 1.247 4.300) 7.784 14.541 ( 1.521 1.634 -10.993) 11.218 17.997 ( -17.900 0.111 -16.244) 24.172 18.194 ( 16.732 -0.105 1.210) 16.776 19.242 ( -10.442 0.480 -2.028) 10.647 19.579 ( 11.673 0.422 -2.503) 11.946 21.470 ( -29.123 2.895 -5.816) 29.839 21.918 ( 22.722 -2.042 13.404) 26.460 23.786 ( -6.426 -1.190 -0.546) 6.558 24.106 ( 10.529 -0.088 -1.704) 10.666 ======================= Grid point 522 (254/361) ======================= q-point: ( 0.20 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.530 ( -1.906 2.976 0.748) 3.612 2.777 ( 8.419 -5.056 1.436) 9.925 2.967 ( -1.103 0.696 -3.767) 3.986 3.140 ( 3.034 2.819 -2.492) 4.834 3.388 ( -1.537 5.712 2.710) 6.506 3.594 ( -1.880 0.544 6.040) 6.349 3.621 ( 6.065 -5.376 -8.402) 11.673 4.050 ( 8.947 -5.359 2.518) 10.729 5.125 ( -4.774 -1.021 -5.873) 7.637 5.218 ( -2.013 -0.918 3.585) 4.213 5.625 ( -14.790 -0.149 6.729) 16.250 6.010 ( -2.539 1.300 -6.402) 7.009 6.734 ( -13.318 2.023 3.486) 13.914 7.278 ( 2.547 -1.312 -1.411) 3.194 8.477 ( -11.939 22.881 -2.553) 25.934 8.973 ( -0.906 10.497 12.228) 16.141 9.434 ( -16.483 -17.280 7.578) 25.054 9.736 ( -9.307 -2.800 15.240) 18.075 9.936 ( -7.667 -3.246 -9.412) 12.566 10.107 ( 2.189 0.205 6.103) 6.487 10.735 ( 14.339 -7.167 11.301) 19.614 11.213 ( -0.694 5.865 -11.579) 12.998 11.616 ( 20.020 3.048 -18.980) 27.755 12.217 ( 23.153 -2.592 12.323) 26.356 13.463 ( -2.043 -5.735 4.121) 7.351 13.716 ( 1.568 -7.577 -3.988) 8.705 14.040 ( -9.091 3.397 6.311) 11.576 14.444 ( 2.709 -0.287 -7.801) 8.263 17.559 ( -18.347 0.152 -11.988) 21.917 18.488 ( 16.302 -0.167 7.105) 17.784 19.075 ( -8.003 -0.547 -3.160) 8.622 19.668 ( 5.191 0.155 -1.789) 5.493 21.003 ( -20.560 3.878 -6.935) 22.042 22.418 ( 18.557 -3.624 14.938) 24.096 23.707 ( -2.737 -0.331 -3.055) 4.115 24.238 ( 9.021 0.099 0.345) 9.028 ======================= Grid point 523 (255/361) ======================= q-point: (-0.70 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.487 ( -5.035 -2.718 1.898) 6.028 2.771 ( -5.203 -4.180 -8.333) 10.676 3.047 ( 1.776 1.501 -0.333) 2.349 3.122 ( 8.282 1.640 0.636) 8.467 3.360 ( 0.675 3.940 4.976) 6.382 3.633 ( 4.226 -5.144 -5.066) 8.366 3.768 ( 11.716 3.008 5.484) 13.281 4.256 ( 6.767 -4.151 3.967) 8.875 4.940 ( -11.214 -0.346 -5.170) 12.353 5.187 ( -8.092 -1.448 1.409) 8.340 5.476 ( -14.981 -1.373 3.067) 15.353 5.874 ( -1.192 1.696 -8.871) 9.110 6.566 ( -13.467 3.136 5.444) 14.860 7.323 ( 2.994 -2.572 -1.327) 4.164 8.112 ( -4.690 15.981 -6.467) 17.866 8.954 ( -3.226 8.072 3.558) 9.393 9.415 ( -19.253 -14.690 6.278) 25.018 9.734 ( -6.762 -4.405 -1.011) 8.133 9.865 ( -8.927 -0.656 12.766) 15.591 10.145 ( -5.843 -0.910 5.160) 7.848 10.969 ( 11.478 17.850 -5.197) 21.849 11.180 ( 6.843 -8.809 6.835) 13.082 11.671 ( 23.561 3.168 -21.217) 31.865 12.640 ( 16.776 -1.021 5.249) 17.608 13.566 ( 2.794 -5.497 1.249) 6.292 13.753 ( -0.502 -8.103 0.441) 8.131 13.941 ( -11.142 4.625 7.659) 14.290 14.452 ( 5.345 -6.841 -5.762) 10.420 17.194 ( -17.868 0.522 -3.461) 18.208 18.803 ( 11.120 -2.028 6.217) 12.901 18.966 ( 0.131 -0.188 -2.564) 2.575 19.698 ( 0.055 -1.853 -0.100) 1.857 20.635 ( -11.367 6.152 -8.284) 15.352 22.865 ( 10.923 -6.783 14.681) 19.515 23.634 ( 1.993 2.751 -6.123) 7.002 24.375 ( 7.164 -0.110 3.285) 7.882 ======================= Grid point 524 (256/361) ======================= q-point: (-0.60 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.466 ( -9.939 -5.926 3.038) 11.964 2.593 ( -12.153 -0.886 -2.361) 12.412 2.997 ( 3.593 0.619 -5.598) 6.681 3.260 ( 7.612 4.669 3.612) 9.633 3.466 ( 3.319 -1.840 5.504) 6.685 3.709 ( 6.939 -8.151 -5.549) 12.057 3.975 ( 15.426 6.206 2.987) 16.894 4.387 ( -0.965 -1.030 5.619) 5.794 4.725 ( -14.519 -0.405 1.460) 14.597 5.073 ( -7.962 -1.583 -1.258) 8.215 5.305 ( -12.314 -3.143 -1.923) 12.854 5.733 ( 0.586 2.025 -10.506) 10.715 6.443 ( -11.109 3.348 8.848) 14.591 7.370 ( 2.528 -3.710 -2.163) 4.983 7.905 ( 1.268 7.681 -6.431) 10.098 8.828 ( -4.263 10.195 -0.991) 11.094 9.303 ( -22.218 -14.085 3.412) 26.527 9.700 ( -3.697 -5.103 1.033) 6.386 9.878 ( -13.233 -0.167 13.698) 19.047 10.136 ( -4.275 -1.818 4.786) 6.669 10.907 ( 12.493 20.694 -1.446) 24.216 11.418 ( 3.754 -5.705 4.611) 8.240 11.688 ( 21.496 5.667 -22.626) 31.719 12.841 ( 7.167 -1.736 -1.146) 7.463 13.586 ( -1.846 -3.674 -4.259) 5.920 13.829 ( -8.552 1.644 3.106) 9.245 13.929 ( 4.780 -0.677 10.740) 11.775 14.576 ( 8.214 -13.180 -5.060) 16.334 16.988 ( -14.707 -0.419 9.844) 17.703 18.829 ( 0.329 -7.303 -12.175) 14.201 19.156 ( 12.926 3.851 9.186) 16.318 19.707 ( -1.760 -2.554 0.318) 3.118 20.364 ( -3.970 7.837 -7.144) 11.324 23.181 ( -3.184 -13.526 11.295) 17.907 23.579 ( 10.878 8.789 -8.035) 16.129 24.528 ( 5.377 -0.426 6.179) 8.202 ======================= Grid point 525 (257/361) ======================= q-point: (-0.50 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.301 ( -12.701 -0.262 -4.934) 13.628 2.446 ( -18.318 3.068 13.210) 22.792 3.019 ( 6.645 -1.099 -4.246) 7.962 3.355 ( 7.767 4.679 0.671) 9.092 3.566 ( -0.217 -4.688 2.047) 5.120 3.797 ( 0.784 -9.659 -4.583) 10.720 4.171 ( 11.547 3.370 1.081) 12.078 4.402 ( -2.982 -0.434 7.325) 7.920 4.585 ( -13.614 -0.082 7.508) 15.547 5.015 ( 1.226 -0.142 -0.583) 1.365 5.138 ( -8.560 -3.004 -5.591) 10.656 5.606 ( 2.830 1.795 -10.693) 11.206 6.410 ( -7.640 2.593 12.269) 14.684 7.415 ( 1.816 -4.261 -1.595) 4.899 7.812 ( 2.851 1.240 -8.748) 9.284 8.656 ( -5.166 10.374 1.639) 11.704 9.150 ( -20.143 -12.598 3.120) 23.962 9.734 ( -0.909 -2.250 4.035) 4.708 9.828 ( -15.344 -0.681 11.657) 19.282 10.169 ( -0.205 0.641 3.639) 3.701 10.916 ( 8.682 13.125 2.628) 15.955 11.480 ( -1.030 -0.286 -1.813) 2.105 11.649 ( 18.140 5.901 -20.674) 28.129 12.882 ( -0.013 -1.083 -2.118) 2.379 13.515 ( -5.032 -0.565 -2.290) 5.557 13.740 ( -7.510 -0.132 2.602) 7.949 14.075 ( 4.665 4.192 4.279) 7.592 14.783 ( 11.263 -14.211 -6.604) 19.298 17.051 ( -7.284 -3.914 23.554) 24.963 18.717 ( 2.432 -5.936 -20.066) 21.067 19.381 ( 9.579 3.312 5.590) 11.575 19.711 ( 2.128 -0.590 -1.171) 2.499 20.209 ( -0.735 6.410 -2.525) 6.928 23.288 ( -14.356 -19.440 4.327) 24.551 23.607 ( 16.325 11.375 -5.698) 20.697 24.666 ( 2.544 0.814 6.013) 6.580 ======================= Grid point 526 (258/361) ======================= q-point: (-0.40 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.074 ( -12.651 5.881 3.586) 14.405 2.294 ( -17.690 7.843 13.654) 23.682 3.079 ( 5.473 -0.310 -1.795) 5.768 3.406 ( 6.621 3.320 -3.703) 8.281 3.567 ( -4.076 -2.993 -4.094) 6.507 3.800 ( -11.864 -9.654 5.070) 16.114 4.188 ( -3.305 -9.179 -5.941) 11.422 4.492 ( -11.043 1.470 9.791) 14.832 4.657 ( 18.232 1.551 9.229) 20.493 4.963 ( -7.469 -0.561 -7.183) 10.378 5.077 ( 5.291 1.678 2.541) 6.105 5.545 ( 8.090 1.240 -8.612) 11.881 6.477 ( -3.833 0.393 14.492) 14.995 7.444 ( -0.950 -1.429 0.229) 1.731 7.713 ( 2.833 -0.522 -14.296) 14.583 8.588 ( -6.985 -1.088 10.264) 12.463 9.065 ( -11.079 -6.766 6.053) 14.323 9.739 ( -10.348 2.797 7.353) 12.999 9.819 ( -3.453 -2.669 10.446) 11.321 10.165 ( 0.919 8.145 -0.017) 8.197 10.944 ( -2.576 0.008 2.211) 3.395 11.389 ( 1.598 5.642 -7.800) 9.759 11.611 ( 12.673 3.367 -14.180) 19.314 12.821 ( -5.004 1.159 -1.241) 5.285 13.395 ( -6.450 4.418 -0.543) 7.837 13.677 ( -6.510 -0.712 3.065) 7.230 14.125 ( 3.214 4.294 2.227) 5.808 14.948 ( 10.758 -11.241 -12.416) 19.906 17.403 ( 2.614 -8.128 28.178) 29.443 18.517 ( 4.654 -0.587 -24.678) 25.120 19.478 ( 0.989 -0.399 -0.396) 1.137 19.799 ( 12.760 0.307 -1.740) 12.882 20.136 ( -1.448 5.836 1.521) 6.202 23.294 ( -15.596 -22.289 1.674) 27.255 23.658 ( 12.769 8.520 -5.832) 16.421 24.694 ( -2.907 4.797 1.903) 5.923 ======================= Grid point 527 (259/361) ======================= q-point: (-0.30 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.954 ( -8.316 8.305 13.065) 17.574 2.171 ( -12.083 9.559 15.986) 22.202 3.129 ( 2.993 -0.637 -1.308) 3.328 3.382 ( -4.729 -2.085 -3.662) 6.334 3.421 ( -0.149 2.878 -10.132) 10.533 3.794 ( -13.531 -7.278 12.155) 19.591 4.144 ( -1.363 -12.826 -13.329) 18.548 4.492 ( -5.879 2.145 13.203) 14.611 4.723 ( -6.384 4.154 -10.728) 13.157 5.049 ( 12.984 -0.684 12.364) 17.942 5.179 ( 8.227 1.527 1.482) 8.497 5.623 ( 13.850 -0.170 -3.924) 14.396 6.647 ( 0.343 -3.603 15.068) 15.497 7.415 ( -3.774 3.181 2.183) 5.397 7.572 ( 2.644 -0.045 -13.598) 13.852 8.721 ( -9.153 -15.475 15.870) 23.982 9.104 ( -2.386 -1.321 9.414) 9.801 9.677 ( -6.892 3.837 9.394) 12.267 9.931 ( -6.557 0.838 12.213) 13.887 10.059 ( 4.967 11.740 -2.648) 13.020 10.845 ( -16.937 -6.458 -0.535) 18.134 11.250 ( 4.100 10.690 -9.730) 15.025 11.617 ( 10.301 0.078 -10.320) 14.582 12.697 ( -8.342 1.630 -0.898) 8.547 13.267 ( -5.813 7.979 5.086) 11.105 13.632 ( -5.371 0.187 2.653) 5.994 14.154 ( 2.559 2.664 1.039) 3.838 14.991 ( 8.733 -8.074 -17.501) 21.160 17.863 ( 8.712 -9.810 12.026) 17.798 18.337 ( 11.228 3.485 -13.750) 18.091 19.424 ( -6.404 -4.972 -5.656) 9.885 19.923 ( 6.288 2.072 -7.254) 9.821 20.161 ( 9.940 5.361 8.193) 13.952 23.270 ( -21.446 -25.352 0.060) 33.206 23.685 ( 13.035 7.046 -7.427) 16.575 24.534 ( -9.459 10.099 -1.465) 13.914 ======================= Grid point 528 (260/361) ======================= q-point: (-0.20 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.006 ( -2.292 4.421 16.603) 17.334 2.178 ( -6.407 7.799 19.609) 22.054 3.132 ( -1.943 -1.469 -0.595) 2.508 3.197 ( -9.957 -2.641 -5.696) 11.772 3.374 ( 9.962 3.542 -8.469) 13.547 3.840 ( -7.092 -3.313 10.364) 12.988 4.042 ( -4.444 -11.248 -14.538) 18.911 4.429 ( -9.670 4.893 -10.176) 14.866 4.595 ( 0.744 2.170 11.855) 12.075 5.200 ( -0.670 3.237 6.398) 7.201 5.436 ( 14.833 -2.250 4.827) 15.760 5.820 ( 14.894 -1.391 -0.559) 14.969 6.901 ( 4.302 -8.110 9.886) 13.491 7.326 ( -1.901 7.830 -1.859) 8.269 7.545 ( 1.814 -3.036 5.591) 6.616 8.945 ( -13.526 -20.129 19.526) 31.135 9.225 ( 1.763 -1.668 7.957) 8.319 9.719 ( 4.396 8.668 6.770) 11.845 9.775 ( -12.154 10.400 6.053) 17.103 10.196 ( 7.399 2.342 10.074) 12.716 10.602 ( -23.039 -7.404 0.742) 24.211 11.069 ( 2.530 14.198 -8.719) 16.853 11.601 ( 6.718 -1.189 -14.688) 16.195 12.540 ( -11.100 -0.093 -0.647) 11.119 13.229 ( -3.098 6.768 9.997) 12.464 13.582 ( -2.563 1.855 0.357) 3.183 14.172 ( 0.995 1.208 0.389) 1.613 14.932 ( 6.583 -5.183 -19.460) 21.187 17.944 ( 9.461 -1.884 -18.213) 20.610 18.604 ( 20.041 -1.690 10.509) 22.692 19.246 ( -11.856 -6.753 -10.651) 17.310 19.802 ( -4.244 4.661 -5.731) 8.520 20.479 ( 21.706 2.501 8.545) 23.461 23.075 ( -30.559 -18.862 -5.574) 36.341 23.746 ( 13.727 3.388 -6.222) 15.447 24.257 ( -12.343 10.556 0.254) 16.243 ======================= Grid point 529 (261/361) ======================= q-point: (-0.10 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.168 ( -0.672 0.656 14.977) 15.007 2.314 ( -2.090 3.011 20.225) 20.554 3.024 ( -6.873 -1.519 -2.892) 7.610 3.160 ( 5.030 -1.336 -1.619) 5.451 3.394 ( 10.785 3.022 -9.014) 14.377 3.807 ( -7.582 -3.802 -8.843) 12.253 3.939 ( -3.708 -4.507 0.106) 5.837 4.119 ( -9.803 5.150 -9.153) 14.367 4.762 ( 4.064 0.697 11.332) 12.059 5.217 ( -2.307 1.950 4.506) 5.425 5.661 ( 5.981 -1.114 4.461) 7.544 6.022 ( 11.102 -1.117 -0.321) 11.163 7.070 ( -1.630 -5.997 -0.380) 6.226 7.227 ( 4.060 5.215 -2.478) 7.058 7.847 ( 5.144 -4.337 27.722) 28.527 9.143 ( -18.750 -14.481 22.139) 32.425 9.384 ( 2.329 -8.419 6.625) 10.964 9.577 ( 1.216 11.416 -0.880) 11.515 9.822 ( 1.440 9.942 7.920) 12.793 10.199 ( -18.523 9.206 11.453) 23.644 10.558 ( -1.222 -17.591 -1.599) 17.706 10.903 ( 6.538 16.401 1.249) 17.700 11.483 ( 6.237 -0.422 -18.944) 19.949 12.345 ( -14.036 -1.495 -4.189) 14.724 13.279 ( -1.925 3.460 10.663) 11.375 13.553 ( 2.309 2.201 -1.114) 3.379 14.168 ( -1.428 0.203 0.644) 1.580 14.816 ( 4.454 -2.532 -17.863) 18.583 17.908 ( 13.161 -0.167 -14.213) 19.372 18.849 ( -6.546 0.614 -10.979) 12.797 19.106 ( 11.975 -6.172 0.099) 13.472 19.616 ( -8.136 3.120 -3.668) 9.454 20.914 ( 24.817 1.118 10.002) 26.780 22.616 ( -36.004 -6.710 -8.047) 37.497 23.853 ( 12.373 0.583 -4.458) 13.164 24.033 ( -11.221 4.541 2.125) 12.290 ======================= Grid point 531 (262/361) ======================= q-point: ( 0.10 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.579 ( -2.090 -0.000 -3.251) 3.865 2.707 ( 6.338 0.000 3.168) 7.085 2.971 ( -1.444 -0.000 -3.674) 3.948 3.181 ( 6.476 0.000 -2.195) 6.838 3.446 ( -2.478 -0.000 -10.023) 10.325 3.546 ( 2.818 0.000 4.831) 5.593 3.621 ( 0.248 0.000 8.300) 8.304 3.984 ( 8.873 0.000 1.175) 8.950 5.115 ( -4.258 -0.000 -6.690) 7.930 5.210 ( -1.271 -0.000 3.659) 3.873 5.625 ( -15.524 -0.000 7.067) 17.057 6.023 ( -2.473 -0.000 -6.505) 6.959 6.754 ( -12.929 -0.000 3.885) 13.500 7.262 ( 1.717 0.000 -1.813) 2.498 8.864 ( -14.431 -0.000 14.980) 20.801 8.924 ( -15.978 -0.000 -19.053) 24.866 9.231 ( -8.465 -0.000 20.964) 22.609 9.734 ( -7.958 -0.000 23.228) 24.553 9.900 ( -7.980 -0.000 -13.194) 15.419 10.110 ( 11.406 0.000 -4.728) 12.347 10.656 ( 10.871 0.000 18.115) 21.127 11.282 ( 5.975 0.000 -12.790) 14.117 11.653 ( 18.265 0.000 -19.435) 26.671 12.191 ( 23.038 0.000 15.064) 27.526 13.405 ( -1.877 -0.000 3.975) 4.396 13.638 ( 1.807 0.000 -4.701) 5.036 14.073 ( -9.165 -0.000 7.000) 11.532 14.442 ( 1.066 0.000 -9.105) 9.167 17.560 ( -18.220 -0.000 -11.948) 21.788 18.487 ( 16.279 0.000 7.116) 17.767 19.071 ( -8.768 -0.000 -2.726) 9.182 19.668 ( 4.031 0.000 -1.806) 4.417 21.041 ( -19.529 -0.000 -8.088) 21.138 22.382 ( 16.507 0.000 16.499) 23.338 23.705 ( -1.585 -0.000 -2.411) 2.885 24.238 ( 9.565 0.000 -0.447) 9.575 ======================= Grid point 532 (263/361) ======================= q-point: (-0.80 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.465 ( -4.236 0.005 -5.536) 6.970 2.687 ( -5.205 -3.535 -5.620) 8.436 3.078 ( 9.057 1.075 2.714) 9.516 3.187 ( 3.751 5.598 -2.732) 7.271 3.328 ( -0.158 -6.433 -5.939) 8.757 3.619 ( 2.139 2.516 4.406) 5.506 3.821 ( 7.758 2.052 12.543) 14.890 4.160 ( 8.278 -4.603 2.308) 9.749 4.933 ( -8.670 -0.299 -6.911) 11.091 5.166 ( -9.680 -0.542 1.381) 9.793 5.465 ( -16.270 -0.183 4.495) 16.880 5.901 ( -0.165 0.939 -9.159) 9.209 6.612 ( -13.370 1.540 5.711) 14.619 7.279 ( 2.092 -1.554 -1.467) 2.991 8.391 ( -12.134 12.550 -14.957) 22.988 8.902 ( -12.696 -10.855 8.869) 18.912 9.281 ( -13.737 0.533 12.072) 18.295 9.671 ( -6.969 -2.198 -7.023) 10.135 9.889 ( -10.000 1.528 22.102) 24.307 10.123 ( 0.871 -0.973 -6.460) 6.591 11.045 ( 13.503 -2.477 13.117) 18.987 11.261 ( 14.059 8.213 -8.351) 18.298 11.714 ( 24.422 1.367 -21.551) 32.600 12.633 ( 16.447 0.021 7.310) 17.999 13.494 ( 5.186 -1.855 4.944) 7.401 13.600 ( -0.665 -6.176 -4.742) 7.815 14.009 ( -12.728 2.128 10.108) 16.392 14.366 ( 1.895 -2.387 -7.808) 8.382 17.200 ( -17.704 0.176 -3.733) 18.094 18.771 ( 6.781 -1.027 2.636) 7.347 18.979 ( 2.941 0.705 3.126) 4.350 19.669 ( -1.682 -0.989 -0.333) 1.979 20.714 ( -9.357 2.302 -10.021) 13.902 22.766 ( 5.125 -3.141 17.006) 18.037 23.686 ( 5.933 1.943 -3.994) 7.411 24.367 ( 7.771 -0.437 0.906) 7.836 ======================= Grid point 533 (264/361) ======================= q-point: (-0.70 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.362 ( -4.623 -4.556 -4.379) 7.830 2.567 ( -7.984 -1.842 -1.179) 8.278 3.020 ( 1.281 2.378 -8.469) 8.889 3.327 ( 8.025 -0.861 2.550) 8.464 3.385 ( 3.689 -3.747 1.338) 5.426 3.671 ( 0.715 3.412 5.499) 6.511 4.075 ( 12.407 4.305 8.715) 15.761 4.308 ( 0.408 -6.492 1.016) 6.584 4.747 ( -9.646 1.881 0.505) 9.841 5.005 ( -13.157 -4.235 -1.094) 13.865 5.279 ( -14.122 -0.224 1.036) 14.162 5.779 ( 2.770 2.417 -11.453) 12.028 6.501 ( -11.215 2.677 8.775) 14.489 7.300 ( 0.754 -3.144 -2.283) 3.958 8.008 ( -6.460 3.239 -13.544) 15.351 8.928 ( -7.863 -2.213 9.607) 12.611 9.124 ( -19.698 -0.816 2.527) 19.876 9.577 ( -5.639 -7.120 -0.715) 9.111 9.932 ( -9.279 4.302 11.680) 15.525 10.074 ( -6.181 -3.542 3.984) 8.162 11.291 ( 19.054 17.725 -6.409) 26.801 11.371 ( 10.375 -0.099 7.685) 12.912 11.772 ( 22.981 3.239 -22.254) 32.153 12.819 ( 6.094 -0.399 -1.267) 6.237 13.500 ( -2.536 -4.977 -5.624) 7.926 13.781 ( 7.362 -5.077 -0.200) 8.945 13.963 ( -8.518 3.119 19.282) 21.310 14.367 ( 4.121 -8.669 -6.609) 11.653 16.982 ( -15.500 -0.226 8.261) 17.565 18.729 ( -1.209 -3.548 -9.829) 10.519 19.228 ( 13.022 3.465 11.108) 17.463 19.658 ( -1.407 -2.474 0.466) 2.884 20.471 ( -3.504 3.908 -10.372) 11.624 22.969 ( -9.081 -8.549 11.892) 17.233 23.746 ( 13.856 7.928 -2.785) 16.205 24.498 ( 5.585 -2.301 2.894) 6.698 ======================= Grid point 534 (265/361) ======================= q-point: (-0.60 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.275 ( -5.234 -2.147 -3.928) 6.887 2.486 ( -11.735 1.398 10.133) 15.567 2.972 ( 6.368 -3.330 -8.267) 10.954 3.423 ( -1.091 -8.769 -3.006) 9.334 3.486 ( 6.767 7.309 6.231) 11.749 3.702 ( -2.238 -0.766 1.502) 2.802 4.226 ( -2.914 0.309 -0.763) 3.028 4.364 ( 3.861 -1.776 6.843) 8.056 4.613 ( -10.738 2.912 6.238) 12.755 4.946 ( -1.536 -6.973 -0.035) 7.140 5.109 ( -9.373 0.246 0.346) 9.383 5.660 ( 5.371 3.506 -12.529) 14.075 6.461 ( -8.321 2.782 11.672) 14.602 7.310 ( -0.642 -5.851 -2.477) 6.386 7.799 ( -3.051 -3.229 -10.641) 11.530 8.802 ( -20.737 3.267 0.637) 21.002 8.987 ( -4.888 -2.235 7.700) 9.391 9.602 ( -5.987 -10.786 3.919) 12.944 9.878 ( -6.460 4.590 6.443) 10.214 10.096 ( -9.170 -4.855 10.400) 14.691 11.292 ( 16.644 23.129 -5.533) 29.028 11.532 ( 7.718 5.064 1.335) 9.327 11.760 ( 19.090 5.576 -22.427) 29.975 12.848 ( 0.621 -1.985 -2.343) 3.133 13.451 ( -3.016 -5.847 -3.914) 7.655 13.746 ( -9.675 0.398 4.036) 10.491 14.139 ( 4.930 2.920 6.053) 8.335 14.514 ( 9.137 -14.225 -2.934) 17.159 16.989 ( -9.992 -2.681 21.539) 23.895 18.615 ( 1.752 -4.689 -15.911) 16.679 19.472 ( 10.776 5.687 6.452) 13.787 19.692 ( 3.478 -1.418 -0.424) 3.779 20.290 ( -1.935 2.684 -7.423) 8.128 22.983 ( -16.490 -13.260 6.063) 22.012 23.832 ( 14.012 12.353 -2.204) 18.809 24.635 ( 2.843 -3.809 4.170) 6.323 ======================= Grid point 535 (266/361) ======================= q-point: (-0.50 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.179 ( -4.410 5.138 2.921) 7.374 2.416 ( -14.732 5.854 14.584) 21.540 3.044 ( 7.558 -4.522 -4.119) 9.723 3.397 ( -5.270 -4.676 -2.867) 7.607 3.559 ( -0.784 2.354 0.440) 2.519 3.679 ( 0.149 -2.854 -0.059) 2.859 4.052 ( -14.611 -5.424 -3.873) 16.059 4.502 ( -4.923 0.445 7.626) 9.088 4.675 ( 9.871 -0.527 10.799) 14.640 4.919 ( -4.946 -3.345 -6.133) 8.559 5.104 ( 2.204 1.291 7.022) 7.472 5.588 ( 9.862 3.112 -11.054) 15.137 6.495 ( -5.188 1.421 12.880) 13.958 7.332 ( -3.541 -8.732 -0.464) 9.434 7.690 ( -0.104 -3.480 -9.641) 10.250 8.509 ( -20.653 -5.837 1.770) 21.535 9.056 ( -0.009 4.494 10.369) 11.301 9.665 ( -11.273 -11.195 8.730) 18.128 9.844 ( -2.196 5.174 6.904) 8.903 10.143 ( -8.230 -6.274 8.611) 13.463 11.181 ( 6.092 22.231 -6.017) 23.823 11.564 ( 14.191 12.060 -8.333) 20.403 11.692 ( 12.484 5.321 -16.119) 21.071 12.822 ( -3.546 -1.124 -1.236) 3.919 13.413 ( -3.817 -2.407 -0.915) 4.604 13.668 ( -8.876 -0.236 5.771) 10.590 14.195 ( 2.576 2.618 0.607) 3.723 14.723 ( 9.049 -12.333 -6.814) 16.746 17.265 ( -1.793 -6.620 28.938) 29.740 18.471 ( 4.692 -3.738 -21.217) 22.049 19.547 ( 2.878 7.016 -2.035) 7.852 19.798 ( 12.877 -0.390 -1.945) 13.028 20.195 ( -1.593 0.554 -1.572) 2.306 22.922 ( -19.311 -17.117 4.248) 26.152 23.860 ( 11.199 12.538 -3.752) 17.225 24.716 ( -1.890 -2.114 1.983) 3.461 ======================= Grid point 536 (267/361) ======================= q-point: (-0.40 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.134 ( -4.159 10.612 11.179) 15.966 2.336 ( -12.193 8.217 16.158) 21.847 3.127 ( 2.708 -1.034 -0.004) 2.898 3.288 ( -11.632 -5.281 -2.227) 12.967 3.464 ( -3.049 -1.115 -6.236) 7.030 3.736 ( 3.488 2.229 2.302) 4.736 3.904 ( -6.474 -12.959 -9.223) 17.173 4.522 ( -7.031 1.127 12.419) 14.315 4.744 ( -8.795 -1.558 -5.930) 10.721 5.032 ( 17.244 -1.420 7.912) 19.026 5.214 ( 2.756 2.318 6.275) 7.235 5.633 ( 13.903 1.267 -6.290) 15.312 6.600 ( -1.656 -1.579 12.355) 12.566 7.343 ( -8.353 -9.232 3.160) 12.844 7.597 ( 2.380 0.825 -10.823) 11.112 8.420 ( -13.904 -15.590 8.581) 22.583 9.148 ( -0.137 5.367 11.884) 13.041 9.688 ( -14.386 -5.313 14.947) 21.415 9.914 ( 1.372 -1.016 7.722) 7.909 10.154 ( -7.523 -1.083 4.836) 9.009 10.938 ( -2.797 17.483 -5.802) 18.631 11.500 ( 19.427 13.628 -21.739) 32.183 11.660 ( 6.519 6.776 -3.814) 10.147 12.723 ( -8.367 0.808 -1.276) 8.502 13.367 ( -4.473 2.429 3.855) 6.386 13.636 ( -5.729 0.114 5.588) 8.004 14.204 ( 1.311 2.119 0.233) 2.503 14.817 ( 6.559 -10.158 -12.647) 17.497 17.694 ( 5.169 -8.425 20.954) 23.168 18.338 ( 9.121 -2.974 -17.764) 20.189 19.417 ( -4.186 4.187 -7.662) 9.683 19.939 ( 8.035 -0.072 -6.110) 10.095 20.232 ( 9.289 1.782 4.538) 10.491 22.845 ( -22.680 -20.093 3.983) 30.561 23.848 ( 10.198 10.456 -5.453) 15.591 24.646 ( -7.876 2.273 -1.921) 8.420 ======================= Grid point 537 (268/361) ======================= q-point: (-0.30 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.133 ( -4.115 9.057 13.846) 17.049 2.332 ( -8.299 8.102 18.984) 22.246 3.120 ( -11.583 -2.807 -1.479) 12.010 3.131 ( -2.392 -1.112 -0.848) 2.771 3.417 ( 6.260 0.178 -5.409) 8.275 3.800 ( 3.942 -1.474 -3.715) 5.613 3.824 ( -4.069 -10.880 -7.599) 13.881 4.464 ( -12.175 -0.780 -4.663) 13.061 4.658 ( -0.526 4.252 10.855) 11.670 5.276 ( 0.397 4.295 5.363) 6.882 5.375 ( 13.579 -4.103 5.925) 15.373 5.795 ( 14.289 -1.105 -1.589) 14.419 6.775 ( 2.291 -5.574 9.247) 11.037 7.367 ( -8.267 -6.623 7.871) 13.197 7.502 ( 3.674 1.170 -6.484) 7.544 8.552 ( -11.309 -21.410 12.397) 27.202 9.240 ( -1.636 3.457 11.766) 12.372 9.758 ( -13.664 -2.303 23.092) 26.931 10.057 ( 3.027 15.577 0.539) 15.878 10.062 ( -5.813 -13.179 6.984) 16.008 10.683 ( -5.694 13.662 -1.484) 14.876 11.370 ( 17.166 16.770 -19.399) 30.858 11.607 ( 3.395 4.510 -9.146) 10.748 12.544 ( -12.785 0.366 -1.725) 12.906 13.349 ( -3.474 5.190 8.411) 10.476 13.627 ( -1.776 2.809 3.750) 5.011 14.200 ( -0.244 1.553 0.463) 1.639 14.802 ( 4.665 -8.485 -16.263) 18.928 17.903 ( 8.848 -2.342 -10.740) 14.111 18.512 ( 15.076 -8.876 7.798) 19.154 19.179 ( -9.522 0.671 -11.251) 14.755 19.867 ( -3.051 2.159 -6.754) 7.719 20.529 ( 22.487 2.460 6.438) 23.520 22.706 ( -28.198 -19.483 1.931) 34.329 23.845 ( 10.863 7.175 -5.980) 14.327 24.421 ( -12.087 6.400 -3.221) 14.051 ======================= Grid point 538 (269/361) ======================= q-point: (-0.20 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.200 ( -2.087 2.949 12.991) 13.484 2.401 ( -5.345 5.902 19.194) 20.780 2.977 ( -7.038 -3.452 -2.312) 8.173 3.134 ( 2.206 -0.822 -0.842) 2.500 3.467 ( 10.658 3.757 -4.999) 12.357 3.679 ( -4.571 -9.089 -14.029) 17.329 3.877 ( 1.459 -2.003 0.101) 2.481 4.201 ( -11.320 2.881 -7.032) 13.634 4.792 ( 2.259 2.835 12.746) 13.252 5.280 ( -1.322 4.465 3.589) 5.879 5.621 ( 5.958 -3.153 5.212) 8.521 5.987 ( 10.695 -2.342 -0.349) 10.954 6.951 ( 2.134 -6.392 3.269) 7.490 7.309 ( -1.813 2.516 -4.365) 5.355 7.702 ( 4.243 -10.461 20.391) 23.308 8.750 ( -12.366 -24.580 12.115) 30.065 9.327 ( -3.123 1.344 11.839) 12.317 9.775 ( -18.757 5.630 18.669) 27.056 10.022 ( 9.837 14.522 6.051) 18.554 10.214 ( -6.177 -16.922 3.505) 18.352 10.490 ( -3.005 16.950 2.826) 17.445 11.232 ( 13.507 20.159 -8.921) 25.853 11.473 ( 5.727 -0.113 -17.963) 18.854 12.308 ( -16.105 -1.948 -4.501) 16.835 13.373 ( -2.444 5.602 9.990) 11.711 13.628 ( 2.867 5.704 1.626) 6.587 14.177 ( -2.559 0.699 0.695) 2.742 14.727 ( 3.422 -6.908 -16.421) 18.141 17.903 ( 12.960 -0.272 -13.167) 18.477 18.853 ( -14.616 -3.345 -13.985) 20.504 18.944 ( 17.445 -7.050 6.794) 20.005 19.688 ( -6.037 3.789 -6.305) 9.517 20.950 ( 25.615 2.557 8.727) 27.181 22.415 ( -33.125 -13.446 -2.061) 35.809 23.890 ( 11.173 3.501 -4.780) 12.646 24.148 ( -12.252 6.643 -1.399) 14.007 ======================= Grid point 539 (270/361) ======================= q-point: (-0.10 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.325 ( 0.053 -0.431 11.816) 11.824 2.528 ( -0.531 2.085 12.424) 12.609 2.951 ( -0.097 -2.188 3.107) 3.801 3.167 ( 3.476 -4.322 -5.604) 7.885 3.458 ( 4.061 0.818 -12.838) 13.490 3.586 ( 1.874 1.200 -0.554) 2.293 3.838 ( -5.748 -0.363 -6.135) 8.414 3.971 ( -3.920 3.174 -4.206) 6.567 4.966 ( 4.068 1.068 10.447) 11.262 5.256 ( -1.617 3.517 2.176) 4.441 5.731 ( -2.387 -1.537 5.541) 6.226 6.109 ( 4.709 -2.012 -1.771) 5.419 6.983 ( -6.210 -1.490 0.855) 6.444 7.260 ( 2.978 -0.619 -3.339) 4.517 8.211 ( 6.788 -13.084 28.283) 31.894 8.906 ( -15.168 -23.983 8.480) 29.618 9.416 ( -6.368 -1.315 13.643) 15.114 9.737 ( -1.632 6.893 12.004) 13.938 10.062 ( -6.004 18.959 -1.121) 19.918 10.148 ( -4.050 4.966 12.310) 13.878 10.396 ( -2.393 -1.669 -5.947) 6.624 11.287 ( 18.130 11.723 7.358) 22.809 11.375 ( 12.580 0.121 -18.927) 22.727 12.011 ( -15.516 -3.970 -10.300) 19.042 13.404 ( -2.750 5.017 8.644) 10.366 13.643 ( 5.486 6.246 -0.373) 8.322 14.138 ( -4.552 -0.716 1.804) 4.948 14.636 ( 2.427 -4.597 -13.840) 14.784 17.990 ( 15.640 0.025 -6.301) 16.862 18.449 ( -16.625 -0.759 -16.819) 23.661 19.283 ( 8.400 -7.390 2.406) 11.444 19.505 ( -1.222 4.394 -5.258) 6.960 21.418 ( 24.412 1.503 11.361) 26.968 21.974 ( -32.870 -5.731 -4.931) 33.728 23.925 ( -8.578 3.679 -0.021) 9.334 23.988 ( 9.622 1.196 -3.110) 10.182 ======================= Grid point 542 (271/361) ======================= q-point: ( 0.20 0.20 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.318 ( -3.175 -0.000 -6.971) 7.660 2.545 ( -5.735 -0.000 -1.414) 5.907 3.059 ( -0.397 -0.000 -11.423) 11.429 3.260 ( 2.165 0.000 -1.125) 2.440 3.383 ( 11.496 0.000 5.514) 12.750 3.728 ( -3.000 -0.000 10.401) 10.825 4.118 ( 10.978 0.000 11.398) 15.825 4.227 ( 0.689 0.000 -1.024) 1.234 4.766 ( -4.314 -0.000 -1.539) 4.580 4.962 ( -17.597 -0.000 -0.927) 17.621 5.279 ( -14.824 -0.000 2.343) 15.008 5.804 ( 3.516 0.000 -11.661) 12.180 6.528 ( -11.256 -0.000 8.704) 14.229 7.270 ( -0.026 -0.000 -1.836) 1.836 8.034 ( -10.350 -0.000 -18.884) 21.534 8.874 ( -7.041 -0.000 13.179) 14.942 9.157 ( -20.624 -0.000 7.338) 21.890 9.496 ( -7.078 -0.000 -2.644) 7.556 9.996 ( -14.683 -0.000 22.222) 26.635 10.022 ( 2.134 0.000 -9.806) 10.036 11.368 ( 12.436 0.000 9.343) 15.555 11.475 ( 22.116 0.000 -8.350) 23.640 11.802 ( 23.406 0.000 -21.906) 32.058 12.820 ( 5.598 0.000 -1.104) 5.705 13.443 ( -4.107 -0.000 -6.617) 7.788 13.724 ( 11.960 0.000 2.401) 12.199 13.997 ( -11.155 -0.000 19.900) 22.813 14.284 ( 2.304 0.000 -8.064) 8.386 16.980 ( -15.779 -0.000 7.718) 17.565 18.697 ( -1.769 -0.000 -9.176) 9.345 19.264 ( 13.044 0.000 12.510) 18.074 19.632 ( -1.343 -0.000 0.163) 1.353 20.507 ( -3.269 -0.000 -11.853) 12.296 22.889 ( -10.310 -0.000 12.211) 15.982 23.826 ( 14.103 0.000 0.244) 14.105 24.470 ( 5.570 0.000 0.696) 5.613 ======================= Grid point 543 (272/361) ======================= q-point: (-0.70 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.242 ( -0.212 -1.059 -2.441) 2.669 2.496 ( -4.832 -0.121 5.687) 7.464 2.931 ( 2.293 -0.835 -10.171) 10.459 3.280 ( 0.852 -4.900 -3.321) 5.980 3.585 ( 8.329 2.151 4.137) 9.546 3.754 ( -9.774 4.703 10.515) 15.106 4.147 ( -10.137 -5.470 -2.161) 11.720 4.388 ( 9.767 2.145 9.037) 13.479 4.670 ( -13.897 2.698 0.621) 14.170 4.821 ( 2.274 -5.207 0.753) 5.732 5.119 ( -11.194 0.418 4.295) 11.997 5.712 ( 6.306 1.688 -13.431) 14.933 6.501 ( -9.004 1.340 11.525) 14.686 7.229 ( -3.549 -2.501 -2.181) 4.859 7.730 ( -4.541 -2.800 -14.250) 15.215 8.800 ( -20.586 -0.639 -2.485) 20.746 9.032 ( -7.131 3.155 17.093) 18.788 9.418 ( -7.155 -6.918 1.284) 10.036 9.956 ( 0.507 3.257 -0.863) 3.407 10.034 ( -14.314 -2.198 16.359) 21.848 11.585 ( 11.070 5.211 0.013) 12.235 11.658 ( 25.287 8.243 -10.896) 28.742 11.839 ( 16.855 2.808 -17.614) 24.541 12.829 ( 0.445 -0.075 -2.923) 2.958 13.338 ( -3.591 -4.837 -4.057) 7.262 13.746 ( -8.135 -0.249 2.942) 8.655 14.193 ( 4.422 3.471 3.520) 6.633 14.300 ( 6.699 -8.430 3.975) 11.478 16.956 ( -11.467 -0.926 20.455) 23.468 18.556 ( 1.151 -1.622 -14.328) 14.465 19.562 ( 10.587 3.403 9.112) 14.377 19.663 ( 5.094 -1.505 -0.082) 5.312 20.317 ( -2.591 0.523 -11.837) 12.128 22.817 ( -17.299 -4.635 7.110) 19.269 24.021 ( 12.433 6.731 2.464) 14.351 24.555 ( 2.945 -3.641 0.812) 4.753 ======================= Grid point 544 (273/361) ======================= q-point: (-0.60 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.253 ( 0.942 2.974 4.225) 5.252 2.514 ( -7.621 4.507 12.954) 15.691 2.929 ( 7.483 -6.420 -6.725) 11.935 3.288 ( 0.389 -5.917 -5.342) 7.981 3.601 ( -15.565 2.289 2.459) 15.923 3.680 ( 0.590 0.757 3.008) 3.157 3.992 ( -11.992 -1.187 -2.381) 12.284 4.524 ( -3.441 1.566 6.628) 7.630 4.627 ( 2.377 -3.537 7.530) 8.653 4.867 ( 0.988 -2.279 -3.457) 4.257 5.127 ( -0.418 1.238 11.401) 11.475 5.643 ( 10.090 2.443 -13.000) 16.637 6.522 ( -6.775 1.357 12.383) 14.180 7.176 ( -7.171 -7.234 -0.745) 10.213 7.601 ( 0.267 -4.856 -8.445) 9.745 8.440 ( -21.577 -1.486 -3.753) 21.951 9.148 ( -2.673 4.249 16.484) 17.231 9.432 ( -7.817 -11.778 3.827) 14.645 9.937 ( -7.453 4.427 10.732) 13.796 10.054 ( -7.033 -3.187 9.281) 12.073 11.567 ( 9.429 16.228 -10.320) 21.419 11.742 ( 22.382 4.331 -26.965) 35.311 11.850 ( 12.956 13.442 1.283) 18.713 12.790 ( -2.813 -1.949 -1.791) 3.862 13.327 ( -2.087 -5.994 -0.214) 6.351 13.663 ( -10.642 -0.451 6.480) 12.468 14.201 ( 3.545 -1.833 -5.601) 6.878 14.544 ( 6.423 -6.101 3.431) 9.500 17.170 ( -4.889 -3.595 29.607) 30.222 18.407 ( 4.060 -2.780 -19.568) 20.177 19.696 ( 4.924 8.073 0.101) 9.456 19.788 ( 12.765 -0.551 -1.884) 12.915 20.164 ( -2.089 -3.285 -7.096) 8.094 22.685 ( -19.923 -8.677 5.958) 22.532 24.092 ( 7.949 11.895 -0.296) 14.310 24.633 ( -0.774 -6.261 0.633) 6.340 ======================= Grid point 545 (274/361) ======================= q-point: (-0.50 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.302 ( -1.326 6.709 10.216) 12.294 2.494 ( -9.200 9.656 14.908) 20.003 3.044 ( 3.501 -7.018 -1.158) 7.928 3.242 ( -5.014 -0.300 -2.173) 5.472 3.407 ( -9.221 -3.492 -2.326) 10.130 3.652 ( -8.078 -11.874 -6.502) 15.765 3.859 ( 2.713 6.706 -1.728) 7.437 4.538 ( -7.502 1.006 8.926) 11.704 4.696 ( -5.302 -2.647 1.425) 6.095 4.982 ( 12.302 -4.252 3.395) 13.452 5.268 ( 2.236 3.497 10.906) 11.669 5.660 ( 13.187 1.398 -8.393) 15.694 6.585 ( -3.717 -0.282 11.096) 11.705 7.140 ( -11.078 -11.425 2.742) 16.149 7.582 ( 2.944 -1.991 -6.082) 7.044 8.194 ( -15.010 -8.716 1.229) 17.401 9.258 ( -3.440 5.652 15.711) 17.048 9.493 ( -7.950 -12.777 6.660) 16.456 9.917 ( -17.646 0.754 19.632) 26.408 10.131 ( 3.288 -0.629 4.502) 5.610 11.339 ( 4.463 22.361 -12.757) 26.128 11.634 ( 16.234 3.758 -27.041) 31.763 11.933 ( 16.171 18.745 -0.810) 24.770 12.719 ( -7.310 -1.477 -1.904) 7.697 13.360 ( -2.429 -2.569 4.179) 5.474 13.628 ( -7.114 -1.266 7.729) 10.581 14.203 ( 2.702 -2.591 -4.793) 6.082 14.661 ( 2.511 -5.835 -3.374) 7.192 17.561 ( 1.408 -5.885 28.487) 29.122 18.261 ( 7.040 -4.432 -20.765) 22.369 19.552 ( -3.040 9.607 -9.454) 13.817 19.925 ( 6.618 -1.334 -5.154) 8.493 20.217 ( 12.599 -3.265 0.758) 13.037 22.555 ( -21.905 -11.526 6.496) 25.590 24.055 ( 6.001 11.704 -3.217) 13.541 24.628 ( -6.054 -3.871 -1.886) 7.429 ======================= Grid point 546 (275/361) ======================= q-point: (-0.40 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.303 ( -7.378 7.976 10.897) 15.389 2.475 ( -8.079 8.621 17.448) 21.072 3.037 ( -8.778 -4.322 -3.096) 10.263 3.160 ( -4.176 2.513 3.876) 6.228 3.378 ( 4.595 -3.732 -2.468) 6.413 3.579 ( -3.724 -13.475 -10.614) 17.553 3.855 ( 7.777 4.012 -5.042) 10.099 4.429 ( -12.499 -2.098 -2.387) 12.897 4.734 ( -0.046 3.903 11.927) 12.550 5.245 ( 9.020 -7.088 1.547) 11.575 5.389 ( 3.442 5.040 10.472) 12.121 5.783 ( 12.894 -0.414 -2.514) 13.144 6.695 ( -0.017 -3.241 8.675) 9.261 7.158 ( -10.145 -13.559 7.746) 18.622 7.540 ( 2.725 2.006 -6.578) 7.397 8.194 ( -10.974 -17.247 7.140) 21.654 9.332 ( -4.888 5.765 15.160) 16.940 9.620 ( -5.516 -11.753 12.223) 17.832 9.894 ( -22.465 -4.081 21.069) 31.068 10.255 ( 8.499 5.640 4.699) 11.230 11.023 ( 2.221 22.151 -11.263) 24.949 11.513 ( 16.180 2.025 -25.887) 30.595 11.908 ( 11.669 23.523 -5.546) 26.837 12.547 ( -13.471 -0.198 -2.635) 13.728 13.403 ( -3.148 0.939 8.169) 8.805 13.666 ( -0.872 0.774 6.917) 7.014 14.205 ( 0.839 -1.769 -2.565) 3.227 14.655 ( 0.034 -6.386 -9.029) 11.059 17.868 ( 7.242 -1.338 -0.555) 7.386 18.309 ( 9.125 -11.970 3.171) 15.381 19.258 ( -7.315 6.837 -12.909) 16.337 19.880 ( -2.570 -0.655 -6.327) 6.860 20.551 ( 25.392 -0.352 3.277) 25.605 22.407 ( -25.238 -12.535 5.879) 28.787 23.996 ( 6.479 8.970 -4.784) 12.055 24.483 ( -10.471 0.479 -4.140) 11.270 ======================= Grid point 547 (276/361) ======================= q-point: (-0.30 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.265 ( -6.655 3.608 10.331) 12.807 2.519 ( -6.443 7.027 17.574) 19.993 2.907 ( -5.947 -3.849 -3.144) 7.750 3.142 ( -1.776 1.710 2.027) 3.192 3.495 ( 3.794 -4.741 -7.057) 9.310 3.506 ( 2.630 -5.856 -4.401) 7.783 3.869 ( 7.784 1.176 -7.638) 10.969 4.219 ( -11.456 -0.591 -4.863) 12.460 4.864 ( 1.498 4.720 13.271) 14.165 5.345 ( 1.031 1.036 1.083) 1.819 5.564 ( 4.326 -1.670 8.362) 9.562 5.946 ( 9.615 -1.989 -0.237) 9.822 6.842 ( 2.102 -5.518 5.199) 7.867 7.257 ( -5.862 -9.821 3.192) 11.875 7.548 ( 4.554 -3.633 6.205) 8.511 8.312 ( -11.016 -22.275 7.430) 25.938 9.392 ( -5.795 4.844 15.277) 17.042 9.791 ( -20.864 -2.799 27.283) 34.460 9.902 ( -5.896 -13.143 7.593) 16.283 10.353 ( 10.081 15.181 3.874) 18.630 10.777 ( 2.492 15.609 -4.903) 16.550 11.433 ( 15.655 0.097 -23.387) 28.143 11.709 ( 7.889 26.667 -9.457) 29.373 12.284 ( -17.548 -0.666 -4.459) 18.117 13.453 ( -3.222 2.808 10.095) 10.962 13.740 ( 4.474 5.710 4.986) 8.802 14.187 ( -2.693 -0.145 -0.192) 2.704 14.581 ( 0.029 -8.097 -12.792) 15.139 17.901 ( 12.588 0.173 -11.819) 17.268 18.652 ( 1.155 -13.500 6.059) 14.843 18.953 ( -1.948 3.394 -9.418) 10.198 19.736 ( -4.517 1.357 -7.468) 8.833 20.993 ( 28.238 1.816 6.218) 28.971 22.181 ( -29.145 -11.030 2.807) 31.288 23.974 ( 7.881 5.434 -4.602) 10.621 24.246 ( -11.960 3.647 -3.789) 13.065 ======================= Grid point 548 (277/361) ======================= q-point: (-0.20 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.318 ( -1.739 -0.231 10.371) 10.518 2.579 ( -1.725 3.311 9.678) 10.373 2.904 ( 1.186 -2.760 3.163) 4.362 3.115 ( -2.101 -0.991 -1.187) 2.609 3.386 ( -1.431 -6.282 -11.832) 13.472 3.651 ( 6.881 2.276 4.014) 8.285 3.840 ( 3.684 1.452 -10.674) 11.385 4.016 ( -5.669 1.475 -5.202) 7.834 5.007 ( 2.365 3.396 11.359) 12.089 5.329 ( -1.160 3.624 0.592) 3.851 5.695 ( -2.071 -2.012 7.050) 7.618 6.065 ( 4.468 -2.595 -1.174) 5.299 6.938 ( -3.332 -3.442 2.554) 5.428 7.227 ( -1.068 -3.542 -3.337) 4.982 7.929 ( 9.009 -15.714 19.519) 26.629 8.445 ( -10.648 -24.677 3.809) 27.145 9.448 ( -7.904 3.503 16.173) 18.339 9.800 ( -20.035 0.153 27.079) 33.685 10.045 ( -3.110 -9.989 1.226) 10.534 10.390 ( 10.809 16.434 4.274) 20.129 10.613 ( -3.653 17.564 -2.347) 18.093 11.369 ( 12.591 -0.142 -18.645) 22.498 11.576 ( 19.227 19.041 -4.804) 27.483 11.948 ( -18.694 -1.826 -8.759) 20.725 13.497 ( -3.380 4.321 9.777) 11.211 13.793 ( 6.268 9.479 1.904) 11.523 14.127 ( -6.041 -0.400 0.936) 6.126 14.515 ( 1.901 -8.283 -12.111) 14.795 17.991 ( 15.572 0.186 -5.925) 16.662 18.433 ( -16.039 -0.913 -15.290) 22.178 19.135 ( 8.051 -8.614 5.654) 13.076 19.571 ( -0.926 2.735 -7.917) 8.427 21.457 ( 23.336 2.598 9.714) 25.410 21.849 ( -27.058 -7.115 -1.814) 28.036 24.005 ( -4.791 4.498 -2.234) 6.942 24.017 ( 3.184 1.880 -2.911) 4.706 ======================= Grid point 549 (278/361) ======================= q-point: (-0.10 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.448 ( 1.031 -2.495 7.929) 8.376 2.657 ( 4.960 2.258 4.076) 6.805 3.008 ( 3.317 -3.498 -2.073) 5.248 3.093 ( -0.334 -1.247 1.375) 1.886 3.321 ( -0.747 -4.735 -2.575) 5.442 3.655 ( -10.815 -0.687 0.279) 10.840 3.731 ( 8.848 8.100 -10.591) 16.002 3.960 ( 6.259 2.743 -1.647) 7.030 5.134 ( 1.634 1.537 7.528) 7.856 5.266 ( -2.105 2.992 -2.204) 4.271 5.713 ( -9.259 -0.743 7.269) 11.795 6.084 ( -0.512 -2.020 -3.698) 4.245 6.865 ( -11.069 -1.368 1.759) 11.291 7.253 ( 3.143 -2.008 -1.630) 4.070 8.397 ( -4.239 -21.191 10.072) 23.843 8.604 ( 1.224 -21.087 9.506) 23.163 9.503 ( -10.444 1.715 18.406) 21.232 9.911 ( -8.319 0.444 19.645) 21.338 9.961 ( -9.397 5.919 -0.367) 11.112 10.269 ( -8.662 13.973 -9.308) 18.892 10.507 ( 13.052 11.258 7.015) 18.610 11.352 ( 9.680 1.051 -16.267) 18.958 11.624 ( -4.487 -3.719 -11.107) 12.543 11.797 ( 22.757 7.081 5.601) 24.482 13.501 ( -3.785 6.067 6.884) 9.926 13.785 ( 4.471 9.467 -1.572) 10.587 14.067 ( -7.125 -2.776 3.018) 8.220 14.484 ( 3.058 -4.482 -9.144) 10.632 17.994 ( -17.727 -0.084 -15.870) 23.793 18.197 ( 16.629 0.283 1.292) 16.682 19.221 ( -7.668 -2.015 -0.410) 7.939 19.566 ( 11.036 -0.967 -4.016) 11.784 21.388 ( -28.874 -5.095 -2.845) 29.458 21.975 ( 24.731 3.645 10.362) 27.061 23.824 ( -7.377 2.775 -1.643) 8.051 24.109 ( 9.260 0.271 -1.129) 9.332 ======================= Grid point 553 (279/361) ======================= q-point: ( 0.30 -0.70 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( 2.510 0.000 5.184) 5.759 2.558 ( -1.898 -0.000 11.437) 11.593 2.863 ( 5.619 0.000 -7.578) 9.434 3.225 ( 2.276 0.000 -5.221) 5.696 3.642 ( -5.223 -0.000 -2.048) 5.610 3.668 ( -22.352 -0.000 7.374) 23.537 3.989 ( -3.622 -0.000 0.020) 3.622 4.532 ( -5.049 -0.000 5.383) 7.380 4.599 ( 2.043 0.000 6.895) 7.191 4.842 ( 2.154 0.000 -2.886) 3.601 5.141 ( -1.001 -0.000 13.275) 13.313 5.667 ( 10.007 0.000 -13.909) 17.135 6.536 ( -7.674 -0.000 12.474) 14.645 7.103 ( -8.693 -0.000 -1.196) 8.775 7.552 ( 1.329 0.000 -8.273) 8.379 8.432 ( -21.788 -0.000 -5.253) 22.412 9.191 ( -5.234 -0.000 19.257) 19.955 9.311 ( -6.110 -0.000 2.723) 6.689 9.993 ( -22.048 -0.000 21.855) 31.044 10.014 ( 7.331 0.000 -2.122) 7.632 11.728 ( 9.267 0.000 -5.882) 10.976 11.764 ( 21.398 0.000 -30.420) 37.192 12.013 ( 19.467 0.000 -1.452) 19.521 12.768 ( -4.380 -0.000 -2.262) 4.929 13.255 ( -0.983 -0.000 0.457) 1.084 13.657 ( -11.261 -0.000 6.325) 12.916 14.172 ( 4.376 0.000 -9.100) 10.098 14.495 ( 4.810 0.000 8.886) 10.104 17.136 ( -6.002 -0.000 29.829) 30.426 18.380 ( 3.742 0.000 -19.144) 19.506 19.777 ( 13.143 0.000 -2.475) 13.374 19.792 ( 6.068 0.000 4.763) 7.714 20.119 ( -3.138 -0.000 -12.299) 12.693 22.606 ( -19.877 -0.000 6.635) 20.955 24.229 ( 6.217 0.000 2.880) 6.851 24.547 ( 0.014 0.000 -1.731) 1.731 ======================= Grid point 555 (280/361) ======================= q-point: (-0.60 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.380 ( -2.078 2.142 9.651) 10.102 2.656 ( -2.403 5.994 12.184) 13.790 2.936 ( 6.676 -3.433 0.083) 7.508 3.227 ( 5.358 -1.672 -4.960) 7.490 3.372 ( -19.908 -0.081 1.288) 19.950 3.477 ( -13.058 -5.987 -5.421) 15.353 3.949 ( -0.227 2.432 -2.338) 3.381 4.560 ( -5.457 0.872 4.593) 7.186 4.679 ( -0.332 0.987 7.935) 8.003 4.890 ( 5.446 -4.507 1.951) 7.333 5.325 ( 2.908 2.089 13.461) 13.929 5.676 ( 12.673 0.312 -10.556) 16.497 6.584 ( -5.580 0.064 11.105) 12.428 6.978 ( -11.347 -5.047 1.658) 12.529 7.547 ( 3.982 -1.276 -1.837) 4.567 8.096 ( -16.725 -2.365 -4.172) 17.399 9.308 ( -3.682 -4.810 5.243) 8.011 9.335 ( -6.944 1.316 18.805) 20.089 9.928 ( -24.326 0.362 23.111) 33.556 10.126 ( 8.594 -0.089 1.408) 8.709 11.634 ( 12.902 6.445 -24.105) 28.090 11.702 ( 9.909 4.860 -18.277) 21.350 12.234 ( 20.873 11.670 -3.036) 24.106 12.666 ( -8.089 -3.662 -1.747) 9.049 13.307 ( 1.130 -2.173 4.807) 5.395 13.596 ( -9.930 -1.542 8.391) 13.091 14.140 ( 4.473 -2.704 -8.493) 9.972 14.606 ( -0.751 -0.971 3.800) 3.993 17.486 ( -1.075 -2.148 32.571) 32.660 18.201 ( 6.175 -1.814 -22.433) 23.338 19.728 ( -4.392 8.104 -11.108) 14.434 19.887 ( 2.331 -2.935 -3.169) 4.908 20.142 ( 19.507 -3.484 -2.269) 19.945 22.419 ( -20.720 -3.535 7.776) 22.412 24.253 ( 1.862 8.568 -0.759) 8.801 24.526 ( -3.661 -5.902 -2.852) 7.508 ======================= Grid point 556 (281/361) ======================= q-point: (-0.50 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.391 ( -9.994 2.191 9.330) 13.847 2.670 ( -4.314 11.470 12.052) 17.188 2.976 ( -7.624 -1.670 0.523) 7.823 3.204 ( -7.435 0.197 4.492) 8.689 3.297 ( 4.507 -5.266 -2.287) 7.299 3.354 ( 0.335 -8.363 -7.221) 11.054 3.898 ( 3.658 0.037 -6.962) 7.864 4.423 ( -10.591 1.622 -3.114) 11.158 4.802 ( 1.857 3.744 12.727) 13.396 5.095 ( 7.207 -8.564 3.440) 11.710 5.484 ( 2.713 4.905 11.049) 12.389 5.769 ( 11.684 -1.190 -3.934) 12.385 6.652 ( -2.678 -1.563 8.790) 9.321 6.935 ( -9.451 -9.431 5.808) 14.561 7.576 ( 2.262 2.051 -2.296) 3.820 7.935 ( -11.309 -10.675 1.486) 15.622 9.406 ( -2.923 -3.067 10.439) 11.266 9.442 ( -5.813 -1.309 16.193) 17.255 9.859 ( -26.518 -0.657 25.306) 36.661 10.299 ( 10.897 0.407 4.175) 11.677 11.410 ( 6.461 16.979 -18.662) 26.044 11.543 ( 12.198 2.126 -24.885) 27.795 12.299 ( 13.156 16.837 -5.143) 21.978 12.538 ( -9.513 -0.755 -3.949) 10.328 13.408 ( -0.837 0.631 8.872) 8.933 13.635 ( -1.751 -4.336 8.261) 9.493 14.138 ( 3.493 -4.287 -6.749) 8.725 14.590 ( -5.390 -1.148 -0.339) 5.521 17.860 ( 4.368 0.487 14.113) 14.781 18.112 ( 7.472 -8.724 -7.020) 13.462 19.391 ( -9.219 6.690 -14.622) 18.535 19.852 ( -2.313 -2.095 -5.490) 6.315 20.524 ( 29.453 -1.986 0.578) 29.526 22.249 ( -22.276 -5.128 7.486) 24.053 24.161 ( 1.578 8.684 -3.577) 9.523 24.448 ( -7.890 -3.932 -4.191) 9.761 ======================= Grid point 557 (282/361) ======================= q-point: (-0.40 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.317 ( -9.720 2.006 8.135) 12.832 2.665 ( -5.414 8.880 13.250) 16.844 2.848 ( -6.209 -2.347 -2.718) 7.173 3.173 ( -4.223 -0.316 2.634) 4.987 3.332 ( -1.293 -6.901 -6.989) 9.906 3.461 ( 7.454 -2.870 3.960) 8.915 3.893 ( 10.319 0.331 -10.575) 14.779 4.206 ( -10.452 0.044 -4.944) 11.562 4.950 ( 1.970 4.323 12.285) 13.171 5.282 ( 4.147 -6.759 0.973) 7.990 5.597 ( 1.406 4.394 10.060) 11.067 5.911 ( 8.082 -2.090 0.169) 8.349 6.752 ( -0.091 -4.173 6.313) 7.568 7.024 ( -4.636 -12.709 6.876) 15.175 7.546 ( 1.779 1.894 -0.607) 2.668 7.958 ( -9.022 -16.019 4.096) 18.836 9.477 ( -8.018 3.901 16.595) 18.839 9.644 ( 1.166 -9.012 11.573) 14.715 9.799 ( -27.510 -1.606 27.004) 38.582 10.518 ( 12.260 3.748 6.082) 14.189 11.100 ( 3.586 18.105 -14.643) 23.559 11.428 ( 13.867 -0.248 -23.540) 27.322 12.186 ( 9.550 21.744 -10.934) 26.145 12.289 ( -15.870 2.569 -4.194) 16.615 13.483 ( -4.175 1.196 11.204) 12.017 13.805 ( 7.692 0.301 7.133) 10.495 14.144 ( 1.030 -4.358 -4.488) 6.340 14.476 ( -7.633 -2.603 -4.876) 9.424 17.912 ( 12.252 1.092 -11.666) 16.953 18.419 ( 3.071 -11.276 14.572) 18.679 19.022 ( -8.872 3.753 -13.468) 16.559 19.741 ( -3.179 -0.603 -7.527) 8.193 21.008 ( 32.188 -0.178 3.496) 32.377 22.033 ( -25.280 -5.114 4.725) 26.222 24.079 ( 3.190 5.746 -4.106) 7.749 24.278 ( -10.070 -0.013 -4.484) 11.023 ======================= Grid point 558 (283/361) ======================= q-point: (-0.30 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.322 ( -2.121 0.762 8.645) 8.934 2.639 ( -3.404 2.832 4.380) 6.228 2.863 ( 2.884 -1.125 4.337) 5.328 3.129 ( -5.079 2.014 2.846) 6.161 3.266 ( -2.242 -6.364 -8.132) 10.567 3.624 ( -0.187 -4.173 6.284) 7.546 3.904 ( 13.433 4.497 -13.000) 19.226 4.025 ( -4.399 -0.307 -5.814) 7.298 5.075 ( 1.211 3.449 10.286) 10.916 5.350 ( -0.162 -2.036 -0.898) 2.231 5.687 ( -2.222 1.830 9.451) 9.879 6.020 ( 3.711 -2.230 -0.060) 4.330 6.859 ( -1.626 -4.969 4.149) 6.674 7.108 ( -3.856 -9.520 -0.713) 10.296 7.700 ( 8.652 -8.219 10.787) 16.086 8.043 ( -6.405 -18.458 1.726) 19.614 9.518 ( -9.886 3.690 16.245) 19.371 9.777 ( -25.308 -2.021 30.473) 39.663 9.866 ( 1.502 -8.608 6.269) 10.754 10.666 ( 8.094 11.881 2.964) 14.678 10.881 ( 2.418 11.745 -6.321) 13.555 11.364 ( 14.773 -0.386 -20.474) 25.250 11.935 ( -5.029 12.369 -8.247) 15.694 11.998 ( -0.036 13.756 -8.221) 16.025 13.547 ( -4.731 1.216 11.534) 12.525 13.963 ( 8.280 8.417 4.048) 12.482 14.119 ( -5.115 -1.290 -0.545) 5.304 14.353 ( -1.731 -8.377 -8.795) 12.269 17.997 ( 15.502 0.441 -5.688) 16.518 18.417 ( -14.201 -0.880 -12.000) 18.613 18.980 ( 5.009 -7.870 7.408) 11.913 19.605 ( -0.296 1.037 -9.165) 9.228 21.505 ( 25.246 2.467 6.931) 26.296 21.736 ( -22.131 -4.812 -0.213) 22.649 24.050 ( -0.214 1.646 -2.819) 3.272 24.080 ( -4.464 3.455 -3.152) 6.465 ======================= Grid point 559 (284/361) ======================= q-point: (-0.20 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.422 ( 0.921 -0.074 7.771) 7.826 2.688 ( 7.165 0.996 2.603) 7.688 2.955 ( 1.918 -2.040 -1.445) 3.151 3.097 ( -1.556 1.969 4.229) 4.918 3.229 ( -0.399 -5.411 -1.111) 5.538 3.612 ( -13.225 -3.901 2.221) 13.966 3.858 ( 10.322 4.403 -15.189) 18.885 4.010 ( 9.536 3.814 -0.895) 10.309 5.170 ( -0.259 1.666 7.420) 7.609 5.304 ( -3.412 0.603 -2.890) 4.512 5.712 ( -7.770 1.196 8.225) 11.377 6.047 ( -0.407 -1.787 -2.585) 3.169 6.829 ( -10.890 -2.619 1.109) 11.255 7.173 ( 3.122 -7.236 0.429) 7.893 8.029 ( -2.379 -17.194 1.926) 17.464 8.238 ( 9.643 -18.334 8.804) 22.508 9.530 ( -13.174 1.286 18.014) 22.354 9.865 ( -16.738 -3.528 27.806) 32.646 9.970 ( -0.219 -2.190 0.996) 2.416 10.616 ( -10.173 17.794 -4.816) 21.055 10.683 ( 5.429 7.428 -1.552) 9.330 11.385 ( 16.658 1.768 -16.100) 23.234 11.613 ( -10.006 4.744 -8.200) 13.779 11.979 ( 20.698 12.221 -0.339) 24.039 13.595 ( -4.717 3.429 10.181) 11.733 13.953 ( -1.750 6.760 -1.052) 7.062 14.029 ( -4.363 -0.110 -0.680) 4.417 14.390 ( 6.957 -5.047 -4.690) 9.791 17.995 ( -17.735 0.231 -15.764) 23.729 18.204 ( 16.476 0.414 1.583) 16.557 19.164 ( -2.616 -4.065 4.197) 6.402 19.549 ( 9.014 -0.787 -7.045) 11.467 21.308 ( -28.670 -3.303 -2.113) 28.937 22.037 ( 28.749 2.805 7.281) 29.789 23.880 ( -8.150 3.088 -2.177) 8.984 24.115 ( 6.720 0.282 -0.433) 6.739 ======================= Grid point 560 (285/361) ======================= q-point: (-0.10 -0.70 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.503 ( -1.620 0.220 5.420) 5.662 2.851 ( 12.346 2.640 -1.324) 12.695 2.942 ( -0.914 -1.395 0.046) 1.669 3.115 ( 1.901 -0.160 -2.035) 2.789 3.289 ( -4.481 -4.393 3.427) 7.150 3.533 ( -2.959 -4.870 6.470) 8.622 3.760 ( 9.753 7.485 -15.073) 19.451 4.132 ( 8.758 3.454 3.110) 9.914 5.144 ( -6.864 0.649 -4.495) 8.231 5.239 ( -3.016 0.835 3.403) 4.624 5.638 ( -12.813 1.599 6.134) 14.295 5.984 ( -2.690 -1.252 -5.799) 6.514 6.689 ( -13.719 -2.713 2.514) 14.209 7.283 ( 4.325 -1.879 0.172) 4.718 8.086 ( -6.407 -18.878 -4.101) 20.353 8.699 ( 10.179 -17.354 8.698) 21.919 9.569 ( -14.367 -0.027 19.751) 24.424 9.878 ( -8.948 4.857 2.740) 10.544 10.014 ( -10.005 3.459 11.965) 15.976 10.180 ( -8.891 13.854 -3.864) 16.909 10.766 ( 6.910 -7.062 -1.460) 9.988 11.233 ( -3.719 11.718 -3.033) 12.663 11.566 ( 21.020 -2.186 -18.746) 28.249 12.282 ( 22.658 4.487 7.483) 24.280 13.586 ( -2.825 6.880 5.565) 9.289 13.848 ( -3.874 3.722 -0.605) 5.406 13.974 ( -5.371 -1.932 1.299) 5.854 14.462 ( 7.386 2.071 -4.064) 8.680 17.554 ( -18.742 -0.304 -12.179) 22.354 18.492 ( 16.131 0.250 7.122) 17.636 19.096 ( -5.458 1.860 -3.338) 6.662 19.656 ( 7.990 -1.314 -1.955) 8.329 20.916 ( -23.006 -5.025 -5.513) 24.185 22.495 ( 23.556 4.207 10.717) 26.219 23.725 ( -5.315 1.964 -3.251) 6.532 24.231 ( 7.442 -0.772 1.932) 7.727 ======================= Grid point 565 (286/361) ======================= q-point: ( 0.40 -0.60 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.408 ( -9.733 -0.000 7.629) 12.367 2.800 ( 0.401 0.000 8.363) 8.372 3.001 ( -8.073 -0.000 5.342) 9.680 3.097 ( -15.388 -0.000 0.818) 15.410 3.282 ( 2.984 0.000 -5.096) 5.905 3.292 ( 8.076 0.000 -0.495) 8.091 3.886 ( -0.200 -0.000 -6.322) 6.325 4.450 ( -9.128 -0.000 -4.359) 10.115 4.859 ( 2.848 0.000 12.600) 12.918 4.986 ( 6.212 0.000 4.598) 7.728 5.539 ( 2.092 0.000 12.843) 13.012 5.751 ( 11.695 0.000 -5.981) 13.136 6.637 ( -4.168 -0.000 9.253) 10.148 6.845 ( -8.496 -0.000 4.826) 9.771 7.603 ( 2.699 0.000 1.909) 3.306 7.828 ( -12.019 -0.000 -3.205) 12.439 9.342 ( 1.281 0.000 7.546) 7.654 9.465 ( -10.165 -0.000 20.422) 22.812 9.855 ( -26.694 -0.000 25.194) 36.706 10.299 ( 11.712 0.000 3.315) 12.172 11.527 ( 13.924 0.000 -26.508) 29.942 11.617 ( 5.369 0.000 -20.273) 20.972 12.472 ( -12.438 -0.000 -0.446) 12.446 12.517 ( 16.572 0.000 -7.358) 18.132 13.435 ( 7.364 0.000 7.126) 10.247 13.559 ( -8.901 -0.000 9.700) 13.165 14.094 ( 4.074 0.000 -6.835) 7.958 14.584 ( -6.995 -0.000 2.391) 7.392 17.872 ( 1.363 0.000 30.673) 30.704 18.022 ( 8.965 0.000 -21.895) 23.659 19.462 ( -11.513 -0.000 -15.594) 19.384 19.826 ( -1.583 -0.000 -4.832) 5.085 20.502 ( 31.576 0.000 -0.439) 31.579 22.205 ( -20.990 -0.000 7.862) 22.414 24.274 ( -1.754 -0.000 -2.369) 2.948 24.378 ( -5.480 -0.000 -4.856) 7.322 ======================= Grid point 567 (287/361) ======================= q-point: (-0.50 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.340 ( -8.573 0.604 6.016) 10.491 2.787 ( -9.301 1.112 0.171) 9.369 2.875 ( -4.076 8.346 5.623) 10.858 3.059 ( -2.998 -9.807 2.510) 10.558 3.303 ( -2.374 1.032 0.269) 2.602 3.420 ( 6.267 -1.183 3.231) 7.149 3.873 ( 10.472 -1.537 -7.573) 13.015 4.226 ( -9.656 1.311 -7.670) 12.401 5.020 ( 2.542 3.265 10.187) 10.996 5.156 ( 4.773 -5.605 3.526) 8.163 5.682 ( 0.266 3.716 10.664) 11.296 5.866 ( 7.681 -2.343 -0.365) 8.039 6.697 ( -2.718 -1.635 7.569) 8.207 6.854 ( -3.250 -4.969 5.633) 8.185 7.604 ( -0.775 4.557 -0.432) 4.642 7.728 ( -5.698 -9.278 1.368) 10.974 9.504 ( 2.584 -1.445 10.299) 10.716 9.553 ( -9.549 -0.343 18.986) 21.254 9.783 ( -28.372 -0.364 27.731) 39.675 10.545 ( 14.887 0.305 5.371) 15.829 11.356 ( 1.376 8.211 -20.320) 21.959 11.424 ( 13.245 -0.383 -24.098) 27.501 12.291 ( -10.634 0.987 -1.405) 10.772 12.515 ( 5.587 9.121 -11.569) 15.756 13.533 ( -4.683 4.749 10.654) 12.570 13.726 ( 10.986 -7.370 6.722) 14.839 14.085 ( 2.864 -1.330 -4.398) 5.414 14.464 ( -11.725 0.177 0.242) 11.728 17.936 ( 12.459 1.141 -14.536) 19.179 18.263 ( 2.637 -4.937 21.958) 22.660 19.075 ( -13.108 1.706 -15.137) 20.096 19.727 ( -1.898 -0.639 -7.370) 7.637 20.998 ( 35.038 -0.499 1.878) 35.091 21.980 ( -22.676 -1.123 4.912) 23.229 24.176 ( -1.479 4.670 -3.846) 6.228 24.251 ( -7.131 -2.753 -4.357) 8.799 ======================= Grid point 568 (288/361) ======================= q-point: (-0.40 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.344 ( 0.216 1.501 6.544) 6.718 2.665 ( -3.174 -0.034 -1.822) 3.660 2.878 ( 0.702 2.559 6.050) 6.606 3.129 ( -0.076 -4.000 -0.384) 4.019 3.205 ( -8.719 1.517 2.544) 9.209 3.541 ( -2.149 -4.047 5.908) 7.477 3.972 ( 10.366 2.590 -11.500) 15.698 4.014 ( 1.603 -0.666 -6.272) 6.507 5.124 ( 0.384 2.102 7.505) 7.803 5.274 ( 0.881 -5.073 0.460) 5.170 5.752 ( -2.269 4.368 9.453) 10.657 5.978 ( 2.978 -2.486 1.480) 4.152 6.774 ( -1.790 -3.727 5.563) 6.931 6.924 ( -3.647 -8.727 1.337) 9.552 7.623 ( 5.235 -0.968 4.722) 7.116 7.782 ( -1.522 -10.146 0.382) 10.267 9.575 ( -11.531 2.421 15.835) 19.738 9.738 ( -6.339 -3.386 14.806) 16.458 9.747 ( -16.771 -2.883 25.571) 30.716 10.806 ( 11.630 4.018 4.597) 13.135 11.046 ( -3.237 5.969 -14.178) 15.720 11.357 ( 15.960 -0.286 -21.530) 26.802 12.083 ( -10.647 7.916 -1.993) 13.416 12.312 ( 5.359 13.355 -13.034) 19.416 13.565 ( -5.778 1.492 11.585) 13.031 14.015 ( 6.755 -7.597 0.798) 10.197 14.098 ( 7.214 4.118 1.054) 8.374 14.268 ( -12.257 -0.929 -2.371) 12.519 18.006 ( 15.465 0.486 -5.924) 16.568 18.400 ( -10.911 -0.912 -6.600) 12.785 18.864 ( -0.427 -4.468 6.398) 7.815 19.614 ( 0.610 0.074 -9.439) 9.459 21.537 ( 32.492 0.865 4.127) 32.765 21.680 ( -23.178 -1.436 -0.120) 23.222 24.073 ( -5.289 0.863 -2.681) 5.992 24.128 ( -1.800 1.815 -3.073) 3.997 ======================= Grid point 569 (289/361) ======================= q-point: (-0.30 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.449 ( 3.909 2.954 6.590) 8.211 2.691 ( 8.474 -0.796 0.271) 8.516 2.938 ( 0.389 0.199 0.435) 0.616 3.114 ( 0.122 -5.160 -3.243) 6.096 3.172 ( -3.800 3.968 9.632) 11.089 3.526 ( -14.965 -5.049 4.511) 16.425 3.878 ( 8.401 -1.073 -13.788) 16.181 4.108 ( 13.927 5.575 -4.260) 15.595 5.179 ( -2.758 -0.574 5.173) 5.890 5.280 ( -3.585 -2.889 -1.901) 4.982 5.763 ( -6.137 3.938 8.032) 10.848 6.020 ( -0.607 -1.305 -0.514) 1.528 6.774 ( -9.347 -3.060 0.580) 9.852 6.996 ( 0.557 -11.027 2.545) 11.331 7.802 ( 2.669 -7.862 -2.102) 8.565 7.959 ( 12.217 -11.610 6.908) 18.214 9.549 ( -16.097 0.796 16.942) 23.384 9.802 ( -20.214 -2.999 29.166) 35.613 9.930 ( 5.259 -1.794 5.338) 7.705 10.738 ( -7.194 1.313 -7.543) 10.506 10.879 ( -4.929 8.873 -4.738) 11.202 11.396 ( 21.876 -0.163 -17.522) 28.029 11.817 ( -7.580 15.533 -0.401) 17.288 12.204 ( 13.907 10.776 -6.281) 18.681 13.620 ( -6.012 -0.111 12.103) 13.514 14.000 ( -11.269 0.723 0.037) 11.293 14.043 ( -1.604 -2.085 -6.650) 7.151 14.349 ( 13.968 1.429 2.826) 14.323 18.002 ( -18.107 0.379 -16.171) 24.280 18.212 ( 16.239 0.438 1.991) 16.366 19.083 ( 2.131 -4.407 10.234) 11.344 19.538 ( 6.947 -0.367 -9.932) 12.126 21.271 ( -27.491 -0.860 -3.958) 27.788 22.074 ( 32.415 1.265 4.375) 32.733 23.933 ( -7.648 2.603 -1.157) 8.161 24.117 ( 3.279 -0.047 -0.231) 3.288 ======================= Grid point 570 (290/361) ======================= q-point: (-0.20 -0.60 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.535 ( -0.516 3.174 7.991) 8.613 2.869 ( 10.276 -0.102 -6.049) 11.925 2.942 ( 4.438 0.679 6.442) 7.853 3.116 ( 2.275 0.180 -1.681) 2.835 3.229 ( -7.803 -2.514 2.165) 8.479 3.431 ( -3.995 -5.580 6.213) 9.257 3.857 ( 11.767 2.450 -14.311) 18.689 4.199 ( 8.710 4.560 0.707) 9.857 5.136 ( -8.919 -1.518 -2.091) 9.286 5.229 ( -4.495 -2.169 1.566) 5.231 5.691 ( -10.041 3.955 5.028) 11.906 5.972 ( -2.908 -0.038 -3.976) 4.926 6.637 ( -13.306 -2.878 1.403) 13.685 7.173 ( 4.587 -10.171 2.737) 11.488 7.833 ( 0.256 -8.024 -5.933) 9.983 8.388 ( 15.785 -15.713 4.935) 22.812 9.547 ( -15.991 -1.577 20.043) 25.689 9.877 ( -14.630 -2.599 17.346) 22.840 10.052 ( 1.998 2.128 5.985) 6.658 10.517 ( -14.742 16.790 -6.179) 23.182 10.583 ( -6.701 -9.143 -6.754) 13.196 11.483 ( 17.962 4.323 -14.886) 23.726 11.604 ( 1.155 14.697 -1.880) 14.862 12.373 ( 20.300 4.964 2.732) 21.076 13.679 ( -5.138 1.800 11.163) 12.420 13.825 ( -10.127 -1.575 -0.460) 10.259 13.982 ( -0.673 -0.694 -4.823) 4.919 14.531 ( 12.395 5.285 0.290) 13.478 17.548 ( -19.354 -0.431 -12.538) 23.064 18.497 ( 15.465 0.211 7.171) 17.048 19.146 ( -1.172 3.540 -0.844) 3.823 19.616 ( 10.721 -3.082 -3.227) 11.613 20.835 ( -25.426 -3.604 -6.574) 26.508 22.554 ( 28.489 2.069 4.953) 28.991 23.785 ( -6.824 4.501 -0.893) 8.224 24.206 ( 4.991 -2.026 3.098) 6.214 ======================= Grid point 571 (291/361) ======================= q-point: (-0.10 -0.60 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.554 ( -8.029 3.983 9.830) 13.303 2.823 ( -1.920 2.129 -8.509) 8.979 3.029 ( -6.475 -1.709 -0.256) 6.702 3.118 ( 7.071 1.586 -1.441) 7.388 3.269 ( 8.457 -4.342 6.435) 11.480 3.641 ( 8.233 -4.777 7.853) 12.340 3.811 ( 12.908 6.835 -13.977) 20.216 4.298 ( 3.651 1.047 5.014) 6.290 4.946 ( -12.682 0.332 -2.997) 13.035 5.186 ( -7.023 -2.293 0.473) 7.403 5.528 ( -12.329 4.127 1.032) 13.043 5.855 ( -2.782 -0.023 -7.563) 8.058 6.507 ( -13.385 -3.158 4.920) 14.606 7.334 ( 4.851 -3.037 0.711) 5.768 7.851 ( 1.515 -10.599 -5.729) 12.143 8.731 ( 7.351 -14.114 -1.099) 15.951 9.567 ( -19.607 0.768 19.202) 27.454 9.815 ( -8.951 2.967 2.185) 9.679 10.029 ( -13.523 15.548 4.352) 21.060 10.142 ( -5.051 0.101 1.222) 5.198 10.633 ( 3.356 -16.092 -1.217) 16.484 11.424 ( 2.107 16.606 4.296) 17.282 11.606 ( 20.611 -3.493 -20.843) 29.520 12.669 ( 16.931 1.750 3.124) 17.306 13.670 ( 0.466 5.127 -1.780) 5.448 13.783 ( -10.475 -4.734 13.569) 17.783 13.915 ( -0.596 1.704 -3.749) 4.161 14.606 ( 9.796 9.444 -3.138) 13.965 17.181 ( -18.144 -0.783 -2.934) 18.396 18.818 ( 14.234 -0.656 9.715) 17.246 19.025 ( -0.092 6.658 -8.282) 10.627 19.724 ( 3.380 0.577 -0.037) 3.429 20.500 ( -15.217 -8.188 -7.244) 18.737 22.968 ( 21.229 3.306 7.335) 22.703 23.631 ( -5.099 3.553 -3.642) 7.203 24.361 ( 5.932 -1.914 5.675) 8.430 ======================= Grid point 577 (292/361) ======================= q-point: (-0.50 0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.362 ( 2.192 0.000 5.402) 5.830 2.659 ( -2.616 -0.000 -3.289) 4.203 2.917 ( -2.044 -0.000 3.752) 4.272 3.075 ( -0.539 -0.000 2.736) 2.789 3.231 ( -7.829 0.000 4.287) 8.926 3.499 ( -2.817 -0.000 6.051) 6.675 3.997 ( -4.974 -0.000 -11.849) 12.851 4.006 ( 17.236 -0.000 -5.290) 18.030 5.153 ( 0.118 0.000 5.592) 5.594 5.211 ( 1.378 -0.000 1.811) 2.276 5.805 ( -2.836 0.000 9.234) 9.660 5.945 ( 3.330 -0.000 2.115) 3.945 6.738 ( -2.374 -0.000 6.889) 7.286 6.838 ( -3.223 0.000 0.732) 3.305 7.637 ( 0.882 -0.000 4.952) 5.030 7.671 ( 3.481 -0.000 -1.971) 4.000 9.600 ( -13.213 -0.000 15.862) 20.644 9.694 ( 6.796 -0.000 8.857) 11.164 9.730 ( -28.546 -0.000 32.406) 43.186 10.839 ( 14.517 -0.000 5.031) 15.364 11.099 ( -8.253 -0.000 -17.060) 18.951 11.355 ( 16.323 -0.000 -21.906) 27.319 12.172 ( -4.743 -0.000 -1.247) 4.904 12.434 ( 0.095 -0.000 -12.538) 12.538 13.594 ( -6.308 -0.000 10.198) 11.992 13.911 ( 7.780 0.000 -0.457) 7.793 14.142 ( 10.088 -0.000 3.211) 10.587 14.267 ( -15.164 -0.000 -0.457) 15.171 18.011 ( 15.467 -0.000 -6.235) 16.676 18.390 ( -8.967 -0.000 -3.301) 9.555 18.823 ( -3.447 -0.000 5.007) 6.079 19.613 ( 1.066 -0.000 -9.436) 9.496 21.543 ( 36.058 -0.000 3.006) 36.183 21.670 ( -24.254 0.000 -0.366) 24.256 24.081 ( -7.008 -0.000 -2.605) 7.477 24.145 ( -0.994 -0.000 -2.902) 3.068 ======================= Grid point 579 (293/361) ======================= q-point: (-0.40 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.517 ( 10.050 3.570 4.968) 11.766 2.658 ( 6.889 -2.298 -1.868) 7.498 2.959 ( -1.592 2.130 1.752) 3.184 3.018 ( -2.345 -4.405 1.385) 5.179 3.253 ( -1.603 3.337 7.505) 8.368 3.447 ( -17.243 -2.927 6.211) 18.560 3.855 ( 7.443 -0.910 -13.504) 15.447 4.180 ( 15.654 2.036 -4.584) 16.438 5.171 ( -3.946 0.227 2.673) 4.772 5.221 ( -3.266 -2.821 -0.558) 4.351 5.829 ( -5.555 2.436 6.642) 8.995 5.998 ( -0.676 -0.914 1.879) 2.197 6.738 ( -8.102 -0.358 -0.736) 8.143 6.825 ( -0.954 -6.244 4.295) 7.638 7.717 ( 6.004 -2.000 -3.399) 7.184 7.819 ( 12.109 -3.686 5.455) 13.783 9.559 ( -17.868 0.251 16.458) 24.294 9.763 ( -21.346 -1.129 29.271) 36.245 9.909 ( 8.051 -0.580 7.740) 11.184 10.745 ( -14.633 -0.058 -12.296) 19.113 10.975 ( 0.293 2.298 -2.488) 3.400 11.392 ( 22.336 -0.149 -17.655) 28.472 12.082 ( -2.670 10.428 1.484) 10.866 12.322 ( 6.868 1.724 -8.016) 10.696 13.624 ( -6.260 0.790 10.510) 12.258 13.938 ( -0.635 -4.495 -3.520) 5.744 14.036 ( -13.857 0.773 -1.336) 13.942 14.395 ( 15.493 1.950 4.954) 16.382 18.007 ( -18.544 0.173 -16.647) 24.920 18.218 ( 15.994 0.202 2.264) 16.155 19.021 ( 4.691 -1.899 14.295) 15.164 19.534 ( 6.021 -0.106 -11.345) 12.844 21.266 ( -26.265 0.055 -5.997) 26.941 22.086 ( 34.406 0.252 2.450) 34.494 23.969 ( -6.232 1.147 0.455) 6.353 24.114 ( 0.262 -0.189 -0.627) 0.705 ======================= Grid point 580 (294/361) ======================= q-point: (-0.30 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.618 ( 0.872 5.737 6.909) 9.023 2.867 ( 13.090 -0.678 -4.341) 13.808 2.915 ( 3.434 -3.614 4.119) 6.467 3.129 ( 3.565 0.995 2.235) 4.323 3.192 ( -15.032 -1.328 1.959) 15.217 3.357 ( -0.606 -2.101 5.181) 5.624 3.862 ( 11.520 -1.002 -11.063) 16.003 4.290 ( 9.493 4.492 -2.286) 10.748 5.103 ( -9.087 -1.487 0.301) 9.213 5.168 ( -5.822 -3.807 -1.018) 7.031 5.762 ( -8.413 3.211 3.000) 9.492 5.978 ( -3.225 0.466 -1.063) 3.427 6.590 ( -12.317 -2.027 0.361) 12.488 6.968 ( 3.446 -9.965 3.582) 11.136 7.768 ( 6.038 -0.509 -4.965) 7.834 8.150 ( 17.356 -9.639 1.798) 19.934 9.522 ( -17.795 -0.973 19.647) 26.526 9.825 ( -15.898 -2.445 21.407) 26.777 10.099 ( 6.389 2.785 4.310) 8.194 10.416 ( -15.432 -6.867 -6.962) 18.270 10.779 ( -10.789 9.516 -5.658) 15.458 11.485 ( 21.138 -0.571 -20.429) 29.402 11.947 ( -3.524 17.737 4.969) 18.754 12.433 ( 15.798 0.687 -0.290) 15.816 13.659 ( -7.861 -1.488 10.992) 13.596 13.848 ( -7.443 2.267 -1.255) 7.881 13.921 ( -1.648 -4.941 -3.280) 6.156 14.627 ( 14.124 4.348 2.340) 14.963 17.540 ( -19.940 -0.360 -12.874) 23.738 18.499 ( 14.604 0.106 7.181) 16.274 19.218 ( 3.417 3.928 6.068) 7.995 19.550 ( 11.896 -3.661 -7.767) 14.671 20.788 ( -26.751 -1.542 -9.522) 28.437 22.573 ( 31.040 0.207 0.132) 31.041 23.879 ( -5.549 5.245 2.870) 8.157 24.158 ( 1.953 -3.033 3.136) 4.780 ======================= Grid point 581 (295/361) ======================= q-point: (-0.20 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.618 ( -12.041 3.136 12.781) 17.838 2.867 ( 0.678 2.492 -6.687) 7.168 2.957 ( -13.770 -5.485 0.693) 14.838 3.174 ( 5.810 2.821 -1.850) 6.718 3.220 ( 17.049 -0.186 3.538) 17.413 3.546 ( 11.781 -4.938 4.051) 13.401 3.908 ( 13.446 2.996 -10.096) 17.079 4.327 ( -0.078 2.693 3.641) 4.529 4.951 ( -12.259 0.080 -0.344) 12.264 5.109 ( -6.114 -5.323 -1.629) 8.269 5.603 ( -10.165 3.439 -1.975) 10.912 5.875 ( -4.301 1.866 -4.737) 6.665 6.454 ( -13.009 -2.521 4.507) 13.997 7.181 ( 6.339 -11.786 2.424) 13.600 7.779 ( 6.129 1.757 -5.911) 8.695 8.476 ( 13.122 -13.096 -4.197) 19.008 9.540 ( -19.260 -2.258 22.958) 30.052 9.850 ( -11.924 0.612 11.205) 16.374 10.016 ( -8.132 -5.933 -5.725) 11.580 10.380 ( -7.066 5.872 -9.088) 12.923 10.460 ( -3.700 5.037 11.950) 13.486 11.529 ( 19.976 -2.894 -22.290) 30.071 11.775 ( -5.419 18.609 5.090) 20.039 12.685 ( 15.606 -0.617 1.277) 15.670 13.669 ( -9.800 -3.719 6.079) 12.118 13.774 ( -0.171 3.485 3.342) 4.832 13.906 ( -0.781 -3.030 -2.319) 3.895 14.770 ( 12.353 7.687 -1.383) 14.616 17.167 ( -18.433 -0.756 -2.268) 18.588 18.796 ( 12.921 -1.270 7.524) 15.006 19.193 ( 4.706 11.078 -6.120) 13.503 19.706 ( 8.235 -2.934 -0.451) 8.753 20.352 ( -20.870 -7.421 -8.915) 23.877 22.976 ( 26.336 -1.627 -2.470) 26.501 23.767 ( -6.157 10.291 3.466) 12.484 24.300 ( 3.908 -4.734 6.885) 9.224 ======================= Grid point 582 (296/361) ======================= q-point: (-0.10 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.534 ( -18.417 0.875 12.929) 22.519 2.609 ( -15.702 0.605 -6.479) 16.997 2.971 ( 4.570 -1.855 -1.875) 5.276 3.225 ( 8.775 1.283 -2.333) 9.170 3.475 ( 9.037 -0.140 4.988) 10.323 3.846 ( 15.276 -3.459 4.605) 16.326 3.912 ( 12.553 8.290 -11.169) 18.736 4.360 ( -6.046 -2.585 9.670) 11.694 4.757 ( -14.217 2.014 1.824) 14.474 5.049 ( -3.675 -3.293 -2.925) 5.737 5.374 ( -10.151 3.203 -5.633) 12.043 5.724 ( -2.672 1.238 -8.174) 8.688 6.386 ( -11.008 -2.766 9.050) 14.516 7.375 ( 4.996 -5.411 0.488) 7.381 7.796 ( 7.403 -1.003 -5.897) 9.517 8.621 ( 2.021 -11.867 -7.553) 14.211 9.487 ( -25.673 4.277 17.282) 31.242 9.752 ( -6.635 2.006 3.067) 7.580 9.968 ( -11.058 2.008 1.144) 11.297 10.088 ( -1.645 -1.292 0.676) 2.198 10.662 ( 6.104 -4.330 8.620) 11.415 11.578 ( 16.674 -4.760 -21.033) 27.259 11.597 ( -2.067 12.308 1.349) 12.553 12.862 ( 7.529 -0.069 -1.258) 7.634 13.609 ( -6.583 -1.309 0.308) 6.718 13.798 ( -3.509 -0.034 2.906) 4.556 13.929 ( 3.314 -1.746 2.628) 4.576 14.811 ( 11.334 11.673 -4.669) 16.927 16.996 ( -13.598 0.492 12.176) 18.260 18.963 ( 5.448 4.476 -15.645) 17.161 19.133 ( 9.231 4.316 8.290) 13.136 19.745 ( -1.989 1.448 -0.454) 2.502 20.185 ( -4.420 -11.676 -4.388) 13.234 23.308 ( 20.538 -4.142 -2.589) 21.111 23.584 ( -8.539 13.588 1.571) 16.124 24.500 ( 4.681 -3.636 8.117) 10.051 ======================= Grid point 589 (297/361) ======================= q-point: (-0.40 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.709 ( 0.222 0.000 3.505) 3.512 2.809 ( 14.696 0.000 5.201) 15.589 2.891 ( 1.676 0.000 -3.617) 3.987 3.136 ( 7.447 0.000 5.313) 9.148 3.183 ( -20.911 -0.000 2.342) 21.041 3.343 ( 2.407 0.000 3.235) 4.033 3.848 ( 11.277 0.000 -10.036) 15.096 4.335 ( 9.782 0.000 -2.419) 10.077 5.094 ( -8.922 -0.000 0.161) 8.923 5.121 ( -6.078 -0.000 -1.418) 6.241 5.793 ( -8.050 -0.000 1.844) 8.259 5.983 ( -3.366 -0.000 0.512) 3.405 6.571 ( -11.811 -0.000 -0.300) 11.815 6.869 ( 2.996 0.000 3.875) 4.898 7.771 ( 8.195 0.000 -3.457) 8.894 8.057 ( 17.301 0.000 -0.173) 17.302 9.513 ( -18.508 -0.000 19.518) 26.898 9.801 ( -15.946 -0.000 21.381) 26.672 10.132 ( 10.254 0.000 6.718) 12.258 10.346 ( -20.606 -0.000 -9.182) 22.559 10.866 ( -8.762 -0.000 -4.842) 10.011 11.480 ( 20.328 0.000 -20.324) 28.745 12.146 ( -4.158 -0.000 5.209) 6.665 12.413 ( 13.625 0.000 -0.984) 13.660 13.653 ( -6.645 -0.000 8.732) 10.973 13.858 ( -2.440 -0.000 -2.115) 3.229 13.871 ( -7.366 -0.000 -0.076) 7.367 14.669 ( 14.337 0.000 2.813) 14.610 17.536 ( -20.182 -0.000 -13.001) 24.007 18.500 ( 14.215 0.000 7.172) 15.922 19.262 ( 5.636 0.000 12.885) 14.064 19.508 ( 11.851 0.000 -13.363) 17.861 20.775 ( -27.082 -0.000 -11.118) 29.276 22.573 ( 31.650 0.000 -1.629) 31.692 23.940 ( -3.680 -0.000 5.367) 6.508 24.119 ( -0.220 -0.000 2.184) 2.195 ======================= Grid point 590 (298/361) ======================= q-point: (-0.30 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.676 ( -13.885 2.927 11.035) 17.976 2.835 ( -22.729 -4.623 3.143) 23.406 2.927 ( 9.227 1.505 -6.267) 11.255 3.157 ( 12.649 -1.709 2.233) 12.958 3.291 ( 12.066 4.163 -0.746) 12.786 3.471 ( 12.165 -2.950 1.021) 12.559 3.929 ( 14.014 0.025 -6.265) 15.351 4.386 ( -1.889 2.642 3.217) 4.571 4.938 ( -13.137 -1.455 0.060) 13.218 5.034 ( -3.235 -1.874 -2.812) 4.678 5.645 ( -9.734 1.185 -4.061) 10.614 5.905 ( -5.032 1.017 -2.657) 5.781 6.420 ( -12.601 -1.026 4.345) 13.368 7.003 ( 6.701 -5.816 2.067) 9.110 7.845 ( 8.780 3.526 -2.588) 9.809 8.282 ( 15.252 -6.810 -7.719) 18.400 9.507 ( -18.917 -1.040 22.058) 29.077 9.824 ( -8.850 -2.116 9.741) 13.330 9.966 ( -21.231 -0.164 -0.638) 21.242 10.340 ( 9.325 -1.864 -2.386) 9.805 10.659 ( -12.210 6.784 5.368) 14.964 11.490 ( 18.093 -1.100 -22.679) 29.033 12.060 ( -9.415 10.094 5.243) 14.765 12.643 ( 14.087 -2.871 0.744) 14.396 13.643 ( -5.957 0.651 4.683) 7.605 13.816 ( -0.969 -0.611 -0.736) 1.361 13.833 ( -2.220 -1.998 2.089) 3.644 14.869 ( 13.271 2.851 -0.676) 13.591 17.156 ( -18.622 -0.320 -1.770) 18.708 18.779 ( 12.251 -0.499 6.068) 13.681 19.406 ( 7.614 11.215 0.229) 13.557 19.607 ( 12.827 -7.749 -4.401) 15.619 20.252 ( -25.907 -3.001 -11.648) 28.563 22.944 ( 26.540 -1.216 -6.949) 27.462 23.958 ( -1.726 8.950 8.172) 12.241 24.193 ( 0.571 -6.240 6.217) 8.827 ======================= Grid point 591 (299/361) ======================= q-point: (-0.20 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.524 ( -22.508 -1.391 9.843) 24.606 2.585 ( -20.449 -2.607 0.268) 20.616 2.964 ( 6.235 1.082 -2.447) 6.785 3.269 ( 7.786 2.100 -5.238) 9.616 3.476 ( 12.657 0.600 2.314) 12.881 3.761 ( 20.741 -3.922 1.281) 21.148 4.069 ( 15.404 6.111 -5.142) 17.351 4.339 ( -12.120 1.069 11.795) 16.946 4.758 ( -15.904 -2.413 2.091) 16.221 4.996 ( 2.016 -1.465 -4.720) 5.338 5.408 ( -9.975 0.792 -8.992) 13.453 5.762 ( -5.008 2.096 -5.945) 8.051 6.346 ( -10.900 -1.538 9.584) 14.596 7.204 ( 7.870 -9.920 0.698) 12.682 7.885 ( 9.633 8.543 -3.902) 13.454 8.402 ( 6.492 -11.707 -11.866) 17.889 9.496 ( -23.020 -1.671 21.785) 31.738 9.751 ( -13.217 -5.151 4.877) 15.000 9.852 ( -2.652 -1.712 3.517) 4.726 10.217 ( -7.264 5.838 -9.725) 13.469 10.695 ( 1.966 5.491 15.893) 16.929 11.490 ( 17.683 -3.584 -22.390) 28.755 11.854 ( -10.726 12.683 2.953) 16.871 12.832 ( 7.512 -2.779 -1.019) 8.074 13.580 ( -7.044 -0.698 0.409) 7.090 13.800 ( -1.300 -1.387 -1.874) 2.670 13.881 ( 1.721 -1.899 3.425) 4.277 14.981 ( 13.026 6.476 -4.945) 15.365 17.004 ( -12.597 0.349 14.423) 19.152 18.968 ( 11.082 -1.340 -8.867) 14.256 19.336 ( 4.598 15.025 -1.740) 15.808 19.759 ( 0.110 -0.100 -1.136) 1.146 19.943 ( -6.966 -14.301 -3.115) 16.210 23.205 ( 21.150 -4.688 -9.743) 23.754 23.891 ( -4.215 17.263 7.006) 19.102 24.389 ( 2.934 -8.607 8.571) 12.496 ======================= Grid point 592 (300/361) ======================= q-point: (-0.10 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( -19.699 -1.884 -2.242) 19.915 2.365 ( -21.987 -5.675 11.287) 25.358 3.024 ( 5.223 0.520 -0.912) 5.327 3.309 ( 9.489 -1.496 -6.376) 11.529 3.617 ( 3.164 1.715 2.214) 4.226 4.008 ( -3.643 11.872 -1.221) 12.479 4.132 ( 19.503 -0.726 3.357) 19.803 4.391 ( -0.031 -0.713 8.829) 8.857 4.586 ( -16.162 -1.057 5.798) 17.204 5.001 ( 4.631 -0.842 -3.722) 6.001 5.160 ( -7.810 -0.894 -9.285) 12.166 5.605 ( -1.129 1.316 -8.306) 8.485 6.371 ( -7.218 -1.473 13.403) 15.294 7.387 ( 4.560 -7.664 -0.197) 8.920 7.846 ( 7.014 6.551 -11.513) 14.989 8.466 ( 2.656 -10.106 -1.183) 10.516 9.347 ( -27.322 6.875 14.975) 31.906 9.746 ( -3.618 -0.333 6.825) 7.732 9.830 ( -6.747 -2.927 -0.931) 7.413 10.058 ( -1.540 -5.038 1.350) 5.438 10.866 ( 3.626 3.713 10.561) 11.767 11.502 ( 11.215 -2.019 -18.093) 21.383 11.624 ( -4.248 6.943 -3.399) 8.820 12.876 ( -0.673 -1.426 -2.038) 2.577 13.478 ( -7.725 -3.882 -2.168) 8.913 13.748 ( -4.462 0.145 -0.389) 4.481 13.995 ( 4.217 -3.794 3.217) 6.521 15.006 ( 12.767 9.682 -9.060) 18.407 17.124 ( -4.060 3.777 26.020) 26.604 18.801 ( 3.005 2.563 -26.433) 26.726 19.387 ( 6.467 4.652 7.703) 11.082 19.715 ( 1.323 -0.031 -1.534) 2.026 20.055 ( 1.397 -10.197 0.409) 10.300 23.416 ( 16.371 -7.560 -9.691) 20.472 23.688 ( -8.752 21.883 5.152) 24.125 24.595 ( 1.715 -7.190 6.198) 9.646 ======================= Grid point 600 (301/361) ======================= q-point: (-0.30 -0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.503 ( -24.792 -0.000 4.725) 25.239 2.558 ( -20.499 -0.000 6.148) 21.402 2.981 ( 6.318 0.000 -3.111) 7.042 3.284 ( 6.946 0.000 -5.313) 8.745 3.490 ( 13.077 0.000 0.222) 13.078 3.720 ( 22.335 0.000 1.654) 22.396 4.120 ( 18.873 0.000 -2.633) 19.055 4.370 ( -15.406 -0.000 13.127) 20.240 4.715 ( -15.590 -0.000 0.209) 15.592 4.989 ( 3.456 0.000 -4.791) 5.908 5.414 ( -10.485 -0.000 -10.094) 14.555 5.783 ( -5.615 -0.000 -5.342) 7.750 6.332 ( -10.844 -0.000 9.963) 14.727 7.102 ( 8.585 0.000 0.182) 8.587 8.009 ( 10.839 0.000 2.629) 11.154 8.253 ( 7.702 0.000 -18.453) 19.995 9.471 ( -19.155 -0.000 17.097) 25.675 9.684 ( -14.808 -0.000 6.805) 16.297 9.859 ( -8.876 -0.000 11.200) 14.290 10.261 ( -1.786 -0.000 -14.641) 14.749 10.764 ( -1.584 -0.000 17.742) 17.812 11.456 ( 17.082 0.000 -22.349) 28.130 11.984 ( -13.505 -0.000 3.233) 13.887 12.797 ( 8.489 0.000 -0.652) 8.514 13.582 ( -5.836 -0.000 -3.746) 6.935 13.765 ( -3.490 -0.000 1.606) 3.842 13.873 ( 2.702 0.000 2.001) 3.362 15.041 ( 13.579 0.000 -5.150) 14.522 17.008 ( -12.189 -0.000 15.378) 19.623 18.954 ( 11.521 0.000 -8.028) 14.042 19.609 ( 10.837 0.000 -13.424) 17.253 19.647 ( 2.551 0.000 7.849) 8.253 19.790 ( -15.888 -0.000 -2.448) 16.075 23.161 ( 20.908 0.000 -10.788) 23.528 24.158 ( 3.110 0.000 9.009) 9.531 24.205 ( -2.854 -0.000 7.274) 7.814 ======================= Grid point 601 (302/361) ======================= q-point: (-0.20 -0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.245 ( -22.544 -2.031 5.181) 23.220 2.274 ( -24.601 -2.647 4.026) 25.068 3.049 ( 5.636 1.505 0.419) 5.849 3.278 ( 7.834 -1.516 -10.960) 13.557 3.642 ( 5.224 0.918 1.784) 5.596 4.105 ( 21.730 -0.209 4.815) 22.258 4.231 ( -9.897 9.470 8.724) 16.240 4.371 ( 5.382 -2.823 3.297) 6.914 4.545 ( -12.286 -2.292 5.327) 13.586 4.995 ( 6.091 0.046 -5.702) 8.344 5.130 ( -9.577 -1.420 -11.546) 15.068 5.630 ( -3.341 0.922 -7.122) 7.920 6.356 ( -7.007 -0.329 14.626) 16.221 7.238 ( 7.214 -5.585 -1.410) 9.231 8.004 ( 4.056 8.308 -17.812) 20.068 8.293 ( 10.116 -7.945 3.341) 13.289 9.393 ( -23.716 -0.379 19.079) 30.440 9.648 ( -6.558 -4.778 8.643) 11.855 9.860 ( -5.135 3.315 4.626) 7.665 10.032 ( -6.467 -0.392 -8.804) 10.930 10.938 ( 0.181 2.758 12.603) 12.903 11.459 ( 17.754 -1.386 -18.807) 25.900 11.777 ( -14.264 5.926 0.103) 15.446 12.853 ( 0.759 -0.637 -2.013) 2.243 13.402 ( -9.875 -3.306 -6.535) 12.294 13.738 ( -4.432 -0.696 1.787) 4.829 13.954 ( 4.835 -0.854 1.649) 5.180 15.127 ( 13.613 3.359 -10.422) 17.471 17.176 ( -1.716 1.622 27.878) 27.978 18.817 ( 3.212 -0.088 -29.566) 29.740 19.527 ( 0.985 8.257 8.970) 12.231 19.720 ( 1.444 1.300 -0.481) 2.001 19.853 ( 5.466 -10.754 -0.322) 12.068 23.318 ( 17.998 -2.780 -10.410) 20.976 24.080 ( -4.809 20.040 5.017) 21.211 24.399 ( -0.452 -14.207 5.339) 15.184 ======================= Grid point 602 (303/361) ======================= q-point: (-0.10 -0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.982 ( -19.270 -3.740 5.065) 20.272 2.138 ( -18.780 -8.059 12.353) 23.880 3.100 ( 5.673 2.563 -2.089) 6.566 3.320 ( 9.831 -5.469 -8.517) 14.110 3.622 ( -5.690 2.427 -2.704) 6.751 3.998 ( -21.342 10.805 13.291) 27.366 4.363 ( 7.248 8.275 -8.460) 13.877 4.438 ( -9.520 -3.268 10.628) 14.638 4.630 ( 17.482 -1.691 4.458) 18.121 4.929 ( -4.855 -3.741 -6.711) 9.089 5.050 ( 6.023 -0.949 -0.454) 6.114 5.542 ( 5.176 0.481 -6.362) 8.216 6.482 ( -2.766 0.803 16.959) 17.201 7.360 ( 2.938 -7.881 -1.343) 8.517 7.756 ( 1.848 3.085 -18.711) 19.053 8.583 ( 9.153 -0.183 12.253) 15.295 9.223 ( -24.306 7.201 15.832) 29.888 9.709 ( -4.654 -0.759 -2.459) 5.318 9.807 ( 0.782 -3.678 9.052) 9.802 9.963 ( -5.969 -8.151 2.015) 10.302 11.014 ( -0.753 2.161 3.196) 3.931 11.413 ( -8.908 7.615 -7.547) 13.939 11.571 ( 8.712 -1.178 -9.533) 12.968 12.797 ( -5.217 -0.829 -1.568) 5.510 13.268 ( -8.765 -8.332 -1.090) 12.143 13.689 ( -5.688 0.412 2.097) 6.077 14.060 ( 4.725 -2.422 1.465) 5.508 15.111 ( 11.941 6.225 -15.153) 20.272 17.542 ( 7.217 6.398 28.384) 29.978 18.491 ( 2.934 -2.696 -28.574) 28.850 19.567 ( -0.444 8.561 2.224) 8.857 19.789 ( 12.400 -0.670 -1.114) 12.468 19.989 ( -0.645 -9.806 2.123) 10.054 23.479 ( 15.377 -3.534 -8.215) 17.788 23.788 ( -12.032 23.422 0.425) 26.335 24.531 ( -4.762 -13.111 1.442) 14.023 ======================= Grid point 611 (304/361) ======================= q-point: (-0.20 -0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.947 ( -22.062 -0.000 5.715) 22.790 2.053 ( -18.827 -0.000 12.048) 22.352 3.149 ( 5.841 0.000 -0.384) 5.854 3.244 ( 10.075 0.000 -12.278) 15.883 3.645 ( -5.564 -0.000 -2.443) 6.076 4.127 ( -31.252 -0.000 21.883) 38.152 4.354 ( -0.224 -0.000 0.769) 0.800 4.500 ( 20.074 0.000 -2.881) 20.280 4.594 ( 4.890 0.000 -0.605) 4.927 4.880 ( -2.083 -0.000 -5.131) 5.538 5.043 ( 5.630 0.000 -1.339) 5.787 5.549 ( 3.940 0.000 -5.505) 6.769 6.493 ( -2.293 -0.000 18.585) 18.726 7.270 ( 4.489 0.000 -3.045) 5.424 7.788 ( 0.470 0.000 -20.433) 20.438 8.586 ( 14.693 0.000 12.755) 19.457 9.284 ( -26.557 -0.000 22.380) 34.729 9.672 ( 3.935 0.000 0.874) 4.031 9.807 ( -4.182 -0.000 -10.980) 11.749 9.881 ( -11.221 -0.000 13.788) 17.777 11.023 ( -1.091 -0.000 1.329) 1.719 11.535 ( 16.854 0.000 -10.364) 19.786 11.541 ( -20.294 -0.000 -3.077) 20.526 12.796 ( -4.496 -0.000 -2.410) 5.101 13.168 ( -10.237 -0.000 -0.980) 10.284 13.692 ( -5.586 -0.000 2.256) 6.024 14.039 ( 5.455 0.000 0.667) 5.496 15.169 ( 12.394 0.000 -16.027) 20.260 17.607 ( 9.556 0.000 29.174) 30.700 18.458 ( 1.491 0.000 -30.589) 30.625 19.729 ( -4.330 -0.000 -0.518) 4.361 19.760 ( 10.096 0.000 9.095) 13.588 19.841 ( 5.361 0.000 -4.152) 6.781 23.439 ( 17.219 0.000 -8.950) 19.406 24.177 ( -8.881 -0.000 -6.998) 11.306 24.249 ( -7.851 -0.000 7.912) 11.147 ======================= Grid point 612 (305/361) ======================= q-point: (-0.10 -0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.848 ( -10.062 -2.983 14.404) 17.822 2.024 ( -12.495 -5.063 16.472) 21.286 3.170 ( 3.899 3.456 -3.591) 6.328 3.297 ( 10.637 -5.510 -10.097) 15.667 3.454 ( -11.807 1.570 -4.996) 12.917 3.924 ( -24.396 4.892 18.184) 30.818 4.361 ( 1.227 10.016 -13.301) 16.696 4.452 ( -2.061 -1.579 6.646) 7.135 4.604 ( -4.282 -7.669 -9.123) 12.664 5.057 ( 6.442 0.128 12.132) 13.737 5.160 ( 14.585 -0.476 0.232) 14.595 5.631 ( 13.278 0.428 -2.118) 13.453 6.719 ( 2.134 3.186 19.046) 19.429 7.295 ( 0.422 -5.956 -2.764) 6.579 7.589 ( 1.503 0.747 -12.504) 12.616 8.926 ( 8.633 5.970 15.138) 18.421 9.176 ( -20.680 4.310 20.725) 29.593 9.635 ( -0.130 1.240 -3.687) 3.892 9.768 ( -0.137 -12.192 -5.960) 13.572 9.957 ( -4.450 -0.776 18.892) 19.425 10.966 ( -5.608 2.687 -5.129) 8.061 11.155 ( -20.514 0.045 -3.294) 20.777 11.629 ( 11.827 0.775 -9.822) 15.393 12.680 ( -8.004 -0.152 -1.059) 8.075 13.123 ( -5.786 -5.718 6.850) 10.635 13.630 ( -5.577 -0.050 1.124) 5.690 14.120 ( 4.028 -0.968 0.346) 4.157 15.094 ( 9.738 2.931 -19.541) 22.029 18.046 ( 11.682 9.951 5.441) 16.282 18.222 ( 10.863 -8.362 -10.038) 16.991 19.557 ( -7.916 7.136 -5.780) 12.124 19.854 ( 1.177 -4.722 -6.068) 7.778 20.078 ( 15.286 -2.619 9.537) 18.206 23.589 ( 15.870 -1.802 -7.242) 17.537 23.725 ( -21.147 19.697 -8.234) 30.050 24.292 ( -10.556 -14.212 2.722) 17.911 ======================= Grid point 622 (306/361) ======================= q-point: (-0.10 -0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.970 ( -1.165 -0.000 17.662) 17.700 2.094 ( -5.938 -0.000 20.220) 21.074 3.158 ( -0.803 -0.000 -2.266) 2.404 3.215 ( -9.532 -0.000 -6.179) 11.360 3.333 ( 11.021 0.000 -8.956) 14.202 3.878 ( -12.202 -0.000 13.682) 18.333 4.187 ( -6.470 -0.000 -15.134) 16.459 4.339 ( -6.342 -0.000 -11.391) 13.037 4.577 ( 1.693 0.000 10.865) 10.996 5.169 ( -1.195 -0.000 6.450) 6.560 5.457 ( 15.118 0.000 4.947) 15.907 5.835 ( 14.998 0.000 -0.108) 14.998 7.020 ( 7.209 0.000 12.297) 14.254 7.204 ( -2.844 -0.000 -3.609) 4.595 7.572 ( 2.961 0.000 6.698) 7.323 9.188 ( -22.900 -0.000 29.085) 37.018 9.249 ( 9.610 0.000 7.865) 12.418 9.583 ( -4.543 -0.000 -4.212) 6.195 9.673 ( 6.838 0.000 -1.167) 6.937 10.138 ( -3.773 -0.000 18.053) 18.443 10.791 ( -21.139 -0.000 3.259) 21.389 10.856 ( -2.290 -0.000 -9.607) 9.876 11.615 ( 6.700 0.000 -15.199) 16.610 12.544 ( -10.196 -0.000 -0.188) 10.198 13.156 ( -2.528 -0.000 10.891) 11.181 13.564 ( -2.920 -0.000 -0.921) 3.062 14.161 ( 1.715 0.000 0.079) 1.717 14.981 ( 7.122 0.000 -20.407) 21.614 17.963 ( 9.556 0.000 -21.316) 23.360 18.613 ( 20.716 0.000 11.762) 23.822 19.333 ( -11.633 -0.000 -11.667) 16.476 19.742 ( -4.887 -0.000 -3.854) 6.224 20.454 ( 21.801 0.000 9.123) 23.633 23.280 ( -31.657 -0.000 -12.745) 34.126 23.722 ( 13.843 0.000 -5.473) 14.886 24.125 ( -11.181 -0.000 4.779) 12.160 ======================= Grid point 623 (307/361) ======================= q-point: ( 0.00 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.538 ( 1.196 0.000 7.878) 7.968 2.621 ( -1.606 -0.000 -0.165) 1.614 3.031 ( 3.483 0.000 -0.050) 3.484 3.068 ( -0.667 -0.000 -5.747) 5.786 3.396 ( 4.960 0.000 7.907) 9.334 3.538 ( -2.112 -0.000 -3.873) 4.411 3.748 ( -8.190 -0.000 -1.547) 8.335 3.813 ( 2.686 0.000 -7.309) 7.787 5.121 ( 3.930 0.000 6.525) 7.617 5.217 ( -2.311 -0.000 -2.871) 3.685 5.895 ( -4.617 -0.000 8.481) 9.657 6.047 ( 5.070 0.000 -6.148) 7.969 7.048 ( -8.359 -0.000 4.745) 9.612 7.163 ( 7.660 0.000 -6.145) 9.820 8.943 ( 6.658 0.000 25.629) 26.480 9.366 ( -4.214 -0.000 -17.050) 17.564 9.491 ( -17.854 -0.000 12.458) 21.771 9.674 ( 14.221 0.000 -5.824) 15.367 9.797 ( -1.875 -0.000 15.703) 15.814 10.146 ( -3.513 -0.000 -17.892) 18.234 10.565 ( -13.873 -0.000 23.555) 27.337 11.000 ( 13.604 0.000 -19.907) 24.112 11.483 ( 19.030 0.000 16.589) 25.246 11.801 ( -17.621 -0.000 -14.625) 22.900 13.481 ( -3.551 -0.000 4.614) 5.822 13.546 ( 4.737 0.000 -2.270) 5.253 14.235 ( -4.465 -0.000 6.928) 8.242 14.420 ( 4.246 0.000 -11.348) 12.116 17.965 ( 17.831 0.000 4.134) 18.304 18.144 ( -18.169 -0.000 -13.134) 22.419 19.383 ( 13.807 0.000 0.130) 13.808 19.394 ( -11.654 -0.000 -1.045) 11.701 21.643 ( 27.629 0.000 11.807) 30.046 21.863 ( -31.052 -0.000 -9.933) 32.602 23.907 ( -10.578 -0.000 0.780) 10.606 23.929 ( 11.496 0.000 -1.590) 11.606 ======================= Grid point 624 (308/361) ======================= q-point: ( 0.10 0.00 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.566 ( -1.295 1.648 -3.365) 3.964 2.657 ( 5.234 -1.244 1.651) 5.628 2.986 ( -2.946 -0.057 -0.719) 3.033 3.083 ( 3.707 -0.307 -0.617) 3.771 3.412 ( -2.759 -0.539 -9.475) 9.883 3.524 ( 2.575 3.209 3.692) 5.528 3.707 ( -2.650 0.835 8.220) 8.677 3.886 ( 9.098 -4.480 1.593) 10.265 5.124 ( -3.573 -1.175 -6.315) 7.351 5.231 ( 2.031 -0.943 3.418) 4.086 5.874 ( -11.197 0.550 6.926) 13.178 5.986 ( -0.359 0.729 -8.247) 8.287 6.968 ( -11.706 1.111 5.757) 13.092 7.188 ( 5.445 -0.602 -4.429) 7.045 8.838 ( -13.967 22.965 -13.627) 30.136 9.167 ( -0.713 10.423 11.540) 15.567 9.520 ( -11.743 -15.359 6.116) 20.278 9.845 ( 2.269 -3.243 -12.946) 13.537 9.956 ( 3.360 -8.272 -1.688) 9.086 10.012 ( 0.111 -5.228 17.565) 18.327 10.721 ( -0.811 0.905 19.146) 19.184 10.996 ( 18.935 0.065 -19.293) 27.033 11.396 ( -8.319 2.244 -17.591) 19.588 11.980 ( 22.396 -0.017 14.297) 26.570 13.484 ( -3.692 -3.544 2.328) 5.623 13.586 ( 3.327 -4.403 -4.393) 7.054 14.247 ( -7.009 1.938 9.597) 12.041 14.345 ( 2.890 0.464 -8.266) 8.769 17.749 ( -18.441 -0.005 -7.670) 19.972 18.311 ( 17.485 -0.023 10.083) 20.184 19.200 ( -12.008 0.527 -2.249) 12.228 19.550 ( 10.059 0.549 -0.465) 10.084 21.317 ( -27.583 0.958 -9.062) 29.050 22.189 ( 26.508 0.133 13.248) 29.634 23.775 ( -8.830 -0.592 -0.287) 8.854 24.081 ( 11.395 -0.727 -0.877) 11.452 ======================= Grid point 625 (309/361) ======================= q-point: ( 0.20 0.00 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.479 ( -1.460 -1.690 -6.308) 6.692 2.713 ( 1.220 -4.049 -5.222) 6.720 3.021 ( 5.003 0.520 4.611) 6.824 3.102 ( -2.916 1.155 0.774) 3.231 3.303 ( 3.203 -5.585 -9.544) 11.513 3.561 ( 3.348 7.486 5.376) 9.806 3.803 ( 2.817 5.265 10.077) 11.714 4.119 ( 9.020 -6.477 4.648) 12.038 4.987 ( -5.331 -2.376 -7.569) 9.558 5.271 ( -2.581 -1.192 1.512) 3.220 5.736 ( -16.067 0.830 4.173) 16.621 5.835 ( -2.766 1.104 -10.747) 11.152 6.834 ( -13.261 3.161 5.951) 14.875 7.235 ( 4.205 -2.465 -1.933) 5.243 8.290 ( -9.540 17.435 -15.565) 25.244 9.124 ( -3.085 12.473 4.801) 13.717 9.520 ( -10.822 -11.440 -1.219) 15.795 9.714 ( -2.826 -5.565 -6.289) 8.860 10.101 ( -4.286 -5.446 10.293) 12.408 10.216 ( -3.513 -4.709 8.711) 10.507 10.918 ( 6.468 8.064 1.912) 10.513 11.075 ( 11.669 -2.490 -0.997) 11.973 11.173 ( 15.755 -0.065 -20.814) 26.105 12.426 ( 19.660 0.763 7.699) 21.128 13.507 ( -0.466 -4.376 -0.169) 4.404 13.621 ( 2.161 -8.874 -4.768) 10.302 14.220 ( -7.876 4.558 8.522) 12.467 14.321 ( 0.870 -2.892 -1.210) 3.254 17.444 ( -17.616 0.120 1.095) 17.650 18.683 ( 13.823 -0.314 11.165) 17.772 18.998 ( -7.664 1.664 -4.180) 8.887 19.657 ( 4.848 -0.523 0.838) 4.948 20.843 ( -21.155 1.848 -8.797) 22.986 22.707 ( 22.749 0.886 13.496) 26.465 23.652 ( -6.990 -0.021 -1.927) 7.251 24.250 ( 10.592 -2.063 0.721) 10.815 ======================= Grid point 626 (310/361) ======================= q-point: ( 0.30 0.00 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.418 ( -0.788 -7.471 -8.798) 11.568 2.676 ( -2.576 -6.743 -4.424) 8.466 3.004 ( -8.128 1.257 0.844) 8.267 3.183 ( 10.737 2.170 3.368) 11.460 3.374 ( 6.881 -7.981 -4.621) 11.506 3.620 ( 4.239 9.600 7.901) 13.136 3.918 ( 8.066 8.546 6.059) 13.221 4.351 ( 5.871 -5.757 6.014) 10.187 4.851 ( -5.840 -2.754 -4.433) 7.832 5.198 ( -10.198 -0.893 -0.178) 10.238 5.516 ( -17.258 1.105 1.204) 17.336 5.647 ( -0.953 0.546 -13.380) 13.425 6.702 ( -11.247 3.879 7.360) 13.990 7.292 ( 1.918 -3.449 -0.693) 4.007 7.906 ( -1.606 8.965 -13.851) 16.577 8.989 ( -1.480 16.493 0.798) 16.579 9.410 ( -11.844 -11.998 -6.306) 17.999 9.698 ( -5.414 -9.220 0.942) 10.733 10.138 ( -12.186 -9.691 2.709) 15.804 10.275 ( -3.761 5.851 14.365) 15.961 10.862 ( 9.375 11.743 -5.952) 16.162 11.207 ( 25.690 4.413 -21.795) 33.978 11.342 ( 5.565 -5.994 7.593) 11.160 12.694 ( 11.512 -0.253 0.566) 11.529 13.512 ( 0.172 -4.469 -5.244) 6.893 13.728 ( 6.252 -7.546 -2.081) 10.018 14.167 ( -7.052 5.168 8.574) 12.245 14.390 ( 0.271 -7.238 3.410) 8.006 17.288 ( -15.093 -0.312 12.455) 19.571 18.732 ( -5.948 -2.596 -10.536) 12.374 19.080 ( 13.616 4.816 10.358) 17.773 19.721 ( -0.886 -2.426 2.517) 3.607 20.472 ( -12.361 3.254 -7.956) 15.056 23.132 ( 15.665 1.002 11.265) 19.321 23.526 ( -4.528 1.555 -3.735) 6.072 24.442 ( 9.062 -3.525 3.211) 10.240 ======================= Grid point 627 (311/361) ======================= q-point: (-0.60 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.335 ( -4.426 -6.182 -8.936) 11.733 2.714 ( -0.391 -8.217 1.814) 8.424 2.892 ( -6.167 1.040 0.089) 6.255 3.340 ( 8.887 7.174 4.673) 12.340 3.471 ( 3.057 -11.233 -5.698) 12.961 3.691 ( 3.524 6.454 5.298) 9.063 4.044 ( 14.115 8.642 2.796) 16.785 4.518 ( -2.905 -4.684 7.924) 9.652 4.764 ( -5.874 -1.086 0.229) 5.977 5.039 ( -7.278 -1.138 -2.457) 7.765 5.274 ( -14.851 1.684 0.503) 14.955 5.482 ( 1.335 -0.612 -14.026) 14.103 6.628 ( -7.514 3.408 8.199) 11.631 7.344 ( 0.464 -5.021 0.829) 5.110 7.718 ( 2.926 3.393 -11.539) 12.378 8.826 ( 0.871 18.007 0.541) 18.036 9.258 ( -14.616 -14.420 -6.411) 21.510 9.740 ( -2.486 -6.223 3.320) 7.479 10.052 ( -9.850 -5.356 -0.083) 11.213 10.348 ( -7.284 4.608 17.332) 19.357 10.865 ( 11.392 7.320 -4.354) 14.224 11.231 ( 19.951 7.605 -19.310) 28.788 11.492 ( 0.952 -3.223 2.473) 4.172 12.813 ( 5.198 -1.905 -1.264) 5.679 13.484 ( -0.416 -4.022 -5.109) 6.516 13.810 ( 1.861 -1.819 -2.113) 3.352 14.148 ( -2.426 4.357 6.615) 8.284 14.533 ( 2.990 -9.112 2.532) 9.919 17.333 ( -10.170 -2.036 22.837) 25.082 18.514 ( -1.724 -1.909 -18.881) 19.055 19.323 ( 10.050 4.189 7.110) 13.004 19.725 ( -4.614 -1.647 1.391) 5.093 20.255 ( -3.412 2.845 -3.997) 5.975 23.378 ( -12.668 -14.188 7.622) 20.491 23.437 ( 18.076 15.810 -5.052) 24.540 24.636 ( 6.150 -3.079 4.419) 8.176 ======================= Grid point 628 (312/361) ======================= q-point: (-0.50 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.223 ( -4.578 -0.518 -2.258) 5.131 2.704 ( -16.226 4.430 11.724) 20.502 2.905 ( 11.256 -5.144 -7.564) 14.504 3.397 ( 3.556 10.257 4.037) 11.583 3.530 ( -1.217 -9.689 -5.314) 11.117 3.729 ( 2.591 -3.000 -1.324) 4.179 4.200 ( 3.716 1.135 1.118) 4.043 4.529 ( -2.065 -1.290 4.401) 5.029 4.727 ( -4.622 -0.633 4.321) 6.358 4.984 ( -0.774 -0.574 -3.858) 3.977 5.128 ( -5.729 3.729 8.125) 10.618 5.363 ( 4.913 -1.386 -13.081) 14.041 6.624 ( -3.207 1.272 7.116) 7.909 7.424 ( -0.180 -5.481 3.422) 6.464 7.593 ( 2.459 3.573 -11.054) 11.874 8.734 ( -0.194 7.927 4.054) 8.905 9.134 ( -8.685 -9.361 -2.605) 13.032 9.804 ( 0.387 -0.708 2.918) 3.027 9.975 ( -5.149 -2.084 0.634) 5.591 10.390 ( -11.178 4.705 17.646) 21.412 10.920 ( 7.811 0.614 -5.123) 9.361 11.178 ( 10.705 4.669 -15.254) 19.212 11.519 ( 0.208 0.176 -0.130) 0.302 12.851 ( 0.045 -0.565 -0.873) 1.041 13.448 ( -1.239 -0.556 -2.353) 2.716 13.792 ( -3.349 0.501 1.513) 3.709 14.162 ( 0.300 3.498 3.430) 4.908 14.662 ( 5.134 -7.094 -4.274) 9.744 17.565 ( -3.435 -3.884 24.395) 24.940 18.266 ( 2.461 0.020 -22.435) 22.569 19.457 ( 3.609 1.348 1.927) 4.308 19.691 ( 0.679 -0.094 -0.611) 0.918 20.194 ( -0.499 1.971 0.116) 2.036 23.336 ( -8.778 -9.710 0.795) 13.113 23.534 ( 9.398 6.851 -1.598) 11.739 24.748 ( 0.967 0.174 2.090) 2.310 ======================= Grid point 629 (313/361) ======================= q-point: (-0.40 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.177 ( -2.540 5.204 6.617) 8.793 2.556 ( -13.979 9.205 12.154) 20.685 3.017 ( 11.058 -1.102 -5.922) 12.592 3.371 ( 0.643 10.762 1.768) 10.925 3.456 ( -7.971 -6.825 -6.136) 12.156 3.802 ( 1.229 -11.856 -4.149) 12.621 4.094 ( -14.102 -7.650 -2.974) 16.316 4.673 ( 5.351 -0.457 0.963) 5.456 4.702 ( -0.735 6.009 -0.761) 6.101 4.949 ( 2.511 -1.235 5.967) 6.591 5.209 ( 0.968 3.653 11.076) 11.703 5.371 ( 13.201 -1.578 -7.852) 15.440 6.686 ( 1.427 -2.273 4.270) 5.044 7.449 ( 2.424 3.856 -10.083) 11.064 7.511 ( -2.721 -1.390 7.227) 7.847 8.784 ( -4.685 -11.877 6.673) 14.407 9.136 ( 3.004 2.058 3.800) 5.263 9.795 ( 0.732 5.931 -0.755) 6.023 10.000 ( 3.193 0.392 3.876) 5.037 10.361 ( -16.749 4.862 17.884) 24.981 10.914 ( 3.689 0.264 -9.220) 9.934 11.102 ( -1.424 -5.304 -8.476) 10.100 11.518 ( 2.187 3.007 -0.564) 3.761 12.803 ( -4.708 1.581 -0.343) 4.978 13.406 ( -1.956 3.878 2.288) 4.909 13.754 ( -5.425 1.370 3.566) 6.635 14.173 ( 0.835 2.983 2.078) 3.731 14.695 ( 5.891 -4.630 -11.921) 14.080 17.755 ( 4.251 -2.107 -7.825) 9.151 18.169 ( 5.919 -0.395 5.184) 7.878 19.434 ( -5.187 -2.919 -3.957) 7.148 19.759 ( 8.988 0.564 -1.957) 9.216 20.188 ( 0.916 2.464 3.030) 4.011 23.337 ( -12.186 -16.426 3.130) 20.690 23.537 ( 8.456 8.201 -6.583) 13.494 24.697 ( -5.350 4.667 -1.529) 7.262 ======================= Grid point 630 (314/361) ======================= q-point: (-0.30 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.205 ( -1.755 7.059 11.819) 13.878 2.478 ( -6.431 9.057 13.973) 17.850 3.101 ( 9.868 1.453 -4.337) 10.877 3.241 ( -6.000 2.812 -4.614) 8.074 3.327 ( -8.034 0.045 -1.440) 8.162 3.832 ( -1.727 -12.908 -10.631) 16.811 3.973 ( -9.617 -9.469 -0.312) 13.500 4.510 ( -5.328 6.021 -9.829) 12.698 4.726 ( -1.686 3.373 8.925) 9.689 5.186 ( 13.240 0.105 1.092) 13.285 5.346 ( 1.931 0.702 14.892) 15.034 5.557 ( 17.362 -1.616 -2.393) 17.601 6.802 ( 6.028 -5.361 -0.348) 8.074 7.337 ( 1.599 5.095 -6.026) 8.052 7.608 ( -1.974 -2.609 13.679) 14.065 8.959 ( -4.940 -22.816 5.894) 24.077 9.243 ( 6.420 6.918 7.903) 12.309 9.745 ( 5.473 10.508 -2.081) 12.029 10.085 ( 6.896 12.815 4.415) 15.208 10.313 ( -18.910 -7.397 19.048) 27.841 10.810 ( -4.105 2.130 -4.597) 6.521 11.012 ( -6.271 -5.721 -5.639) 10.190 11.479 ( 0.148 2.944 -5.823) 6.527 12.690 ( -8.910 1.076 0.256) 8.978 13.389 ( -1.414 5.952 6.562) 8.972 13.684 ( -6.378 3.591 2.351) 7.688 14.187 ( 0.837 2.280 2.018) 3.158 14.642 ( 6.921 -3.387 -16.933) 18.604 17.643 ( 10.258 0.227 -21.059) 23.426 18.466 ( 10.433 -1.663 15.146) 18.466 19.279 ( -10.953 -5.540 -8.855) 15.135 19.799 ( 3.150 2.764 -5.143) 6.634 20.317 ( 11.617 1.083 7.617) 13.933 23.265 ( -24.115 -17.802 -1.767) 30.026 23.541 ( 14.658 7.390 -5.663) 17.365 24.497 ( -10.073 7.314 -2.247) 12.649 ======================= Grid point 631 (315/361) ======================= q-point: (-0.20 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.291 ( -0.161 2.767 11.967) 12.284 2.529 ( -2.074 6.614 14.266) 15.861 3.088 ( -6.776 -2.719 -4.331) 8.489 3.157 ( -1.539 2.224 3.356) 4.310 3.213 ( 5.995 3.885 -7.184) 10.131 3.744 ( -4.948 -10.558 -11.964) 16.706 3.941 ( -4.415 -6.429 -2.603) 8.222 4.241 ( -8.486 6.497 -7.776) 13.217 4.818 ( 2.818 3.302 9.682) 10.611 5.276 ( 1.512 1.911 1.286) 2.755 5.603 ( 6.946 -1.509 11.270) 13.325 5.797 ( 16.429 -1.576 -1.923) 16.616 6.938 ( 8.886 -5.779 -3.363) 11.120 7.238 ( -1.408 5.033 -2.962) 6.007 7.899 ( 5.450 -8.307 22.072) 24.205 9.167 ( -2.373 -21.987 1.935) 22.199 9.378 ( 3.630 2.212 9.777) 10.661 9.685 ( 4.289 13.753 -1.635) 14.499 10.064 ( -0.447 18.949 10.057) 21.458 10.418 ( -3.164 -13.605 1.144) 14.015 10.669 ( -19.577 2.381 14.631) 24.556 10.914 ( 0.893 1.733 -3.512) 4.017 11.316 ( -2.018 2.057 -13.577) 13.879 12.520 ( -14.480 -1.089 -2.137) 14.678 13.416 ( -0.731 5.015 8.128) 9.579 13.580 ( -2.823 5.648 -0.070) 6.315 14.201 ( -0.541 1.291 2.629) 2.979 14.563 ( 7.416 -3.053 -17.144) 18.928 17.601 ( 14.275 0.104 -13.867) 19.902 18.784 ( 10.708 0.780 5.172) 11.917 19.022 ( -11.491 -6.395 -9.860) 16.437 19.703 ( -4.175 2.408 -3.756) 6.110 20.660 ( 21.188 0.420 9.305) 23.145 22.936 ( -28.231 -8.796 -9.022) 30.916 23.653 ( 12.281 1.660 -2.462) 12.635 24.260 ( -11.713 5.560 -0.163) 12.967 ======================= Grid point 632 (316/361) ======================= q-point: (-0.10 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.421 ( -0.160 -0.249 10.328) 10.332 2.608 ( -1.728 1.658 7.908) 8.263 3.007 ( -2.365 -1.444 -0.329) 2.791 3.119 ( 0.688 1.746 -2.054) 2.783 3.262 ( 7.715 1.585 -0.504) 7.892 3.621 ( -4.603 -4.628 -6.948) 9.533 3.878 ( -3.205 -4.082 -6.833) 8.581 3.974 ( -7.988 6.069 -6.239) 11.814 4.968 ( 4.357 1.370 9.130) 10.209 5.266 ( -1.540 1.306 0.179) 2.027 5.803 ( 1.820 -0.811 9.169) 9.383 5.982 ( 11.714 -0.918 -3.727) 12.326 7.065 ( 4.401 -4.584 -1.508) 6.531 7.145 ( 0.438 4.082 -2.537) 4.826 8.416 ( 10.484 -10.987 26.423) 30.476 9.326 ( -0.434 -17.954 -2.407) 18.120 9.547 ( 3.922 -2.870 6.229) 7.901 9.609 ( -2.228 8.618 6.446) 10.991 9.917 ( -4.195 24.628 1.815) 25.049 10.372 ( -1.595 -5.059 -14.598) 15.532 10.565 ( -24.566 0.423 22.116) 33.057 11.048 ( 11.756 -1.778 4.407) 12.680 11.122 ( 4.878 3.189 -9.567) 11.202 12.217 ( -19.395 -1.384 -9.055) 21.449 13.461 ( -1.591 2.947 7.239) 7.976 13.526 ( 2.782 4.133 -1.144) 5.112 14.215 ( -2.454 -0.014 4.237) 4.896 14.493 ( 6.215 -1.921 -14.342) 15.748 17.714 ( 16.768 0.019 -4.341) 17.321 18.568 ( -16.098 -0.237 -14.746) 21.832 19.150 ( 14.306 -2.148 2.760) 14.728 19.561 ( -8.822 0.720 -1.670) 9.008 21.120 ( 25.962 0.236 10.379) 27.961 22.431 ( -31.183 -2.804 -10.709) 33.089 23.788 ( 11.433 0.450 -1.883) 11.596 24.064 ( -11.611 2.095 1.046) 11.845 ======================= Grid point 634 (317/361) ======================= q-point: ( 0.10 0.10 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.469 ( -3.369 -0.000 -7.664) 8.372 2.666 ( -0.134 -0.000 -5.828) 5.830 3.024 ( 3.813 0.000 6.333) 7.393 3.133 ( 5.170 0.000 -1.587) 5.408 3.230 ( -2.789 -0.000 -9.891) 10.277 3.649 ( 3.701 0.000 7.915) 8.738 3.868 ( 2.727 0.000 11.719) 12.032 4.029 ( 9.396 0.000 3.743) 10.114 4.963 ( -5.069 -0.000 -8.324) 9.746 5.260 ( -2.066 -0.000 1.292) 2.436 5.745 ( -16.459 -0.000 4.743) 17.128 5.847 ( -2.754 -0.000 -10.777) 11.123 6.867 ( -13.729 -0.000 6.963) 15.394 7.208 ( 4.386 0.000 -2.903) 5.260 8.493 ( -13.886 -0.000 -24.022) 27.746 9.119 ( -13.817 -0.000 10.698) 17.474 9.545 ( -8.507 -0.000 10.728) 13.692 9.665 ( -2.401 -0.000 -9.256) 9.562 9.955 ( 9.548 0.000 -10.863) 14.462 10.203 ( -6.268 -0.000 22.134) 23.005 10.994 ( 7.203 0.000 15.903) 17.458 11.054 ( 12.523 0.000 -9.982) 16.014 11.186 ( 17.750 0.000 -26.861) 32.196 12.437 ( 19.411 0.000 8.608) 21.234 13.470 ( 0.853 0.000 2.877) 3.001 13.523 ( 0.688 0.000 -6.921) 6.955 14.277 ( -9.806 -0.000 13.311) 16.533 14.281 ( 1.176 0.000 -6.584) 6.688 17.445 ( -17.535 -0.000 0.999) 17.563 18.680 ( 12.807 0.000 10.649) 16.656 19.017 ( -7.379 -0.000 -2.005) 7.647 19.651 ( 4.074 0.000 0.152) 4.077 20.860 ( -20.078 -0.000 -9.862) 22.370 22.713 ( 19.973 0.000 16.286) 25.771 23.658 ( -4.938 -0.000 -1.881) 5.284 24.228 ( 10.808 0.000 -0.818) 10.839 ======================= Grid point 635 (318/361) ======================= q-point: ( 0.20 0.10 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.322 ( -3.204 -2.729 -8.723) 9.685 2.577 ( -1.004 -3.252 -7.417) 8.161 3.030 ( -6.393 1.319 -2.670) 7.053 3.194 ( 7.153 -1.135 -0.825) 7.289 3.267 ( 9.434 -2.449 2.087) 9.968 3.791 ( 2.108 7.166 12.081) 14.203 4.044 ( 8.167 4.346 8.618) 12.644 4.226 ( 5.229 -6.121 4.717) 9.330 4.803 ( -4.269 -1.924 -6.460) 7.979 5.179 ( -11.375 -0.633 -0.004) 11.393 5.536 ( -17.775 0.785 2.874) 18.023 5.664 ( -0.005 0.759 -14.315) 14.335 6.761 ( -12.305 2.001 8.585) 15.137 7.241 ( 2.532 -1.704 -1.618) 3.454 8.012 ( -9.150 2.758 -21.185) 23.241 9.096 ( -9.251 -3.060 8.651) 13.030 9.407 ( -12.434 9.333 0.768) 15.566 9.577 ( -2.868 -3.987 -1.728) 5.207 9.944 ( -0.284 -9.036 -8.885) 12.676 10.341 ( -9.566 1.687 20.513) 22.697 11.041 ( 17.391 5.653 -18.739) 26.183 11.273 ( 25.329 2.391 -14.641) 29.354 11.290 ( 10.070 -0.735 8.979) 13.512 12.699 ( 10.324 0.557 0.103) 10.340 13.439 ( -0.911 -2.825 -7.299) 7.879 13.606 ( 8.658 -4.157 2.354) 9.888 14.216 ( -1.188 0.338 -3.017) 3.260 14.315 ( -9.493 -1.022 15.598) 18.288 17.284 ( -15.454 -0.100 11.897) 19.503 18.698 ( -7.000 -0.938 -8.171) 10.800 19.158 ( 13.248 2.714 12.099) 18.146 19.681 ( -1.821 -1.489 1.666) 2.882 20.508 ( -10.820 0.864 -10.639) 15.199 23.100 ( 1.841 -2.010 16.132) 16.361 23.615 ( 7.592 4.547 -2.571) 9.216 24.375 ( 9.228 -2.756 -0.335) 9.636 ======================= Grid point 636 (319/361) ======================= q-point: ( 0.30 0.10 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( -0.207 -4.254 -6.982) 8.179 2.566 ( 3.817 -6.846 -3.759) 8.693 2.903 ( -7.643 0.338 0.289) 7.656 3.275 ( 3.581 -7.478 -4.976) 9.669 3.457 ( 9.895 3.368 4.639) 11.436 3.852 ( -2.677 10.419 10.967) 15.363 4.207 ( 9.976 7.978 3.617) 13.276 4.383 ( -2.197 -8.906 7.241) 11.686 4.750 ( -0.818 -1.249 -1.305) 1.983 4.974 ( -14.123 -4.185 -1.949) 14.858 5.317 ( -14.698 2.355 3.221) 15.230 5.497 ( 4.233 1.406 -16.433) 17.028 6.693 ( -8.782 3.288 8.938) 12.955 7.264 ( -0.446 -3.322 -0.282) 3.364 7.708 ( -2.874 -3.262 -15.044) 15.660 9.057 ( -16.081 -5.427 -5.899) 17.968 9.144 ( -3.196 13.920 8.397) 16.568 9.604 ( -3.296 -8.247 3.488) 9.542 9.907 ( -2.846 -7.334 -5.069) 9.358 10.413 ( -12.243 2.096 20.207) 23.720 11.024 ( 24.213 6.923 -23.753) 34.618 11.396 ( 17.169 9.464 -8.963) 21.556 11.491 ( 8.839 1.852 2.311) 9.322 12.783 ( 4.305 -0.943 -1.647) 4.704 13.385 ( -0.866 -6.097 -5.480) 8.244 13.762 ( 5.552 -2.664 -1.278) 6.289 14.174 ( -0.667 -1.485 -2.421) 2.917 14.426 ( -4.463 -2.105 16.244) 16.977 17.305 ( -11.697 -1.030 22.750) 25.602 18.479 ( -4.219 -1.564 -15.326) 15.973 19.428 ( 10.811 6.230 8.237) 14.951 19.685 ( -3.293 -2.632 2.280) 4.793 20.275 ( -3.890 -0.138 -9.238) 10.024 23.173 ( -15.465 -7.848 8.560) 19.340 23.724 ( 17.244 14.186 0.749) 22.342 24.541 ( 6.747 -6.565 1.291) 9.502 ======================= Grid point 637 (320/361) ======================= q-point: ( 0.40 0.10 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.220 ( 2.549 0.275 -0.846) 2.700 2.703 ( 1.955 -5.700 5.505) 8.161 2.822 ( -1.215 -1.699 -1.983) 2.880 3.309 ( 0.185 -10.084 -6.909) 12.225 3.586 ( 7.017 6.212 3.935) 10.165 3.774 ( -9.535 7.805 5.075) 13.326 4.225 ( -9.906 0.157 0.109) 9.908 4.510 ( 4.381 0.205 6.496) 7.838 4.707 ( -1.805 -1.464 3.373) 4.096 4.910 ( -3.950 -6.303 -2.714) 7.918 5.208 ( -4.472 4.232 8.942) 10.857 5.367 ( 8.320 1.266 -16.255) 18.305 6.660 ( -4.534 2.562 5.717) 7.733 7.309 ( -2.358 -6.619 3.921) 8.046 7.581 ( -0.247 -4.138 -9.603) 10.460 8.724 ( -18.499 -4.748 -7.323) 20.455 9.188 ( 3.299 10.449 11.348) 15.774 9.702 ( -4.758 -12.129 6.108) 14.390 9.880 ( 0.176 -2.172 -3.074) 3.768 10.453 ( -14.518 1.392 20.478) 25.141 11.016 ( 23.194 6.501 -24.043) 34.034 11.342 ( 6.668 12.446 -10.643) 17.682 11.591 ( 9.673 7.142 -0.086) 12.024 12.822 ( 0.500 -2.119 -0.150) 2.183 13.391 ( -0.242 -5.377 -1.475) 5.581 13.789 ( -1.867 -0.734 0.586) 2.090 14.164 ( 0.802 -3.325 -3.352) 4.789 14.577 ( 0.073 -1.669 8.848) 9.005 17.510 ( -6.277 -2.161 28.051) 28.826 18.243 ( 0.104 -1.996 -20.206) 20.305 19.545 ( 5.789 7.276 0.950) 9.346 19.686 ( 0.836 -0.327 -0.328) 0.956 20.177 ( -1.066 -3.485 -4.289) 5.628 23.098 ( -17.945 -11.306 6.025) 22.049 23.799 ( 13.280 16.896 -1.341) 21.532 24.690 ( 2.191 -6.322 1.157) 6.790 ======================= Grid point 638 (321/361) ======================= q-point: (-0.50 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.281 ( 3.863 5.827 7.046) 9.926 2.700 ( -12.328 6.360 13.083) 19.068 2.951 ( 13.791 -6.276 -5.667) 16.177 3.294 ( -3.114 -9.242 -7.077) 12.050 3.587 ( -10.343 9.123 3.773) 14.298 3.653 ( 1.543 -2.477 -2.336) 3.738 3.984 ( -17.631 -4.028 -3.048) 18.340 4.654 ( 2.309 -0.745 3.873) 4.570 4.785 ( -0.014 2.406 -3.492) 4.241 4.883 ( 2.579 -5.175 8.267) 10.088 5.277 ( 1.950 3.197 6.669) 7.649 5.373 ( 14.769 1.617 -6.246) 16.117 6.663 ( 0.145 -0.272 1.962) 1.986 7.396 ( -6.176 -9.430 7.143) 13.345 7.506 ( 1.187 1.249 -6.794) 7.010 8.514 ( -13.639 -13.682 -0.947) 19.342 9.298 ( 4.210 11.343 13.238) 17.934 9.806 ( -8.990 -15.145 4.593) 18.201 9.905 ( 8.046 4.154 1.325) 9.152 10.469 ( -15.307 2.290 19.454) 24.860 10.963 ( 13.349 6.600 -18.658) 23.872 11.149 ( 5.153 8.741 -16.228) 19.139 11.643 ( 8.413 10.668 0.200) 13.587 12.813 ( -4.364 -0.675 0.346) 4.430 13.427 ( -0.595 -1.487 2.854) 3.273 13.769 ( -4.562 0.096 3.765) 5.915 14.169 ( 1.674 -3.812 -3.983) 5.762 14.647 ( 0.695 -0.050 0.151) 0.713 17.737 ( 1.309 0.225 3.803) 4.028 18.118 ( 2.787 -4.896 0.211) 5.637 19.460 ( -3.087 5.663 -6.182) 8.934 19.762 ( 9.402 -0.192 -1.428) 9.512 20.178 ( 0.992 -3.692 -0.811) 3.908 23.027 ( -19.363 -14.668 6.366) 25.112 23.780 ( 10.414 15.577 -4.470) 19.264 24.716 ( -3.905 -2.480 -1.936) 5.014 ======================= Grid point 639 (322/361) ======================= q-point: (-0.40 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.360 ( -0.456 9.205 11.215) 14.516 2.643 ( -7.328 8.368 13.752) 17.688 3.110 ( 11.381 -1.199 -3.875) 12.082 3.192 ( -8.648 -5.300 -6.968) 12.305 3.407 ( -10.408 4.340 3.318) 11.754 3.629 ( -1.909 -8.145 -10.514) 13.436 3.823 ( -6.444 -5.522 -0.691) 8.515 4.563 ( -8.454 0.099 -7.689) 11.429 4.786 ( 0.359 3.173 8.880) 9.437 5.149 ( 12.526 -4.030 2.984) 13.492 5.381 ( 3.476 2.511 9.561) 10.478 5.550 ( 15.826 1.233 -0.433) 15.879 6.722 ( 4.512 -3.313 -0.527) 5.622 7.409 ( -0.854 0.148 -5.878) 5.941 7.495 ( -5.584 -6.876 10.257) 13.552 8.557 ( -7.671 -20.234 5.280) 22.274 9.407 ( 1.464 10.096 13.590) 16.993 9.869 ( 0.179 -5.861 2.965) 6.571 10.046 ( 5.772 -0.552 5.679) 8.116 10.420 ( -14.914 8.900 15.701) 23.413 10.827 ( -5.139 3.426 -3.373) 7.037 10.996 ( 14.307 2.593 -22.848) 27.082 11.618 ( 4.228 12.754 -2.913) 13.749 12.709 ( -10.159 0.596 -0.205) 10.178 13.467 ( -0.798 2.327 5.901) 6.394 13.745 ( -4.865 2.454 4.889) 7.321 14.187 ( 2.223 -3.259 -3.039) 4.980 14.609 ( 0.864 0.720 -7.109) 7.197 17.655 ( 9.104 1.082 -19.242) 21.315 18.397 ( 5.267 -5.967 18.959) 20.562 19.240 ( -8.682 1.941 -9.840) 13.265 19.833 ( 3.459 0.957 -4.585) 5.823 20.308 ( 12.945 -2.581 3.298) 13.605 22.940 ( -23.612 -16.150 5.145) 29.066 23.731 ( 10.672 12.443 -6.050) 17.474 24.583 ( -8.988 1.721 -4.305) 10.113 ======================= Grid point 640 (323/361) ======================= q-point: (-0.30 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.376 ( -4.022 6.183 10.532) 12.858 2.668 ( -3.964 7.857 12.941) 15.650 3.024 ( -8.336 -4.087 -4.369) 10.261 3.200 ( 1.380 1.997 3.028) 3.881 3.301 ( 2.682 5.236 -4.043) 7.138 3.539 ( -2.827 -11.101 -10.744) 15.706 3.817 ( -0.936 -6.236 -3.312) 7.123 4.325 ( -9.998 2.411 -6.828) 12.345 4.887 ( 2.533 4.039 9.510) 10.638 5.305 ( 4.413 0.187 -0.176) 4.420 5.578 ( 5.317 -0.577 11.968) 13.109 5.770 ( 15.386 -0.849 -1.042) 15.445 6.837 ( 7.540 -5.074 -1.448) 9.203 7.313 ( -1.715 2.326 -4.792) 5.596 7.694 ( 0.273 -12.879 15.293) 19.996 8.723 ( -7.808 -24.000 4.938) 25.717 9.495 ( -0.108 8.154 13.712) 15.954 9.974 ( 10.895 9.514 -0.847) 14.489 10.165 ( -3.637 -6.806 4.023) 8.702 10.320 ( -10.034 9.013 16.332) 21.181 10.707 ( -12.233 1.602 7.270) 14.320 10.945 ( 17.200 1.326 -19.175) 25.794 11.444 ( -1.473 13.691 -7.947) 15.899 12.505 ( -15.937 -0.406 -2.664) 16.163 13.508 ( -0.106 4.531 7.074) 8.402 13.703 ( -2.446 6.607 3.911) 8.058 14.211 ( 0.457 -1.473 -0.266) 1.565 14.509 ( 2.286 -1.425 -12.139) 12.434 17.604 ( 13.983 0.337 -13.929) 19.740 18.757 ( 9.586 -5.742 12.893) 17.062 18.937 ( -12.993 -0.023 -12.698) 18.167 19.743 ( -4.306 1.505 -5.464) 7.117 20.658 ( 23.456 -0.957 6.531) 24.367 22.729 ( -28.838 -12.491 -0.294) 31.429 23.735 ( 11.589 7.135 -4.482) 14.328 24.354 ( -11.451 3.891 -3.498) 12.590 ======================= Grid point 641 (324/361) ======================= q-point: (-0.20 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.423 ( -1.821 0.758 9.317) 9.524 2.656 ( -4.850 3.191 4.627) 7.424 2.967 ( -2.029 -2.601 1.669) 3.697 3.170 ( -5.069 3.451 2.494) 6.620 3.294 ( 7.561 0.526 -6.192) 9.786 3.521 ( 2.574 -3.966 -3.674) 5.988 3.800 ( -0.080 -4.752 -6.404) 7.975 4.074 ( -9.949 4.069 -5.814) 12.220 5.014 ( 3.576 3.378 9.165) 10.402 5.308 ( -0.371 2.804 -0.683) 2.910 5.778 ( 1.739 -1.625 9.660) 9.949 5.954 ( 11.192 -1.759 -3.107) 11.748 6.980 ( 6.408 -4.672 -0.063) 7.931 7.205 ( -2.451 2.051 -3.974) 5.100 8.116 ( 8.527 -19.153 18.197) 27.761 8.864 ( -10.157 -26.979 0.302) 28.830 9.601 ( -1.272 5.129 15.195) 16.087 9.933 ( 7.975 21.747 0.804) 23.177 10.182 ( -4.628 -6.213 -4.292) 8.857 10.341 ( -1.730 10.676 9.308) 14.270 10.589 ( -18.351 3.492 12.885) 22.693 11.005 ( 15.137 -2.722 -14.818) 21.357 11.240 ( 6.375 11.000 -1.867) 12.850 12.184 ( -20.570 -1.518 -8.079) 22.152 13.548 ( -0.111 5.890 6.997) 9.147 13.656 ( 1.328 8.983 1.480) 9.200 14.213 ( -3.201 -0.338 2.914) 4.342 14.429 ( 4.510 -4.529 -13.134) 14.607 17.715 ( 16.875 0.084 -4.385) 17.435 18.561 ( -16.434 -0.544 -14.281) 21.779 19.084 ( 12.667 -4.524 6.346) 14.873 19.580 ( -7.913 0.943 -4.301) 9.056 21.125 ( 27.388 0.111 8.629) 28.716 22.339 ( -31.476 -6.754 -5.831) 32.717 23.816 ( 11.278 2.897 -2.312) 11.872 24.122 ( -11.625 3.540 -1.243) 12.215 ======================= Grid point 642 (325/361) ======================= q-point: (-0.10 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.523 ( -0.037 -1.392 7.790) 7.914 2.620 ( -0.316 -0.089 -1.351) 1.390 3.010 ( 0.999 -1.489 1.514) 2.347 3.086 ( -0.478 1.215 -4.890) 5.061 3.368 ( 1.326 -2.723 6.609) 7.270 3.533 ( 2.967 0.404 -6.166) 6.855 3.767 ( -3.237 1.408 0.468) 3.561 3.850 ( -1.482 3.078 -6.674) 7.497 5.139 ( 3.175 2.009 6.884) 7.843 5.241 ( -1.903 2.533 -3.233) 4.526 5.883 ( -4.425 -1.137 8.452) 9.607 6.032 ( 4.995 -1.462 -5.896) 7.865 7.041 ( -7.469 -0.876 4.815) 8.930 7.157 ( 6.725 -0.814 -6.177) 9.167 8.679 ( 9.450 -22.383 17.953) 30.210 8.921 ( -11.245 -27.698 -6.120) 30.514 9.722 ( -5.253 3.951 15.616) 16.943 9.906 ( 11.570 19.981 2.903) 23.271 9.992 ( -9.406 14.345 -1.698) 17.237 10.169 ( -3.158 8.277 -12.976) 15.711 10.555 ( -13.252 -0.997 22.212) 25.884 10.986 ( 14.921 -1.455 -20.292) 25.229 11.501 ( 20.248 2.413 13.190) 24.286 11.774 ( -19.158 -2.231 -13.268) 23.410 13.545 ( -3.597 6.311 5.341) 9.016 13.619 ( 4.756 7.431 -2.225) 9.099 14.217 ( -5.138 -1.879 6.258) 8.312 14.389 ( 4.529 -3.334 -10.754) 12.136 17.966 ( 17.868 0.144 4.123) 18.338 18.143 ( -18.104 -0.041 -12.924) 22.244 19.340 ( 4.768 -3.374 3.200) 6.661 19.412 ( -2.518 0.610 -4.095) 4.846 21.642 ( 27.202 -0.097 10.834) 29.280 21.839 ( -30.113 -2.575 -8.514) 31.400 23.926 ( -7.377 1.921 0.242) 7.627 23.942 ( 7.955 1.369 -1.485) 8.208 ======================= Grid point 645 (326/361) ======================= q-point: ( 0.20 0.20 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.194 ( 1.386 0.000 -5.726) 5.891 2.498 ( 4.319 0.000 -5.847) 7.269 2.907 ( -7.073 -0.000 -1.232) 7.180 3.202 ( 2.088 0.000 -3.779) 4.317 3.487 ( 11.074 0.000 4.894) 12.107 3.993 ( -3.819 -0.000 15.198) 15.670 4.234 ( -6.141 -0.000 1.979) 6.452 4.318 ( 12.170 0.000 7.884) 14.500 4.726 ( 3.504 0.000 -2.859) 4.523 4.933 ( -18.909 -0.000 -1.897) 19.004 5.341 ( -14.436 -0.000 3.967) 14.971 5.512 ( 5.016 0.000 -17.139) 17.858 6.728 ( -9.646 -0.000 9.950) 13.858 7.232 ( -0.464 -0.000 -1.392) 1.467 7.665 ( -5.191 -0.000 -16.738) 17.525 9.005 ( -12.894 -0.000 -2.163) 13.074 9.318 ( -11.537 -0.000 11.054) 15.978 9.489 ( -5.964 -0.000 1.736) 6.211 9.835 ( 6.466 0.000 -8.895) 10.997 10.432 ( -14.379 -0.000 21.517) 25.880 11.085 ( 28.100 0.000 -31.115) 41.925 11.493 ( 7.430 0.000 2.674) 7.897 11.522 ( 21.333 0.000 -4.747) 21.854 12.778 ( 4.017 0.000 -2.062) 4.516 13.314 ( -1.439 -0.000 -6.127) 6.293 13.735 ( 6.828 0.000 -0.250) 6.833 14.149 ( -0.300 -0.000 -5.321) 5.329 14.416 ( -7.226 -0.000 20.752) 21.974 17.295 ( -12.247 -0.000 22.786) 25.868 18.464 ( -4.932 -0.000 -14.443) 15.262 19.501 ( 11.437 0.000 10.595) 15.591 19.649 ( -3.166 -0.000 1.684) 3.586 20.270 ( -4.264 -0.000 -11.902) 12.643 23.100 ( -16.136 -0.000 9.095) 18.523 23.878 ( 16.770 0.000 5.045) 17.512 24.459 ( 6.758 0.000 -2.055) 7.063 ======================= Grid point 646 (327/361) ======================= q-point: ( 0.30 0.20 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.232 ( 7.335 0.748 1.119) 7.458 2.579 ( 11.001 -4.980 -2.601) 12.353 2.817 ( -6.971 0.157 3.605) 7.850 3.177 ( 0.375 -3.902 -5.786) 6.989 3.646 ( 4.295 1.322 2.064) 4.945 3.963 ( -13.601 10.374 9.112) 19.382 4.163 ( -14.497 -6.486 3.051) 16.172 4.551 ( 8.358 2.838 6.653) 11.053 4.688 ( -6.250 0.338 1.859) 6.530 4.791 ( 0.972 -5.672 -2.647) 6.334 5.265 ( -4.978 1.742 9.317) 10.707 5.389 ( 9.331 0.794 -18.322) 20.576 6.706 ( -6.140 1.843 5.829) 8.664 7.202 ( -4.180 -3.985 0.060) 5.776 7.504 ( -0.335 -2.808 -5.721) 6.381 8.675 ( -19.428 -0.760 -9.234) 21.524 9.355 ( -2.059 6.797 13.732) 15.460 9.485 ( -7.663 -9.099 6.332) 13.476 9.872 ( 8.477 0.084 -4.006) 9.377 10.465 ( -18.136 0.281 22.735) 29.084 11.092 ( 29.809 1.868 -34.788) 45.851 11.533 ( 5.786 5.888 -7.611) 11.229 11.738 ( 16.311 6.341 -0.031) 17.500 12.794 ( 0.054 -0.585 -0.254) 0.640 13.281 ( 0.483 -4.803 -1.334) 5.008 13.775 ( -0.927 -0.572 0.382) 1.154 14.094 ( 0.498 -2.695 -5.683) 6.310 14.575 ( -2.944 0.435 15.555) 15.837 17.485 ( -8.067 -0.658 30.874) 31.917 18.212 ( -1.036 -1.005 -20.109) 20.161 19.648 ( 3.678 1.471 0.977) 4.079 19.712 ( 5.350 4.040 3.212) 7.434 20.093 ( -2.726 -4.159 -10.404) 11.532 22.957 ( -18.911 -3.927 7.372) 20.674 24.083 ( 10.555 11.806 3.321) 16.181 24.543 ( 3.513 -7.819 -1.954) 8.792 ======================= Grid point 647 (328/361) ======================= q-point: ( 0.40 0.20 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( 7.715 4.639 7.725) 11.862 2.788 ( -7.318 2.719 9.876) 12.589 2.808 ( 14.455 -7.453 -1.640) 16.346 3.151 ( 1.278 -5.870 -7.619) 9.702 3.589 ( -11.387 -0.412 -1.903) 11.552 3.753 ( -16.034 2.774 2.697) 16.494 3.970 ( -11.967 3.040 0.135) 12.348 4.660 ( -0.039 1.177 3.445) 3.641 4.761 ( -4.378 -3.937 5.109) 7.795 4.817 ( 8.690 -1.829 1.346) 8.982 5.330 ( 7.716 2.802 -2.737) 8.654 5.402 ( 10.142 0.814 1.483) 10.282 6.672 ( -1.044 1.102 0.353) 1.558 7.196 ( -7.849 -10.370 1.914) 13.146 7.522 ( 1.114 0.552 3.345) 3.568 8.335 ( -16.250 -5.827 -5.819) 18.218 9.450 ( -1.224 0.476 10.720) 10.800 9.557 ( -7.190 -5.569 10.934) 14.222 9.968 ( 10.408 2.105 -0.544) 10.633 10.470 ( -20.913 -0.613 24.169) 31.967 11.051 ( 25.921 2.568 -34.094) 42.906 11.376 ( 4.263 12.591 -14.821) 19.909 11.875 ( 13.918 12.683 1.062) 18.860 12.782 ( -4.451 -2.241 0.735) 5.037 13.362 ( 1.225 -4.845 3.967) 6.381 13.759 ( -4.323 -0.947 3.122) 5.416 14.074 ( 2.007 -5.005 -6.383) 8.356 14.672 ( -3.007 1.775 8.335) 9.036 17.762 ( -2.272 2.298 18.016) 18.304 18.012 ( 1.419 -5.795 -8.949) 10.756 19.617 ( -2.101 10.305 -7.069) 12.672 19.758 ( 9.789 0.192 -1.115) 9.854 20.058 ( 1.286 -9.098 -4.304) 10.147 22.824 ( -19.944 -7.346 8.055) 22.730 24.073 ( 6.246 15.681 -1.851) 16.980 24.614 ( -1.836 -8.270 -2.508) 8.835 ======================= Grid point 648 (329/361) ======================= q-point: (-0.50 0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.513 ( 0.347 6.613 10.446) 12.369 2.779 ( -7.109 6.470 12.812) 16.017 3.033 ( 6.461 -5.730 0.161) 8.637 3.126 ( 5.689 -1.991 -9.598) 11.334 3.393 ( -12.679 -3.763 0.057) 13.226 3.524 ( -14.307 -5.506 -4.459) 15.965 3.826 ( -2.770 4.770 -1.648) 5.757 4.551 ( -9.622 -0.331 -4.846) 10.779 4.834 ( 1.980 1.980 8.849) 9.281 5.051 ( 10.703 -6.366 2.379) 12.678 5.430 ( 9.335 3.003 3.085) 10.280 5.587 ( 10.622 1.838 4.632) 11.733 6.681 ( 3.460 -1.175 -1.560) 3.973 7.212 ( -8.688 -13.979 2.257) 16.613 7.535 ( -1.448 5.482 3.285) 6.553 8.233 ( -9.895 -15.144 3.241) 18.378 9.564 ( -2.528 0.985 12.564) 12.854 9.643 ( -4.946 -6.249 9.872) 12.688 10.122 ( 11.711 3.155 3.237) 12.553 10.470 ( -22.317 -1.281 25.032) 33.560 10.959 ( 18.490 5.113 -27.992) 33.935 11.109 ( 6.538 12.367 -19.611) 24.089 11.916 ( 10.777 17.970 -1.467) 21.005 12.702 ( -10.365 -1.563 -0.150) 10.484 13.475 ( 0.520 -1.347 7.041) 7.187 13.759 ( -3.744 -0.941 5.164) 6.447 14.086 ( 3.594 -6.198 -6.663) 9.784 14.657 ( -4.662 3.453 2.251) 6.223 17.684 ( 8.020 1.998 -19.376) 21.065 18.266 ( -0.510 -7.394 24.756) 25.842 19.340 ( -7.546 8.124 -11.151) 15.725 19.836 ( 2.288 -0.583 -4.184) 4.804 20.220 ( 16.674 -6.625 -0.089) 17.942 22.701 ( -22.436 -9.606 8.034) 25.694 23.975 ( 5.628 13.709 -4.775) 15.570 24.560 ( -7.052 -4.036 -4.777) 9.425 ======================= Grid point 649 (330/361) ======================= q-point: (-0.40 0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.493 ( -8.624 5.688 8.241) 13.215 2.801 ( -5.872 6.494 13.448) 16.047 2.956 ( -8.807 -2.520 -4.351) 10.141 3.221 ( 6.356 0.470 0.304) 6.381 3.349 ( -3.710 -8.990 -10.644) 14.418 3.371 ( 1.516 0.874 3.393) 3.817 3.747 ( 0.451 -0.834 -5.820) 5.897 4.339 ( -11.103 -0.237 -5.097) 12.219 4.958 ( 3.536 3.445 8.555) 9.877 5.256 ( 7.336 -5.362 -0.109) 9.087 5.596 ( 5.292 2.331 9.904) 11.468 5.774 ( 11.765 1.035 1.591) 11.917 6.757 ( 6.438 -3.516 -1.185) 7.430 7.246 ( -5.547 -11.359 -1.111) 12.690 7.538 ( -0.288 -1.009 7.442) 7.516 8.317 ( -10.552 -20.064 5.150) 23.247 9.643 ( -4.004 6.678 14.612) 16.557 9.807 ( -0.307 -12.263 7.757) 14.514 10.301 ( 8.924 5.485 7.102) 12.655 10.449 ( -20.392 4.188 22.749) 30.837 10.781 ( 3.914 9.561 -12.144) 15.944 10.959 ( 19.720 0.914 -26.556) 33.090 11.798 ( 4.800 22.621 -5.729) 23.823 12.501 ( -16.450 -0.183 -2.375) 16.621 13.570 ( 0.406 2.134 8.281) 8.561 13.790 ( -0.468 2.298 5.290) 5.787 14.124 ( 3.925 -6.976 -5.985) 9.994 14.538 ( -6.132 3.860 -2.770) 7.757 17.613 ( 13.644 0.599 -14.466) 19.894 18.610 ( 0.795 -8.447 16.617) 18.657 19.007 ( -9.017 6.069 -10.968) 15.441 19.751 ( -4.452 -0.684 -6.501) 7.909 20.617 ( 27.167 -3.439 3.744) 27.639 22.521 ( -26.976 -9.452 5.083) 29.032 23.895 ( 7.308 9.771 -5.072) 13.214 24.389 ( -9.999 -0.116 -5.096) 11.223 ======================= Grid point 650 (331/361) ======================= q-point: (-0.30 0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.446 ( -5.658 1.429 7.863) 9.792 2.711 ( -7.634 2.359 -0.891) 8.040 2.925 ( -2.597 -1.349 6.576) 7.198 3.214 ( -4.724 -1.239 -5.740) 7.536 3.268 ( -0.715 -0.046 2.864) 2.953 3.524 ( 13.759 3.209 -0.735) 14.147 3.706 ( 1.955 -4.999 -7.346) 9.099 4.115 ( -11.194 0.632 -5.110) 12.322 5.080 ( 3.541 3.501 8.245) 9.632 5.338 ( 1.760 -0.414 -1.381) 2.275 5.761 ( 1.379 0.199 10.220) 10.315 5.930 ( 9.594 -0.663 -1.763) 9.777 6.893 ( 6.929 -4.791 0.706) 8.454 7.198 ( -4.909 -3.683 -4.435) 7.571 7.787 ( 6.667 -14.866 12.631) 20.616 8.394 ( -12.008 -23.646 1.062) 26.542 9.701 ( -4.611 5.223 14.155) 15.776 9.975 ( -0.376 -9.882 1.202) 9.962 10.358 ( -8.903 16.045 14.649) 23.480 10.438 ( -1.998 4.612 14.740) 15.574 10.687 ( 3.504 4.848 -4.129) 7.269 10.956 ( 18.054 -2.464 -21.839) 28.442 11.559 ( 5.532 22.835 -5.359) 24.099 12.177 ( -20.627 0.923 -6.171) 21.550 13.649 ( -0.444 4.462 9.241) 10.272 13.816 ( 3.246 7.726 2.397) 8.716 14.172 ( 1.501 -5.446 -2.571) 6.207 14.372 ( -4.538 -0.092 -7.058) 8.391 17.717 ( 17.108 0.182 -4.572) 17.710 18.548 ( -15.854 -0.829 -12.292) 20.078 19.005 ( 8.293 -3.626 9.730) 13.289 19.587 ( -6.644 -0.223 -7.099) 9.726 21.117 ( 30.189 -1.137 6.110) 30.822 22.208 ( -30.737 -6.827 -0.340) 31.488 23.893 ( 9.027 5.335 -3.130) 10.942 24.176 ( -10.784 2.105 -3.112) 11.419 ======================= Grid point 651 (332/361) ======================= q-point: (-0.20 0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.497 ( -1.572 -1.227 7.685) 7.939 2.617 ( 0.753 -0.295 -3.648) 3.737 2.985 ( -0.854 -1.186 4.471) 4.704 3.101 ( -1.077 0.196 -5.880) 5.981 3.322 ( -2.837 -1.489 9.511) 10.036 3.565 ( 7.632 2.712 -12.180) 14.628 3.778 ( 2.381 -0.354 4.570) 5.166 3.893 ( -4.881 1.298 -6.487) 8.221 5.189 ( 2.281 2.969 6.970) 7.912 5.294 ( -1.521 2.555 -3.664) 4.719 5.862 ( -3.964 -0.778 8.477) 9.390 6.002 ( 4.656 -1.458 -5.156) 7.098 7.009 ( -5.081 -2.771 4.898) 7.582 7.125 ( 4.074 -2.989 -6.134) 7.947 8.254 ( 9.756 -22.469 12.589) 27.542 8.430 ( -9.768 -25.262 -4.958) 27.535 9.770 ( -5.182 2.206 14.770) 15.807 9.990 ( -0.614 -3.491 -6.539) 7.437 10.297 ( -7.182 15.166 17.025) 23.905 10.509 ( -4.000 19.246 -6.074) 20.574 10.549 ( -5.227 2.570 13.526) 14.727 10.952 ( 18.061 -2.056 -21.781) 28.369 11.598 ( 20.269 8.978 5.667) 22.881 11.760 ( -20.898 1.928 -9.559) 23.062 13.679 ( -3.744 7.289 7.886) 11.373 13.789 ( 5.035 10.178 -2.749) 11.684 14.174 ( -6.741 -2.394 4.160) 8.275 14.304 ( 5.022 -5.608 -8.829) 11.603 17.970 ( 18.035 0.327 4.107) 18.500 18.144 ( -18.030 0.176 -12.531) 21.958 19.267 ( 4.386 -4.450 7.130) 9.481 19.415 ( -2.088 -0.254 -7.652) 7.936 21.638 ( 26.435 -0.386 8.257) 27.697 21.777 ( -27.684 -3.897 -5.402) 28.474 23.972 ( 5.568 2.814 -0.811) 6.292 23.976 ( -5.978 2.354 -1.181) 6.532 ======================= Grid point 652 (333/361) ======================= q-point: (-0.10 0.20 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.539 ( -1.107 -0.814 -0.232) 1.393 2.673 ( 8.636 0.199 -0.699) 8.667 2.992 ( -3.113 0.768 1.280) 3.453 3.083 ( 2.227 -0.786 0.742) 2.475 3.406 ( -2.804 -1.891 2.410) 4.153 3.487 ( 5.203 1.147 -9.073) 10.522 3.687 ( -6.788 -1.546 3.342) 7.722 3.977 ( 10.653 4.210 3.274) 11.913 5.163 ( -4.059 2.782 -5.647) 7.491 5.263 ( 1.112 2.218 3.530) 4.315 5.858 ( -10.475 -0.886 6.364) 12.289 5.964 ( -0.268 -1.360 -8.042) 8.161 6.932 ( -12.412 -2.659 4.092) 13.337 7.197 ( 6.864 -0.200 -2.655) 7.363 8.386 ( -12.028 -24.583 -8.204) 28.571 8.793 ( 11.375 -24.074 7.145) 27.568 9.841 ( -9.270 5.469 9.938) 14.650 9.882 ( -2.215 5.091 -6.315) 8.408 10.087 ( -8.941 15.676 -2.839) 18.268 10.268 ( -4.627 12.743 12.033) 18.127 10.704 ( 3.003 -0.330 12.595) 12.952 10.995 ( 20.901 -0.067 -19.743) 28.751 11.361 ( -12.262 0.850 -11.892) 17.102 11.990 ( 23.302 1.569 10.834) 25.746 13.597 ( -4.572 8.052 2.125) 9.501 13.722 ( 3.895 9.184 -4.479) 10.935 14.181 ( -7.676 -5.132 8.043) 12.245 14.330 ( 5.273 -0.884 -5.614) 7.753 17.749 ( -18.638 0.020 -7.658) 20.150 18.312 ( 17.476 0.178 9.772) 20.024 19.185 ( -10.867 -0.981 -3.486) 11.454 19.528 ( 10.710 -1.808 0.492) 10.872 21.285 ( -28.790 -2.497 -7.012) 29.736 22.182 ( 28.646 -0.754 9.612) 30.225 23.800 ( -9.507 2.259 -0.513) 9.785 24.103 ( 10.648 1.460 0.447) 10.757 ======================= Grid point 656 (334/361) ======================= q-point: ( 0.30 0.30 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.430 ( 8.073 0.000 8.593) 11.790 2.715 ( 16.249 0.000 -5.404) 17.124 2.824 ( -4.786 -0.000 12.694) 13.566 3.094 ( 2.195 0.000 -7.022) 7.357 3.593 ( -10.871 -0.000 -2.740) 11.211 3.758 ( -26.646 -0.000 1.666) 26.698 4.020 ( -7.578 -0.000 2.627) 8.020 4.663 ( -2.575 -0.000 5.873) 6.413 4.743 ( 0.436 0.000 7.675) 7.688 4.783 ( 6.459 0.000 -2.887) 7.075 5.366 ( 16.306 0.000 -14.511) 21.828 5.401 ( 2.230 0.000 12.431) 12.629 6.688 ( -1.840 -0.000 -0.049) 1.841 7.088 ( -7.425 -0.000 -0.219) 7.428 7.527 ( 1.091 0.000 8.101) 8.174 8.285 ( -17.746 -0.000 -8.645) 19.740 9.382 ( -5.160 -0.000 4.222) 6.667 9.573 ( -3.763 -0.000 18.814) 19.187 9.985 ( 10.534 0.000 -1.251) 10.608 10.464 ( -22.317 -0.000 24.999) 33.511 11.073 ( 27.920 0.000 -37.295) 46.587 11.505 ( 6.262 0.000 -15.582) 16.793 12.012 ( 16.382 0.000 0.655) 16.395 12.756 ( -5.577 -0.000 0.676) 5.618 13.303 ( 2.639 0.000 4.525) 5.238 13.748 ( -4.663 -0.000 2.923) 5.504 14.024 ( 1.737 0.000 -5.795) 6.049 14.690 ( -4.002 -0.000 10.382) 11.126 17.795 ( -5.543 -0.000 34.935) 35.372 17.945 ( 2.889 0.000 -24.101) 24.274 19.724 ( 3.695 0.000 -3.095) 4.820 19.833 ( 2.579 0.000 -0.565) 2.640 19.889 ( 3.116 0.000 -10.193) 10.658 22.757 ( -19.862 -0.000 8.595) 21.642 24.278 ( 2.887 0.000 1.539) 3.272 24.478 ( 0.515 0.000 -5.067) 5.093 ======================= Grid point 657 (335/361) ======================= q-point: ( 0.40 0.30 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.587 ( -3.238 1.699 10.379) 11.005 2.848 ( 2.642 0.338 5.384) 6.007 2.991 ( 7.910 1.967 6.096) 10.178 3.091 ( 9.843 -2.061 -8.098) 12.911 3.342 ( -15.102 -1.337 -4.027) 15.687 3.430 ( -20.561 -3.552 0.860) 20.883 3.903 ( -6.919 2.367 -2.168) 7.627 4.569 ( -10.384 1.677 -2.227) 10.752 4.866 ( 4.750 2.014 7.467) 9.076 4.934 ( 8.803 -5.629 2.433) 10.729 5.485 ( 15.317 2.374 -3.104) 15.807 5.599 ( 5.059 -0.271 10.209) 11.397 6.674 ( 2.668 0.183 -2.339) 3.553 7.010 ( -7.881 -6.497 1.151) 10.279 7.638 ( -2.570 4.679 10.509) 11.787 8.013 ( -12.379 -7.858 -3.055) 14.978 9.422 ( -1.699 -5.386 6.537) 8.639 9.720 ( -5.848 3.778 18.778) 20.027 10.141 ( 12.116 -0.275 0.390) 12.125 10.444 ( -24.872 -0.823 26.958) 36.688 10.997 ( 24.322 0.603 -35.268) 42.846 11.335 ( 5.980 8.100 -19.738) 22.157 12.196 ( 14.981 10.072 -1.569) 18.120 12.656 ( -10.483 -2.660 0.071) 10.815 13.435 ( 2.739 -1.984 7.803) 8.504 13.729 ( -4.905 -1.465 4.841) 7.045 14.005 ( 3.382 -2.230 -5.332) 6.697 14.706 ( -6.664 1.520 5.747) 8.930 17.718 ( 7.734 1.333 -22.415) 23.750 18.159 ( -3.999 -3.515 31.139) 31.591 19.490 ( -10.275 6.293 -11.544) 16.687 19.814 ( -0.497 -1.473 -4.800) 5.046 20.102 ( 23.537 -4.563 -1.284) 24.010 22.588 ( -21.283 -2.996 8.995) 23.299 24.211 ( 0.442 11.092 -3.547) 11.653 24.446 ( -3.930 -7.652 -5.076) 9.988 ======================= Grid point 658 (336/361) ======================= q-point: (-0.50 0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.554 ( -12.472 0.938 6.994) 14.329 2.909 ( -4.945 5.437 11.230) 13.421 2.952 ( -9.838 1.948 -3.375) 10.582 3.191 ( -3.284 -7.914 -6.496) 10.752 3.228 ( 11.282 0.372 -1.760) 11.424 3.352 ( 2.009 -2.172 5.015) 5.822 3.761 ( -2.640 1.006 -6.052) 6.679 4.345 ( -12.409 1.308 -3.854) 13.060 5.009 ( 4.655 2.127 7.099) 8.751 5.137 ( 8.108 -6.566 0.828) 10.466 5.653 ( 8.634 3.553 5.764) 10.972 5.787 ( 6.825 -0.212 5.714) 8.903 6.711 ( 5.235 -1.450 -1.753) 5.708 7.014 ( -5.090 -10.869 1.415) 12.084 7.600 ( -3.820 6.220 4.121) 8.383 7.993 ( -10.899 -15.311 4.481) 19.321 9.579 ( 1.350 -7.402 8.442) 11.309 9.800 ( -6.826 5.361 16.836) 18.941 10.340 ( 6.866 0.398 7.082) 9.872 10.439 ( -19.048 -2.791 23.717) 30.547 10.918 ( 21.762 1.247 -30.217) 37.259 11.082 ( 6.026 12.137 -18.521) 22.949 12.187 ( 7.866 17.916 -5.788) 20.405 12.492 ( -14.172 -1.085 -1.689) 14.313 13.588 ( 2.366 0.110 8.854) 9.165 13.773 ( -0.196 -3.856 5.344) 6.593 14.019 ( 3.862 -3.242 -5.525) 7.480 14.611 ( -9.820 3.264 1.755) 10.496 17.624 ( 13.437 0.545 -15.505) 20.524 18.481 ( -2.616 -5.140 21.265) 22.033 19.126 ( -12.010 6.048 -10.396) 16.997 19.721 ( -3.832 -2.183 -7.525) 8.722 20.547 ( 31.176 -3.560 2.223) 31.457 22.395 ( -24.749 -4.362 6.969) 26.079 24.074 ( 2.064 9.347 -5.026) 10.811 24.351 ( -7.376 -3.909 -5.363) 9.922 ======================= Grid point 659 (337/361) ======================= q-point: (-0.40 0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.464 ( -8.663 0.286 6.555) 10.867 2.733 ( -9.314 0.230 -4.453) 10.326 2.932 ( -3.486 1.805 8.048) 8.955 3.149 ( -0.514 -3.428 -6.415) 7.291 3.306 ( -2.235 2.480 7.138) 7.881 3.544 ( 10.691 -3.102 3.281) 11.605 3.673 ( 7.064 2.671 -10.579) 12.998 4.111 ( -12.844 -0.498 -3.992) 13.459 5.130 ( 3.699 1.817 6.022) 7.297 5.284 ( 3.866 -4.916 -0.567) 6.280 5.792 ( 2.142 3.002 8.905) 9.639 5.928 ( 6.626 -0.019 0.805) 6.674 6.810 ( 5.857 -4.036 0.528) 7.132 7.058 ( -3.898 -10.257 -1.913) 11.138 7.625 ( 2.589 -3.008 6.712) 7.797 8.019 ( -11.630 -17.008 1.858) 20.688 9.747 ( -0.478 -2.400 8.370) 8.720 9.857 ( -5.146 -0.521 10.762) 11.941 10.395 ( -25.551 -1.137 29.223) 38.834 10.612 ( 13.121 2.583 3.430) 13.806 10.824 ( 10.353 10.520 -14.059) 20.384 10.926 ( 16.611 0.344 -22.479) 27.952 11.990 ( 4.319 21.704 -8.260) 23.620 12.219 ( -17.535 3.481 -3.390) 18.195 13.699 ( -1.864 1.207 10.268) 10.505 13.920 ( 8.671 2.281 4.131) 9.872 14.035 ( 3.425 -6.943 -6.715) 10.248 14.418 ( -12.031 3.726 -1.580) 12.693 17.721 ( 17.444 0.222 -4.928) 18.129 18.529 ( -13.158 -1.217 -7.561) 15.224 18.963 ( 0.021 -0.907 10.137) 10.178 19.571 ( -4.664 -1.384 -9.228) 10.432 21.085 ( 33.369 -2.159 4.299) 33.714 22.107 ( -29.010 -4.076 2.514) 29.402 23.999 ( 4.868 5.834 -3.658) 8.433 24.194 ( -8.687 -0.208 -3.818) 9.491 ======================= Grid point 660 (338/361) ======================= q-point: (-0.30 0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.480 ( -1.791 -0.619 7.274) 7.517 2.608 ( 0.610 -0.806 -5.084) 5.183 2.973 ( -1.650 -0.021 5.396) 5.643 3.088 ( 0.700 -1.364 -6.355) 6.538 3.329 ( -7.170 2.054 12.531) 14.582 3.603 ( 8.027 0.444 -13.334) 15.570 3.774 ( 3.894 0.797 5.411) 6.714 3.900 ( -3.358 -0.259 -6.521) 7.339 5.228 ( 1.497 0.864 5.490) 5.756 5.310 ( -0.925 -1.144 -2.992) 3.334 5.869 ( -3.243 1.650 8.001) 8.790 5.987 ( 3.794 -0.152 -3.664) 5.276 6.937 ( -2.466 -5.009 4.437) 7.131 7.038 ( 0.940 -6.597 -5.142) 8.416 7.901 ( 7.861 -15.109 8.561) 19.062 8.025 ( -6.606 -18.190 -3.628) 19.689 9.806 ( -6.781 1.691 11.028) 13.056 9.920 ( 2.072 -3.591 -0.525) 4.179 10.390 ( -25.633 -1.104 28.182) 38.112 10.697 ( 3.689 10.031 2.302) 10.933 10.777 ( 3.834 9.185 -5.458) 11.351 10.915 ( 20.818 -1.907 -23.564) 31.500 11.831 ( 5.927 15.051 -1.344) 16.231 11.872 ( -9.255 10.475 -4.688) 14.743 13.773 ( -3.929 2.352 10.761) 11.694 13.950 ( 4.457 5.770 -5.812) 9.324 14.140 ( -1.373 -1.208 2.797) 3.342 14.215 ( -0.564 -2.349 -4.952) 5.510 17.978 ( 18.399 0.473 4.116) 18.860 18.150 ( -18.157 0.496 -12.332) 21.955 19.184 ( 3.083 -4.341 11.248) 12.445 19.405 ( -1.097 -0.706 -10.683) 10.763 21.627 ( 27.913 -0.842 5.150) 28.396 21.707 ( -26.606 -3.460 -2.753) 26.971 24.015 ( 0.353 2.131 -0.522) 2.222 24.029 ( -2.069 2.906 -1.766) 3.981 ======================= Grid point 661 (339/361) ======================= q-point: (-0.20 0.30 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.537 ( 1.114 0.441 1.685) 2.068 2.669 ( 10.529 -0.523 -1.174) 10.607 3.012 ( -2.797 1.005 5.228) 6.014 3.054 ( 2.426 -1.659 -2.388) 3.786 3.375 ( -5.649 -1.052 7.743) 9.642 3.543 ( 7.797 3.986 -12.130) 14.961 3.645 ( -10.158 -3.019 -0.619) 10.616 4.030 ( 12.204 1.932 2.934) 12.699 5.208 ( -4.896 1.600 -4.602) 6.907 5.292 ( -0.461 0.310 3.121) 3.170 5.853 ( -9.043 0.520 5.077) 10.384 5.949 ( -0.071 0.020 -6.972) 6.972 6.872 ( -12.381 -3.848 2.495) 13.203 7.158 ( 7.769 -4.681 -0.522) 9.086 7.980 ( -8.766 -18.582 -6.199) 21.460 8.366 ( 14.874 -21.521 3.793) 26.434 9.832 ( -5.934 -2.098 8.099) 10.257 9.950 ( 2.656 2.340 -1.973) 4.053 10.363 ( -19.957 1.014 20.615) 28.710 10.476 ( -11.580 19.451 -6.131) 23.453 10.703 ( -2.132 -0.815 3.810) 4.441 10.985 ( 25.157 -1.073 -23.397) 34.373 11.513 ( -9.882 15.871 -1.256) 18.738 12.050 ( 22.240 5.053 5.979) 23.578 13.751 ( -5.728 7.944 2.858) 10.202 13.869 ( 2.675 5.386 -5.404) 8.085 14.070 ( -8.811 -6.383 5.039) 11.990 14.330 ( 10.068 1.500 -1.388) 10.273 17.749 ( -19.094 0.026 -7.689) 20.584 18.318 ( 17.410 0.480 9.423) 19.802 19.172 ( -8.044 -0.140 -5.029) 9.487 19.482 ( 11.041 -3.253 1.931) 11.671 21.232 ( -30.430 -3.090 -5.122) 31.012 22.159 ( 30.985 -1.647 4.556) 31.362 23.858 ( -9.138 4.081 0.273) 10.012 24.127 ( 8.902 0.973 1.626) 9.102 ======================= Grid point 662 (340/361) ======================= q-point: (-0.10 0.30 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.538 ( 3.036 4.484 -4.148) 6.821 2.780 ( 3.661 2.785 -0.936) 4.694 3.010 ( 4.472 -0.053 -0.967) 4.575 3.108 ( -5.968 1.039 5.605) 8.254 3.344 ( -0.705 -3.835 1.196) 4.079 3.485 ( 8.855 2.033 -9.542) 13.176 3.695 ( 1.286 -5.921 8.044) 10.071 4.210 ( 9.404 3.190 4.758) 11.012 5.036 ( -6.436 2.613 -6.015) 9.189 5.290 ( -3.897 0.097 1.486) 4.172 5.724 ( -14.392 -0.243 2.125) 14.550 5.821 ( -2.895 0.170 -9.756) 10.177 6.767 ( -12.652 -3.906 4.561) 14.005 7.271 ( 5.059 0.517 -0.157) 5.087 7.953 ( -4.374 -17.933 -9.805) 20.901 8.771 ( 8.698 -21.465 -0.003) 23.161 9.751 ( -4.528 7.827 -9.504) 13.118 9.912 ( -11.402 10.874 6.068) 16.884 10.119 ( -5.364 5.890 7.645) 11.041 10.324 ( -12.517 2.545 8.831) 15.528 10.743 ( -2.866 -9.602 1.580) 10.144 11.081 ( 25.231 -2.126 -22.188) 33.667 11.311 ( 1.681 15.856 3.242) 16.271 12.423 ( 20.141 0.539 5.800) 20.967 13.612 ( -2.142 6.348 -2.697) 7.222 13.787 ( 2.547 7.794 -4.366) 9.290 14.109 ( -8.699 -7.384 9.563) 14.888 14.398 ( 6.137 5.715 -1.095) 8.458 17.441 ( -17.852 -0.232 1.414) 17.910 18.687 ( 15.561 -0.055 11.772) 19.512 18.977 ( -6.884 -0.021 -8.663) 11.065 19.661 ( 6.560 -0.397 2.414) 7.001 20.791 ( -23.995 -3.757 -6.679) 25.189 22.668 ( 27.438 -3.472 6.052) 28.312 23.688 ( -9.536 4.388 0.026) 10.497 24.285 ( 9.704 1.277 3.260) 10.316 ======================= Grid point 667 (341/361) ======================= q-point: ( 0.40 0.40 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.556 ( -13.313 -0.000 6.951) 15.018 2.951 ( -7.613 -0.000 4.872) 9.039 3.045 ( -3.047 -0.000 -5.221) 6.045 3.058 ( -8.231 -0.000 1.462) 8.360 3.235 ( 12.547 0.000 0.207) 12.548 3.327 ( 4.258 0.000 3.016) 5.218 3.768 ( -4.618 -0.000 -5.015) 6.817 4.366 ( -13.541 -0.000 -3.589) 14.008 5.043 ( 5.076 0.000 5.265) 7.313 5.052 ( 8.640 0.000 2.326) 8.948 5.699 ( 13.131 0.000 1.264) 13.192 5.773 ( 1.887 0.000 10.238) 10.411 6.701 ( 4.721 0.000 -2.214) 5.215 6.907 ( -4.387 -0.000 1.496) 4.635 7.739 ( -7.579 -0.000 10.594) 13.026 7.771 ( -8.676 -0.000 -2.307) 8.977 9.508 ( 2.957 0.000 8.867) 9.347 9.856 ( -9.508 -0.000 17.985) 20.343 10.340 ( 16.197 0.000 0.154) 16.198 10.408 ( -26.790 -0.000 28.824) 39.351 10.923 ( 23.170 0.000 -32.402) 39.834 11.210 ( 4.666 0.000 -18.917) 19.484 12.388 ( 9.185 0.000 -5.942) 10.940 12.457 ( -13.182 -0.000 -1.247) 13.241 13.589 ( 6.703 0.000 7.754) 10.250 13.717 ( -4.613 -0.000 6.079) 7.631 13.996 ( 4.141 0.000 -3.878) 5.674 14.642 ( -10.710 -0.000 2.979) 11.117 17.630 ( 13.394 0.000 -16.127) 20.964 18.433 ( -3.689 -0.000 23.427) 23.716 19.190 ( -14.870 -0.000 -10.066) 17.956 19.695 ( -2.658 -0.000 -8.203) 8.623 20.511 ( 33.040 0.000 1.859) 33.092 22.356 ( -23.764 -0.000 7.260) 24.849 24.200 ( -1.792 -0.000 -5.121) 5.425 24.276 ( -4.560 -0.000 -5.149) 6.878 ======================= Grid point 668 (342/361) ======================= q-point: ( 0.50 0.40 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.461 ( -9.046 -0.309 5.902) 10.806 2.734 ( -11.344 0.052 -4.145) 12.078 2.963 ( -2.519 0.958 1.646) 3.159 3.112 ( -0.904 -0.691 1.703) 2.048 3.348 ( -0.437 1.833 5.585) 5.894 3.472 ( 8.224 -3.142 0.718) 8.833 3.724 ( 10.842 1.582 -6.906) 12.951 4.110 ( -15.481 0.278 -3.261) 15.823 5.152 ( 3.700 0.864 3.637) 5.259 5.196 ( 4.953 -3.538 0.862) 6.147 5.856 ( 4.270 3.520 5.974) 8.143 5.912 ( 3.484 -1.897 4.424) 5.942 6.758 ( 4.726 -1.384 -0.378) 4.939 6.902 ( -2.242 -5.179 -0.047) 5.643 7.639 ( -2.430 3.665 2.702) 5.161 7.775 ( -8.749 -9.579 3.303) 13.387 9.684 ( 4.736 -2.256 7.699) 9.316 9.887 ( -11.167 1.434 12.985) 17.186 10.379 ( -26.857 -0.507 29.321) 39.765 10.612 ( 19.160 -0.633 0.815) 19.188 10.881 ( 21.994 -0.229 -27.804) 35.452 11.030 ( 0.258 5.116 -11.403) 12.500 12.245 ( -7.930 4.171 -3.394) 9.581 12.320 ( -2.412 7.192 -7.429) 10.617 13.721 ( -2.288 1.939 8.026) 8.568 13.833 ( 8.234 -6.694 3.110) 11.058 14.020 ( 6.276 1.348 -2.392) 6.850 14.473 ( -14.212 1.771 0.301) 14.325 17.724 ( 17.722 0.105 -5.256) 18.485 18.510 ( -10.576 -0.659 -2.978) 11.007 18.961 ( -7.605 0.285 9.004) 11.790 19.547 ( -2.426 -0.918 -10.528) 10.843 21.051 ( 35.436 -1.127 3.632) 35.639 22.059 ( -27.523 -1.204 3.058) 27.718 24.095 ( 0.500 4.381 -4.141) 6.049 24.169 ( -5.753 -2.315 -3.591) 7.166 ======================= Grid point 669 (343/361) ======================= q-point: (-0.40 0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.474 ( -0.015 -0.120 6.288) 6.289 2.590 ( -0.624 -0.997 -5.090) 5.224 2.982 ( -0.341 0.729 4.398) 4.471 3.065 ( -1.438 -0.923 -4.071) 4.416 3.374 ( -7.513 2.274 11.413) 13.852 3.582 ( 7.876 -1.791 -5.947) 10.030 3.807 ( -6.363 2.070 -0.332) 6.699 3.895 ( 7.545 -0.147 -6.005) 9.644 5.223 ( 0.394 -0.923 3.013) 3.176 5.264 ( 0.147 -3.147 -1.292) 3.405 5.914 ( -2.518 2.770 6.275) 7.307 5.989 ( 2.853 0.016 -1.188) 3.090 6.845 ( -0.628 -4.117 2.809) 5.023 6.904 ( -1.213 -6.951 -2.662) 7.542 7.714 ( 3.703 -5.676 4.279) 8.015 7.777 ( -1.748 -8.986 -1.653) 9.302 9.830 ( -6.864 0.961 8.000) 10.585 9.868 ( 2.994 -2.042 3.605) 5.111 10.360 ( -26.146 -1.463 28.229) 38.505 10.827 ( -0.599 4.128 -1.863) 4.568 10.871 ( 2.818 1.705 -5.036) 6.018 10.890 ( 25.200 -0.296 -22.387) 33.709 12.059 ( -8.272 10.200 0.249) 13.135 12.119 ( 5.081 12.238 -6.140) 14.604 13.776 ( -3.954 -0.936 9.485) 10.319 13.937 ( 2.127 -5.020 -6.449) 8.445 14.171 ( 12.610 3.625 3.776) 13.653 14.229 ( -12.637 2.125 -2.096) 12.984 17.986 ( 18.831 0.384 4.153) 19.288 18.160 ( -18.460 0.484 -12.379) 22.232 19.117 ( 1.165 -2.724 14.563) 14.862 19.392 ( 0.306 -0.610 -12.612) 12.630 21.609 ( 33.289 -1.013 3.080) 33.446 21.659 ( -29.615 -1.679 -1.865) 29.721 24.048 ( -3.897 1.286 0.116) 4.106 24.073 ( 1.130 1.783 -2.242) 3.080 ======================= Grid point 670 (344/361) ======================= q-point: (-0.30 -0.60 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.549 ( 4.328 0.826 0.803) 4.478 2.658 ( 11.753 -0.705 0.100) 11.775 2.996 ( -2.409 -1.924 3.396) 4.586 3.062 ( 3.104 1.648 -1.052) 3.668 3.371 ( -7.805 0.756 7.834) 11.085 3.580 ( -16.391 -3.303 -0.841) 16.741 3.610 ( 10.337 2.354 -9.097) 13.969 4.066 ( 14.541 2.229 0.165) 14.711 5.213 ( -5.181 -0.875 -2.380) 5.768 5.263 ( -2.375 -3.166 1.237) 4.147 5.877 ( -7.464 1.852 2.493) 8.085 5.967 ( 0.051 1.702 -4.313) 4.637 6.796 ( -10.842 -4.241 1.471) 11.734 7.023 ( 5.191 -9.171 0.997) 10.585 7.740 ( -3.089 -7.496 -4.189) 9.126 8.031 ( 15.203 -14.600 0.899) 21.098 9.790 ( -6.741 -2.144 4.992) 8.658 9.987 ( 7.009 1.791 -0.952) 7.297 10.339 ( -24.261 -1.993 25.063) 34.939 10.660 ( -13.466 -2.253 -0.168) 13.655 10.765 ( -5.080 9.478 -4.559) 11.680 10.978 ( 24.385 1.170 -23.626) 33.973 11.859 ( -4.372 19.281 4.579) 20.294 12.165 ( 17.026 6.739 1.316) 18.359 13.848 ( -4.693 0.408 9.391) 10.506 13.891 ( -0.430 -1.565 -7.639) 7.810 13.987 ( -10.520 -1.145 -1.464) 10.683 14.392 ( 14.266 4.588 1.439) 15.054 17.750 ( -19.758 0.010 -7.745) 21.222 18.329 ( 17.195 0.615 9.215) 19.519 19.186 ( -3.259 1.747 -5.988) 7.038 19.411 ( 9.876 -4.440 3.211) 11.294 21.179 ( -31.704 -2.527 -4.946) 32.187 22.126 ( 32.147 -1.822 0.757) 32.208 23.941 ( -6.865 4.650 1.871) 8.500 24.134 ( 6.209 -0.267 1.964) 6.518 ======================= Grid point 671 (345/361) ======================= q-point: (-0.20 -0.60 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.621 ( 8.364 3.843 -2.715) 9.596 2.816 ( 4.748 1.565 3.701) 6.220 3.038 ( 3.780 3.061 -5.668) 7.469 3.104 ( 1.257 -2.000 8.232) 8.564 3.254 ( -12.418 -4.102 0.893) 13.109 3.500 ( 4.898 -3.388 -4.617) 7.536 3.652 ( 6.944 2.548 -0.269) 7.402 4.248 ( 9.881 1.555 3.763) 10.687 5.074 ( -7.541 1.439 -3.878) 8.601 5.251 ( -5.906 -4.415 0.461) 7.388 5.730 ( -11.440 0.836 -1.817) 11.614 5.854 ( -3.307 3.160 -6.609) 8.037 6.697 ( -11.782 -3.641 3.879) 12.928 7.207 ( 5.963 -8.559 1.524) 10.542 7.705 ( -0.342 -7.043 -7.430) 10.243 8.398 ( 13.652 -18.703 -2.590) 23.300 9.811 ( -1.823 -3.429 1.852) 4.302 9.949 ( -1.902 3.387 -5.839) 7.013 10.307 ( -19.488 -1.723 14.795) 24.529 10.419 ( -13.728 14.109 1.385) 19.734 10.609 ( -8.728 -2.169 9.267) 12.914 11.035 ( 25.312 -2.341 -25.829) 36.240 11.681 ( -2.430 22.412 5.731) 23.261 12.443 ( 19.386 1.405 3.482) 19.747 13.715 ( -3.709 4.271 -5.464) 7.865 13.878 ( 0.996 2.229 -3.202) 4.026 13.963 ( -7.769 -7.895 9.090) 14.329 14.523 ( 10.632 7.335 -0.530) 12.927 17.436 ( -18.194 -0.283 1.958) 18.301 18.675 ( 14.420 -1.185 9.133) 17.110 19.017 ( -1.132 4.562 -10.382) 11.397 19.634 ( 7.940 -2.680 4.450) 9.489 20.710 ( -27.665 -4.854 -5.582) 28.637 22.590 ( 29.060 -4.587 -1.273) 29.447 23.808 ( -7.983 8.293 3.136) 11.930 24.287 ( 7.905 -1.113 4.840) 9.336 ======================= Grid point 672 (346/361) ======================= q-point: (-0.10 -0.60 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.573 ( 1.134 8.612 -9.307) 12.731 2.802 ( -5.265 6.632 2.760) 8.906 2.981 ( -8.308 -1.418 0.327) 8.435 3.125 ( 6.332 -3.814 1.525) 7.547 3.427 ( 7.188 -5.737 9.187) 12.999 3.559 ( 14.206 4.834 -10.657) 18.405 3.772 ( 6.025 -5.481 4.725) 9.416 4.415 ( 6.123 1.482 6.670) 9.175 4.899 ( -7.806 2.527 -2.770) 8.660 5.179 ( -9.206 -3.613 -0.858) 9.927 5.505 ( -14.528 -0.110 -2.971) 14.829 5.668 ( -3.336 3.202 -10.134) 11.139 6.632 ( -10.366 -3.499 6.687) 12.822 7.340 ( 3.428 0.010 1.027) 3.579 7.709 ( 4.280 -10.179 -9.241) 14.399 8.656 ( 5.196 -18.225 -4.903) 19.575 9.653 ( -5.853 12.184 -9.582) 16.569 9.867 ( -10.907 4.093 2.959) 12.020 10.135 ( -2.385 -5.246 -2.236) 6.181 10.280 ( -18.231 5.933 20.055) 27.745 10.702 ( 1.345 -4.091 7.036) 8.249 11.120 ( 24.490 -4.888 -24.337) 34.870 11.539 ( -1.370 15.424 4.762) 16.200 12.704 ( 12.997 0.569 0.643) 13.026 13.587 ( -0.304 3.404 -5.648) 6.601 13.832 ( 2.916 3.160 -4.035) 5.897 14.048 ( -7.038 -7.124 10.786) 14.718 14.554 ( 6.430 9.825 -1.030) 11.787 17.295 ( -14.442 0.500 13.568) 19.822 18.771 ( -1.123 0.511 -16.455) 16.502 19.031 ( 11.950 1.096 10.827) 16.162 19.756 ( 0.635 1.069 2.993) 3.240 20.382 ( -15.430 -6.591 -4.590) 17.395 23.022 ( 25.027 -9.152 -1.840) 26.711 23.627 ( -10.573 11.110 3.372) 15.703 24.479 ( 8.187 0.142 5.837) 10.056 ======================= Grid point 678 (347/361) ======================= q-point: (-0.50 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.473 ( 1.642 0.000 5.618) 5.853 2.579 ( -1.847 -0.000 -4.750) 5.097 2.990 ( 1.838 0.000 3.606) 4.048 3.057 ( -4.600 -0.000 -2.877) 5.426 3.397 ( -6.800 -0.000 10.308) 12.349 3.563 ( 8.476 0.000 -3.019) 8.997 3.828 ( -18.987 -0.000 -2.015) 19.094 3.895 ( 19.340 0.000 -5.608) 20.137 5.214 ( 0.225 0.000 1.345) 1.364 5.226 ( 0.357 0.000 -0.009) 0.358 5.947 ( -3.170 -0.000 4.685) 5.656 5.985 ( 3.420 0.000 0.749) 3.501 6.811 ( 2.888 0.000 1.231) 3.139 6.826 ( -4.831 -0.000 -0.852) 4.905 7.672 ( -3.289 -0.000 1.410) 3.578 7.691 ( 5.473 0.000 0.367) 5.485 9.844 ( -10.935 -0.000 6.652) 12.799 9.844 ( 7.345 0.000 5.264) 9.037 10.346 ( -26.272 -0.000 28.200) 38.542 10.858 ( 13.961 0.000 -14.050) 19.807 10.880 ( -11.403 -0.000 -4.084) 12.113 10.895 ( 23.978 0.000 -12.170) 26.889 12.164 ( -2.211 -0.000 1.090) 2.465 12.238 ( -0.593 -0.000 -6.711) 6.737 13.768 ( -3.759 -0.000 7.134) 8.063 13.875 ( 2.550 0.000 -3.470) 4.306 14.210 ( 15.549 0.000 3.003) 15.837 14.252 ( -16.151 -0.000 -1.252) 16.199 17.990 ( 19.031 0.000 4.176) 19.484 18.165 ( -18.628 -0.000 -12.443) 22.401 19.091 ( 0.223 0.000 15.854) 15.856 19.386 ( 0.995 0.000 -13.250) 13.287 21.598 ( 35.082 0.000 2.559) 35.175 21.644 ( -30.446 -0.000 -1.976) 30.510 24.060 ( -4.921 -0.000 0.401) 4.937 24.090 ( 1.762 0.000 -2.386) 2.966 ======================= Grid point 679 (348/361) ======================= q-point: (-0.40 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.565 ( 7.714 0.731 -3.561) 8.527 2.643 ( 11.949 -0.687 3.935) 12.599 2.969 ( -4.303 -0.880 0.288) 4.401 3.086 ( 4.336 0.812 3.464) 5.609 3.395 ( -6.813 1.284 5.662) 8.951 3.526 ( -17.481 -2.029 -3.751) 17.993 3.635 ( 6.206 0.482 -2.407) 6.674 4.105 ( 16.966 1.502 -2.396) 17.201 5.193 ( -4.628 -0.741 -0.504) 4.715 5.204 ( -3.926 -2.332 -0.521) 4.596 5.906 ( -6.719 1.012 0.804) 6.842 5.995 ( 0.069 0.916 -2.533) 2.695 6.734 ( -8.996 -1.996 0.931) 9.262 6.883 ( 2.185 -4.568 1.614) 5.315 7.675 ( 2.021 -0.780 -1.246) 2.499 7.842 ( 13.517 -5.689 -2.257) 14.838 9.762 ( -7.443 -0.858 2.090) 7.778 10.012 ( 9.910 0.755 0.874) 9.977 10.312 ( -25.634 -0.812 26.583) 36.938 10.623 ( -19.530 -1.216 -0.379) 19.571 10.845 ( 8.501 0.991 -12.306) 14.989 11.025 ( 15.861 2.294 -14.508) 21.617 12.148 ( 0.154 10.907 5.024) 12.009 12.249 ( 9.646 0.978 0.097) 9.696 13.799 ( -4.989 -2.304 6.055) 8.177 13.855 ( 0.935 -1.946 -4.991) 5.438 14.009 ( -12.803 1.478 -1.190) 12.943 14.461 ( 15.532 2.236 1.769) 15.792 17.750 ( -20.295 -0.001 -7.771) 21.732 18.338 ( 16.925 0.289 9.119) 19.228 19.236 ( 3.044 3.361 -8.563) 9.690 19.327 ( 6.145 -4.372 6.205) 9.766 21.145 ( -32.316 -0.976 -5.682) 32.826 22.100 ( 32.385 -0.796 -0.878) 32.407 24.014 ( -3.837 2.769 3.649) 5.976 24.119 ( 3.297 -1.038 1.289) 3.689 ======================= Grid point 680 (349/361) ======================= q-point: (-0.30 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.668 ( 12.475 1.417 -3.536) 13.043 2.854 ( 5.420 2.833 4.723) 7.727 3.017 ( 6.945 -5.161 4.058) 9.557 3.125 ( 1.894 3.481 -2.567) 4.722 3.210 ( -18.537 -0.360 0.499) 18.547 3.419 ( -0.017 -4.246 -0.132) 4.248 3.707 ( 9.981 2.036 -2.523) 10.494 4.286 ( 11.450 2.662 1.694) 11.877 5.091 ( -7.421 0.495 -1.689) 7.627 5.148 ( -7.720 -5.779 -0.842) 9.680 5.752 ( -10.460 1.379 -3.661) 11.168 5.911 ( -2.841 2.443 -5.322) 6.509 6.640 ( -10.700 -2.374 4.063) 11.689 7.011 ( 4.382 -9.911 1.116) 10.894 7.686 ( 4.680 3.028 -3.832) 6.764 8.101 ( 15.079 -13.347 -5.292) 20.821 9.711 ( -2.781 -4.908 -2.296) 6.090 10.056 ( 2.594 6.444 -7.023) 9.878 10.270 ( -22.758 -1.776 21.287) 31.213 10.415 ( -16.268 -5.795 6.064) 18.303 10.770 ( -6.025 9.388 6.615) 12.969 11.016 ( 21.122 0.798 -24.787) 32.576 12.065 ( -4.040 18.001 6.328) 19.504 12.457 ( 15.975 -0.549 1.838) 16.090 13.741 ( -5.645 -1.642 -5.362) 7.957 13.843 ( -1.565 -3.820 -0.690) 4.185 13.904 ( -3.802 0.641 4.785) 6.145 14.640 ( 12.732 4.820 -0.771) 13.636 17.431 ( -18.506 -0.202 2.534) 18.679 18.653 ( 12.286 -1.070 5.182) 13.377 19.130 ( 7.490 6.874 -10.762) 14.804 19.563 ( 7.085 -4.748 7.365) 11.269 20.628 ( -30.885 -3.605 -6.090) 31.685 22.518 ( 28.514 -2.936 -4.999) 29.098 23.968 ( -3.731 8.445 5.349) 10.670 24.243 ( 5.148 -3.670 5.147) 8.152 ======================= Grid point 681 (350/361) ======================= q-point: (-0.20 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.707 ( 1.607 5.641 -8.794) 10.570 2.887 ( -10.137 1.587 12.715) 16.338 2.948 ( -10.324 -2.744 -2.382) 10.945 3.087 ( 5.182 1.638 -5.567) 7.780 3.322 ( 13.658 -4.818 5.730) 15.575 3.544 ( 14.854 -4.983 -3.735) 16.107 3.801 ( 8.871 5.639 -0.293) 10.516 4.434 ( 5.418 1.602 6.228) 8.410 4.944 ( -7.726 2.296 -1.681) 8.233 5.072 ( -9.423 -7.450 -1.284) 12.081 5.510 ( -13.039 0.609 -5.898) 14.324 5.743 ( -4.534 4.070 -8.079) 10.119 6.579 ( -9.708 -2.202 6.990) 12.164 7.211 ( 6.474 -12.346 1.032) 13.979 7.661 ( 6.205 4.874 -6.624) 10.302 8.341 ( 9.242 -16.155 -7.349) 20.010 9.723 ( 0.304 -10.547 -4.629) 11.522 9.867 ( -2.523 8.845 -8.030) 12.210 10.146 ( -18.669 1.489 4.908) 19.361 10.350 ( -19.134 -0.237 19.233) 27.130 10.758 ( -2.416 10.004 16.431) 19.388 11.038 ( 23.290 -3.684 -25.951) 35.064 11.866 ( -7.555 18.647 3.632) 20.445 12.700 ( 12.982 -1.385 0.267) 13.058 13.620 ( -1.814 -0.160 -6.626) 6.872 13.836 ( -0.448 -2.292 -2.461) 3.393 13.944 ( -3.493 -3.454 7.431) 8.908 14.719 ( 9.640 7.495 -3.293) 12.648 17.305 ( -13.690 0.512 14.967) 20.290 18.741 ( 6.393 -2.746 -18.045) 19.340 19.138 ( 9.125 9.470 6.952) 14.876 19.752 ( 3.143 -1.656 3.982) 5.336 20.239 ( -20.562 -8.436 -2.726) 22.392 22.863 ( 24.381 -7.212 -7.672) 26.557 23.868 ( -5.816 14.001 5.734) 16.209 24.442 ( 6.380 -4.250 6.839) 10.273 ======================= Grid point 682 (351/361) ======================= q-point: (-0.10 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.444 ( -10.102 5.379 -8.717) 14.387 2.791 ( -18.925 -2.617 10.837) 21.965 2.904 ( 7.100 4.403 -6.389) 10.517 3.190 ( 6.950 -7.619 1.253) 10.389 3.580 ( 5.697 -2.774 4.669) 7.871 3.715 ( 13.455 9.784 -8.185) 18.541 3.925 ( 15.426 -2.989 3.123) 16.020 4.553 ( -2.924 0.213 9.037) 9.501 4.804 ( -6.839 2.813 0.411) 7.406 4.993 ( -5.207 -5.372 -2.355) 7.843 5.255 ( -13.069 -0.875 -3.575) 13.578 5.530 ( -2.751 4.075 -10.865) 11.925 6.577 ( -6.705 -2.063 8.715) 11.187 7.391 ( 3.189 -3.933 2.119) 5.489 7.629 ( 7.031 -1.248 -11.060) 13.165 8.513 ( 5.401 -15.593 -2.170) 16.644 9.543 ( -11.009 14.750 -9.516) 20.720 9.803 ( -3.200 -1.923 3.087) 4.845 9.978 ( -3.083 -8.194 -3.864) 9.570 10.336 ( -18.753 2.128 24.312) 30.778 10.851 ( 3.295 5.526 7.328) 9.752 11.115 ( 20.557 -5.119 -20.509) 29.486 11.636 ( -7.324 12.195 1.062) 14.265 12.833 ( 5.595 -0.138 -1.449) 5.781 13.522 ( -1.264 -0.111 -6.043) 6.175 13.816 ( -1.334 -0.952 -0.979) 1.909 14.047 ( -1.056 -5.815 7.336) 9.420 14.711 ( 7.395 9.189 -4.965) 12.797 17.377 ( -8.067 2.613 23.449) 24.935 18.531 ( 2.653 -0.365 -25.366) 25.507 19.311 ( 7.564 3.542 8.519) 11.931 19.744 ( -5.580 0.505 0.400) 5.618 20.159 ( -3.132 -7.836 0.697) 8.468 23.175 ( 19.982 -12.152 -8.099) 24.750 23.678 ( -9.683 17.857 5.619) 21.077 24.640 ( 5.050 -2.804 5.575) 8.027 ======================= Grid point 689 (352/361) ======================= q-point: (-0.40 -0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.680 ( 14.272 0.000 -5.144) 15.171 2.917 ( 17.000 0.000 5.116) 17.753 2.928 ( -5.890 -0.000 5.616) 8.138 3.147 ( -6.824 -0.000 -3.972) 7.896 3.232 ( -9.503 -0.000 1.523) 9.624 3.370 ( -0.866 -0.000 -0.629) 1.070 3.722 ( 9.618 0.000 -1.645) 9.757 4.319 ( 12.872 0.000 0.879) 12.902 5.085 ( -9.176 -0.000 -1.027) 9.234 5.096 ( -6.671 -0.000 -1.239) 6.785 5.768 ( -10.567 -0.000 -3.802) 11.230 5.934 ( -2.400 -0.000 -5.450) 5.955 6.617 ( -10.201 -0.000 4.435) 11.123 6.913 ( 3.582 0.000 0.813) 3.673 7.742 ( 6.889 0.000 0.311) 6.896 7.953 ( 14.921 0.000 -9.146) 17.501 9.664 ( -3.627 -0.000 -4.508) 5.786 10.136 ( 10.765 0.000 -8.093) 13.468 10.246 ( -24.427 -0.000 19.609) 31.324 10.347 ( -23.542 -0.000 12.707) 26.753 10.845 ( 2.802 0.000 -0.654) 2.878 11.040 ( 13.191 0.000 -17.323) 21.774 12.267 ( -5.052 -0.000 6.308) 8.082 12.426 ( 14.322 0.000 1.554) 14.406 13.713 ( -5.860 -0.000 -3.334) 6.742 13.808 ( 0.596 0.000 -3.274) 3.328 13.913 ( -5.355 -0.000 4.383) 6.920 14.686 ( 13.253 0.000 -0.987) 13.290 17.429 ( -18.632 -0.000 2.789) 18.839 18.642 ( 11.567 0.000 3.650) 12.129 19.212 ( 13.726 0.000 -13.263) 19.087 19.502 ( 3.914 0.000 10.967) 11.645 20.593 ( -32.181 -0.000 -6.631) 32.857 22.490 ( 28.066 0.000 -5.926) 28.685 24.074 ( -0.219 -0.000 7.155) 7.159 24.182 ( 2.408 0.000 4.040) 4.703 ======================= Grid point 690 (353/361) ======================= q-point: (-0.30 -0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.775 ( 3.939 1.827 -8.120) 9.209 2.878 ( -20.089 -1.820 3.156) 20.417 2.901 ( -7.380 -0.787 7.766) 10.743 3.147 ( 4.200 2.162 -5.775) 7.461 3.272 ( 16.845 -0.194 1.847) 16.947 3.460 ( 14.816 -3.319 -1.588) 15.266 3.873 ( 12.440 1.780 0.215) 12.569 4.486 ( 6.391 3.115 5.615) 9.060 4.940 ( -11.986 -5.151 -0.472) 13.054 4.977 ( -5.848 0.866 -2.528) 6.430 5.522 ( -13.754 0.541 -6.339) 15.154 5.795 ( -4.247 1.419 -8.075) 9.233 6.554 ( -9.360 -0.630 7.860) 12.239 7.021 ( 6.745 -6.242 0.035) 9.190 7.812 ( 8.984 10.150 -2.974) 13.878 8.067 ( 10.453 -13.246 -10.333) 19.787 9.566 ( -1.101 -4.814 -7.404) 8.900 10.028 ( -4.165 7.876 -5.316) 10.375 10.135 ( -9.865 -2.976 -1.327) 10.389 10.303 ( -24.205 -2.679 28.750) 37.678 10.927 ( 2.135 4.231 11.091) 12.061 11.006 ( 14.207 1.086 -18.990) 23.742 12.149 ( -11.434 9.963 3.402) 15.543 12.655 ( 12.401 -2.689 0.307) 12.693 13.596 ( -2.674 -1.416 -7.164) 7.777 13.793 ( 0.441 -1.523 -1.813) 2.409 13.911 ( -3.033 -0.658 4.474) 5.445 14.814 ( 10.921 2.685 -4.502) 12.114 17.312 ( -13.162 0.225 15.989) 20.711 18.701 ( 8.842 -1.254 -18.624) 20.654 19.319 ( 13.205 8.004 2.532) 15.648 19.693 ( 3.948 -3.997 7.060) 9.023 20.113 ( -26.367 -4.101 -2.987) 26.851 22.773 ( 23.411 -2.511 -9.346) 25.332 24.110 ( -0.274 11.554 6.526) 13.272 24.327 ( 3.137 -7.857 6.683) 10.781 ======================= Grid point 691 (354/361) ======================= q-point: (-0.20 -0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.525 ( -15.458 3.518 -5.733) 16.858 2.690 ( -19.783 -6.454 6.144) 21.698 2.973 ( 2.159 1.669 1.787) 3.262 3.097 ( 7.920 -2.119 -8.828) 12.048 3.539 ( 11.612 -1.036 3.117) 12.068 3.775 ( 23.372 -1.490 0.156) 23.420 3.998 ( 12.039 7.509 -2.470) 14.402 4.573 ( -3.564 2.885 9.581) 10.622 4.830 ( -12.628 -2.847 3.342) 13.369 4.886 ( 1.516 -3.288 -5.887) 6.911 5.241 ( -14.514 -0.550 -4.453) 15.192 5.600 ( -4.150 2.902 -9.930) 11.147 6.555 ( -6.275 -0.444 9.963) 11.783 7.208 ( 7.160 -11.104 0.079) 13.213 7.727 ( 5.710 8.613 -12.577) 16.278 8.259 ( 9.398 -12.065 -0.272) 15.296 9.579 ( 1.848 -10.108 -4.224) 11.109 9.823 ( -0.458 9.105 -11.035) 14.313 9.945 ( -15.659 0.759 2.414) 15.862 10.344 ( -23.289 -1.196 29.790) 37.832 10.968 ( 8.407 2.296 -10.622) 13.739 11.080 ( 10.674 4.003 3.228) 11.848 11.886 ( -12.619 12.854 0.262) 18.015 12.807 ( 5.885 -2.315 -1.420) 6.481 13.481 ( -3.685 -3.691 -7.264) 8.943 13.792 ( -0.925 -1.260 -0.351) 1.602 13.961 ( -0.046 -3.197 4.777) 5.748 14.845 ( 9.389 5.120 -8.265) 13.516 17.421 ( -6.127 2.000 24.607) 25.437 18.506 ( 6.158 -1.758 -30.786) 31.445 19.448 ( 6.055 10.515 8.974) 15.092 19.747 ( -6.314 0.064 -0.085) 6.315 19.974 ( -3.310 -11.854 3.941) 12.923 23.005 ( 20.204 -6.265 -9.841) 23.331 24.009 ( -4.738 17.686 4.612) 18.882 24.533 ( 2.923 -8.857 5.642) 10.901 ======================= Grid point 692 (355/361) ======================= q-point: (-0.10 -0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.237 ( -12.016 0.993 -2.041) 12.229 2.577 ( -18.784 -8.645 9.818) 22.890 2.970 ( 7.773 2.219 -6.684) 10.489 3.216 ( 5.722 -8.319 0.170) 10.098 3.634 ( -1.736 2.462 -0.695) 3.092 3.900 ( 10.176 13.134 -7.123) 18.077 4.202 ( 14.597 0.994 2.639) 14.867 4.549 ( -5.403 1.409 3.846) 6.780 4.723 ( -9.828 -1.515 3.845) 10.662 4.926 ( 4.790 -5.318 -4.598) 8.507 5.085 ( -8.145 -1.529 7.418) 11.122 5.412 ( 1.128 3.288 -10.546) 11.104 6.617 ( -2.145 0.504 9.268) 9.527 7.398 ( 3.759 -10.323 0.880) 11.021 7.563 ( 2.406 3.463 -12.576) 13.264 8.556 ( 11.565 -8.197 8.190) 16.371 9.395 ( -12.145 14.394 -7.665) 20.333 9.802 ( -4.465 -0.803 3.739) 5.879 9.827 ( 5.556 -12.966 -4.953) 14.951 10.364 ( -22.243 0.739 26.535) 34.632 10.944 ( 8.895 -0.371 -12.295) 15.180 11.200 ( 7.528 7.110 0.083) 10.355 11.597 ( -10.604 8.361 -0.742) 13.524 12.839 ( -0.491 -1.591 -1.597) 2.307 13.405 ( -3.338 -5.120 -2.918) 6.773 13.777 ( -3.416 -0.803 1.648) 3.877 14.073 ( 1.314 -5.148 4.611) 7.034 14.794 ( 8.099 6.365 -11.557) 15.481 17.649 ( -0.462 4.946 22.729) 23.265 18.232 ( 4.687 -3.495 -27.153) 27.776 19.512 ( 1.487 7.147 4.261) 8.453 19.687 ( 0.569 -0.463 -0.826) 1.105 20.103 ( -0.064 -7.785 3.343) 8.473 23.237 ( 17.313 -9.062 -7.985) 21.110 23.764 ( -10.911 20.130 2.557) 23.039 24.679 ( -0.528 -7.434 2.291) 7.797 ======================= Grid point 700 (356/361) ======================= q-point: (-0.30 -0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.576 ( -17.263 -0.000 -4.422) 17.820 2.603 ( -20.906 -0.000 5.280) 21.563 2.979 ( 4.329 0.000 3.450) 5.536 3.087 ( 4.348 0.000 -12.568) 13.299 3.535 ( 13.042 0.000 3.030) 13.389 3.754 ( 25.730 0.000 1.412) 25.769 4.074 ( 14.514 0.000 -2.430) 14.716 4.642 ( -2.965 -0.000 10.370) 10.786 4.734 ( -12.036 -0.000 1.786) 12.168 4.881 ( -0.191 -0.000 -5.868) 5.871 5.236 ( -16.001 -0.000 -4.264) 16.560 5.627 ( -4.233 -0.000 -9.883) 10.751 6.553 ( -6.173 -0.000 10.850) 12.483 7.094 ( 7.646 0.000 -0.634) 7.672 7.843 ( 3.239 0.000 -20.546) 20.800 8.116 ( 13.676 0.000 7.570) 15.631 9.472 ( 2.255 0.000 -4.560) 5.087 9.936 ( -14.164 -0.000 4.781) 14.949 9.937 ( 1.210 0.000 -17.455) 17.497 10.324 ( -27.242 -0.000 35.885) 45.055 10.965 ( 16.601 0.000 -23.030) 28.389 11.153 ( 0.116 0.000 17.095) 17.095 12.020 ( -14.759 -0.000 0.362) 14.764 12.778 ( 6.855 0.000 -1.205) 6.960 13.436 ( -5.130 -0.000 -8.325) 9.778 13.779 ( -0.049 -0.000 -0.326) 0.329 13.932 ( 0.014 0.000 3.652) 3.652 14.892 ( 9.986 0.000 -9.268) 13.624 17.441 ( -5.311 -0.000 25.297) 25.849 18.487 ( 7.180 0.000 -32.742) 33.520 19.608 ( 10.347 0.000 7.572) 12.822 19.774 ( -14.742 -0.000 1.141) 14.786 19.776 ( 0.239 0.000 4.873) 4.879 22.947 ( 20.143 0.000 -10.291) 22.620 24.272 ( 0.885 0.000 2.620) 2.766 24.353 ( -1.489 -0.000 7.169) 7.322 ======================= Grid point 701 (357/361) ======================= q-point: (-0.20 -0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.260 ( -17.647 1.338 -0.965) 17.724 2.432 ( -18.868 -5.601 8.868) 21.588 3.005 ( 6.934 1.801 -9.736) 12.088 3.099 ( 5.362 -4.277 -0.281) 6.865 3.665 ( 1.156 0.982 0.179) 1.527 4.110 ( 18.777 7.830 -5.122) 20.979 4.213 ( 17.001 -0.200 -1.671) 17.085 4.591 ( -11.571 2.527 5.827) 13.200 4.670 ( -9.310 -3.159 4.883) 10.977 4.841 ( 2.779 -3.164 -7.900) 8.952 5.064 ( -7.768 -0.683 9.013) 11.918 5.459 ( -0.173 1.448 -9.554) 9.665 6.636 ( -1.281 1.075 11.457) 11.578 7.214 ( 5.563 -6.750 -0.746) 8.778 7.619 ( 0.968 1.780 -16.177) 16.304 8.465 ( 15.995 -2.121 10.905) 19.474 9.503 ( 2.194 -2.856 -2.722) 4.514 9.716 ( -0.377 2.785 -13.342) 13.635 9.795 ( -11.680 -0.558 3.713) 12.269 10.369 ( -26.600 -0.195 33.842) 43.045 10.918 ( 11.935 -1.243 -18.956) 22.435 11.332 ( 3.879 4.724 9.878) 11.617 11.757 ( -16.247 6.283 -1.551) 17.489 12.813 ( 0.169 -0.722 -1.779) 1.927 13.296 ( -5.800 -4.800 -3.072) 8.132 13.768 ( -2.526 -0.194 0.971) 2.713 14.003 ( 2.277 -2.063 3.394) 4.578 14.876 ( 9.360 2.328 -14.208) 17.173 17.728 ( 1.700 2.903 25.207) 25.431 18.165 ( 5.342 -2.727 -33.176) 33.714 19.678 ( 0.482 0.537 -2.118) 2.237 19.694 ( -0.080 10.853 5.551) 12.190 19.921 ( 0.918 -11.473 6.113) 13.032 23.121 ( 18.838 -3.259 -9.103) 21.174 24.127 ( -7.080 17.925 -0.380) 19.276 24.484 ( -3.141 -12.925 3.647) 13.792 ======================= Grid point 702 (358/361) ======================= q-point: (-0.10 -0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.101 ( -8.493 -2.865 6.437) 11.035 2.385 ( -13.923 -8.293 11.948) 20.134 3.016 ( 9.798 -0.393 -7.130) 12.124 3.209 ( 2.836 -6.476 -0.298) 7.076 3.549 ( -9.081 3.230 -4.371) 10.584 4.054 ( 4.501 14.601 -7.272) 16.921 4.248 ( -11.355 8.357 -1.836) 14.218 4.546 ( 2.106 -10.066 -6.060) 11.936 4.676 ( -2.525 -1.309 5.247) 5.968 4.926 ( 11.283 -2.801 3.006) 12.008 5.168 ( -1.493 -0.815 13.795) 13.900 5.413 ( 10.566 2.280 -6.095) 12.409 6.745 ( 3.241 3.899 6.411) 8.173 7.327 ( 2.696 -8.357 -4.760) 9.988 7.508 ( 0.524 -0.840 0.112) 0.996 8.848 ( 13.770 -0.532 13.024) 18.961 9.304 ( -7.206 14.821 -5.323) 17.318 9.689 ( -1.721 -5.550 -2.870) 6.481 9.816 ( 5.328 -13.336 1.931) 14.491 10.377 ( -24.274 2.957 28.879) 37.842 10.872 ( 8.376 -3.081 -15.841) 18.182 11.315 ( -11.030 13.515 0.420) 17.450 11.508 ( -3.902 0.704 0.014) 3.965 12.771 ( -4.513 -1.294 -0.594) 4.732 13.294 ( -3.240 -7.367 3.342) 8.714 13.731 ( -5.647 -0.890 1.897) 6.023 14.104 ( 2.176 -3.469 3.056) 5.109 14.779 ( 8.524 3.711 -17.627) 19.928 17.805 ( 6.429 2.952 -20.747) 21.920 18.142 ( 7.785 -2.574 13.251) 15.583 19.547 ( -6.279 8.277 -3.685) 11.023 19.742 ( 7.495 -1.389 -2.981) 8.185 20.103 ( 1.952 -5.978 7.790) 10.011 23.326 ( 17.332 -6.014 -7.276) 19.736 23.763 ( -16.224 20.169 -2.380) 25.994 24.549 ( -6.831 -10.998 0.358) 12.951 ======================= Grid point 711 (359/361) ======================= q-point: (-0.20 -0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.075 ( -11.221 -0.000 6.404) 12.920 2.300 ( -13.417 -0.000 12.202) 18.136 3.014 ( 10.925 0.000 -9.892) 14.737 3.146 ( 2.142 0.000 1.205) 2.458 3.578 ( -9.210 -0.000 -4.141) 10.098 4.298 ( 6.318 0.000 -14.247) 15.585 4.301 ( 9.444 0.000 -4.236) 10.350 4.388 ( -20.126 -0.000 2.709) 20.308 4.650 ( -5.498 -0.000 4.406) 7.046 4.893 ( 17.051 0.000 2.117) 17.182 5.163 ( -2.507 -0.000 15.014) 15.222 5.436 ( 9.752 0.000 -5.426) 11.160 6.794 ( 4.738 0.000 7.510) 8.879 7.227 ( 2.167 0.000 -1.007) 2.390 7.499 ( 1.469 0.000 -4.477) 4.711 8.844 ( 16.096 0.000 11.902) 20.018 9.536 ( 3.743 0.000 0.041) 3.743 9.566 ( 2.249 0.000 -12.711) 12.908 9.669 ( -12.075 -0.000 6.192) 13.570 10.407 ( -25.340 -0.000 33.737) 42.193 10.838 ( 9.121 0.000 -17.743) 19.950 11.483 ( 2.749 0.000 2.288) 3.576 11.494 ( -21.689 -0.000 -0.992) 21.711 12.763 ( -4.330 -0.000 -0.641) 4.377 13.207 ( -3.502 -0.000 4.185) 5.457 13.723 ( -5.605 -0.000 0.961) 5.687 14.070 ( 3.071 0.000 2.629) 4.043 14.814 ( 9.245 0.000 -19.024) 21.151 17.839 ( 7.381 0.000 -30.287) 31.173 18.110 ( 8.067 0.000 21.213) 22.695 19.668 ( -8.083 -0.000 -5.756) 9.923 19.706 ( 6.618 0.000 -4.113) 7.792 20.029 ( 4.305 0.000 12.258) 12.992 23.268 ( 18.101 0.000 -8.207) 19.875 24.016 ( -14.978 -0.000 -8.223) 17.086 24.384 ( -7.505 -0.000 5.392) 9.241 ======================= Grid point 712 (360/361) ======================= q-point: (-0.10 -0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.116 ( -1.570 -2.464 11.934) 12.287 2.345 ( -6.543 -4.407 14.946) 16.900 3.078 ( 10.717 -0.692 -6.158) 12.380 3.171 ( -1.271 -2.598 -0.765) 2.992 3.354 ( -11.672 1.088 -5.010) 12.748 4.063 ( -3.029 10.821 -13.298) 17.410 4.125 ( -12.289 5.545 0.574) 13.494 4.363 ( -1.732 -8.576 -8.828) 12.429 4.664 ( -1.755 -2.757 7.667) 8.334 5.170 ( 12.041 -0.813 0.800) 12.095 5.350 ( 3.728 0.460 16.165) 16.596 5.587 ( 16.780 1.108 -2.290) 16.971 6.902 ( 8.627 4.401 -2.432) 9.986 7.242 ( -0.633 -4.274 -2.186) 4.842 7.612 ( 3.719 -0.785 15.547) 16.005 9.158 ( 10.329 -1.812 5.391) 11.792 9.374 ( -0.101 21.142 1.853) 21.223 9.598 ( 0.229 -4.538 -2.752) 5.312 9.763 ( 0.275 -19.191 7.858) 20.739 10.457 ( -17.743 5.169 27.947) 33.504 10.751 ( 4.232 -2.873 -14.206) 15.099 11.136 ( -23.150 4.878 1.961) 23.739 11.467 ( -0.263 0.353 -7.552) 7.564 12.680 ( -7.889 -0.018 1.019) 7.954 13.280 ( -1.234 -4.370 8.264) 9.429 13.635 ( -6.988 -1.410 -0.614) 7.155 14.146 ( 1.921 -1.413 2.440) 3.411 14.694 ( 9.017 1.716 -20.069) 22.069 17.643 ( 10.944 0.030 -22.720) 25.218 18.476 ( 12.258 -0.010 14.011) 18.617 19.392 ( -11.793 4.898 -10.452) 16.502 19.741 ( 2.540 -2.704 -4.469) 5.809 20.291 ( 11.794 -1.109 10.971) 16.145 23.395 ( 6.912 -1.834 -12.835) 14.693 23.606 ( -14.664 10.165 -2.320) 17.993 24.349 ( -10.141 -6.831 2.325) 12.447 ======================= Grid point 722 (361/361) ======================= q-point: (-0.10 -0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 3.67e-09 3.67e-09 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.270 ( 1.701 0.000 12.374) 12.490 2.460 ( -1.494 -0.000 15.231) 15.304 3.125 ( -1.490 -0.000 -0.754) 1.670 3.125 ( -6.567 -0.000 -1.509) 6.739 3.173 ( 6.603 0.000 -6.927) 9.570 3.865 ( -7.018 -0.000 -12.680) 14.493 4.019 ( -4.974 -0.000 -2.745) 5.681 4.144 ( -7.979 -0.000 -7.858) 11.198 4.783 ( 3.669 0.000 9.691) 10.363 5.257 ( 0.621 0.000 1.933) 2.030 5.619 ( 7.332 0.000 10.957) 13.184 5.813 ( 16.552 0.000 -2.146) 16.690 7.012 ( 12.093 0.000 -6.723) 13.836 7.171 ( -4.502 -0.000 0.311) 4.512 7.977 ( 9.075 0.000 26.545) 28.053 9.278 ( 10.763 0.000 -4.405) 11.629 9.553 ( -2.057 -0.000 1.860) 2.774 9.662 ( 9.585 0.000 -1.562) 9.712 9.668 ( -12.590 -0.000 18.476) 22.358 10.593 ( 2.364 0.000 -16.571) 16.739 10.612 ( -17.435 -0.000 28.207) 33.160 10.893 ( -14.258 -0.000 6.741) 15.772 11.305 ( -1.230 -0.000 -15.533) 15.581 12.533 ( -13.792 -0.000 -1.758) 13.903 13.360 ( -0.792 -0.000 9.351) 9.384 13.526 ( -2.656 -0.000 -2.629) 3.737 14.188 ( 0.101 0.000 2.834) 2.836 14.593 ( 8.357 0.000 -17.981) 19.828 17.600 ( 14.387 0.000 -13.906) 20.009 18.774 ( 9.503 0.000 3.511) 10.131 19.091 ( -9.513 -0.000 -10.725) 14.336 19.676 ( -4.135 -0.000 -2.377) 4.770 20.654 ( 20.485 0.000 10.450) 22.996 23.018 ( -25.954 -0.000 -14.041) 29.508 23.649 ( 10.105 0.000 -1.490) 10.214 24.197 ( -11.389 -0.000 2.435) 11.646 =================== 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 3/46800 10.0 7627.735 8791.709 6695.947 0.000 -34.107 0.000 3/46800 20.0 984.850 879.593 912.019 0.000 14.731 0.000 3/46800 30.0 302.535 239.254 269.098 0.000 1.445 0.000 3/46800 40.0 149.590 109.914 127.508 0.000 -0.197 0.000 3/46800 50.0 92.698 65.015 76.743 0.000 -0.438 0.000 3/46800 60.0 64.932 44.230 52.864 0.000 -0.481 0.000 3/46800 70.0 49.041 32.802 39.591 0.000 -0.498 0.000 3/46800 80.0 38.976 25.778 31.357 0.000 -0.512 0.000 3/46800 90.0 32.142 21.115 25.843 0.000 -0.524 0.000 3/46800 100.0 27.256 17.836 21.936 0.000 -0.532 0.000 3/46800 110.0 23.622 15.427 19.047 0.000 -0.536 0.000 3/46800 120.0 20.830 13.592 16.835 0.000 -0.534 0.000 3/46800 130.0 18.628 12.153 15.093 0.000 -0.529 0.000 3/46800 140.0 16.852 10.998 13.691 0.000 -0.520 0.000 3/46800 150.0 15.393 10.049 12.538 0.000 -0.509 0.000 3/46800 160.0 14.175 9.258 11.575 0.000 -0.496 0.000 3/46800 170.0 13.143 8.587 10.759 0.000 -0.482 0.000 3/46800 180.0 12.258 8.012 10.057 0.000 -0.468 0.000 3/46800 190.0 11.491 7.512 9.449 0.000 -0.453 0.000 3/46800 200.0 10.819 7.074 8.915 0.000 -0.438 0.000 3/46800 210.0 10.227 6.686 8.442 0.000 -0.424 0.000 3/46800 220.0 9.700 6.341 8.021 0.000 -0.410 0.000 3/46800 230.0 9.228 6.032 7.643 0.000 -0.397 0.000 3/46800 240.0 8.802 5.752 7.301 0.000 -0.384 0.000 3/46800 250.0 8.417 5.499 6.991 0.000 -0.371 0.000 3/46800 260.0 8.066 5.268 6.708 0.000 -0.359 0.000 3/46800 270.0 7.745 5.056 6.448 0.000 -0.348 0.000 3/46800 280.0 7.450 4.862 6.209 0.000 -0.337 0.000 3/46800 290.0 7.178 4.682 5.987 0.000 -0.327 0.000 3/46800 300.0 6.926 4.516 5.782 0.000 -0.317 0.000 3/46800 310.0 6.692 4.361 5.591 0.000 -0.308 0.000 3/46800 320.0 6.474 4.218 5.413 0.000 -0.299 0.000 3/46800 330.0 6.271 4.083 5.246 0.000 -0.291 0.000 3/46800 340.0 6.080 3.957 5.089 0.000 -0.283 0.000 3/46800 350.0 5.901 3.839 4.942 0.000 -0.275 0.000 3/46800 360.0 5.733 3.728 4.804 0.000 -0.268 0.000 3/46800 370.0 5.575 3.624 4.673 0.000 -0.261 0.000 3/46800 380.0 5.425 3.525 4.549 0.000 -0.255 0.000 3/46800 390.0 5.283 3.431 4.432 0.000 -0.248 0.000 3/46800 400.0 5.149 3.343 4.321 0.000 -0.242 0.000 3/46800 410.0 5.022 3.259 4.216 0.000 -0.237 0.000 3/46800 420.0 4.901 3.179 4.115 0.000 -0.231 0.000 3/46800 430.0 4.786 3.104 4.020 0.000 -0.226 0.000 3/46800 440.0 4.676 3.031 3.928 0.000 -0.221 0.000 3/46800 450.0 4.571 2.962 3.841 0.000 -0.216 0.000 3/46800 460.0 4.471 2.897 3.758 0.000 -0.212 0.000 3/46800 470.0 4.375 2.834 3.678 0.000 -0.207 0.000 3/46800 480.0 4.284 2.774 3.602 0.000 -0.203 0.000 3/46800 490.0 4.196 2.716 3.528 0.000 -0.199 0.000 3/46800 500.0 4.112 2.661 3.458 0.000 -0.195 0.000 3/46800 510.0 4.031 2.608 3.391 0.000 -0.191 0.000 3/46800 520.0 3.953 2.557 3.326 0.000 -0.188 0.000 3/46800 530.0 3.878 2.508 3.263 0.000 -0.184 0.000 3/46800 540.0 3.806 2.461 3.203 0.000 -0.181 0.000 3/46800 550.0 3.737 2.416 3.145 0.000 -0.178 0.000 3/46800 560.0 3.670 2.372 3.089 0.000 -0.174 0.000 3/46800 570.0 3.606 2.330 3.035 0.000 -0.171 0.000 3/46800 580.0 3.544 2.289 2.983 0.000 -0.168 0.000 3/46800 590.0 3.484 2.250 2.933 0.000 -0.166 0.000 3/46800 600.0 3.426 2.212 2.884 0.000 -0.163 0.000 3/46800 610.0 3.370 2.175 2.837 0.000 -0.160 0.000 3/46800 620.0 3.315 2.140 2.792 0.000 -0.158 0.000 3/46800 630.0 3.263 2.106 2.748 0.000 -0.155 0.000 3/46800 640.0 3.212 2.073 2.705 0.000 -0.153 0.000 3/46800 650.0 3.162 2.040 2.664 0.000 -0.150 0.000 3/46800 660.0 3.115 2.009 2.624 0.000 -0.148 0.000 3/46800 670.0 3.068 1.979 2.585 0.000 -0.146 0.000 3/46800 680.0 3.023 1.950 2.547 0.000 -0.144 0.000 3/46800 690.0 2.979 1.921 2.510 0.000 -0.142 0.000 3/46800 700.0 2.937 1.894 2.474 0.000 -0.140 0.000 3/46800 710.0 2.896 1.867 2.440 0.000 -0.138 0.000 3/46800 720.0 2.856 1.841 2.406 0.000 -0.136 0.000 3/46800 730.0 2.817 1.815 2.373 0.000 -0.134 0.000 3/46800 740.0 2.779 1.791 2.341 0.000 -0.132 0.000 3/46800 750.0 2.742 1.767 2.310 0.000 -0.130 0.000 3/46800 760.0 2.706 1.743 2.280 0.000 -0.129 0.000 3/46800 770.0 2.671 1.721 2.251 0.000 -0.127 0.000 3/46800 780.0 2.636 1.698 2.222 0.000 -0.125 0.000 3/46800 790.0 2.603 1.677 2.194 0.000 -0.124 0.000 3/46800 800.0 2.571 1.656 2.167 0.000 -0.122 0.000 3/46800 810.0 2.539 1.635 2.140 0.000 -0.121 0.000 3/46800 820.0 2.508 1.615 2.114 0.000 -0.119 0.000 3/46800 830.0 2.478 1.596 2.089 0.000 -0.118 0.000 3/46800 840.0 2.449 1.576 2.064 0.000 -0.116 0.000 3/46800 850.0 2.420 1.558 2.040 0.000 -0.115 0.000 3/46800 860.0 2.392 1.540 2.016 0.000 -0.114 0.000 3/46800 870.0 2.364 1.522 1.993 0.000 -0.112 0.000 3/46800 880.0 2.338 1.505 1.970 0.000 -0.111 0.000 3/46800 890.0 2.311 1.488 1.948 0.000 -0.110 0.000 3/46800 900.0 2.286 1.471 1.927 0.000 -0.109 0.000 3/46800 910.0 2.261 1.455 1.906 0.000 -0.108 0.000 3/46800 920.0 2.236 1.439 1.885 0.000 -0.106 0.000 3/46800 930.0 2.212 1.423 1.865 0.000 -0.105 0.000 3/46800 940.0 2.189 1.408 1.845 0.000 -0.104 0.000 3/46800 950.0 2.166 1.393 1.826 0.000 -0.103 0.000 3/46800 960.0 2.143 1.379 1.807 0.000 -0.102 0.000 3/46800 970.0 2.121 1.365 1.788 0.000 -0.101 0.000 3/46800 980.0 2.100 1.351 1.770 0.000 -0.100 0.000 3/46800 990.0 2.078 1.337 1.752 0.000 -0.099 0.000 3/46800 1000.0 2.058 1.323 1.735 0.000 -0.098 0.000 3/46800 Thermal conductivity related properties were written into "kappa-m101013.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 11:24:51]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|