----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 12:26:04]------------------------- 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: [1 3 2] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) Number of symmetry operations in supercell: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.870426380132457 -1.936698805000000 0.000000000000000 b 4.870426380132457 1.936698805000000 0.000000000000000 c -2.787903698648423 0.000000000000000 9.301344589116619 Atomic positions (fractional): *1 Dy 0.22167829399195 0.22167829399195 0.20283212245651 162.500 2 Dy 0.77832170600805 0.77832170600805 0.79716787754349 162.500 *3 Ti 0.38107833810123 0.38107833810123 0.57045932253744 47.867 4 Ti 0.61892166189877 0.61892166189877 0.42954067746256 47.867 *5 Cl 0.88671406818478 0.88671406818478 0.09615927830879 35.453 6 Cl 0.11328593181522 0.11328593181522 0.90384072169121 35.453 *7 O 0.83147647200423 0.83147647200423 0.56599337589234 15.999 *8 O 0.42168178353513 0.42168178353513 0.37450445655930 15.999 *9 O 0.35169557686961 0.35169557686961 0.75170733502298 15.999 10 O 0.64830442313039 0.64830442313039 0.24829266497702 15.999 11 O 0.16852352799577 0.16852352799577 0.43400662410766 15.999 12 O 0.57831821646487 0.57831821646487 0.62549554344070 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 9.740852760264914 0.000000000000000 0.000000000000000 b 0.000000000000000 3.873397610000000 0.000000000000000 c -2.787903698648423 0.000000000000000 9.301344589116619 Atomic positions (fractional): *1 Dy 0.22167829399195 0.00000000000000 0.20283212245651 162.500 > 1 2 Dy 0.27832170600805 0.50000000000000 0.79716787754349 162.500 > 2 3 Dy 0.72167829399195 0.50000000000000 0.20283212245651 162.500 > 1 4 Dy 0.77832170600805 0.00000000000000 0.79716787754349 162.500 > 2 *5 Ti 0.38107833810123 0.00000000000000 0.57045932253744 47.867 > 3 6 Ti 0.11892166189877 0.50000000000000 0.42954067746256 47.867 > 4 7 Ti 0.88107833810123 0.50000000000000 0.57045932253744 47.867 > 3 8 Ti 0.61892166189877 0.00000000000000 0.42954067746256 47.867 > 4 *9 Cl 0.38671406818478 0.50000000000000 0.09615927830879 35.453 > 5 10 Cl 0.11328593181522 0.00000000000000 0.90384072169121 35.453 > 6 11 Cl 0.88671406818478 0.00000000000000 0.09615927830879 35.453 > 5 12 Cl 0.61328593181522 0.50000000000000 0.90384072169121 35.453 > 6 *13 O 0.33147647200423 0.50000000000000 0.56599337589234 15.999 > 7 *14 O 0.42168178353513 0.00000000000000 0.37450445655930 15.999 > 8 *15 O 0.35169557686961 0.00000000000000 0.75170733502298 15.999 > 9 16 O 0.14830442313039 0.50000000000000 0.24829266497702 15.999 > 10 17 O 0.16852352799577 0.00000000000000 0.43400662410766 15.999 > 11 18 O 0.07831821646487 0.50000000000000 0.62549554344070 15.999 > 12 19 O 0.83147647200423 0.00000000000000 0.56599337589234 15.999 > 7 20 O 0.92168178353513 0.50000000000000 0.37450445655930 15.999 > 8 21 O 0.85169557686961 0.50000000000000 0.75170733502298 15.999 > 9 22 O 0.64830442313039 0.00000000000000 0.24829266497702 15.999 > 10 23 O 0.66852352799577 0.50000000000000 0.43400662410766 15.999 > 11 24 O 0.57831821646487 0.00000000000000 0.62549554344070 15.999 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 9.740852760264914 0.000000000000000 0.000000000000000 b 0.000000000000000 11.620192830000001 0.000000000000000 c -5.575807397296846 0.000000000000000 18.602689178233238 Atomic positions (fractional): *1 Dy 0.22167829399195 0.00000000000000 0.10141606122826 162.500 > 1 2 Dy 0.22167829399195 0.33333333333333 0.10141606122826 162.500 > 1 3 Dy 0.22167829399195 0.66666666666667 0.10141606122826 162.500 > 1 4 Dy 0.22167829399195 0.00000000000000 0.60141606122826 162.500 > 1 5 Dy 0.22167829399195 0.33333333333333 0.60141606122826 162.500 > 1 6 Dy 0.22167829399195 0.66666666666667 0.60141606122826 162.500 > 1 7 Dy 0.27832170600805 0.16666666666667 0.39858393877174 162.500 > 2 8 Dy 0.27832170600805 0.50000000000000 0.39858393877174 162.500 > 2 9 Dy 0.27832170600805 0.83333333333333 0.39858393877174 162.500 > 2 10 Dy 0.27832170600805 0.16666666666667 0.89858393877174 162.500 > 2 11 Dy 0.27832170600805 0.50000000000000 0.89858393877174 162.500 > 2 12 Dy 0.27832170600805 0.83333333333333 0.89858393877174 162.500 > 2 13 Dy 0.72167829399195 0.16666666666667 0.10141606122826 162.500 > 1 14 Dy 0.72167829399195 0.50000000000000 0.10141606122826 162.500 > 1 15 Dy 0.72167829399195 0.83333333333333 0.10141606122826 162.500 > 1 16 Dy 0.72167829399195 0.16666666666667 0.60141606122826 162.500 > 1 17 Dy 0.72167829399195 0.50000000000000 0.60141606122826 162.500 > 1 18 Dy 0.72167829399195 0.83333333333333 0.60141606122826 162.500 > 1 19 Dy 0.77832170600805 0.00000000000000 0.39858393877174 162.500 > 2 20 Dy 0.77832170600805 0.33333333333333 0.39858393877174 162.500 > 2 21 Dy 0.77832170600805 0.66666666666667 0.39858393877174 162.500 > 2 22 Dy 0.77832170600805 0.00000000000000 0.89858393877174 162.500 > 2 23 Dy 0.77832170600805 0.33333333333333 0.89858393877174 162.500 > 2 24 Dy 0.77832170600805 0.66666666666667 0.89858393877174 162.500 > 2 *25 Ti 0.38107833810123 0.00000000000000 0.28522966126872 47.867 > 3 26 Ti 0.38107833810123 0.33333333333333 0.28522966126872 47.867 > 3 27 Ti 0.38107833810123 0.66666666666667 0.28522966126872 47.867 > 3 28 Ti 0.38107833810123 0.00000000000000 0.78522966126872 47.867 > 3 29 Ti 0.38107833810123 0.33333333333333 0.78522966126872 47.867 > 3 30 Ti 0.38107833810123 0.66666666666667 0.78522966126872 47.867 > 3 31 Ti 0.11892166189877 0.16666666666667 0.21477033873128 47.867 > 4 32 Ti 0.11892166189877 0.50000000000000 0.21477033873128 47.867 > 4 33 Ti 0.11892166189877 0.83333333333333 0.21477033873128 47.867 > 4 34 Ti 0.11892166189877 0.16666666666667 0.71477033873128 47.867 > 4 35 Ti 0.11892166189877 0.50000000000000 0.71477033873128 47.867 > 4 36 Ti 0.11892166189877 0.83333333333333 0.71477033873128 47.867 > 4 37 Ti 0.88107833810123 0.16666666666667 0.28522966126872 47.867 > 3 38 Ti 0.88107833810123 0.50000000000000 0.28522966126872 47.867 > 3 39 Ti 0.88107833810123 0.83333333333333 0.28522966126872 47.867 > 3 40 Ti 0.88107833810123 0.16666666666667 0.78522966126872 47.867 > 3 41 Ti 0.88107833810123 0.50000000000000 0.78522966126872 47.867 > 3 42 Ti 0.88107833810123 0.83333333333333 0.78522966126872 47.867 > 3 43 Ti 0.61892166189877 0.00000000000000 0.21477033873128 47.867 > 4 44 Ti 0.61892166189877 0.33333333333333 0.21477033873128 47.867 > 4 45 Ti 0.61892166189877 0.66666666666667 0.21477033873128 47.867 > 4 46 Ti 0.61892166189877 0.00000000000000 0.71477033873128 47.867 > 4 47 Ti 0.61892166189877 0.33333333333333 0.71477033873128 47.867 > 4 48 Ti 0.61892166189877 0.66666666666667 0.71477033873128 47.867 > 4 *49 Cl 0.38671406818478 0.16666666666667 0.04807963915439 35.453 > 5 50 Cl 0.38671406818478 0.50000000000000 0.04807963915439 35.453 > 5 51 Cl 0.38671406818478 0.83333333333333 0.04807963915439 35.453 > 5 52 Cl 0.38671406818478 0.16666666666667 0.54807963915439 35.453 > 5 53 Cl 0.38671406818478 0.50000000000000 0.54807963915439 35.453 > 5 54 Cl 0.38671406818478 0.83333333333333 0.54807963915439 35.453 > 5 55 Cl 0.11328593181522 0.00000000000000 0.45192036084561 35.453 > 6 56 Cl 0.11328593181522 0.33333333333333 0.45192036084561 35.453 > 6 57 Cl 0.11328593181522 0.66666666666667 0.45192036084561 35.453 > 6 58 Cl 0.11328593181522 0.00000000000000 0.95192036084561 35.453 > 6 59 Cl 0.11328593181522 0.33333333333333 0.95192036084561 35.453 > 6 60 Cl 0.11328593181522 0.66666666666667 0.95192036084561 35.453 > 6 61 Cl 0.88671406818478 0.00000000000000 0.04807963915439 35.453 > 5 62 Cl 0.88671406818478 0.33333333333333 0.04807963915439 35.453 > 5 63 Cl 0.88671406818478 0.66666666666667 0.04807963915439 35.453 > 5 64 Cl 0.88671406818478 0.00000000000000 0.54807963915439 35.453 > 5 65 Cl 0.88671406818478 0.33333333333333 0.54807963915439 35.453 > 5 66 Cl 0.88671406818478 0.66666666666667 0.54807963915439 35.453 > 5 67 Cl 0.61328593181522 0.16666666666667 0.45192036084561 35.453 > 6 68 Cl 0.61328593181522 0.50000000000000 0.45192036084561 35.453 > 6 69 Cl 0.61328593181522 0.83333333333333 0.45192036084561 35.453 > 6 70 Cl 0.61328593181522 0.16666666666667 0.95192036084561 35.453 > 6 71 Cl 0.61328593181522 0.50000000000000 0.95192036084561 35.453 > 6 72 Cl 0.61328593181522 0.83333333333333 0.95192036084561 35.453 > 6 *73 O 0.33147647200423 0.16666666666667 0.28299668794617 15.999 > 7 74 O 0.33147647200423 0.50000000000000 0.28299668794617 15.999 > 7 75 O 0.33147647200423 0.83333333333333 0.28299668794617 15.999 > 7 76 O 0.33147647200423 0.16666666666667 0.78299668794617 15.999 > 7 77 O 0.33147647200423 0.50000000000000 0.78299668794617 15.999 > 7 78 O 0.33147647200423 0.83333333333333 0.78299668794617 15.999 > 7 *79 O 0.42168178353513 0.00000000000000 0.18725222827965 15.999 > 8 80 O 0.42168178353513 0.33333333333333 0.18725222827965 15.999 > 8 81 O 0.42168178353513 0.66666666666667 0.18725222827965 15.999 > 8 82 O 0.42168178353513 0.00000000000000 0.68725222827965 15.999 > 8 83 O 0.42168178353513 0.33333333333333 0.68725222827965 15.999 > 8 84 O 0.42168178353513 0.66666666666667 0.68725222827965 15.999 > 8 *85 O 0.35169557686961 0.00000000000000 0.37585366751149 15.999 > 9 86 O 0.35169557686961 0.33333333333333 0.37585366751149 15.999 > 9 87 O 0.35169557686961 0.66666666666667 0.37585366751149 15.999 > 9 88 O 0.35169557686961 0.00000000000000 0.87585366751149 15.999 > 9 89 O 0.35169557686961 0.33333333333333 0.87585366751149 15.999 > 9 90 O 0.35169557686961 0.66666666666667 0.87585366751149 15.999 > 9 91 O 0.14830442313039 0.16666666666667 0.12414633248851 15.999 > 10 92 O 0.14830442313039 0.50000000000000 0.12414633248851 15.999 > 10 93 O 0.14830442313039 0.83333333333333 0.12414633248851 15.999 > 10 94 O 0.14830442313039 0.16666666666667 0.62414633248851 15.999 > 10 95 O 0.14830442313039 0.50000000000000 0.62414633248851 15.999 > 10 96 O 0.14830442313039 0.83333333333333 0.62414633248851 15.999 > 10 97 O 0.16852352799577 0.00000000000000 0.21700331205383 15.999 > 11 98 O 0.16852352799577 0.33333333333333 0.21700331205383 15.999 > 11 99 O 0.16852352799577 0.66666666666667 0.21700331205383 15.999 > 11 100 O 0.16852352799577 0.00000000000000 0.71700331205383 15.999 > 11 101 O 0.16852352799577 0.33333333333333 0.71700331205383 15.999 > 11 102 O 0.16852352799577 0.66666666666667 0.71700331205383 15.999 > 11 103 O 0.07831821646487 0.16666666666667 0.31274777172035 15.999 > 12 104 O 0.07831821646487 0.50000000000000 0.31274777172035 15.999 > 12 105 O 0.07831821646487 0.83333333333333 0.31274777172035 15.999 > 12 106 O 0.07831821646487 0.16666666666667 0.81274777172035 15.999 > 12 107 O 0.07831821646487 0.50000000000000 0.81274777172035 15.999 > 12 108 O 0.07831821646487 0.83333333333333 0.81274777172035 15.999 > 12 109 O 0.83147647200423 0.00000000000000 0.28299668794617 15.999 > 7 110 O 0.83147647200423 0.33333333333333 0.28299668794617 15.999 > 7 111 O 0.83147647200423 0.66666666666667 0.28299668794617 15.999 > 7 112 O 0.83147647200423 0.00000000000000 0.78299668794617 15.999 > 7 113 O 0.83147647200423 0.33333333333333 0.78299668794617 15.999 > 7 114 O 0.83147647200423 0.66666666666667 0.78299668794617 15.999 > 7 115 O 0.92168178353513 0.16666666666667 0.18725222827965 15.999 > 8 116 O 0.92168178353513 0.50000000000000 0.18725222827965 15.999 > 8 117 O 0.92168178353513 0.83333333333333 0.18725222827965 15.999 > 8 118 O 0.92168178353513 0.16666666666667 0.68725222827965 15.999 > 8 119 O 0.92168178353513 0.50000000000000 0.68725222827965 15.999 > 8 120 O 0.92168178353513 0.83333333333333 0.68725222827965 15.999 > 8 121 O 0.85169557686961 0.16666666666667 0.37585366751149 15.999 > 9 122 O 0.85169557686961 0.50000000000000 0.37585366751149 15.999 > 9 123 O 0.85169557686961 0.83333333333333 0.37585366751149 15.999 > 9 124 O 0.85169557686961 0.16666666666667 0.87585366751149 15.999 > 9 125 O 0.85169557686961 0.50000000000000 0.87585366751149 15.999 > 9 126 O 0.85169557686961 0.83333333333333 0.87585366751149 15.999 > 9 127 O 0.64830442313039 0.00000000000000 0.12414633248851 15.999 > 10 128 O 0.64830442313039 0.33333333333333 0.12414633248851 15.999 > 10 129 O 0.64830442313039 0.66666666666667 0.12414633248851 15.999 > 10 130 O 0.64830442313039 0.00000000000000 0.62414633248851 15.999 > 10 131 O 0.64830442313039 0.33333333333333 0.62414633248851 15.999 > 10 132 O 0.64830442313039 0.66666666666667 0.62414633248851 15.999 > 10 133 O 0.66852352799577 0.16666666666667 0.21700331205383 15.999 > 11 134 O 0.66852352799577 0.50000000000000 0.21700331205383 15.999 > 11 135 O 0.66852352799577 0.83333333333333 0.21700331205383 15.999 > 11 136 O 0.66852352799577 0.16666666666667 0.71700331205383 15.999 > 11 137 O 0.66852352799577 0.50000000000000 0.71700331205383 15.999 > 11 138 O 0.66852352799577 0.83333333333333 0.71700331205383 15.999 > 11 139 O 0.57831821646487 0.00000000000000 0.31274777172035 15.999 > 12 140 O 0.57831821646487 0.33333333333333 0.31274777172035 15.999 > 12 141 O 0.57831821646487 0.66666666666667 0.31274777172035 15.999 > 12 142 O 0.57831821646487 0.00000000000000 0.81274777172035 15.999 > 12 143 O 0.57831821646487 0.33333333333333 0.81274777172035 15.999 > 12 144 O 0.57831821646487 0.66666666666667 0.81274777172035 15.999 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.8947775 0.0000000 -0.1563284 0.0000000 4.8653853 0.0000000 -0.1563640 0.0000000 4.4267366 -------------------------- Born effective charges -------------------------- 1 Dy 3.7404793 0.0000000 0.3726287 0.0000000 4.2040981 0.0000000 0.0182958 0.0000000 4.0976545 2 Dy 3.7404793 0.0000000 0.3726287 0.0000000 4.2040981 0.0000000 0.0182958 0.0000000 4.0976545 3 Ti 5.9666735 0.0000000 -0.8272608 0.0000000 5.6515691 0.0000000 -0.3968298 0.0000000 3.8947141 4 Ti 5.9666735 0.0000000 -0.8272608 0.0000000 5.6515691 0.0000000 -0.3968298 0.0000000 3.8947141 5 Cl -1.2998187 0.0000000 0.0458698 0.0000000 -1.0941656 0.0000000 0.0783319 0.0000000 -1.6104401 6 Cl -1.2998187 0.0000000 0.0458698 0.0000000 -1.0941656 0.0000000 0.0783319 0.0000000 -1.6104401 7 O -2.0966018 0.0000000 -0.2948939 0.0000000 -4.5550558 0.0000000 -0.3022432 0.0000000 -1.4855107 8 O -4.3046054 0.0000000 -0.4760527 0.0000000 -1.0027177 0.0000000 -0.3311686 0.0000000 -2.3612833 9 O -2.0061270 0.0000000 1.1797089 0.0000000 -3.2037281 0.0000000 0.9336139 0.0000000 -2.5351345 10 O -2.0061270 0.0000000 1.1797089 0.0000000 -3.2037281 0.0000000 0.9336139 0.0000000 -2.5351345 11 O -2.0966018 0.0000000 -0.2948939 0.0000000 -4.5550558 0.0000000 -0.3022432 0.0000000 -1.4855107 12 O -4.3046054 0.0000000 -0.4760527 0.0000000 -1.0027177 0.0000000 -0.3311686 0.0000000 -2.3612833 ---------------------------------------------------------------------------- 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: 9324/9324 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2160 Number of blocks in projector: 2160 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 239 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 69 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 565 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 288 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 288 Use standard eigh solver. Tree of FC basis block matrices: - (2160, 2131), data: False |-- (288, 288), data: True |-- (288, 288), data: True |-- (336, 330), data: True |-- (336, 330), data: True |-- (336, 330), data: True |-- (576, 565), data: False |-- (576, 565), data: False |-- (576, 18), data: (576, 29) @ (29, 18) |-- (76, 69), data: True |-- (250, 239), data: True |-- (250, 239), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.005 Solver_block: 100 / 400 - Time: 0.835 Solver_block: 200 / 400 - Time: 0.802 Solver_block: 300 / 400 - Time: 0.797 Solver_block: 400 / 400 - Time: 0.798 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 3.313 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 432/432 Permutation basis: 9324/9324 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2160 Number of blocks in projector: 2160 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 239 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 69 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 565 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 288 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 288 Use standard eigh solver. Tree of FC basis block matrices: - (2160, 2131), data: False |-- (288, 288), data: True |-- (288, 288), data: True |-- (336, 330), data: True |-- (336, 330), data: True |-- (336, 330), data: True |-- (576, 565), data: False |-- (576, 565), data: False |-- (576, 18), data: (576, 29) @ (29, 18) |-- (76, 69), data: True |-- (250, 239), data: True |-- (250, 239), data: True Max drift after symmetrization by symfc projector: 0.00000000 (xx) 0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 12:26:29]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 12:26:30]------------------------- 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): [1 3 2] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.870426380132457 -1.936698805000000 0.000000000000000 b 4.870426380132457 1.936698805000000 0.000000000000000 c -2.787903698648423 0.000000000000000 9.301344589116619 Atomic positions (fractional): 1 Dy 0.22167829399195 0.22167829399195 0.20283212245651 162.500 2 Dy 0.77832170600805 0.77832170600805 0.79716787754349 162.500 3 Ti 0.38107833810123 0.38107833810123 0.57045932253744 47.867 4 Ti 0.61892166189877 0.61892166189877 0.42954067746256 47.867 5 Cl 0.88671406818478 0.88671406818478 0.09615927830879 35.453 6 Cl 0.11328593181522 0.11328593181522 0.90384072169121 35.453 7 O 0.83147647200423 0.83147647200423 0.56599337589234 15.999 8 O 0.42168178353513 0.42168178353513 0.37450445655930 15.999 9 O 0.35169557686961 0.35169557686961 0.75170733502298 15.999 10 O 0.64830442313039 0.64830442313039 0.24829266497702 15.999 11 O 0.16852352799577 0.16852352799577 0.43400662410766 15.999 12 O 0.57831821646487 0.57831821646487 0.62549554344070 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.740852760264914 0.000000000000000 0.000000000000000 b 0.000000000000000 11.620192830000001 0.000000000000000 c -5.575807397296846 0.000000000000000 18.602689178233238 Atomic positions (fractional): 1 Dy 0.22167829399195 0.00000000000000 0.10141606122826 162.500 > 1 2 Dy 0.22167829399195 0.33333333333333 0.10141606122826 162.500 > 1 3 Dy 0.22167829399195 0.66666666666667 0.10141606122826 162.500 > 1 4 Dy 0.22167829399195 0.00000000000000 0.60141606122826 162.500 > 1 5 Dy 0.22167829399195 0.33333333333333 0.60141606122826 162.500 > 1 6 Dy 0.22167829399195 0.66666666666667 0.60141606122826 162.500 > 1 7 Dy 0.27832170600805 0.16666666666667 0.39858393877174 162.500 > 7 8 Dy 0.27832170600805 0.50000000000000 0.39858393877174 162.500 > 7 9 Dy 0.27832170600805 0.83333333333333 0.39858393877174 162.500 > 7 10 Dy 0.27832170600805 0.16666666666667 0.89858393877174 162.500 > 7 11 Dy 0.27832170600805 0.50000000000000 0.89858393877174 162.500 > 7 12 Dy 0.27832170600805 0.83333333333333 0.89858393877174 162.500 > 7 13 Dy 0.72167829399195 0.16666666666667 0.10141606122826 162.500 > 1 14 Dy 0.72167829399195 0.50000000000000 0.10141606122826 162.500 > 1 15 Dy 0.72167829399195 0.83333333333333 0.10141606122826 162.500 > 1 16 Dy 0.72167829399195 0.16666666666667 0.60141606122826 162.500 > 1 17 Dy 0.72167829399195 0.50000000000000 0.60141606122826 162.500 > 1 18 Dy 0.72167829399195 0.83333333333333 0.60141606122826 162.500 > 1 19 Dy 0.77832170600805 0.00000000000000 0.39858393877174 162.500 > 7 20 Dy 0.77832170600805 0.33333333333333 0.39858393877174 162.500 > 7 21 Dy 0.77832170600805 0.66666666666667 0.39858393877174 162.500 > 7 22 Dy 0.77832170600805 0.00000000000000 0.89858393877174 162.500 > 7 23 Dy 0.77832170600805 0.33333333333333 0.89858393877174 162.500 > 7 24 Dy 0.77832170600805 0.66666666666667 0.89858393877174 162.500 > 7 25 Ti 0.38107833810123 0.00000000000000 0.28522966126872 47.867 > 25 26 Ti 0.38107833810123 0.33333333333333 0.28522966126872 47.867 > 25 27 Ti 0.38107833810123 0.66666666666667 0.28522966126872 47.867 > 25 28 Ti 0.38107833810123 0.00000000000000 0.78522966126872 47.867 > 25 29 Ti 0.38107833810123 0.33333333333333 0.78522966126872 47.867 > 25 30 Ti 0.38107833810123 0.66666666666667 0.78522966126872 47.867 > 25 31 Ti 0.11892166189877 0.16666666666667 0.21477033873128 47.867 > 31 32 Ti 0.11892166189877 0.50000000000000 0.21477033873128 47.867 > 31 33 Ti 0.11892166189877 0.83333333333333 0.21477033873128 47.867 > 31 34 Ti 0.11892166189877 0.16666666666667 0.71477033873128 47.867 > 31 35 Ti 0.11892166189877 0.50000000000000 0.71477033873128 47.867 > 31 36 Ti 0.11892166189877 0.83333333333333 0.71477033873128 47.867 > 31 37 Ti 0.88107833810123 0.16666666666667 0.28522966126872 47.867 > 25 38 Ti 0.88107833810123 0.50000000000000 0.28522966126872 47.867 > 25 39 Ti 0.88107833810123 0.83333333333333 0.28522966126872 47.867 > 25 40 Ti 0.88107833810123 0.16666666666667 0.78522966126872 47.867 > 25 41 Ti 0.88107833810123 0.50000000000000 0.78522966126872 47.867 > 25 42 Ti 0.88107833810123 0.83333333333333 0.78522966126872 47.867 > 25 43 Ti 0.61892166189877 0.00000000000000 0.21477033873128 47.867 > 31 44 Ti 0.61892166189877 0.33333333333333 0.21477033873128 47.867 > 31 45 Ti 0.61892166189877 0.66666666666667 0.21477033873128 47.867 > 31 46 Ti 0.61892166189877 0.00000000000000 0.71477033873128 47.867 > 31 47 Ti 0.61892166189877 0.33333333333333 0.71477033873128 47.867 > 31 48 Ti 0.61892166189877 0.66666666666667 0.71477033873128 47.867 > 31 49 Cl 0.38671406818478 0.16666666666667 0.04807963915439 35.453 > 49 50 Cl 0.38671406818478 0.50000000000000 0.04807963915439 35.453 > 49 51 Cl 0.38671406818478 0.83333333333333 0.04807963915439 35.453 > 49 52 Cl 0.38671406818478 0.16666666666667 0.54807963915439 35.453 > 49 53 Cl 0.38671406818478 0.50000000000000 0.54807963915439 35.453 > 49 54 Cl 0.38671406818478 0.83333333333333 0.54807963915439 35.453 > 49 55 Cl 0.11328593181522 0.00000000000000 0.45192036084561 35.453 > 55 56 Cl 0.11328593181522 0.33333333333333 0.45192036084561 35.453 > 55 57 Cl 0.11328593181522 0.66666666666667 0.45192036084561 35.453 > 55 58 Cl 0.11328593181522 0.00000000000000 0.95192036084561 35.453 > 55 59 Cl 0.11328593181522 0.33333333333333 0.95192036084561 35.453 > 55 60 Cl 0.11328593181522 0.66666666666667 0.95192036084561 35.453 > 55 61 Cl 0.88671406818478 0.00000000000000 0.04807963915439 35.453 > 49 62 Cl 0.88671406818478 0.33333333333333 0.04807963915439 35.453 > 49 63 Cl 0.88671406818478 0.66666666666667 0.04807963915439 35.453 > 49 64 Cl 0.88671406818478 0.00000000000000 0.54807963915439 35.453 > 49 65 Cl 0.88671406818478 0.33333333333333 0.54807963915439 35.453 > 49 66 Cl 0.88671406818478 0.66666666666667 0.54807963915439 35.453 > 49 67 Cl 0.61328593181522 0.16666666666667 0.45192036084561 35.453 > 55 68 Cl 0.61328593181522 0.50000000000000 0.45192036084561 35.453 > 55 69 Cl 0.61328593181522 0.83333333333333 0.45192036084561 35.453 > 55 70 Cl 0.61328593181522 0.16666666666667 0.95192036084561 35.453 > 55 71 Cl 0.61328593181522 0.50000000000000 0.95192036084561 35.453 > 55 72 Cl 0.61328593181522 0.83333333333333 0.95192036084561 35.453 > 55 73 O 0.33147647200423 0.16666666666667 0.28299668794617 15.999 > 73 74 O 0.33147647200423 0.50000000000000 0.28299668794617 15.999 > 73 75 O 0.33147647200423 0.83333333333333 0.28299668794617 15.999 > 73 76 O 0.33147647200423 0.16666666666667 0.78299668794617 15.999 > 73 77 O 0.33147647200423 0.50000000000000 0.78299668794617 15.999 > 73 78 O 0.33147647200423 0.83333333333333 0.78299668794617 15.999 > 73 79 O 0.42168178353513 0.00000000000000 0.18725222827965 15.999 > 79 80 O 0.42168178353513 0.33333333333333 0.18725222827965 15.999 > 79 81 O 0.42168178353513 0.66666666666667 0.18725222827965 15.999 > 79 82 O 0.42168178353513 0.00000000000000 0.68725222827965 15.999 > 79 83 O 0.42168178353513 0.33333333333333 0.68725222827965 15.999 > 79 84 O 0.42168178353513 0.66666666666667 0.68725222827965 15.999 > 79 85 O 0.35169557686961 0.00000000000000 0.37585366751149 15.999 > 85 86 O 0.35169557686961 0.33333333333333 0.37585366751149 15.999 > 85 87 O 0.35169557686961 0.66666666666667 0.37585366751149 15.999 > 85 88 O 0.35169557686961 0.00000000000000 0.87585366751149 15.999 > 85 89 O 0.35169557686961 0.33333333333333 0.87585366751149 15.999 > 85 90 O 0.35169557686961 0.66666666666667 0.87585366751149 15.999 > 85 91 O 0.14830442313039 0.16666666666667 0.12414633248851 15.999 > 91 92 O 0.14830442313039 0.50000000000000 0.12414633248851 15.999 > 91 93 O 0.14830442313039 0.83333333333333 0.12414633248851 15.999 > 91 94 O 0.14830442313039 0.16666666666667 0.62414633248851 15.999 > 91 95 O 0.14830442313039 0.50000000000000 0.62414633248851 15.999 > 91 96 O 0.14830442313039 0.83333333333333 0.62414633248851 15.999 > 91 97 O 0.16852352799577 0.00000000000000 0.21700331205383 15.999 > 97 98 O 0.16852352799577 0.33333333333333 0.21700331205383 15.999 > 97 99 O 0.16852352799577 0.66666666666667 0.21700331205383 15.999 > 97 100 O 0.16852352799577 0.00000000000000 0.71700331205383 15.999 > 97 101 O 0.16852352799577 0.33333333333333 0.71700331205383 15.999 > 97 102 O 0.16852352799577 0.66666666666667 0.71700331205383 15.999 > 97 103 O 0.07831821646487 0.16666666666667 0.31274777172035 15.999 > 103 104 O 0.07831821646487 0.50000000000000 0.31274777172035 15.999 > 103 105 O 0.07831821646487 0.83333333333333 0.31274777172035 15.999 > 103 106 O 0.07831821646487 0.16666666666667 0.81274777172035 15.999 > 103 107 O 0.07831821646487 0.50000000000000 0.81274777172035 15.999 > 103 108 O 0.07831821646487 0.83333333333333 0.81274777172035 15.999 > 103 109 O 0.83147647200423 0.00000000000000 0.28299668794617 15.999 > 73 110 O 0.83147647200423 0.33333333333333 0.28299668794617 15.999 > 73 111 O 0.83147647200423 0.66666666666667 0.28299668794617 15.999 > 73 112 O 0.83147647200423 0.00000000000000 0.78299668794617 15.999 > 73 113 O 0.83147647200423 0.33333333333333 0.78299668794617 15.999 > 73 114 O 0.83147647200423 0.66666666666667 0.78299668794617 15.999 > 73 115 O 0.92168178353513 0.16666666666667 0.18725222827965 15.999 > 79 116 O 0.92168178353513 0.50000000000000 0.18725222827965 15.999 > 79 117 O 0.92168178353513 0.83333333333333 0.18725222827965 15.999 > 79 118 O 0.92168178353513 0.16666666666667 0.68725222827965 15.999 > 79 119 O 0.92168178353513 0.50000000000000 0.68725222827965 15.999 > 79 120 O 0.92168178353513 0.83333333333333 0.68725222827965 15.999 > 79 121 O 0.85169557686961 0.16666666666667 0.37585366751149 15.999 > 85 122 O 0.85169557686961 0.50000000000000 0.37585366751149 15.999 > 85 123 O 0.85169557686961 0.83333333333333 0.37585366751149 15.999 > 85 124 O 0.85169557686961 0.16666666666667 0.87585366751149 15.999 > 85 125 O 0.85169557686961 0.50000000000000 0.87585366751149 15.999 > 85 126 O 0.85169557686961 0.83333333333333 0.87585366751149 15.999 > 85 127 O 0.64830442313039 0.00000000000000 0.12414633248851 15.999 > 91 128 O 0.64830442313039 0.33333333333333 0.12414633248851 15.999 > 91 129 O 0.64830442313039 0.66666666666667 0.12414633248851 15.999 > 91 130 O 0.64830442313039 0.00000000000000 0.62414633248851 15.999 > 91 131 O 0.64830442313039 0.33333333333333 0.62414633248851 15.999 > 91 132 O 0.64830442313039 0.66666666666667 0.62414633248851 15.999 > 91 133 O 0.66852352799577 0.16666666666667 0.21700331205383 15.999 > 97 134 O 0.66852352799577 0.50000000000000 0.21700331205383 15.999 > 97 135 O 0.66852352799577 0.83333333333333 0.21700331205383 15.999 > 97 136 O 0.66852352799577 0.16666666666667 0.71700331205383 15.999 > 97 137 O 0.66852352799577 0.50000000000000 0.71700331205383 15.999 > 97 138 O 0.66852352799577 0.83333333333333 0.71700331205383 15.999 > 97 139 O 0.57831821646487 0.00000000000000 0.31274777172035 15.999 > 103 140 O 0.57831821646487 0.33333333333333 0.31274777172035 15.999 > 103 141 O 0.57831821646487 0.66666666666667 0.31274777172035 15.999 > 103 142 O 0.57831821646487 0.00000000000000 0.81274777172035 15.999 > 103 143 O 0.57831821646487 0.33333333333333 0.81274777172035 15.999 > 103 144 O 0.57831821646487 0.66666666666667 0.81274777172035 15.999 > 103 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.8947775 0.0000000 -0.1563284 0.0000000 4.8653853 0.0000000 -0.1563640 0.0000000 4.4267366 -------------------------- Born effective charges -------------------------- 1 Dy 3.7404793 0.0000000 0.3726287 0.0000000 4.2040981 0.0000000 0.0182958 0.0000000 4.0976545 2 Dy 3.7404793 0.0000000 0.3726287 0.0000000 4.2040981 0.0000000 0.0182958 0.0000000 4.0976545 3 Ti 5.9666735 0.0000000 -0.8272608 0.0000000 5.6515691 0.0000000 -0.3968298 0.0000000 3.8947141 4 Ti 5.9666735 0.0000000 -0.8272608 0.0000000 5.6515691 0.0000000 -0.3968298 0.0000000 3.8947141 5 Cl -1.2998187 0.0000000 0.0458698 0.0000000 -1.0941656 0.0000000 0.0783319 0.0000000 -1.6104401 6 Cl -1.2998187 0.0000000 0.0458698 0.0000000 -1.0941656 0.0000000 0.0783319 0.0000000 -1.6104401 7 O -2.0966018 0.0000000 -0.2948939 0.0000000 -4.5550558 0.0000000 -0.3022432 0.0000000 -1.4855107 8 O -4.3046054 0.0000000 -0.4760527 0.0000000 -1.0027177 0.0000000 -0.3311686 0.0000000 -2.3612833 9 O -2.0061270 0.0000000 1.1797089 0.0000000 -3.2037281 0.0000000 0.9336139 0.0000000 -2.5351345 10 O -2.0061270 0.0000000 1.1797089 0.0000000 -3.2037281 0.0000000 0.9336139 0.0000000 -2.5351345 11 O -2.0966018 0.0000000 -0.2948939 0.0000000 -4.5550558 0.0000000 -0.3022432 0.0000000 -1.4855107 12 O -4.3046054 0.0000000 -0.4760527 0.0000000 -1.0027177 0.0000000 -0.3311686 0.0000000 -2.3612833 ---------------------------------------------------------------------------- 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] [-0.0029 0.0000 0.0096] [ 0.0029 0.0000 -0.0096] 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] [-0.0029 0.0000 0.0096] [ 0.0029 0.0000 -0.0096] 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] [-0.0029 0.0000 0.0096] [ 0.0029 0.0000 -0.0096] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0029 0.0000 0.0096] [ 0.0029 0.0000 -0.0096] Computing fc3[ 79, 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] [-0.0029 0.0000 0.0096] [ 0.0029 0.0000 -0.0096] Computing fc3[ 85, 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] [-0.0029 0.0000 0.0096] [ 0.0029 0.0000 -0.0096] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000002 (xxx) 0.00000002 (xxx) 0.00000002 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000001 (xz) 0.00000001 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 12:26:58]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 12:26:58]------------------------- 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): [1 3 2] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.870426380132457 -1.936698805000000 0.000000000000000 b 4.870426380132457 1.936698805000000 0.000000000000000 c -2.787903698648423 0.000000000000000 9.301344589116619 Atomic positions (fractional): 1 Dy 0.22167829399195 0.22167829399195 0.20283212245651 162.500 2 Dy 0.77832170600805 0.77832170600805 0.79716787754349 162.500 3 Ti 0.38107833810123 0.38107833810123 0.57045932253744 47.867 4 Ti 0.61892166189877 0.61892166189877 0.42954067746256 47.867 5 Cl 0.88671406818478 0.88671406818478 0.09615927830879 35.453 6 Cl 0.11328593181522 0.11328593181522 0.90384072169121 35.453 7 O 0.83147647200423 0.83147647200423 0.56599337589234 15.999 8 O 0.42168178353513 0.42168178353513 0.37450445655930 15.999 9 O 0.35169557686961 0.35169557686961 0.75170733502298 15.999 10 O 0.64830442313039 0.64830442313039 0.24829266497702 15.999 11 O 0.16852352799577 0.16852352799577 0.43400662410766 15.999 12 O 0.57831821646487 0.57831821646487 0.62549554344070 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.740852760264914 0.000000000000000 0.000000000000000 b 0.000000000000000 11.620192830000001 0.000000000000000 c -5.575807397296846 0.000000000000000 18.602689178233238 Atomic positions (fractional): 1 Dy 0.22167829399195 0.00000000000000 0.10141606122826 162.500 > 1 2 Dy 0.22167829399195 0.33333333333333 0.10141606122826 162.500 > 1 3 Dy 0.22167829399195 0.66666666666667 0.10141606122826 162.500 > 1 4 Dy 0.22167829399195 0.00000000000000 0.60141606122826 162.500 > 1 5 Dy 0.22167829399195 0.33333333333333 0.60141606122826 162.500 > 1 6 Dy 0.22167829399195 0.66666666666667 0.60141606122826 162.500 > 1 7 Dy 0.27832170600805 0.16666666666667 0.39858393877174 162.500 > 7 8 Dy 0.27832170600805 0.50000000000000 0.39858393877174 162.500 > 7 9 Dy 0.27832170600805 0.83333333333333 0.39858393877174 162.500 > 7 10 Dy 0.27832170600805 0.16666666666667 0.89858393877174 162.500 > 7 11 Dy 0.27832170600805 0.50000000000000 0.89858393877174 162.500 > 7 12 Dy 0.27832170600805 0.83333333333333 0.89858393877174 162.500 > 7 13 Dy 0.72167829399195 0.16666666666667 0.10141606122826 162.500 > 1 14 Dy 0.72167829399195 0.50000000000000 0.10141606122826 162.500 > 1 15 Dy 0.72167829399195 0.83333333333333 0.10141606122826 162.500 > 1 16 Dy 0.72167829399195 0.16666666666667 0.60141606122826 162.500 > 1 17 Dy 0.72167829399195 0.50000000000000 0.60141606122826 162.500 > 1 18 Dy 0.72167829399195 0.83333333333333 0.60141606122826 162.500 > 1 19 Dy 0.77832170600805 0.00000000000000 0.39858393877174 162.500 > 7 20 Dy 0.77832170600805 0.33333333333333 0.39858393877174 162.500 > 7 21 Dy 0.77832170600805 0.66666666666667 0.39858393877174 162.500 > 7 22 Dy 0.77832170600805 0.00000000000000 0.89858393877174 162.500 > 7 23 Dy 0.77832170600805 0.33333333333333 0.89858393877174 162.500 > 7 24 Dy 0.77832170600805 0.66666666666667 0.89858393877174 162.500 > 7 25 Ti 0.38107833810123 0.00000000000000 0.28522966126872 47.867 > 25 26 Ti 0.38107833810123 0.33333333333333 0.28522966126872 47.867 > 25 27 Ti 0.38107833810123 0.66666666666667 0.28522966126872 47.867 > 25 28 Ti 0.38107833810123 0.00000000000000 0.78522966126872 47.867 > 25 29 Ti 0.38107833810123 0.33333333333333 0.78522966126872 47.867 > 25 30 Ti 0.38107833810123 0.66666666666667 0.78522966126872 47.867 > 25 31 Ti 0.11892166189877 0.16666666666667 0.21477033873128 47.867 > 31 32 Ti 0.11892166189877 0.50000000000000 0.21477033873128 47.867 > 31 33 Ti 0.11892166189877 0.83333333333333 0.21477033873128 47.867 > 31 34 Ti 0.11892166189877 0.16666666666667 0.71477033873128 47.867 > 31 35 Ti 0.11892166189877 0.50000000000000 0.71477033873128 47.867 > 31 36 Ti 0.11892166189877 0.83333333333333 0.71477033873128 47.867 > 31 37 Ti 0.88107833810123 0.16666666666667 0.28522966126872 47.867 > 25 38 Ti 0.88107833810123 0.50000000000000 0.28522966126872 47.867 > 25 39 Ti 0.88107833810123 0.83333333333333 0.28522966126872 47.867 > 25 40 Ti 0.88107833810123 0.16666666666667 0.78522966126872 47.867 > 25 41 Ti 0.88107833810123 0.50000000000000 0.78522966126872 47.867 > 25 42 Ti 0.88107833810123 0.83333333333333 0.78522966126872 47.867 > 25 43 Ti 0.61892166189877 0.00000000000000 0.21477033873128 47.867 > 31 44 Ti 0.61892166189877 0.33333333333333 0.21477033873128 47.867 > 31 45 Ti 0.61892166189877 0.66666666666667 0.21477033873128 47.867 > 31 46 Ti 0.61892166189877 0.00000000000000 0.71477033873128 47.867 > 31 47 Ti 0.61892166189877 0.33333333333333 0.71477033873128 47.867 > 31 48 Ti 0.61892166189877 0.66666666666667 0.71477033873128 47.867 > 31 49 Cl 0.38671406818478 0.16666666666667 0.04807963915439 35.453 > 49 50 Cl 0.38671406818478 0.50000000000000 0.04807963915439 35.453 > 49 51 Cl 0.38671406818478 0.83333333333333 0.04807963915439 35.453 > 49 52 Cl 0.38671406818478 0.16666666666667 0.54807963915439 35.453 > 49 53 Cl 0.38671406818478 0.50000000000000 0.54807963915439 35.453 > 49 54 Cl 0.38671406818478 0.83333333333333 0.54807963915439 35.453 > 49 55 Cl 0.11328593181522 0.00000000000000 0.45192036084561 35.453 > 55 56 Cl 0.11328593181522 0.33333333333333 0.45192036084561 35.453 > 55 57 Cl 0.11328593181522 0.66666666666667 0.45192036084561 35.453 > 55 58 Cl 0.11328593181522 0.00000000000000 0.95192036084561 35.453 > 55 59 Cl 0.11328593181522 0.33333333333333 0.95192036084561 35.453 > 55 60 Cl 0.11328593181522 0.66666666666667 0.95192036084561 35.453 > 55 61 Cl 0.88671406818478 0.00000000000000 0.04807963915439 35.453 > 49 62 Cl 0.88671406818478 0.33333333333333 0.04807963915439 35.453 > 49 63 Cl 0.88671406818478 0.66666666666667 0.04807963915439 35.453 > 49 64 Cl 0.88671406818478 0.00000000000000 0.54807963915439 35.453 > 49 65 Cl 0.88671406818478 0.33333333333333 0.54807963915439 35.453 > 49 66 Cl 0.88671406818478 0.66666666666667 0.54807963915439 35.453 > 49 67 Cl 0.61328593181522 0.16666666666667 0.45192036084561 35.453 > 55 68 Cl 0.61328593181522 0.50000000000000 0.45192036084561 35.453 > 55 69 Cl 0.61328593181522 0.83333333333333 0.45192036084561 35.453 > 55 70 Cl 0.61328593181522 0.16666666666667 0.95192036084561 35.453 > 55 71 Cl 0.61328593181522 0.50000000000000 0.95192036084561 35.453 > 55 72 Cl 0.61328593181522 0.83333333333333 0.95192036084561 35.453 > 55 73 O 0.33147647200423 0.16666666666667 0.28299668794617 15.999 > 73 74 O 0.33147647200423 0.50000000000000 0.28299668794617 15.999 > 73 75 O 0.33147647200423 0.83333333333333 0.28299668794617 15.999 > 73 76 O 0.33147647200423 0.16666666666667 0.78299668794617 15.999 > 73 77 O 0.33147647200423 0.50000000000000 0.78299668794617 15.999 > 73 78 O 0.33147647200423 0.83333333333333 0.78299668794617 15.999 > 73 79 O 0.42168178353513 0.00000000000000 0.18725222827965 15.999 > 79 80 O 0.42168178353513 0.33333333333333 0.18725222827965 15.999 > 79 81 O 0.42168178353513 0.66666666666667 0.18725222827965 15.999 > 79 82 O 0.42168178353513 0.00000000000000 0.68725222827965 15.999 > 79 83 O 0.42168178353513 0.33333333333333 0.68725222827965 15.999 > 79 84 O 0.42168178353513 0.66666666666667 0.68725222827965 15.999 > 79 85 O 0.35169557686961 0.00000000000000 0.37585366751149 15.999 > 85 86 O 0.35169557686961 0.33333333333333 0.37585366751149 15.999 > 85 87 O 0.35169557686961 0.66666666666667 0.37585366751149 15.999 > 85 88 O 0.35169557686961 0.00000000000000 0.87585366751149 15.999 > 85 89 O 0.35169557686961 0.33333333333333 0.87585366751149 15.999 > 85 90 O 0.35169557686961 0.66666666666667 0.87585366751149 15.999 > 85 91 O 0.14830442313039 0.16666666666667 0.12414633248851 15.999 > 91 92 O 0.14830442313039 0.50000000000000 0.12414633248851 15.999 > 91 93 O 0.14830442313039 0.83333333333333 0.12414633248851 15.999 > 91 94 O 0.14830442313039 0.16666666666667 0.62414633248851 15.999 > 91 95 O 0.14830442313039 0.50000000000000 0.62414633248851 15.999 > 91 96 O 0.14830442313039 0.83333333333333 0.62414633248851 15.999 > 91 97 O 0.16852352799577 0.00000000000000 0.21700331205383 15.999 > 97 98 O 0.16852352799577 0.33333333333333 0.21700331205383 15.999 > 97 99 O 0.16852352799577 0.66666666666667 0.21700331205383 15.999 > 97 100 O 0.16852352799577 0.00000000000000 0.71700331205383 15.999 > 97 101 O 0.16852352799577 0.33333333333333 0.71700331205383 15.999 > 97 102 O 0.16852352799577 0.66666666666667 0.71700331205383 15.999 > 97 103 O 0.07831821646487 0.16666666666667 0.31274777172035 15.999 > 103 104 O 0.07831821646487 0.50000000000000 0.31274777172035 15.999 > 103 105 O 0.07831821646487 0.83333333333333 0.31274777172035 15.999 > 103 106 O 0.07831821646487 0.16666666666667 0.81274777172035 15.999 > 103 107 O 0.07831821646487 0.50000000000000 0.81274777172035 15.999 > 103 108 O 0.07831821646487 0.83333333333333 0.81274777172035 15.999 > 103 109 O 0.83147647200423 0.00000000000000 0.28299668794617 15.999 > 73 110 O 0.83147647200423 0.33333333333333 0.28299668794617 15.999 > 73 111 O 0.83147647200423 0.66666666666667 0.28299668794617 15.999 > 73 112 O 0.83147647200423 0.00000000000000 0.78299668794617 15.999 > 73 113 O 0.83147647200423 0.33333333333333 0.78299668794617 15.999 > 73 114 O 0.83147647200423 0.66666666666667 0.78299668794617 15.999 > 73 115 O 0.92168178353513 0.16666666666667 0.18725222827965 15.999 > 79 116 O 0.92168178353513 0.50000000000000 0.18725222827965 15.999 > 79 117 O 0.92168178353513 0.83333333333333 0.18725222827965 15.999 > 79 118 O 0.92168178353513 0.16666666666667 0.68725222827965 15.999 > 79 119 O 0.92168178353513 0.50000000000000 0.68725222827965 15.999 > 79 120 O 0.92168178353513 0.83333333333333 0.68725222827965 15.999 > 79 121 O 0.85169557686961 0.16666666666667 0.37585366751149 15.999 > 85 122 O 0.85169557686961 0.50000000000000 0.37585366751149 15.999 > 85 123 O 0.85169557686961 0.83333333333333 0.37585366751149 15.999 > 85 124 O 0.85169557686961 0.16666666666667 0.87585366751149 15.999 > 85 125 O 0.85169557686961 0.50000000000000 0.87585366751149 15.999 > 85 126 O 0.85169557686961 0.83333333333333 0.87585366751149 15.999 > 85 127 O 0.64830442313039 0.00000000000000 0.12414633248851 15.999 > 91 128 O 0.64830442313039 0.33333333333333 0.12414633248851 15.999 > 91 129 O 0.64830442313039 0.66666666666667 0.12414633248851 15.999 > 91 130 O 0.64830442313039 0.00000000000000 0.62414633248851 15.999 > 91 131 O 0.64830442313039 0.33333333333333 0.62414633248851 15.999 > 91 132 O 0.64830442313039 0.66666666666667 0.62414633248851 15.999 > 91 133 O 0.66852352799577 0.16666666666667 0.21700331205383 15.999 > 97 134 O 0.66852352799577 0.50000000000000 0.21700331205383 15.999 > 97 135 O 0.66852352799577 0.83333333333333 0.21700331205383 15.999 > 97 136 O 0.66852352799577 0.16666666666667 0.71700331205383 15.999 > 97 137 O 0.66852352799577 0.50000000000000 0.71700331205383 15.999 > 97 138 O 0.66852352799577 0.83333333333333 0.71700331205383 15.999 > 97 139 O 0.57831821646487 0.00000000000000 0.31274777172035 15.999 > 103 140 O 0.57831821646487 0.33333333333333 0.31274777172035 15.999 > 103 141 O 0.57831821646487 0.66666666666667 0.31274777172035 15.999 > 103 142 O 0.57831821646487 0.00000000000000 0.81274777172035 15.999 > 103 143 O 0.57831821646487 0.33333333333333 0.81274777172035 15.999 > 103 144 O 0.57831821646487 0.66666666666667 0.81274777172035 15.999 > 103 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.8947775 0.0000000 -0.1563284 0.0000000 4.8653853 0.0000000 -0.1563640 0.0000000 4.4267366 -------------------------- Born effective charges -------------------------- 1 Dy 3.7404793 0.0000000 0.3726287 0.0000000 4.2040981 0.0000000 0.0182958 0.0000000 4.0976545 2 Dy 3.7404793 0.0000000 0.3726287 0.0000000 4.2040981 0.0000000 0.0182958 0.0000000 4.0976545 3 Ti 5.9666735 0.0000000 -0.8272608 0.0000000 5.6515691 0.0000000 -0.3968298 0.0000000 3.8947141 4 Ti 5.9666735 0.0000000 -0.8272608 0.0000000 5.6515691 0.0000000 -0.3968298 0.0000000 3.8947141 5 Cl -1.2998187 0.0000000 0.0458698 0.0000000 -1.0941656 0.0000000 0.0783319 0.0000000 -1.6104401 6 Cl -1.2998187 0.0000000 0.0458698 0.0000000 -1.0941656 0.0000000 0.0783319 0.0000000 -1.6104401 7 O -2.0966018 0.0000000 -0.2948939 0.0000000 -4.5550558 0.0000000 -0.3022432 0.0000000 -1.4855107 8 O -4.3046054 0.0000000 -0.4760527 0.0000000 -1.0027177 0.0000000 -0.3311686 0.0000000 -2.3612833 9 O -2.0061270 0.0000000 1.1797089 0.0000000 -3.2037281 0.0000000 0.9336139 0.0000000 -2.5351345 10 O -2.0061270 0.0000000 1.1797089 0.0000000 -3.2037281 0.0000000 0.9336139 0.0000000 -2.5351345 11 O -2.0966018 0.0000000 -0.2948939 0.0000000 -4.5550558 0.0000000 -0.3022432 0.0000000 -1.4855107 12 O -4.3046054 0.0000000 -0.4760527 0.0000000 -1.0027177 0.0000000 -0.3311686 0.0000000 -2.3612833 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000002 (xxx) 0.00000002 (xxx) 0.00000002 (xxx) 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 ... [ 14 14 5 ] 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: 0.74, Number of G-points: 289, Lambda: 0.17 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/267) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.478 ( 0.000 0.000 0.000) 0.000 2.577 ( 0.000 0.000 0.000) 0.000 3.472 ( 0.000 0.000 0.000) 0.000 3.564 ( 0.000 0.000 0.000) 0.000 3.795 ( 0.000 0.000 0.000) 0.000 3.950 ( 0.000 0.000 0.000) 0.000 4.202 ( 0.000 0.000 0.000) 0.000 4.396 ( 0.000 0.000 0.000) 0.000 5.092 ( 0.000 0.000 0.000) 0.000 5.548 ( 0.000 0.000 0.000) 0.000 5.655 ( 0.000 0.000 0.000) 0.000 5.757 ( 0.000 0.000 0.000) 0.000 6.031 ( 0.000 0.000 0.000) 0.000 6.227 ( 0.000 0.000 0.000) 0.000 6.719 ( 0.000 0.000 0.000) 0.000 7.289 ( 0.000 0.000 0.000) 0.000 8.954 ( 0.000 0.000 0.000) 0.000 9.140 ( 0.000 0.000 0.000) 0.000 9.520 ( 0.000 0.000 0.000) 0.000 9.544 ( 0.000 0.000 0.000) 0.000 10.867 ( 0.000 0.000 0.000) 0.000 11.839 ( 0.000 0.000 0.000) 0.000 11.974 ( 0.000 0.000 0.000) 0.000 13.638 ( 0.000 0.000 0.000) 0.000 13.811 ( 0.000 0.000 0.000) 0.000 14.219 ( 0.000 0.000 0.000) 0.000 16.387 ( 0.000 0.000 0.000) 0.000 16.862 ( 0.000 0.000 0.000) 0.000 17.272 ( 0.000 0.000 0.000) 0.000 17.971 ( 0.000 0.000 0.000) 0.000 19.074 ( 0.000 0.000 0.000) 0.000 21.534 ( 0.000 0.000 0.000) 0.000 22.661 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/267) ======================= q-point: ( 0.07 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.487 ( 16.456 -21.772 -6.019) 27.947 0.559 ( 8.572 -26.054 8.568) 28.735 1.159 ( 13.038 -54.994 3.893) 56.652 2.553 ( 0.141 -7.143 -0.801) 7.189 2.593 ( 0.889 -1.576 0.753) 1.959 3.742 ( -2.976 3.135 0.555) 4.358 3.837 ( -5.505 -30.380 -4.353) 31.180 3.935 ( 1.844 -2.161 -0.151) 2.845 4.126 ( -8.122 -0.905 2.951) 8.689 4.325 ( 3.650 -8.937 2.895) 10.078 4.627 ( -2.607 -14.164 1.534) 14.483 5.149 ( 4.799 -4.094 -6.139) 8.802 5.498 ( 0.568 2.032 -3.710) 4.268 5.706 ( -8.750 -9.321 -7.125) 14.636 5.903 ( 4.215 -10.080 9.618) 14.556 6.127 ( 5.868 -2.791 1.597) 6.691 6.242 ( 4.488 -0.907 4.193) 6.208 6.736 ( -0.922 -3.316 -1.104) 3.614 7.978 ( -16.276 5.191 2.938) 17.334 8.969 ( -21.439 -9.507 -0.507) 23.457 9.150 ( 0.767 1.957 -0.336) 2.128 9.553 ( 1.638 -2.569 0.056) 3.047 9.748 ( 38.708 1.819 -3.107) 38.875 11.765 ( -6.218 5.836 0.074) 8.527 11.865 ( -3.704 8.157 -0.235) 8.962 13.595 ( 0.046 5.917 -0.368) 5.928 13.768 ( 0.835 3.642 -0.968) 3.860 14.053 ( 0.614 15.043 0.228) 15.057 15.891 (-121.520 -54.108 -20.595) 134.607 16.726 ( 0.190 -14.209 16.577) 21.835 17.079 ( -35.869 -12.260 22.151) 43.904 17.895 ( -6.984 4.268 -6.504) 10.454 19.014 ( 7.150 6.276 -4.545) 10.544 19.930 ( 17.216 -24.082 -149.873) 152.769 22.091 ( 56.925 38.643 81.427) 106.603 22.771 ( 24.479 1.847 13.531) 28.030 ======================= Grid point 2 (3/267) ======================= q-point: ( 0.14 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.008 ( 11.378 -23.977 -4.582) 26.932 1.125 ( 9.750 -26.599 5.634) 28.885 2.198 ( 11.107 -46.246 2.904) 47.649 2.637 ( 0.268 -3.177 2.332) 3.951 2.717 ( 1.778 -8.638 -1.868) 9.014 3.638 ( -4.912 3.958 -0.079) 6.309 3.940 ( -0.666 2.276 -2.139) 3.194 3.966 ( -5.263 -3.696 -1.471) 6.598 4.430 ( 6.757 -13.230 5.116) 15.712 4.724 ( -4.620 -22.253 0.078) 22.728 4.892 ( 2.316 -22.104 -1.289) 22.262 5.242 ( 3.484 -0.807 -1.764) 3.988 5.568 ( 3.681 -10.493 -7.101) 13.194 5.831 ( -14.090 -13.794 -1.040) 19.746 6.164 ( -0.740 0.098 -1.962) 2.099 6.198 ( 5.089 -17.131 1.137) 17.907 6.427 ( 5.728 -12.888 8.600) 16.519 6.902 ( 2.110 -17.071 -1.417) 17.259 7.757 ( -3.538 9.695 1.834) 10.482 8.973 ( -12.832 -4.505 -1.522) 13.684 9.105 ( -7.661 -0.722 0.878) 7.745 9.634 ( 3.945 -4.362 -0.041) 5.882 10.087 ( 24.666 -12.890 -1.018) 27.849 11.524 ( -10.660 12.932 0.147) 16.760 11.662 ( -2.593 10.285 0.032) 10.607 13.384 ( -5.492 13.947 -1.497) 15.064 13.704 ( 1.705 6.513 0.074) 6.733 13.800 ( 5.724 11.668 0.659) 13.013 15.922 ( -64.321 -25.949 -1.431) 69.373 16.870 ( -0.213 4.278 -2.219) 4.824 17.265 ( -21.873 -27.738 6.314) 35.884 17.721 ( -13.991 2.831 -9.105) 16.931 18.991 ( 13.146 4.181 7.354) 15.633 20.181 ( 14.503 -13.471 -53.493) 57.038 22.003 ( 12.944 10.540 25.111) 30.153 22.941 ( 22.626 2.130 8.424) 24.237 ======================= Grid point 3 (4/267) ======================= q-point: ( 0.21 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.481 ( 5.776 -20.629 -1.103) 21.451 1.708 ( 11.253 -26.811 1.545) 29.118 2.712 ( 1.670 -3.499 3.648) 5.323 2.860 ( 3.518 -8.943 -4.050) 10.428 3.034 ( 5.200 -32.867 2.408) 33.363 3.534 ( -6.406 2.582 -0.546) 6.929 3.903 ( -3.093 -0.996 -3.507) 4.781 3.999 ( 0.149 -1.380 2.189) 2.592 4.686 ( 7.687 -8.033 0.498) 11.130 4.967 ( -6.066 -14.052 0.466) 15.312 5.223 ( 4.680 -0.981 2.159) 5.246 5.384 ( 4.836 -19.439 -1.906) 20.122 5.790 ( 3.064 -10.619 -7.290) 13.240 5.965 ( -10.940 -10.371 1.297) 15.130 6.136 ( -0.933 1.472 -1.847) 2.540 6.415 ( -2.620 -4.845 4.305) 6.990 6.995 ( 5.761 -36.521 0.423) 36.975 7.337 ( 14.086 -17.641 -0.332) 22.577 7.662 ( -7.642 -8.937 1.597) 11.867 8.931 ( -1.515 2.184 -1.466) 3.035 9.104 ( -11.318 -6.481 1.322) 13.109 9.801 ( 5.193 -11.178 -0.233) 12.328 10.533 ( 12.291 -18.600 -0.231) 22.296 11.186 ( -8.520 14.388 0.265) 16.723 11.475 ( -4.937 5.447 0.177) 7.353 13.027 ( -8.034 18.633 -1.176) 20.325 13.531 ( -0.168 9.870 1.382) 9.968 13.724 ( 9.239 6.131 -0.008) 11.088 15.916 ( -39.745 -15.390 1.030) 42.634 16.678 ( 0.769 14.254 -4.656) 15.015 17.501 ( -13.721 -2.968 3.953) 14.584 17.696 ( -22.373 -22.950 -10.262) 33.654 19.074 ( 12.801 0.211 12.285) 17.744 20.381 ( 13.296 -6.237 -23.983) 28.123 22.013 ( 2.708 -1.268 9.045) 9.526 23.041 ( 17.490 4.574 3.994) 18.514 ======================= Grid point 4 (5/267) ======================= q-point: ( 0.29 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.843 ( 2.617 -15.434 0.252) 15.656 2.244 ( 9.344 -21.366 0.495) 23.325 2.794 ( 2.644 -2.492 3.955) 5.370 3.034 ( 5.009 -9.461 -3.222) 11.179 3.398 ( -4.022 1.817 -1.226) 4.581 3.591 ( -3.227 -18.537 -1.790) 18.901 3.932 ( -1.413 -5.657 -0.489) 5.852 4.022 ( -0.428 -0.567 2.040) 2.160 4.833 ( 3.878 -3.172 -1.676) 5.283 5.143 ( -1.727 -8.787 -1.408) 9.065 5.350 ( 7.655 -7.537 5.141) 11.909 5.761 ( -0.196 -18.628 -2.022) 18.739 5.945 ( -7.143 -7.767 -1.021) 10.601 6.088 ( -1.088 2.516 -2.380) 3.630 6.124 ( 11.237 -9.217 -2.262) 14.708 6.444 ( -8.898 -2.763 3.627) 9.999 7.369 ( 9.565 0.309 1.861) 9.749 7.744 ( 9.286 -19.199 -1.747) 21.398 8.098 ( -5.033 -32.930 0.300) 33.314 8.934 ( 0.924 -5.445 -0.372) 5.535 9.161 ( -7.511 -6.373 1.066) 9.908 10.113 ( -0.342 -17.037 -0.145) 17.041 10.702 ( -9.302 5.841 -0.053) 10.984 11.033 ( 11.388 -0.006 0.045) 11.388 11.526 ( -5.673 -18.585 0.718) 19.445 12.578 ( -8.838 23.083 -0.466) 24.721 13.379 ( -0.202 6.623 1.271) 6.747 13.671 ( 8.266 6.537 0.070) 10.539 15.928 ( -22.461 -10.793 0.595) 24.927 16.382 ( -0.217 15.878 -3.636) 16.290 17.420 ( -12.030 -0.214 0.295) 12.036 17.939 ( -17.411 -18.740 -4.740) 26.015 19.197 ( 7.667 -2.017 10.549) 13.196 20.503 ( 11.219 -1.658 -11.337) 16.036 22.116 ( 0.036 -6.881 2.999) 7.506 23.049 ( 13.332 7.319 1.901) 15.327 ======================= Grid point 5 (6/267) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.091 ( 0.889 -9.992 0.653) 10.053 2.594 ( 4.230 -11.249 -0.392) 12.024 2.855 ( 4.079 -0.514 5.376) 6.769 3.286 ( -0.060 1.336 -8.658) 8.761 3.289 ( 1.687 -9.640 3.085) 10.261 3.785 ( -0.881 -7.079 -3.892) 8.126 4.023 ( -3.159 -0.785 1.191) 3.466 4.103 ( -1.344 -10.860 2.507) 11.227 4.864 ( 0.738 0.355 -1.115) 1.383 5.308 ( 0.817 -9.432 -0.046) 9.467 5.561 ( 7.727 -7.313 0.945) 10.681 5.967 ( -7.791 -4.966 1.786) 9.410 5.994 ( -2.258 3.213 -5.950) 7.129 6.077 ( -0.609 -10.333 1.306) 10.433 6.379 ( 1.509 -3.721 1.644) 4.339 6.480 ( 6.618 -9.490 -0.167) 11.571 7.399 ( 3.331 0.902 1.579) 3.795 8.027 ( 10.865 -4.888 -1.539) 12.013 8.586 ( -3.418 -22.235 -0.150) 22.496 9.217 ( 3.430 -22.617 0.513) 22.882 9.237 ( -3.336 -7.030 0.386) 7.791 10.166 ( -12.850 6.224 0.376) 14.283 10.523 ( -5.605 6.262 0.037) 8.404 11.275 ( 14.363 -14.989 -0.628) 20.769 11.870 ( -11.815 -6.484 1.335) 13.543 12.127 ( -3.093 6.278 -0.262) 7.003 13.294 ( -0.206 2.628 0.960) 2.805 13.610 ( 6.311 5.686 -0.025) 8.495 15.989 ( -9.438 -8.097 0.146) 12.436 16.105 ( -1.066 12.390 -1.720) 12.555 17.341 ( -9.722 0.196 -0.107) 9.725 18.105 ( -10.801 -11.509 -2.229) 15.941 19.293 ( 3.020 -2.035 6.777) 7.693 20.565 ( 8.181 0.468 -5.304) 9.762 22.261 ( -0.886 -8.135 0.603) 8.206 22.988 ( 10.056 8.489 1.126) 13.208 ======================= Grid point 6 (7/267) ======================= q-point: ( 0.43 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.231 ( 0.119 -4.823 0.534) 4.854 2.749 ( 0.679 -4.643 -2.034) 5.115 2.913 ( 5.567 -0.945 7.649) 9.507 3.152 ( -5.681 4.541 -4.280) 8.438 3.513 ( 3.126 -6.671 -3.282) 8.065 3.906 ( 8.052 -2.483 1.247) 8.518 4.030 ( -6.239 -5.196 -2.075) 8.380 4.243 ( -3.044 -4.898 2.406) 6.249 4.852 ( -0.056 0.622 -0.446) 0.768 5.484 ( 0.851 -8.613 1.100) 8.724 5.716 ( 5.333 -4.058 -2.934) 7.315 5.863 ( -2.127 6.801 -2.532) 7.562 5.976 ( -4.439 -1.173 2.661) 5.307 6.250 ( -0.129 -7.009 -0.285) 7.016 6.390 ( -3.551 -1.350 1.810) 4.208 6.729 ( 8.594 -6.829 -0.489) 10.988 7.400 ( 0.039 0.397 0.707) 0.812 8.151 ( 9.211 -1.981 -0.657) 9.444 8.855 ( -2.156 -8.859 0.142) 9.118 9.376 ( -1.972 -9.434 -0.398) 9.646 9.724 ( 0.484 -23.511 0.374) 23.519 9.964 ( -3.426 0.672 0.634) 3.549 10.334 ( -1.799 9.385 -0.071) 9.556 11.251 ( -8.429 27.257 0.168) 28.531 11.820 ( 5.022 -12.969 -0.378) 13.913 12.348 ( -3.211 -12.770 0.592) 13.181 13.282 ( -0.016 -0.893 0.521) 1.034 13.563 ( 3.516 3.126 -0.103) 4.706 15.917 ( -0.487 6.770 -0.439) 6.802 16.072 ( -2.513 -4.977 -0.052) 5.576 17.275 ( -5.929 0.457 -0.109) 5.947 18.200 ( -4.993 -5.525 -0.790) 7.489 19.346 ( 0.751 -1.114 3.186) 3.458 20.590 ( 4.353 0.761 -2.131) 4.906 22.388 ( -1.292 -6.048 -0.203) 6.188 22.906 ( 6.217 6.590 0.732) 9.089 ======================= Grid point 7 (8/267) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 246 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( 0.000 -0.000 0.000) 0.000 2.788 ( 0.000 -0.000 0.000) 0.000 2.992 ( -0.000 -0.000 -0.000) 0.000 3.044 ( 0.000 -0.000 0.000) 0.000 3.576 ( 0.000 -0.000 0.000) 0.000 3.946 ( -0.000 -0.000 -0.000) 0.000 4.093 ( 0.000 -0.000 0.000) 0.000 4.266 ( -0.000 -0.000 0.000) 0.000 4.845 ( 0.000 -0.000 -0.000) 0.000 5.608 ( 0.000 0.000 0.000) 0.000 5.727 ( -0.000 -0.000 0.000) 0.000 5.792 ( 0.000 -0.000 -0.000) 0.000 5.971 ( 0.000 -0.000 -0.000) 0.000 6.315 ( 0.000 -0.000 0.000) 0.000 6.393 ( -0.000 -0.000 0.000) 0.000 6.823 ( -0.000 -0.000 0.000) 0.000 7.396 ( -0.000 -0.000 0.000) 0.000 8.214 ( -0.000 -0.000 0.000) 0.000 8.917 ( 0.000 -0.000 0.000) 0.000 9.452 ( 0.000 -0.000 0.000) 0.000 9.883 ( 0.000 -0.000 0.000) 0.000 10.031 ( 0.000 0.000 0.000) 0.000 10.423 ( 0.000 -0.000 0.000) 0.000 10.741 ( 0.000 0.000 0.000) 0.000 11.989 ( 0.000 -0.000 0.000) 0.000 12.449 ( -0.000 -0.000 0.000) 0.000 13.298 ( 0.000 -0.000 0.000) 0.000 13.547 ( 0.000 -0.000 -0.000) 0.000 15.852 ( 0.000 -0.000 0.000) 0.000 16.113 ( 0.000 -0.000 0.000) 0.000 17.247 ( 0.000 -0.000 0.000) 0.000 18.232 ( 0.000 -0.000 0.000) 0.000 19.362 ( -0.000 -0.000 -0.000) 0.000 20.596 ( 0.000 -0.000 0.000) 0.000 22.444 ( 0.000 -0.000 0.000) 0.000 22.863 ( -0.000 -0.000 0.000) 0.000 ======================= Grid point 16 (9/267) ======================= q-point: ( 0.07 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.399 ( 23.996 -0.000 9.448) 25.789 0.469 ( 26.155 -0.000 17.090) 31.243 0.725 ( 47.521 -0.000 1.607) 47.548 2.477 ( 0.542 -0.000 -2.264) 2.328 2.591 ( 1.354 -0.000 1.976) 2.396 3.368 ( -9.166 0.000 -0.875) 9.207 3.653 ( 6.986 -0.000 0.710) 7.022 3.779 ( -2.027 0.000 0.676) 2.137 4.196 ( -12.638 0.000 10.827) 16.642 4.215 ( 1.628 -0.000 0.062) 1.629 4.440 ( 3.789 -0.000 11.405) 12.018 5.136 ( 0.883 -0.000 -17.383) 17.405 5.503 ( -9.503 0.000 -11.371) 14.819 5.553 ( 0.632 -0.000 -0.075) 0.637 5.865 ( 2.620 -0.000 16.044) 16.257 6.224 ( 0.455 -0.000 -1.620) 1.682 6.534 ( -2.547 0.000 17.067) 17.256 6.712 ( 0.402 -0.000 -1.113) 1.184 7.288 ( -0.058 0.000 -0.018) 0.061 8.976 ( 2.183 -0.000 1.998) 2.959 9.212 ( 0.799 -0.000 -0.981) 1.265 9.545 ( 2.902 -0.000 0.493) 2.944 10.857 ( -1.294 0.000 -0.118) 1.300 11.204 ( 8.507 -0.000 -28.237) 29.491 11.830 ( -1.826 0.000 0.214) 1.838 12.674 ( -1.350 0.000 -29.719) 29.750 13.658 ( -0.062 0.000 -1.469) 1.470 13.827 ( 4.601 -0.000 -0.378) 4.616 14.221 ( 0.248 -0.000 0.056) 0.254 16.449 ( -30.709 0.000 33.683) 45.580 16.862 ( -0.068 0.000 -0.011) 0.069 17.971 ( 0.016 -0.000 0.008) 0.018 19.084 ( 11.128 -0.000 -34.006) 35.781 19.604 ( 62.023 -0.000 -135.520) 149.038 22.536 ( -15.076 0.000 -2.063) 15.217 23.999 ( -8.901 0.000 42.553) 43.474 ======================= Grid point 17 (10/267) ======================= q-point: ( 0.14 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.777 ( 21.484 -14.921 0.724) 26.167 0.834 ( 21.533 -15.141 8.062) 27.530 1.499 ( 27.277 -40.068 4.866) 48.715 2.552 ( 0.701 -6.926 -2.050) 7.257 2.624 ( 2.433 -2.040 2.100) 3.806 3.602 ( -14.093 -16.145 -4.257) 21.849 3.715 ( -5.638 -0.886 -0.046) 5.708 4.017 ( 6.479 -18.724 1.846) 19.899 4.084 ( -0.861 -2.956 3.058) 4.340 4.338 ( -3.612 -15.795 0.565) 16.213 4.616 ( 1.358 -8.312 5.052) 9.821 5.170 ( 2.523 -7.721 -11.603) 14.163 5.431 ( -7.422 -2.447 -9.367) 12.199 5.589 ( -2.096 -4.123 0.854) 4.703 5.984 ( 1.120 -7.791 9.090) 12.024 6.191 ( 3.234 2.285 -2.095) 4.480 6.409 ( 9.129 2.072 9.359) 13.237 6.715 ( 0.727 -3.979 -2.703) 4.865 7.682 ( -19.336 -16.005 1.988) 25.179 8.844 ( 2.387 7.460 -0.019) 7.833 9.148 ( -0.066 3.869 -1.061) 4.012 9.591 ( 3.051 -2.435 0.565) 3.944 10.274 ( 30.905 11.434 -2.650) 33.058 11.594 ( -14.990 2.080 -0.701) 15.150 11.780 ( -7.946 5.409 0.273) 9.616 13.553 ( -5.826 8.646 -1.851) 10.589 13.772 ( -8.300 -14.032 -5.930) 17.348 14.063 ( -4.094 4.271 -2.985) 6.626 14.163 ( -59.822 -74.934 -10.923) 96.504 16.553 ( -30.292 -26.141 17.889) 43.829 16.881 ( -2.323 -1.501 -0.482) 2.807 17.834 ( -0.026 12.213 -5.458) 13.377 19.111 ( 9.220 -0.631 -12.860) 15.837 19.937 ( 35.949 -14.392 -61.592) 72.753 22.300 ( -13.733 11.015 2.769) 17.821 23.531 ( 30.823 32.748 25.265) 51.583 ======================= Grid point 18 (11/267) ======================= q-point: ( 0.21 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.209 ( 17.240 -16.335 -1.597) 23.804 1.343 ( 16.180 -22.793 3.447) 28.164 2.401 ( 13.111 -37.563 0.859) 39.795 2.669 ( 1.904 -5.280 6.192) 8.357 2.744 ( 3.791 -7.844 -3.433) 9.363 3.537 ( -8.055 3.193 -1.565) 8.805 3.781 ( -9.470 -6.097 -3.614) 11.829 4.053 ( 7.335 2.462 2.936) 8.276 4.500 ( -2.580 -21.198 5.047) 21.943 4.684 ( 1.229 -9.758 -1.868) 10.011 4.930 ( 3.387 -29.809 -0.202) 30.002 5.275 ( 1.553 -0.720 -0.047) 1.713 5.517 ( -7.638 -14.189 -10.606) 19.291 5.709 ( 0.718 -10.654 0.052) 10.679 6.140 ( 0.534 -1.520 -1.891) 2.485 6.284 ( 4.433 -13.445 1.867) 14.279 6.512 ( 0.337 -10.096 6.250) 11.879 6.950 ( 5.023 -20.520 -0.003) 21.126 7.675 ( -7.777 2.266 1.338) 8.210 8.838 ( -0.696 -4.641 -0.927) 4.783 9.067 ( -1.042 4.253 -0.514) 4.409 9.686 ( 3.077 -5.670 0.532) 6.473 10.436 ( 22.301 -4.743 -0.455) 22.805 11.349 ( -12.680 11.196 -0.037) 16.916 11.571 ( -9.643 8.842 0.320) 13.087 13.270 ( -8.680 14.854 -1.930) 17.312 13.716 ( -0.732 9.743 0.131) 9.772 13.921 ( 9.768 7.049 0.690) 12.066 14.906 ( -61.890 -52.702 -7.210) 81.608 16.830 ( -9.368 0.167 -2.280) 9.643 16.943 ( -18.916 -27.798 6.815) 34.307 17.574 ( -3.473 11.485 -4.935) 12.974 19.175 ( 7.925 -0.433 2.032) 8.192 20.295 ( 23.562 -10.636 -28.678) 38.610 22.065 ( -7.308 5.394 3.106) 9.599 23.375 ( 23.694 14.204 9.846) 29.327 ======================= Grid point 19 (12/267) ======================= q-point: ( 0.29 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.602 ( 11.019 -14.808 0.104) 18.458 1.901 ( 14.053 -24.221 -0.409) 28.006 2.737 ( 0.035 -5.597 3.026) 6.363 2.912 ( 5.134 -7.818 -4.304) 10.296 3.127 ( 5.464 -27.385 2.232) 28.014 3.425 ( -7.188 2.564 -1.664) 7.811 3.808 ( -6.060 -4.642 -1.441) 7.769 4.074 ( 6.359 1.877 3.731) 7.608 4.779 ( 4.253 -6.301 -1.650) 7.779 4.886 ( -4.765 -15.816 -0.240) 16.520 5.315 ( 4.556 -3.773 6.019) 8.439 5.422 ( 2.433 -19.079 -3.321) 19.518 5.670 ( -12.683 -12.457 -0.745) 17.793 5.964 ( 7.070 -12.370 -7.599) 16.147 6.137 ( 3.564 0.852 0.852) 3.762 6.395 ( -1.121 -0.002 2.361) 2.614 7.076 ( 2.140 -37.847 1.643) 37.943 7.468 ( -2.679 -29.039 0.916) 29.177 7.604 ( 7.344 -0.759 0.003) 7.383 8.911 ( 0.689 -0.551 -1.322) 1.589 9.015 ( -2.117 -2.668 0.605) 3.459 9.867 ( 3.553 -11.373 0.290) 11.919 10.672 ( 4.260 -4.050 0.249) 5.883 11.107 ( 0.019 3.430 -0.047) 3.430 11.356 ( -11.102 4.770 0.548) 12.096 12.889 ( -9.800 18.586 -1.172) 21.044 13.520 ( -2.301 9.214 1.033) 9.553 13.874 ( 10.480 7.337 0.646) 12.809 15.297 ( -40.188 -33.711 -2.994) 52.541 16.646 ( -2.511 12.641 -4.177) 13.548 17.340 ( -15.701 -21.437 4.426) 26.938 17.388 ( -10.674 -2.330 -3.243) 11.397 19.243 ( 4.986 -0.732 5.641) 7.564 20.536 ( 17.879 -4.033 -13.481) 22.752 22.013 ( -3.989 -3.280 1.037) 5.267 23.318 ( 15.403 10.010 3.888) 18.776 ======================= Grid point 20 (13/267) ======================= q-point: ( 0.36 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.910 ( 6.292 -11.489 0.451) 13.107 2.380 ( 9.016 -17.122 -1.452) 19.405 2.841 ( 1.208 -4.258 4.311) 6.179 3.115 ( 6.904 -10.915 -2.545) 13.164 3.321 ( -4.351 3.478 -2.820) 6.244 3.540 ( -1.877 -16.413 -4.124) 17.027 3.886 ( -3.716 -7.790 3.301) 9.241 4.091 ( 6.307 2.041 3.962) 7.723 4.857 ( 0.423 -1.402 -3.026) 3.362 5.109 ( -1.661 -11.804 -2.165) 12.115 5.499 ( 8.432 -7.380 7.048) 13.238 5.701 ( -7.217 -14.322 -2.038) 16.167 5.817 ( -7.438 -11.756 -0.353) 13.916 6.050 ( -1.555 0.691 -4.135) 4.471 6.352 ( 17.018 -12.113 -0.783) 20.903 6.376 ( -0.608 1.005 2.176) 2.473 7.386 ( -9.518 -2.968 1.482) 10.079 7.880 ( 10.777 -20.511 -0.696) 23.181 8.105 ( 6.397 -29.203 -0.185) 29.897 8.947 ( 0.844 -7.618 -0.069) 7.664 9.100 ( -0.842 -5.727 0.352) 5.799 10.085 ( -4.242 -7.140 0.338) 8.312 10.559 ( -8.844 5.461 -0.206) 10.397 11.211 ( 8.849 -2.096 -0.017) 9.094 11.429 ( -4.549 -22.140 1.142) 22.632 12.437 ( -9.741 22.020 -0.619) 24.086 13.363 ( -2.913 5.855 1.180) 6.645 13.800 ( 8.665 8.265 0.417) 11.982 15.592 ( -21.462 -23.745 -1.230) 32.030 16.358 ( -1.057 15.128 -2.478) 15.366 17.275 ( -7.933 1.124 -0.419) 8.023 17.696 ( -14.898 -22.217 0.915) 26.766 19.297 ( 1.942 -1.204 4.735) 5.258 20.655 ( 14.028 1.065 -6.264) 15.400 22.103 ( -2.028 -7.844 -0.013) 8.102 23.235 ( 9.929 9.769 1.767) 14.041 ======================= Grid point 21 (14/267) ======================= q-point: ( 0.43 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.120 ( 2.847 -7.682 0.456) 8.205 2.639 ( 2.588 -7.760 -3.035) 8.725 2.929 ( 2.486 -2.848 5.390) 6.584 3.194 ( -5.535 4.313 0.278) 7.023 3.392 ( 8.401 -9.601 -5.456) 13.875 3.773 ( 2.022 -12.889 -5.359) 14.105 3.992 ( -2.139 -2.561 5.264) 6.233 4.140 ( 4.230 -3.032 3.852) 6.475 4.852 ( -1.370 0.150 -2.144) 2.549 5.306 ( -0.437 -10.796 -1.405) 10.896 5.670 ( 4.953 -4.441 0.408) 6.665 5.866 ( -6.794 -8.974 5.780) 12.653 5.905 ( -5.156 -0.623 -8.180) 9.689 6.078 ( -0.287 -7.164 2.652) 7.645 6.363 ( -0.138 -0.295 1.173) 1.217 6.683 ( 15.801 -8.588 -0.590) 17.994 7.353 ( -9.463 -2.030 0.109) 9.679 8.145 ( 4.535 -4.143 -0.343) 6.153 8.623 ( 8.608 -19.723 -0.059) 21.520 9.196 ( -0.834 -9.042 0.001) 9.081 9.288 ( 4.438 -21.761 0.345) 22.211 9.986 ( -11.400 5.831 0.538) 12.816 10.453 ( -3.688 4.406 -0.098) 5.747 11.456 ( 9.078 -14.020 -0.573) 16.712 11.676 ( -13.928 3.956 0.934) 14.509 12.100 ( 0.069 -3.682 0.095) 3.684 13.272 ( -3.442 1.647 1.044) 3.956 13.707 ( 6.535 7.680 0.046) 10.084 15.847 ( -8.954 -15.367 -0.421) 17.791 16.098 ( 0.949 11.596 -0.831) 11.664 17.210 ( -8.181 -0.711 -0.189) 8.214 17.955 ( -9.218 -15.400 0.472) 17.954 19.336 ( 0.307 -1.222 2.617) 2.905 20.687 ( 10.352 3.797 -2.660) 11.343 22.245 ( -1.097 -8.203 -0.271) 8.280 23.114 ( 5.979 9.942 0.936) 11.640 ======================= Grid point 22 (15/267) ======================= q-point: ( 0.50 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.240 ( 0.788 -3.853 0.167) 3.936 2.733 ( -1.378 -3.696 -4.502) 5.985 3.017 ( 4.037 -2.936 6.413) 8.127 3.064 ( -3.616 5.663 -1.898) 6.982 3.546 ( 3.356 -4.064 -2.568) 5.863 3.945 ( -4.297 -0.701 1.622) 4.647 4.076 ( 13.345 -6.951 -1.270) 15.100 4.226 ( -0.768 -2.605 3.501) 4.431 4.837 ( -1.384 -0.199 -1.595) 2.121 5.493 ( -0.073 -9.618 0.908) 9.661 5.732 ( -1.792 -0.985 -5.584) 5.947 5.816 ( -3.272 3.284 -0.048) 4.636 5.960 ( 1.138 -2.516 3.456) 4.424 6.217 ( -3.907 -7.084 2.629) 8.507 6.394 ( 2.992 -1.544 -0.821) 3.465 6.858 ( 8.480 -0.520 -0.160) 8.497 7.334 ( -8.343 -3.090 -0.761) 8.929 8.186 ( -4.376 -0.668 0.219) 4.432 8.914 ( 8.906 -5.028 0.001) 10.227 9.368 ( 1.645 -8.998 -0.221) 9.150 9.682 ( -5.077 -14.496 0.414) 15.365 9.982 ( 4.067 -11.842 0.289) 12.525 10.332 ( 2.074 3.468 -0.146) 4.044 11.122 ( -8.993 30.075 -0.181) 31.392 11.838 ( -2.881 -14.910 -0.099) 15.186 12.349 ( 3.711 -11.531 0.429) 12.121 13.253 ( -4.136 -1.985 0.825) 4.662 13.622 ( 4.299 5.608 -0.228) 7.070 15.898 ( -2.179 4.035 -0.052) 4.585 16.060 ( 1.383 -5.067 -0.260) 5.258 17.193 ( -5.337 -3.172 0.177) 6.211 18.133 ( -4.062 -9.171 0.388) 10.038 19.357 ( -0.161 -0.595 0.287) 0.680 20.666 ( 6.447 4.595 -0.539) 7.935 22.373 ( -0.690 -6.195 -0.073) 6.234 22.968 ( 1.884 8.892 0.327) 9.095 ======================= Grid point 23 (16/267) ======================= q-point: (-0.43 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( -0.005 0.205 -0.538) 0.576 2.758 ( -3.165 -2.231 -3.946) 5.529 2.926 ( -3.005 6.070 -2.513) 7.224 3.127 ( 4.869 -3.900 5.232) 8.141 3.594 ( 2.229 1.468 1.240) 2.943 3.886 ( -4.604 2.216 0.471) 5.131 4.190 ( 5.565 5.011 5.074) 9.046 4.289 ( 6.338 -3.149 -4.063) 8.161 4.835 ( -0.975 -0.811 -1.161) 1.720 5.588 ( -3.003 2.943 -0.436) 4.227 5.724 ( -0.474 -4.590 -0.139) 4.616 5.763 ( -2.981 0.224 1.171) 3.211 6.006 ( 4.003 -0.407 -0.055) 4.024 6.271 ( -5.529 -1.735 2.846) 6.456 6.443 ( 6.171 -0.163 -2.128) 6.529 6.832 ( 0.905 6.880 -0.020) 6.939 7.337 ( -7.015 -3.290 -1.230) 7.845 8.098 ( -14.242 2.123 0.713) 14.417 9.002 ( 10.365 2.130 -0.246) 10.585 9.499 ( 5.392 -1.170 0.538) 5.543 9.873 ( -1.136 -6.458 -0.353) 6.567 10.042 ( 1.412 0.701 0.187) 1.587 10.376 ( -5.044 18.755 -0.542) 19.429 10.817 ( 9.052 -20.958 -0.295) 22.831 11.925 ( -7.815 1.850 0.357) 8.038 12.497 ( 5.701 -0.145 -0.183) 5.706 13.261 ( -4.784 -1.668 0.501) 5.091 13.562 ( 1.811 3.337 -0.286) 3.808 15.853 ( 0.052 -0.594 0.098) 0.604 16.120 ( 0.942 -0.434 -0.120) 1.044 17.252 ( 0.518 -4.846 0.343) 4.885 18.239 ( 0.689 -3.640 0.835) 3.798 19.353 ( -0.566 0.700 -2.283) 2.454 20.618 ( 2.425 4.046 1.203) 4.868 22.450 ( 0.719 -1.465 0.274) 1.655 22.832 ( -3.921 4.174 -0.399) 5.741 ======================= Grid point 24 (17/267) ======================= q-point: (-0.36 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.227 ( -0.253 4.960 -1.289) 5.131 2.740 ( -1.266 4.843 0.765) 5.064 2.797 ( -5.435 1.091 -6.101) 8.243 3.251 ( 4.871 -4.402 3.913) 7.643 3.485 ( -2.097 11.209 2.554) 11.686 3.838 ( -1.123 0.290 -0.319) 1.202 4.122 ( 3.093 5.823 5.174) 8.382 4.304 ( 7.590 6.574 -3.916) 10.778 4.844 ( -0.918 -1.051 -0.582) 1.512 5.447 ( -3.628 7.549 -2.066) 8.626 5.645 ( -5.116 6.205 3.021) 8.591 5.897 ( 1.291 -7.840 1.723) 8.130 6.040 ( 5.175 0.086 -2.153) 5.605 6.216 ( -5.340 3.923 3.588) 7.535 6.479 ( 8.955 2.508 -3.088) 9.799 6.625 ( -5.282 12.302 0.203) 13.389 7.329 ( -8.215 -1.672 -1.710) 8.556 7.966 ( -14.403 -0.241 1.452) 14.478 8.964 ( 11.022 12.206 -0.082) 16.446 9.413 ( 2.519 10.190 0.174) 10.499 9.674 ( -4.817 28.882 -0.544) 29.285 10.061 ( 8.469 -12.483 -0.450) 15.091 10.370 ( 2.712 -12.480 -0.034) 12.771 11.357 ( 5.639 -14.492 -0.347) 15.554 11.730 ( -6.180 2.675 0.398) 6.745 12.408 ( 4.509 14.406 -0.426) 15.102 13.251 ( -3.634 -1.232 -0.148) 3.840 13.526 ( -1.478 0.374 -0.087) 1.527 15.924 ( 0.331 -6.806 0.429) 6.827 16.116 ( 2.853 1.438 0.040) 3.195 17.365 ( 5.909 -4.284 0.145) 7.300 18.287 ( 5.787 1.248 2.385) 6.383 19.305 ( -2.255 2.741 -5.460) 6.512 20.562 ( -1.190 3.010 3.255) 4.590 22.410 ( 1.636 6.723 -0.416) 6.932 22.787 ( -9.016 -4.616 -0.475) 10.140 ======================= Grid point 25 (18/267) ======================= q-point: (-0.29 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.079 ( -0.458 10.565 -1.399) 10.668 2.531 ( -3.715 14.894 -0.449) 15.357 2.774 ( -3.857 -0.921 -3.279) 5.145 3.218 ( -3.922 13.330 3.416) 14.308 3.373 ( 4.682 -3.927 0.391) 6.124 3.831 ( 3.486 3.008 1.338) 4.795 4.035 ( -1.673 7.070 3.372) 8.009 4.166 ( 7.321 10.877 -2.624) 13.371 4.847 ( -1.734 0.313 0.296) 1.786 5.271 ( -3.860 7.329 -1.877) 8.494 5.466 ( -4.517 9.448 0.843) 10.506 6.026 ( 0.998 -4.589 0.240) 4.702 6.054 ( 3.011 5.597 -0.874) 6.416 6.085 ( 0.659 5.939 4.406) 7.424 6.237 ( -10.082 15.410 0.318) 18.418 6.573 ( 12.901 1.374 -2.854) 13.284 7.259 ( -13.361 -0.008 -1.633) 13.460 7.882 ( -8.897 2.707 1.846) 9.481 8.680 ( 7.349 25.183 0.297) 26.235 9.158 ( -3.522 20.442 -0.410) 20.748 9.308 ( 5.479 4.827 -0.852) 7.351 10.354 ( 12.946 -4.122 -0.029) 13.586 10.607 ( 5.500 -9.619 -0.267) 11.084 11.059 ( -15.040 18.951 0.472) 24.199 11.994 ( 5.502 18.398 -0.921) 19.225 12.183 ( 4.183 -19.485 0.268) 19.931 13.275 ( -1.917 -3.901 -0.727) 4.407 13.532 ( -4.113 -3.079 0.084) 5.138 16.085 ( 3.387 -6.637 -1.119) 7.535 16.154 ( 4.365 -5.266 2.260) 7.204 17.487 ( 9.567 -2.763 -0.420) 9.967 18.293 ( 12.212 6.188 5.985) 14.942 19.184 ( -6.789 5.220 -9.701) 12.940 20.503 ( -3.776 2.556 6.300) 7.777 22.255 ( -1.055 9.212 -2.427) 9.585 22.834 ( -9.469 -6.828 -0.132) 11.675 ======================= Grid point 26 (19/267) ======================= q-point: (-0.21 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.819 ( -0.782 16.984 -0.798) 17.021 2.126 ( -5.709 24.689 -0.261) 25.342 2.739 ( -2.521 1.647 -2.115) 3.680 3.000 ( -1.576 8.731 1.918) 9.077 3.439 ( 1.180 4.024 0.630) 4.240 3.647 ( 3.707 17.903 -0.634) 18.294 3.914 ( -2.332 1.124 0.980) 2.768 4.081 ( 5.016 4.465 0.533) 6.737 4.775 ( -3.981 5.937 0.520) 7.167 5.155 ( -1.020 2.466 -0.425) 2.702 5.254 ( -2.503 9.784 -1.413) 10.197 5.737 ( -3.653 21.974 0.812) 22.291 5.935 ( -4.171 7.759 1.086) 8.876 6.107 ( 0.570 -1.033 0.872) 1.467 6.131 ( 5.091 -0.722 2.872) 5.890 6.590 ( 12.653 8.285 -4.416) 15.755 7.170 ( -14.722 -3.313 -0.135) 15.091 7.627 ( -6.615 22.093 1.239) 23.096 8.182 ( 4.752 31.476 -0.324) 31.834 8.925 ( -0.449 3.685 0.343) 3.728 9.285 ( 8.545 3.554 -1.183) 9.330 10.114 ( 0.005 26.294 0.352) 26.297 10.762 ( -2.850 5.901 0.430) 6.567 10.950 ( 1.737 -14.954 -0.457) 15.062 11.572 ( 1.232 17.142 -0.251) 17.188 12.690 ( 5.720 -23.962 0.308) 24.637 13.364 ( -1.155 -7.207 -1.052) 7.375 13.571 ( -4.961 -4.553 0.230) 6.738 16.198 ( 14.486 -1.357 -2.983) 14.852 16.389 ( -1.898 -15.381 4.227) 16.064 17.603 ( 11.606 -1.456 -1.699) 11.820 18.256 ( 20.597 13.815 12.511) 27.778 18.973 ( -15.069 5.204 -14.825) 21.770 20.437 ( -4.790 3.324 10.966) 12.420 22.062 ( -4.186 8.349 -5.580) 10.880 22.873 ( -8.563 -4.144 -0.264) 9.517 ======================= Grid point 27 (20/267) ======================= q-point: (-0.14 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.435 ( -1.419 23.890 0.487) 23.937 1.581 ( -4.573 28.774 -0.801) 29.146 2.668 ( -1.727 4.518 -1.528) 5.073 2.852 ( -0.056 8.434 2.113) 8.695 2.964 ( -2.561 35.757 -1.557) 35.882 3.605 ( 2.659 -2.544 -0.050) 3.680 3.901 ( -1.341 -0.373 0.332) 1.431 4.053 ( 3.610 1.874 0.985) 4.185 4.586 ( -4.164 10.462 -0.707) 11.283 5.048 ( 4.356 10.636 -0.446) 11.502 5.167 ( -2.111 0.475 -0.244) 2.177 5.312 ( -4.340 19.365 0.885) 19.865 5.759 ( -1.902 9.850 2.014) 10.232 6.114 ( 4.181 2.092 -0.847) 4.751 6.189 ( 5.650 0.634 4.818) 7.453 6.405 ( -1.038 14.419 -5.667) 15.527 6.941 ( -1.397 39.456 0.528) 39.484 7.161 ( -8.088 6.136 0.382) 10.160 7.729 ( 2.233 13.982 -0.738) 14.179 8.949 ( 0.353 -4.319 0.532) 4.366 9.294 ( 11.241 3.057 -1.069) 11.698 9.724 ( -4.763 12.415 0.572) 13.310 10.376 ( -7.096 26.603 0.212) 27.534 11.299 ( 5.292 -17.368 -0.180) 18.157 11.505 ( 0.052 -5.699 0.018) 5.700 13.122 ( 3.646 -18.894 0.609) 19.252 13.520 ( -0.559 -10.728 -1.096) 10.799 13.623 ( -3.865 -4.521 0.446) 5.965 16.339 ( 16.624 -1.525 -2.915) 16.947 16.668 ( -2.410 -14.994 3.132) 15.506 17.679 ( 9.567 3.261 -3.733) 10.775 18.096 ( 20.857 23.164 13.910) 34.134 18.784 ( -15.962 -3.143 -12.273) 20.379 20.359 ( -3.443 5.050 16.129) 17.248 21.863 ( -7.600 6.855 -9.905) 14.243 22.850 ( -6.042 0.643 -0.579) 6.104 ======================= Grid point 28 (21/267) ======================= q-point: (-0.07 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.932 ( 0.000 28.510 0.000) 28.510 1.037 ( 0.000 28.106 0.000) 28.106 2.102 ( 0.000 49.290 0.000) 49.290 2.631 ( 0.000 3.386 0.000) 3.386 2.708 ( 0.000 8.602 0.000) 8.602 3.675 ( -0.000 -3.893 -0.000) 3.893 3.907 ( -0.000 -1.015 -0.000) 1.015 4.078 ( -0.000 -2.540 -0.000) 2.540 4.341 ( 0.000 14.754 0.000) 14.754 4.766 ( 0.000 33.062 0.000) 33.062 4.877 ( 0.000 11.353 0.000) 11.353 5.212 ( 0.000 1.576 0.000) 1.576 5.552 ( 0.000 9.555 0.000) 9.555 6.012 ( 0.000 19.536 0.000) 19.536 6.068 ( 0.000 7.800 0.000) 7.800 6.223 ( 0.000 0.425 0.000) 0.425 6.334 ( 0.000 20.251 0.000) 20.251 6.892 ( 0.000 14.296 0.000) 14.296 7.774 ( -0.000 -12.292 -0.000) 12.292 9.044 ( -0.000 -4.895 -0.000) 4.895 9.296 ( 0.000 4.613 0.000) 4.613 9.567 ( 0.000 3.161 0.000) 3.161 9.850 ( 0.000 23.321 0.000) 23.321 11.635 ( -0.000 -15.920 -0.000) 15.920 11.651 ( -0.000 -8.632 -0.000) 8.632 13.430 ( -0.000 -12.671 -0.000) 12.671 13.687 ( -0.000 -4.248 -0.000) 4.248 13.756 ( -0.000 -15.056 -0.000) 15.056 16.441 ( -0.000 -1.017 -0.000) 1.017 16.879 ( -0.000 -5.282 -0.000) 5.282 17.432 ( 0.000 23.988 0.000) 23.988 17.945 ( 0.000 2.468 0.000) 2.468 18.831 ( -0.000 -8.471 -0.000) 8.471 20.270 ( 0.000 6.101 0.000) 6.101 21.671 ( 0.000 6.915 0.000) 6.915 22.775 ( 0.000 4.146 0.000) 4.146 ======================= Grid point 31 (22/267) ======================= q-point: ( 0.14 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.781 ( 22.403 -0.000 8.643) 24.013 0.907 ( 23.997 -0.000 14.122) 27.844 1.387 ( 42.182 -0.000 -2.188) 42.239 2.475 ( 1.171 -0.000 -4.073) 4.238 2.634 ( 2.731 -0.000 3.739) 4.630 3.226 ( -9.421 0.000 -0.703) 9.447 3.704 ( -2.345 0.000 0.916) 2.517 3.785 ( 4.269 -0.000 0.541) 4.303 4.002 ( -15.846 0.000 0.355) 15.850 4.248 ( 2.638 -0.000 0.300) 2.655 4.591 ( 8.151 -0.000 9.704) 12.673 5.044 ( -2.692 0.000 -12.569) 12.854 5.336 ( -8.306 0.000 -3.883) 9.169 5.566 ( 1.156 -0.000 -0.140) 1.164 5.943 ( 1.006 -0.000 8.362) 8.422 6.227 ( 0.792 -0.000 -2.935) 3.041 6.535 ( -3.183 0.000 2.248) 3.897 6.769 ( 7.555 -0.000 2.222) 7.875 7.287 ( -0.119 0.000 -0.034) 0.124 9.032 ( 4.020 -0.000 2.439) 4.702 9.223 ( 1.137 -0.000 -0.833) 1.409 9.595 ( 3.103 -0.000 0.492) 3.141 10.829 ( -2.334 0.000 -0.204) 2.343 11.214 ( 4.055 -0.000 -8.455) 9.377 11.760 ( -9.102 0.000 0.507) 9.116 12.515 ( -4.669 0.000 -15.836) 16.510 13.582 ( -7.851 0.000 -2.535) 8.250 13.957 ( 11.448 -0.000 -0.073) 11.448 14.227 ( 0.438 -0.000 0.094) 0.448 16.066 ( -35.287 0.000 17.769) 39.509 16.860 ( -0.121 0.000 -0.016) 0.123 17.972 ( 0.028 -0.000 0.013) 0.031 19.094 ( 9.992 -0.000 -31.900) 33.428 19.988 ( 36.794 -0.000 -28.845) 46.752 22.254 ( -18.861 0.000 -6.847) 20.065 24.047 ( -1.142 0.000 10.448) 10.510 ======================= Grid point 32 (23/267) ======================= q-point: ( 0.21 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.101 ( 19.993 -12.016 7.228) 24.421 1.194 ( 23.073 -9.531 2.870) 25.128 1.921 ( 27.073 -25.720 -0.394) 37.345 2.557 ( 1.590 -7.415 -3.057) 8.177 2.683 ( 3.721 -2.376 3.700) 5.761 3.393 ( -11.489 -15.888 -3.269) 19.877 3.627 ( -6.915 2.260 1.103) 7.358 4.019 ( -6.568 -19.041 0.723) 20.155 4.153 ( 6.406 -12.794 2.611) 14.545 4.275 ( -2.594 -15.056 -0.569) 15.288 4.686 ( 2.845 -3.868 1.330) 4.983 5.150 ( 1.805 -13.095 -3.929) 13.790 5.279 ( -7.606 -0.770 -2.239) 7.966 5.602 ( 2.442 -3.270 -1.064) 4.217 6.030 ( 2.040 -7.282 2.689) 8.026 6.211 ( 0.749 0.684 -3.211) 3.368 6.488 ( -0.845 1.812 2.901) 3.523 6.798 ( 10.447 -1.912 1.935) 10.796 7.488 ( -8.221 -13.209 0.203) 15.560 8.949 ( 9.704 10.376 1.490) 14.285 9.139 ( -0.526 4.636 -1.405) 4.873 9.635 ( 2.189 -2.215 0.457) 3.147 10.633 ( 19.948 6.990 -0.538) 21.144 11.369 ( -14.453 -0.028 -0.768) 14.473 11.622 ( -14.019 5.375 0.374) 15.019 13.197 ( -31.402 -64.589 -12.848) 72.958 13.427 ( -9.174 8.969 -2.795) 13.131 13.971 ( 3.769 6.987 -1.055) 8.009 14.132 ( 5.680 6.589 1.711) 8.866 16.139 ( -33.619 -28.066 12.657) 45.586 16.867 ( -0.244 -0.551 -0.491) 0.777 17.821 ( 0.480 14.057 -2.762) 14.333 19.158 ( 6.276 -4.769 -16.546) 18.327 20.260 ( 26.760 -7.283 -12.677) 30.494 22.067 ( -14.215 3.577 -6.829) 16.171 23.857 ( 8.902 17.633 6.082) 20.668 ======================= Grid point 33 (24/267) ======================= q-point: ( 0.29 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.476 ( 17.662 -11.583 3.943) 21.487 1.610 ( 19.684 -18.376 -2.451) 27.040 2.538 ( 6.597 -21.110 -3.790) 22.439 2.727 ( 1.836 -11.655 2.830) 12.133 2.825 ( 7.651 -9.349 1.507) 12.174 3.410 ( -7.021 1.246 -1.984) 7.402 3.650 ( -7.315 -7.078 -0.524) 10.192 4.177 ( 7.323 2.247 2.882) 8.184 4.429 ( -7.578 -25.050 3.763) 26.440 4.683 ( -1.912 -10.913 -4.792) 12.071 4.991 ( 4.427 -28.868 0.520) 29.210 5.252 ( -7.516 -3.361 0.345) 8.240 5.406 ( 0.256 -10.247 2.620) 10.580 5.760 ( 6.199 -11.787 -7.042) 15.065 6.180 ( 6.225 -0.303 -0.718) 6.274 6.341 ( 2.136 -17.166 0.295) 17.301 6.491 ( -4.267 -8.454 1.766) 9.633 7.047 ( 7.310 -16.831 2.248) 18.487 7.590 ( -2.765 -4.536 0.051) 5.313 8.920 ( 9.610 1.346 -0.075) 9.704 9.051 ( -0.490 4.286 -0.634) 4.360 9.723 ( 1.367 -6.354 0.500) 6.519 10.731 ( 17.308 1.727 0.513) 17.402 11.156 ( -13.699 6.600 -0.261) 15.208 11.403 ( -11.946 7.106 0.371) 13.905 13.122 ( -10.169 14.823 -1.391) 18.030 13.654 ( -9.799 3.701 -0.534) 10.488 14.062 ( 5.173 -4.193 -1.681) 6.868 14.186 ( -26.382 -37.447 -4.456) 46.024 16.503 ( -27.179 -28.365 5.625) 39.685 16.873 ( -1.259 -2.351 0.252) 2.679 17.534 ( -0.618 14.555 -2.182) 14.731 19.242 ( 2.419 -2.913 -4.119) 5.594 20.546 ( 18.967 -7.029 -6.413) 21.220 21.937 ( -7.383 -0.179 -4.536) 8.667 23.650 ( 10.418 13.732 2.911) 17.480 ======================= Grid point 34 (25/267) ======================= q-point: ( 0.36 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.791 ( 13.293 -9.324 2.246) 16.392 2.106 ( 15.028 -20.362 -3.646) 25.568 2.750 ( 0.412 -6.669 2.308) 7.069 2.958 ( 3.933 -10.507 -4.676) 12.155 3.171 ( -1.860 -18.030 -0.157) 18.126 3.349 ( -0.802 0.424 -0.589) 1.081 3.735 ( -3.975 -7.008 2.037) 8.311 4.196 ( 7.517 2.317 4.258) 8.945 4.774 ( -3.220 -10.210 -1.584) 10.822 4.831 ( -2.333 -13.477 -3.542) 14.129 5.331 ( -6.652 -12.103 3.574) 14.266 5.469 ( 2.295 -18.540 -1.550) 18.746 5.534 ( -2.088 -5.095 5.522) 7.798 5.974 ( 0.725 -6.948 -8.923) 11.332 6.296 ( 14.379 -6.026 1.433) 15.656 6.419 ( 4.002 1.137 1.205) 4.331 6.987 ( -14.336 -30.661 0.914) 33.859 7.482 ( 7.569 -25.448 0.383) 26.552 7.764 ( 11.368 -14.695 0.174) 18.580 8.915 ( -0.934 2.554 -0.699) 2.808 9.048 ( 6.534 -1.571 0.215) 6.724 9.897 ( -0.081 -10.705 0.438) 10.714 10.635 ( -8.168 10.243 -0.078) 13.101 11.100 ( -12.451 -4.739 1.086) 13.366 11.286 ( 12.126 -1.263 0.005) 12.191 12.737 ( -10.067 18.577 -0.988) 21.153 13.462 ( -6.676 7.773 0.833) 10.280 14.024 ( 9.185 8.332 0.976) 12.439 14.786 ( -26.018 -42.366 -4.022) 49.880 16.567 ( -6.296 6.439 -2.063) 9.239 17.108 ( -15.106 -26.218 4.289) 30.561 17.309 ( -3.011 7.595 -0.320) 8.177 19.285 ( -0.181 -1.688 -0.133) 1.703 20.749 ( 15.227 -2.293 -3.693) 15.835 21.950 ( -3.309 -5.907 -2.143) 7.102 23.495 ( 7.166 11.011 1.211) 13.193 ======================= Grid point 35 (26/267) ======================= q-point: ( 0.43 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.022 ( 7.879 -6.893 1.438) 10.567 2.486 ( 6.996 -11.701 -4.482) 14.351 2.871 ( 0.719 -5.327 3.763) 6.561 3.165 ( -1.925 -6.362 3.478) 7.502 3.297 ( 6.383 -5.129 -8.971) 12.147 3.503 ( -0.738 -14.057 -3.536) 14.514 3.866 ( -1.732 -8.036 5.327) 9.795 4.220 ( 8.143 2.357 5.377) 10.039 4.822 ( -2.863 -1.452 -3.382) 4.663 5.072 ( -1.976 -13.297 -3.148) 13.807 5.553 ( -11.305 -13.469 0.666) 17.597 5.643 ( 4.082 -7.378 7.787) 11.478 5.737 ( -0.544 -10.320 -3.125) 10.796 6.023 ( 0.269 -2.034 -3.071) 3.694 6.383 ( 2.155 1.168 0.635) 2.533 6.632 ( 18.207 -10.212 0.547) 20.883 7.165 ( -18.027 -8.358 -0.587) 19.879 8.037 ( 9.126 -14.982 0.528) 17.550 8.243 ( 11.341 -27.930 -0.206) 30.145 8.960 ( 1.325 -10.425 0.358) 10.515 9.134 ( 4.738 -3.472 -0.124) 5.875 9.982 ( -9.651 1.202 0.507) 9.739 10.458 ( -4.716 1.014 -0.597) 4.860 11.122 ( -15.867 -14.072 1.058) 21.235 11.574 ( 18.717 -10.911 0.321) 21.668 12.296 ( -8.784 20.189 -0.754) 22.031 13.298 ( -6.837 4.649 1.088) 8.339 13.920 ( 7.221 9.402 0.499) 11.865 15.326 ( -13.326 -32.147 -1.407) 34.828 16.339 ( -0.076 13.098 -1.098) 13.144 17.166 ( -7.623 2.686 -0.204) 8.085 17.508 ( -11.563 -24.235 2.637) 26.982 19.311 ( -1.004 -1.731 0.284) 2.021 20.838 ( 12.641 2.891 -1.965) 13.116 22.074 ( -1.330 -8.959 -0.759) 9.089 23.343 ( 4.034 10.387 0.579) 11.157 ======================= Grid point 36 (27/267) ======================= q-point: ( 0.50 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.171 ( 3.186 -4.682 0.994) 5.749 2.637 ( -0.102 -4.535 -5.924) 7.461 2.976 ( 1.460 -4.447 3.772) 6.011 3.143 ( -2.305 3.652 2.997) 5.257 3.473 ( 5.716 -6.249 -4.804) 9.737 3.796 ( 4.250 -14.920 -5.024) 16.307 4.000 ( -0.107 -6.359 4.407) 7.738 4.261 ( 8.829 1.200 6.277) 10.899 4.809 ( -2.915 -0.675 -2.547) 3.929 5.288 ( -0.875 -12.039 -1.772) 12.200 5.632 ( -8.539 -5.493 -1.993) 10.347 5.795 ( -5.049 -3.186 -4.453) 7.448 5.889 ( 3.876 -7.436 9.360) 12.567 6.092 ( 1.672 -4.643 -0.746) 4.991 6.393 ( 3.510 -0.508 -0.324) 3.561 6.891 ( 11.154 -4.525 0.515) 12.048 7.168 ( -12.985 -5.804 -1.747) 14.330 8.151 ( -3.384 0.124 0.324) 3.401 8.794 ( 12.923 -18.373 0.368) 22.466 9.210 ( 2.555 -8.821 -0.223) 9.186 9.341 ( 2.059 -17.855 0.397) 17.977 9.860 ( -5.202 -1.117 0.372) 5.334 10.419 ( -0.779 3.034 -0.066) 3.133 11.381 ( -16.716 -18.056 0.391) 24.609 11.613 ( 2.606 16.941 -0.599) 17.151 12.154 ( 7.707 -11.171 0.228) 13.573 13.201 ( -6.878 0.607 1.054) 6.984 13.795 ( 5.356 8.920 0.055) 10.405 15.737 ( -5.727 -18.458 -0.079) 19.326 16.132 ( 4.306 9.324 -0.332) 10.275 17.089 ( -8.743 -1.482 -0.003) 8.868 17.838 ( -7.163 -18.355 1.287) 19.745 19.336 ( -0.712 -1.517 -0.346) 1.711 20.831 ( 9.711 6.109 -0.636) 11.490 22.232 ( -0.494 -8.435 -0.113) 8.450 23.170 ( 1.491 10.732 0.248) 10.838 ======================= Grid point 37 (28/267) ======================= q-point: ( 0.57 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.251 ( 0.351 -2.472 0.342) 2.520 2.667 ( -3.887 -2.637 -6.189) 7.770 3.028 ( -0.062 4.872 -0.436) 4.892 3.097 ( 2.504 -2.907 5.555) 6.751 3.592 ( 4.097 -3.949 -1.638) 5.921 3.917 ( -0.692 1.586 2.005) 2.648 4.183 ( 1.698 -8.762 -1.650) 9.076 4.330 ( 12.359 0.484 4.159) 13.049 4.802 ( -2.009 -1.178 -2.119) 3.149 5.493 ( -1.099 -10.024 2.438) 10.374 5.633 ( -6.644 -2.286 -6.952) 9.884 5.772 ( -2.887 0.904 1.508) 3.380 6.021 ( 3.482 -2.099 5.224) 6.619 6.175 ( -2.550 -4.194 -0.102) 4.910 6.456 ( 5.903 -2.346 -1.012) 6.432 6.955 ( 3.711 2.982 0.075) 4.762 7.187 ( -8.990 -5.067 -1.878) 10.489 8.051 ( -12.767 3.981 0.665) 13.390 9.072 ( 11.445 -3.861 0.064) 12.079 9.417 ( 4.182 -10.292 0.166) 11.110 9.612 ( -4.313 -14.913 0.219) 15.526 10.043 ( 3.483 -8.436 0.178) 9.129 10.405 ( 7.798 -5.345 -0.129) 9.455 10.987 ( -9.180 27.751 -0.589) 29.236 11.752 ( -7.618 -13.746 0.118) 15.716 12.448 ( 8.633 -9.881 0.070) 13.122 13.174 ( -6.901 -2.555 0.922) 7.417 13.680 ( 3.539 6.926 -0.199) 7.780 15.859 ( -2.857 -0.423 0.296) 2.904 16.109 ( 4.987 -0.994 -0.382) 5.099 17.116 ( -5.394 -7.316 0.422) 9.100 18.085 ( -2.741 -12.235 0.750) 12.561 19.349 ( -0.401 -0.412 -1.430) 1.541 20.763 ( 6.473 7.297 0.475) 9.766 22.367 ( -0.194 -6.465 0.251) 6.473 22.970 ( -1.299 10.945 -0.141) 11.023 ======================= Grid point 38 (29/267) ======================= q-point: (-0.36 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.267 ( -0.875 0.562 -0.750) 1.282 2.675 ( -4.396 -3.175 -4.674) 7.159 2.901 ( -0.365 7.702 -0.088) 7.711 3.207 ( 3.302 -4.590 3.467) 6.633 3.649 ( 4.064 3.287 1.290) 5.383 3.843 ( -1.783 3.120 0.658) 3.653 4.229 ( -0.658 2.287 3.897) 4.566 4.436 ( 12.480 0.968 -2.573) 12.779 4.811 ( -1.165 -1.434 -1.591) 2.438 5.510 ( -6.707 3.219 -0.930) 7.498 5.704 ( -2.224 -0.500 1.412) 2.682 5.753 ( 0.991 -6.034 0.561) 6.140 6.068 ( 3.900 -0.149 0.511) 3.936 6.197 ( -5.463 -1.079 1.634) 5.804 6.542 ( 8.065 -1.478 -1.464) 8.329 6.840 ( -0.002 11.196 -0.019) 11.196 7.206 ( -8.882 -4.146 -1.864) 9.978 7.868 ( -15.483 2.540 1.056) 15.725 9.174 ( 11.837 1.949 -0.162) 11.998 9.585 ( 5.111 0.685 0.712) 5.206 9.849 ( -1.695 -12.930 -0.507) 13.050 10.074 ( 2.737 3.771 0.460) 4.683 10.292 ( -5.647 19.551 -0.900) 20.370 10.964 ( 10.093 -26.478 -0.406) 28.339 11.795 ( -9.116 3.074 0.373) 9.627 12.588 ( 6.241 1.357 -0.227) 6.391 13.179 ( -6.194 -2.707 0.596) 6.786 13.588 ( 1.710 5.218 -0.253) 5.497 15.853 ( -0.066 -1.530 0.134) 1.537 16.137 ( 1.395 0.286 -0.156) 1.432 17.261 ( 0.325 -9.331 0.405) 9.345 18.259 ( 1.236 -7.135 1.164) 7.335 19.329 ( -0.877 1.849 -2.922) 3.567 20.669 ( 3.306 6.812 1.547) 7.728 22.466 ( 1.207 -3.294 0.226) 3.516 22.757 ( -5.459 8.557 -0.453) 10.160 ======================= Grid point 39 (30/267) ======================= q-point: (-0.29 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.209 ( -1.091 4.771 -1.398) 5.090 2.701 ( -3.051 -3.172 -2.415) 5.020 2.738 ( -0.837 9.772 -0.320) 9.813 3.321 ( 2.677 -4.539 2.553) 5.856 3.478 ( -0.120 14.709 0.860) 14.735 3.846 ( 1.410 -1.760 0.025) 2.255 4.162 ( 0.160 5.393 4.001) 6.717 4.415 ( 8.011 8.949 -2.572) 12.283 4.827 ( -0.839 -1.162 -0.723) 1.605 5.366 ( -5.265 6.756 -1.684) 8.729 5.604 ( -2.199 7.242 2.272) 7.902 5.921 ( 1.292 -7.768 0.730) 7.909 6.099 ( 4.042 -0.179 -3.162) 5.135 6.145 ( -5.989 2.489 4.891) 8.123 6.537 ( -1.407 17.830 -1.133) 17.921 6.644 ( 8.784 -1.253 -0.913) 8.920 7.173 ( -10.741 0.146 -1.522) 10.849 7.792 ( -9.042 -3.493 1.260) 9.774 9.128 ( 9.751 14.445 0.223) 17.430 9.444 ( 1.620 9.677 -0.074) 9.812 9.600 ( -4.559 29.030 -0.561) 29.391 10.174 ( 6.276 -18.681 -0.128) 19.708 10.404 ( 1.697 -14.225 -0.090) 14.326 11.398 ( 0.208 12.269 -0.256) 12.274 11.672 ( -1.518 -20.663 0.220) 20.720 12.461 ( 2.662 16.257 -0.205) 16.475 13.193 ( -3.505 -2.999 0.017) 4.613 13.514 ( -0.335 2.867 -0.105) 2.888 15.931 ( 0.298 -6.795 0.242) 6.806 16.149 ( 1.564 -1.109 0.030) 1.917 17.438 ( 3.695 -7.752 0.005) 8.587 18.382 ( 4.925 -3.582 2.714) 6.667 19.242 ( -2.714 5.790 -4.754) 7.968 20.575 ( 0.771 5.326 2.587) 5.971 22.429 ( 1.286 9.593 -1.391) 9.778 22.661 ( -7.194 -4.778 0.543) 8.653 ======================= Grid point 40 (31/267) ======================= q-point: (-0.21 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.064 ( -0.614 10.266 -0.923) 10.325 2.494 ( -1.153 16.980 -0.073) 17.020 2.724 ( -1.504 -1.247 -1.006) 2.198 3.196 ( -0.864 13.660 1.225) 13.742 3.421 ( 1.671 -3.805 0.124) 4.157 3.882 ( 2.396 -0.127 -0.235) 2.411 4.022 ( -1.347 12.186 1.963) 12.417 4.247 ( 3.663 10.872 -0.710) 11.494 4.826 ( -0.910 1.212 0.064) 1.517 5.204 ( -2.877 6.089 -1.210) 6.842 5.433 ( -1.075 9.952 0.796) 10.042 6.028 ( 0.825 3.146 -5.106) 6.054 6.055 ( -2.747 -2.200 7.647) 8.418 6.123 ( 0.999 11.043 0.719) 11.112 6.148 ( -1.483 9.783 -1.597) 10.022 6.774 ( 14.937 -1.954 -1.681) 15.158 7.033 ( -15.442 3.635 -0.231) 15.866 7.797 ( -3.248 1.299 0.796) 3.588 8.765 ( 3.277 27.925 0.206) 28.118 9.117 ( -1.568 18.250 -0.186) 18.318 9.369 ( 2.587 2.388 -0.454) 3.549 10.541 ( 11.523 -7.674 0.206) 13.846 10.661 ( 1.038 -12.972 -0.475) 13.022 10.857 ( -11.094 27.240 0.335) 29.414 12.035 ( 1.083 25.140 -0.252) 25.165 12.235 ( 2.144 -26.415 0.051) 26.502 13.246 ( -1.242 -4.698 -0.273) 4.867 13.493 ( -1.298 -1.257 0.040) 1.807 16.107 ( 0.674 -11.803 -0.242) 11.825 16.213 ( 1.982 -4.211 0.631) 4.696 17.591 ( 4.054 -5.606 -0.407) 6.930 18.486 ( 8.218 -1.884 5.357) 9.989 19.037 ( -6.104 12.078 -6.619) 15.065 20.497 ( -0.549 3.908 3.012) 4.964 22.218 ( -1.624 11.276 -1.834) 11.539 22.737 ( -3.418 -5.999 0.426) 6.917 ======================= Grid point 41 (32/267) ======================= q-point: (-0.14 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.810 ( 0.000 17.014 0.000) 17.014 2.084 ( 0.000 26.180 0.000) 26.180 2.714 ( 0.000 1.603 0.000) 1.603 2.994 ( 0.000 8.437 0.000) 8.437 3.447 ( 0.000 7.246 0.000) 7.246 3.677 ( 0.000 17.492 0.000) 17.492 3.897 ( 0.000 0.043 0.000) 0.043 4.124 ( 0.000 4.642 0.000) 4.642 4.743 ( 0.000 7.352 0.000) 7.352 5.136 ( -0.000 -0.082 -0.000) 0.082 5.243 ( 0.000 9.993 0.000) 9.993 5.703 ( 0.000 22.891 0.000) 22.891 5.909 ( 0.000 7.256 0.000) 7.256 6.113 ( -0.000 -1.590 -0.000) 1.590 6.181 ( -0.000 -2.763 -0.000) 2.763 6.710 ( 0.000 15.700 0.000) 15.700 7.023 ( -0.000 -9.631 -0.000) 9.631 7.579 ( 0.000 23.640 0.000) 23.640 8.216 ( 0.000 31.146 0.000) 31.146 8.923 ( 0.000 3.019 0.000) 3.019 9.353 ( 0.000 0.895 0.000) 0.895 10.117 ( 0.000 31.275 0.000) 31.275 10.721 ( 0.000 7.395 0.000) 7.395 10.982 ( -0.000 -18.601 -0.000) 18.601 11.577 ( 0.000 17.075 0.000) 17.075 12.735 ( -0.000 -24.481 -0.000) 24.481 13.350 ( -0.000 -7.297 -0.000) 7.297 13.535 ( -0.000 -3.651 -0.000) 3.651 16.312 ( -0.000 -5.174 -0.000) 5.174 16.369 ( -0.000 -15.603 -0.000) 15.603 17.692 ( -0.000 -3.303 -0.000) 3.303 18.603 ( -0.000 -4.325 -0.000) 4.325 18.666 ( 0.000 22.324 0.000) 22.324 20.433 ( 0.000 3.355 0.000) 3.355 22.003 ( 0.000 10.637 0.000) 10.637 22.811 ( -0.000 -3.012 -0.000) 3.012 ======================= Grid point 46 (33/267) ======================= q-point: ( 0.21 0.21 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.127 ( 19.747 -0.000 7.351) 21.071 1.290 ( 21.345 -0.000 8.577) 23.004 1.926 ( 33.566 -0.000 -6.668) 34.222 2.477 ( 1.931 -0.000 -5.058) 5.414 2.701 ( 3.559 -0.000 5.114) 6.230 3.089 ( -8.932 0.000 -0.441) 8.943 3.649 ( -4.942 0.000 1.381) 5.132 3.770 ( -14.751 0.000 -0.022) 14.751 3.855 ( 4.264 -0.000 -0.213) 4.269 4.292 ( 3.046 -0.000 0.640) 3.113 4.638 ( -5.320 0.000 -4.779) 7.151 5.062 ( 6.810 -0.000 7.155) 9.877 5.227 ( -4.339 0.000 0.494) 4.367 5.585 ( 1.473 -0.000 -0.183) 1.485 5.980 ( 2.459 -0.000 -3.255) 4.080 6.215 ( 0.619 -0.000 -3.697) 3.748 6.503 ( -0.896 0.000 0.383) 0.975 6.929 ( 11.688 -0.000 3.997) 12.353 7.285 ( -0.178 0.000 -0.044) 0.184 9.111 ( 5.071 -0.000 0.955) 5.160 9.232 ( 0.501 -0.000 0.345) 0.608 9.630 ( 1.262 -0.000 0.120) 1.268 10.789 ( -2.914 0.000 -0.238) 2.924 11.242 ( 1.621 -0.000 -1.591) 2.271 11.548 ( -18.978 0.000 0.095) 18.979 12.442 ( 3.355 -0.000 -10.944) 11.447 13.436 ( -9.793 0.000 -2.577) 10.127 14.127 ( 11.212 -0.000 -0.043) 11.212 14.234 ( 0.532 -0.000 0.107) 0.543 15.603 ( -36.542 0.000 13.597) 38.989 16.858 ( -0.148 0.000 -0.015) 0.149 17.972 ( 0.035 -0.000 0.014) 0.037 19.096 ( 6.865 -0.000 -23.910) 24.876 20.359 ( 19.512 -0.000 2.972) 19.737 21.976 ( -12.060 0.000 -10.968) 16.302 24.047 ( -1.960 0.000 -0.147) 1.966 ======================= Grid point 47 (34/267) ======================= q-point: ( 0.29 0.21 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.416 ( 18.350 -10.828 7.092) 22.456 1.521 ( 20.605 -8.021 -0.106) 22.112 2.256 ( 19.812 -13.534 -5.397) 24.593 2.573 ( 2.658 -8.071 -3.890) 9.345 2.759 ( 3.747 -3.079 4.535) 6.639 3.241 ( -7.519 -15.935 -1.782) 17.709 3.526 ( -7.430 2.499 1.659) 8.013 3.899 ( -8.951 -20.156 1.878) 22.134 4.210 ( -0.269 -29.765 -0.899) 29.780 4.291 ( 4.043 2.211 1.704) 4.913 4.656 ( -4.238 -9.988 -5.309) 12.079 5.129 ( -6.187 -2.395 0.414) 6.648 5.291 ( 6.663 -6.418 10.245) 13.804 5.637 ( 2.870 -4.697 -1.479) 5.699 6.047 ( -0.702 -7.957 -6.871) 10.536 6.226 ( 7.041 -0.080 -2.629) 7.516 6.490 ( 0.893 1.349 0.995) 1.900 6.984 ( 12.379 0.108 3.793) 12.947 7.421 ( -1.381 -10.194 0.072) 10.288 9.110 ( -0.515 8.124 -0.557) 8.160 9.119 ( 9.648 4.230 1.090) 10.591 9.652 ( -0.052 -2.181 -0.029) 2.182 10.869 ( 11.879 -5.452 0.646) 13.086 11.149 ( -16.925 7.128 -0.387) 18.369 11.397 ( -14.279 2.535 0.058) 14.502 12.854 ( -10.942 -39.250 -8.244) 41.572 13.278 ( -8.900 8.229 -2.709) 12.420 13.992 ( -0.304 13.712 -0.666) 13.731 14.252 ( 8.731 2.651 1.368) 9.226 15.704 ( -32.177 -30.900 10.386) 45.804 16.862 ( -0.228 -0.357 -0.322) 0.532 17.821 ( 0.586 14.409 -1.330) 14.482 19.156 ( 3.004 -5.381 -14.478) 15.735 20.538 ( 11.729 -5.654 5.956) 14.318 21.876 ( -5.696 0.539 -9.501) 11.090 23.925 ( 0.563 9.895 -1.282) 9.994 ======================= Grid point 48 (35/267) ======================= q-point: ( 0.36 0.21 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.744 ( 15.829 -9.243 4.974) 18.992 1.891 ( 20.375 -15.228 -4.278) 25.794 2.592 ( 3.751 -12.334 -3.826) 13.448 2.755 ( 1.910 -10.799 -1.024) 11.014 2.909 ( 1.408 -9.767 1.041) 9.923 3.347 ( -0.495 -0.717 0.275) 0.914 3.553 ( -6.290 -9.113 1.149) 11.133 4.277 ( 4.011 -4.550 0.780) 6.116 4.344 ( -5.128 -22.163 4.279) 23.148 4.582 ( -7.986 -14.575 -4.573) 17.238 5.045 ( 2.811 -26.427 -1.585) 26.624 5.123 ( -8.534 -4.367 0.675) 9.611 5.488 ( 4.780 -6.090 8.582) 11.558 5.809 ( 4.199 -10.081 -5.304) 12.141 6.258 ( -3.001 -16.984 -2.679) 17.454 6.373 ( 9.861 -12.582 -0.960) 16.014 6.476 ( 2.987 1.475 0.648) 3.394 7.177 ( 8.729 -12.213 2.072) 15.154 7.610 ( 5.573 -10.427 0.359) 11.828 8.979 ( -2.663 5.184 -0.583) 5.857 9.136 ( 12.189 2.874 0.635) 12.539 9.725 ( -1.287 -6.755 0.025) 6.877 10.794 ( -16.988 13.721 -0.379) 21.841 11.031 ( 0.856 2.098 1.394) 2.660 11.313 ( 3.931 -4.123 -0.051) 5.697 12.966 ( -10.353 13.719 -0.381) 17.192 13.400 ( -19.879 -17.842 -3.263) 26.910 13.909 ( -4.520 -18.818 -3.725) 19.708 14.232 ( 8.433 6.554 1.324) 10.762 16.146 ( -24.624 -34.047 6.473) 42.514 16.858 ( -0.869 0.033 -0.350) 0.937 17.525 ( 0.070 15.956 -0.808) 15.977 19.225 ( -1.224 -3.535 -6.205) 7.246 20.751 ( 9.345 -7.371 2.979) 12.270 21.847 ( -1.476 -2.122 -5.346) 5.939 23.736 ( 1.870 10.844 -1.037) 11.053 ======================= Grid point 49 (36/267) ======================= q-point: ( 0.43 0.21 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.989 ( 11.405 -5.424 3.143) 13.014 2.307 ( 14.760 -14.442 -4.896) 21.223 2.770 ( 0.934 -7.022 1.880) 7.329 2.991 ( 2.883 -12.233 -3.469) 13.038 3.098 ( -5.027 -12.982 -2.327) 14.115 3.375 ( 2.686 -1.982 0.326) 3.354 3.703 ( -2.553 -9.621 3.555) 10.570 4.318 ( 6.229 0.861 3.705) 7.298 4.708 ( -4.303 -10.711 -1.830) 11.687 4.763 ( -4.326 -15.671 -3.978) 16.737 5.211 ( -9.480 -12.846 1.979) 16.088 5.425 ( -3.823 -15.130 0.603) 15.617 5.654 ( 9.576 -5.961 5.021) 12.347 5.950 ( 0.715 -5.008 -5.119) 7.197 6.431 ( 4.182 1.102 0.552) 4.360 6.577 ( 11.392 -9.918 0.764) 15.124 6.764 ( -11.328 -20.579 -1.016) 23.513 7.637 ( 11.466 -30.781 0.680) 32.855 7.932 ( 11.662 -15.885 0.341) 19.709 8.885 ( -2.388 1.145 0.167) 2.654 9.175 ( 9.580 1.918 -0.044) 9.771 9.868 ( -3.693 -8.015 0.193) 8.827 10.448 ( -17.373 6.585 -0.793) 18.596 10.890 ( -13.256 2.860 1.312) 13.624 11.573 ( 23.708 -8.137 0.339) 25.068 12.594 ( -8.656 18.571 -0.737) 20.503 13.319 ( -13.384 3.801 0.510) 13.922 14.144 ( 6.464 8.706 0.848) 10.877 14.509 ( -10.172 -42.648 -3.124) 43.956 16.453 ( -8.388 -6.321 1.125) 10.563 16.943 ( -9.721 -16.757 2.526) 19.537 17.274 ( -1.939 9.161 -0.041) 9.364 19.254 ( -2.529 -2.730 -2.852) 4.688 20.928 ( 9.790 -2.996 0.634) 10.257 21.913 ( -0.459 -6.605 -1.918) 6.893 23.552 ( 1.038 10.169 -0.615) 10.240 ======================= Grid point 50 (37/267) ======================= q-point: ( 0.50 0.21 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.134 ( 5.662 -3.197 2.160) 6.852 2.548 ( 4.766 -5.304 -5.943) 9.282 2.897 ( 0.729 -5.683 2.990) 6.463 3.133 ( -3.278 -4.269 3.827) 6.604 3.385 ( 8.996 -9.885 -8.256) 15.709 3.493 ( 1.363 -15.191 -2.123) 15.399 3.872 ( -1.099 -8.578 5.355) 10.172 4.362 ( 7.535 0.792 4.849) 8.995 4.757 ( -3.656 -1.851 -2.644) 4.877 5.024 ( -2.390 -14.897 -3.213) 15.426 5.388 ( -10.990 -11.821 0.274) 16.143 5.620 ( -3.783 -10.092 -0.672) 10.799 5.846 ( 8.604 -4.859 7.559) 12.441 6.032 ( 2.945 -4.339 -3.717) 6.428 6.427 ( 3.223 1.255 -0.319) 3.473 6.814 ( -4.169 -9.186 -0.188) 10.090 6.955 ( 0.660 -9.410 -0.989) 9.485 8.126 ( 2.838 -3.922 0.486) 4.866 8.414 ( 11.224 -31.549 0.379) 33.488 9.001 ( 4.092 -13.178 0.888) 13.827 9.221 ( 6.843 -1.238 -0.389) 6.965 9.829 ( -10.662 3.559 0.338) 11.245 10.402 ( -2.994 -5.339 -0.813) 6.175 10.866 ( -18.138 -15.413 0.922) 23.820 11.873 ( 20.142 -1.620 0.202) 20.208 12.186 ( -4.696 14.935 -0.718) 15.672 13.169 ( -11.363 2.254 0.926) 11.621 14.013 ( 5.162 10.014 0.358) 11.272 15.189 ( -5.257 -35.794 -0.818) 36.187 16.356 ( 3.020 9.990 0.132) 10.437 17.029 ( -11.293 1.768 0.281) 11.434 17.386 ( -6.301 -22.787 1.762) 23.708 19.285 ( -1.720 -2.823 -1.677) 3.706 20.995 ( 9.081 3.249 0.011) 9.645 22.061 ( -0.145 -9.327 -0.307) 9.333 23.369 ( -0.030 10.119 -0.301) 10.123 ======================= Grid point 51 (38/267) ======================= q-point: ( 0.57 0.21 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.212 ( 1.589 -2.301 1.450) 3.150 2.594 ( -1.668 -1.318 -5.914) 6.284 3.012 ( 1.636 -5.200 2.382) 5.949 3.142 ( -0.308 2.584 3.129) 4.069 3.519 ( 2.895 -5.662 -2.912) 6.994 3.857 ( 6.837 -13.163 -4.545) 15.513 4.016 ( -0.826 -7.781 4.407) 8.981 4.426 ( 9.397 -0.067 4.672) 10.495 4.754 ( -2.824 -1.468 -2.016) 3.768 5.269 ( -0.758 -13.411 -0.715) 13.451 5.473 ( -10.376 -6.735 -2.794) 12.682 5.725 ( -2.860 -4.228 -1.357) 5.282 5.993 ( 2.969 -4.343 11.612) 12.748 6.120 ( 4.031 -2.281 -5.631) 7.291 6.456 ( 5.295 -1.655 -0.561) 5.576 6.883 ( -11.615 -7.232 -1.893) 13.812 7.108 ( 5.658 -2.552 -0.187) 6.210 8.068 ( -7.119 5.487 0.486) 9.002 8.971 ( 9.996 -17.879 0.659) 20.495 9.255 ( 3.276 -8.820 -0.322) 9.414 9.347 ( -1.142 -9.622 0.509) 9.702 9.842 ( 1.678 -11.801 0.202) 11.922 10.435 ( 3.174 0.709 0.123) 3.255 11.121 ( -17.582 -16.550 -0.280) 24.148 11.623 ( -0.677 17.623 -0.383) 17.640 12.313 ( 12.669 -11.464 -0.004) 17.086 13.084 ( -9.372 -1.104 0.929) 9.483 13.861 ( 3.541 9.653 0.034) 10.282 15.676 ( -2.886 -18.319 0.214) 18.546 16.223 ( 7.920 7.500 0.029) 10.908 16.947 ( -10.473 -3.543 0.084) 11.057 17.759 ( -4.235 -20.171 0.944) 20.632 19.320 ( -0.679 -2.083 -1.305) 2.550 20.954 ( 6.879 7.159 0.215) 9.930 22.229 ( 0.011 -8.451 0.210) 8.453 23.171 ( -0.896 11.107 -0.207) 11.145 ======================= Grid point 52 (39/267) ======================= q-point: ( 0.64 0.21 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.252 ( -0.337 -1.205 0.452) 1.330 2.587 ( -3.089 -1.866 -4.232) 5.562 3.039 ( 1.024 6.471 0.294) 6.558 3.142 ( 1.096 -4.836 2.834) 5.711 3.640 ( 2.733 -5.310 -0.881) 6.037 3.934 ( 1.559 4.172 1.179) 4.607 4.191 ( 0.030 -6.770 0.661) 6.803 4.519 ( 10.321 -0.947 1.320) 10.448 4.767 ( -1.422 -1.955 -1.625) 2.913 5.454 ( -6.946 -4.004 3.408) 8.712 5.533 ( -0.896 -10.651 -5.750) 12.137 5.749 ( -1.136 -0.357 1.330) 1.785 6.087 ( 0.646 -1.682 9.162) 9.337 6.143 ( 0.407 -0.721 -6.454) 6.507 6.550 ( 6.772 -2.978 -0.402) 7.409 6.923 ( -6.627 -3.769 -1.303) 7.734 7.120 ( 0.260 2.418 -0.600) 2.504 7.868 ( -10.876 7.826 0.637) 13.414 9.225 ( 8.464 -4.698 0.113) 9.681 9.470 ( 2.440 -12.254 0.333) 12.499 9.560 ( -2.737 -15.100 -0.041) 15.347 10.086 ( 2.353 -4.935 0.208) 5.471 10.539 ( 9.720 -8.768 0.137) 13.090 10.848 ( -9.349 22.246 -0.814) 24.144 11.649 ( -5.706 -11.499 0.097) 12.837 12.577 ( 8.162 -7.358 -0.179) 10.991 13.071 ( -7.007 -3.557 0.738) 7.893 13.720 ( 1.990 7.613 -0.102) 7.869 15.825 ( -1.753 -2.708 0.269) 3.237 16.184 ( 4.756 3.381 -0.256) 5.841 17.043 ( -4.392 -12.018 0.365) 12.800 18.060 ( -1.209 -14.398 0.515) 14.457 19.337 ( -0.285 -0.209 -1.346) 1.392 20.847 ( 4.141 8.594 0.574) 9.557 22.368 ( 0.015 -6.628 0.291) 6.635 22.942 ( -1.812 12.479 -0.263) 12.612 ======================= Grid point 53 (40/267) ======================= q-point: (-0.29 0.21 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.250 ( -0.708 1.069 -0.391) 1.341 2.612 ( -1.755 -3.478 -1.767) 4.278 2.900 ( 0.070 8.373 0.120) 8.375 3.250 ( 1.156 -5.091 1.191) 5.355 3.705 ( 2.233 4.629 0.423) 5.157 3.830 ( -0.407 3.028 0.273) 3.068 4.233 ( -0.333 1.289 1.554) 2.047 4.574 ( 5.994 2.881 -0.826) 6.701 4.793 ( -0.491 -1.784 -0.811) 2.021 5.417 ( -4.182 2.359 -0.352) 4.814 5.684 ( -0.928 0.010 0.479) 1.044 5.775 ( 0.989 -7.098 0.616) 7.193 6.114 ( 1.411 0.081 1.396) 1.986 6.139 ( -2.166 -0.074 -0.768) 2.299 6.645 ( 5.312 -2.657 -0.477) 5.959 6.830 ( -1.007 11.924 -0.013) 11.966 7.090 ( -4.800 -1.780 -0.999) 5.216 7.702 ( -6.433 1.419 0.559) 6.611 9.307 ( 5.212 1.173 -0.030) 5.342 9.642 ( 2.044 4.320 0.363) 4.793 9.826 ( -0.976 -19.005 -0.276) 19.032 10.128 ( 4.173 13.036 0.773) 13.710 10.207 ( -5.322 10.980 -0.975) 12.241 11.080 ( 4.782 -28.774 -0.204) 29.169 11.689 ( -4.449 4.755 0.165) 6.514 12.660 ( 3.022 3.483 -0.134) 4.614 13.106 ( -3.217 -3.959 0.291) 5.109 13.606 ( 0.661 6.076 -0.090) 6.112 15.852 ( -0.069 -2.313 0.062) 2.315 16.154 ( 0.696 1.399 -0.071) 1.564 17.265 ( 0.024 -12.234 0.172) 12.235 18.279 ( 0.697 -9.584 0.570) 9.627 19.309 ( -0.461 2.978 -1.334) 3.295 20.713 ( 1.587 7.964 0.710) 8.152 22.483 ( 0.826 -5.723 0.031) 5.782 22.689 ( -2.826 12.720 -0.161) 13.031 ======================= Grid point 54 (41/267) ======================= q-point: (-0.21 0.21 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.195 ( 0.000 4.755 0.000) 4.755 2.672 ( -0.000 -3.427 -0.000) 3.427 2.733 ( 0.000 10.239 0.000) 10.239 3.347 ( -0.000 -4.735 -0.000) 4.735 3.480 ( 0.000 15.988 0.000) 15.988 3.859 ( -0.000 -2.461 -0.000) 2.461 4.171 ( 0.000 5.251 0.000) 5.251 4.475 ( 0.000 9.992 0.000) 9.992 4.819 ( -0.000 -1.172 -0.000) 1.172 5.316 ( 0.000 6.465 0.000) 6.465 5.594 ( 0.000 7.416 0.000) 7.416 5.935 ( -0.000 -7.768 -0.000) 7.768 6.103 ( 0.000 2.939 0.000) 2.939 6.127 ( -0.000 -0.674 -0.000) 0.674 6.518 ( 0.000 19.782 0.000) 19.782 6.733 ( -0.000 -4.799 -0.000) 4.799 7.067 ( 0.000 2.802 0.000) 2.802 7.727 ( -0.000 -4.960 -0.000) 4.960 9.209 ( 0.000 15.378 0.000) 15.378 9.457 ( 0.000 8.695 0.000) 8.695 9.558 ( 0.000 29.396 0.000) 29.396 10.223 ( -0.000 -21.523 -0.000) 21.523 10.416 ( -0.000 -14.648 -0.000) 14.648 11.391 ( 0.000 24.951 0.000) 24.951 11.668 ( -0.000 -31.504 -0.000) 31.504 12.481 ( 0.000 17.203 0.000) 17.203 13.165 ( -0.000 -3.691 -0.000) 3.691 13.512 ( 0.000 3.676 0.000) 3.676 15.933 ( -0.000 -6.830 -0.000) 6.830 16.160 ( -0.000 -1.922 -0.000) 1.922 17.466 ( -0.000 -9.177 -0.000) 9.177 18.429 ( -0.000 -6.308 -0.000) 6.308 19.206 ( 0.000 7.848 0.000) 7.848 20.590 ( 0.000 5.963 0.000) 5.963 22.435 ( 0.000 12.755 0.000) 12.755 22.606 ( -0.000 -6.676 -0.000) 6.676 ======================= Grid point 61 (42/267) ======================= q-point: ( 0.29 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.419 ( 16.040 -0.000 5.655) 17.007 1.614 ( 20.043 -0.000 1.805) 20.124 2.305 ( 22.680 -0.000 -8.656) 24.275 2.489 ( 2.788 -0.000 -5.030) 5.751 2.775 ( 3.036 -0.000 5.397) 6.193 2.962 ( -8.087 0.000 -0.175) 8.089 3.582 ( -4.870 0.000 1.516) 5.100 3.594 ( -9.329 0.000 2.164) 9.576 3.903 ( 2.580 -0.000 -0.714) 2.677 4.340 ( 2.920 -0.000 0.851) 3.042 4.484 ( -10.290 0.000 -4.890) 11.392 5.076 ( -5.282 0.000 0.499) 5.305 5.302 ( 4.221 -0.000 13.681) 14.318 5.606 ( 1.512 -0.000 -0.193) 1.524 5.965 ( -0.357 0.000 -10.308) 10.314 6.288 ( 12.901 -0.000 -2.913) 13.226 6.514 ( 1.760 -0.000 0.744) 1.910 7.146 ( 15.972 -0.000 4.192) 16.512 7.282 ( -0.214 0.000 -0.047) 0.219 9.130 ( -3.376 0.000 -1.044) 3.533 9.292 ( 7.701 -0.000 2.322) 8.043 9.629 ( -1.320 0.000 -0.626) 1.461 10.744 ( -2.918 0.000 -0.219) 2.927 11.092 ( -25.006 0.000 -0.398) 25.009 11.368 ( -1.733 0.000 0.244) 1.750 12.519 ( 12.578 -0.000 -7.643) 14.718 13.289 ( -8.472 0.000 -1.892) 8.681 14.242 ( 0.517 -0.000 0.095) 0.526 14.272 ( 8.124 -0.000 -0.295) 8.130 15.127 ( -35.446 0.000 11.171) 37.165 16.856 ( -0.144 0.000 -0.008) 0.145 17.973 ( 0.034 -0.000 0.012) 0.036 19.084 ( 3.812 -0.000 -17.037) 17.458 20.551 ( 2.420 -0.000 11.355) 11.610 21.836 ( -0.736 0.000 -9.483) 9.511 23.995 ( -3.648 0.000 -3.727) 5.215 ======================= Grid point 62 (43/267) ======================= q-point: ( 0.36 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.695 ( 15.644 -12.329 5.338) 20.621 1.801 ( 18.717 -6.524 -2.437) 19.971 2.451 ( 10.036 -4.587 -5.285) 12.235 2.603 ( 4.097 -8.162 -4.722) 10.281 2.813 ( 0.907 -2.191 3.150) 3.943 3.155 ( -4.010 -19.926 -0.779) 20.341 3.441 ( -4.497 3.123 2.304) 5.940 3.795 ( -6.511 -20.494 2.814) 21.687 4.169 ( -4.182 -20.321 -1.243) 20.784 4.348 ( 1.912 0.167 1.317) 2.328 4.579 ( -2.293 -20.026 -3.207) 20.411 5.039 ( -5.681 -0.339 0.030) 5.691 5.408 ( 0.873 -6.579 11.751) 13.495 5.668 ( 1.718 -5.985 -0.340) 6.237 5.968 ( -2.847 -4.476 -9.735) 11.086 6.409 ( 15.680 -1.590 -1.099) 15.799 6.525 ( 3.954 0.728 0.119) 4.023 7.174 ( 10.139 2.157 2.161) 10.589 7.464 ( 8.886 -10.493 1.230) 13.805 9.041 ( -6.453 4.649 -0.164) 7.955 9.306 ( 12.612 4.422 1.434) 13.441 9.630 ( -2.925 -2.211 -0.947) 3.787 10.787 ( -26.107 4.571 -0.415) 26.507 11.021 ( 3.404 -19.036 0.452) 19.343 11.268 ( -3.797 8.709 0.270) 9.504 12.769 ( 2.713 -17.297 -5.268) 18.284 13.153 ( -6.483 7.274 -2.119) 9.971 13.961 ( -3.708 14.658 -0.217) 15.121 14.379 ( 7.488 1.997 0.969) 7.810 15.300 ( -27.869 -35.044 8.012) 45.486 16.858 ( -0.271 -0.087 -0.233) 0.368 17.825 ( 0.600 14.245 -0.518) 14.267 19.123 ( 0.228 -4.289 -10.954) 11.766 20.648 ( -0.089 -7.584 8.202) 11.171 21.824 ( 2.357 0.176 -5.972) 6.423 23.893 ( -2.746 6.587 -3.349) 7.883 ======================= Grid point 63 (44/267) ======================= q-point: ( 0.43 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.982 ( 14.393 -6.207 2.446) 15.864 2.158 ( 17.205 -14.872 -1.227) 22.775 2.617 ( 1.660 -9.906 -3.346) 10.587 2.780 ( 2.464 -9.840 -1.916) 10.324 2.883 ( -3.976 -5.874 -0.355) 7.103 3.379 ( 3.062 -0.642 1.370) 3.416 3.472 ( -5.372 -13.019 1.116) 14.128 4.257 ( -3.498 -28.113 -0.001) 28.330 4.354 ( -0.179 -4.056 2.171) 4.604 4.447 ( -6.721 -14.016 -1.084) 15.582 5.017 ( -5.848 -3.152 0.595) 6.671 5.061 ( 0.414 -23.497 -2.410) 23.624 5.599 ( 5.417 -8.474 7.722) 12.680 5.839 ( 1.904 -7.938 -1.133) 8.241 6.135 ( -8.051 -23.135 -5.777) 25.168 6.486 ( 3.350 1.243 0.915) 3.689 6.624 ( 14.499 -4.696 -0.214) 15.242 7.303 ( 6.919 -11.262 0.715) 13.236 7.771 ( 16.399 -12.575 0.985) 20.689 8.911 ( -5.998 3.824 0.646) 7.143 9.322 ( 12.055 4.616 0.397) 12.915 9.685 ( -3.920 -7.395 -0.767) 8.405 10.431 ( -27.849 9.555 -0.559) 29.448 11.008 ( -3.830 13.611 0.715) 14.158 11.518 ( 19.115 -19.397 0.870) 27.247 12.825 ( -8.491 11.354 0.276) 14.181 13.121 ( -15.774 -11.378 -3.501) 19.762 13.878 ( 0.712 -12.827 -1.990) 13.000 14.344 ( 5.845 6.667 1.032) 8.926 15.849 ( -19.102 -38.463 5.383) 43.282 16.844 ( -0.798 1.129 -0.436) 1.450 17.525 ( 0.171 17.049 -0.136) 17.050 19.166 ( -2.813 -3.497 -5.613) 7.187 20.849 ( 2.623 -10.607 3.674) 11.528 21.841 ( 2.350 -1.431 -2.618) 3.798 23.724 ( -1.722 8.874 -2.101) 9.281 ======================= Grid point 64 (45/267) ======================= q-point: ( 0.50 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.139 ( 7.180 -1.975 2.209) 7.767 2.489 ( 12.208 -7.276 -3.122) 14.551 2.792 ( 1.043 -7.310 1.288) 7.496 2.966 ( -5.397 -9.293 -0.369) 10.753 3.076 ( 4.230 -20.036 -4.037) 20.872 3.411 ( 1.881 -1.205 0.510) 2.291 3.681 ( -2.430 -11.717 2.671) 12.260 4.402 ( 3.232 -1.805 2.102) 4.257 4.641 ( -3.515 -10.047 -1.307) 10.724 4.688 ( -3.477 -18.052 -2.606) 18.567 5.095 ( -7.089 -10.908 1.645) 13.113 5.379 ( -2.286 -13.761 -0.831) 13.974 5.828 ( 10.463 -7.684 6.078) 14.334 5.949 ( 1.389 -5.083 -3.013) 6.071 6.442 ( -8.816 -6.796 -1.694) 11.260 6.517 ( -2.286 -9.047 -0.854) 9.371 6.847 ( 11.075 -8.508 0.805) 13.989 7.793 ( 8.789 -34.400 0.654) 35.511 8.107 ( 11.378 -8.882 -0.082) 14.435 8.868 ( 0.358 -3.897 1.489) 4.187 9.314 ( 9.511 4.172 -0.427) 10.394 9.803 ( -4.884 -3.060 -0.071) 5.764 10.129 ( -24.070 -5.004 -0.895) 24.601 10.754 ( -6.170 8.867 0.723) 10.826 11.950 ( 26.767 -8.298 0.561) 28.030 12.484 ( -5.706 18.683 -0.398) 19.539 13.077 ( -19.437 -1.679 -0.031) 19.509 14.223 ( 4.246 7.520 0.229) 8.639 14.425 ( -1.566 -38.210 -1.433) 38.269 16.346 ( -6.818 -20.134 2.612) 21.417 16.837 ( -5.714 -5.322 0.448) 7.822 17.250 ( -1.333 10.078 -0.002) 10.166 19.201 ( -2.521 -3.809 -2.903) 5.412 21.040 ( 4.999 -5.182 1.220) 7.303 21.914 ( 1.041 -5.860 -0.653) 5.988 23.541 ( -1.380 9.306 -1.056) 9.467 ======================= Grid point 65 (46/267) ======================= q-point: ( 0.57 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.200 ( 2.242 -1.028 1.585) 2.932 2.579 ( 2.544 0.629 -3.977) 4.762 2.918 ( 0.639 -6.063 1.678) 6.323 3.111 ( -1.505 -6.940 2.027) 7.385 3.447 ( 2.444 -3.068 -2.709) 4.767 3.540 ( 5.904 -22.985 -3.066) 23.929 3.873 ( -1.459 -9.368 3.642) 10.157 4.470 ( 4.594 -1.945 2.698) 5.671 4.703 ( -2.252 -1.800 -1.307) 3.166 4.982 ( -1.464 -16.505 -1.900) 16.679 5.247 ( -7.575 -9.613 -0.183) 12.240 5.576 ( -1.692 -9.432 -0.886) 9.623 5.980 ( 2.897 -2.576 8.483) 9.327 6.094 ( 9.175 -4.842 -3.973) 11.109 6.454 ( -0.631 -2.494 -0.965) 2.748 6.624 ( -11.311 -8.300 -2.265) 14.211 7.070 ( 6.823 -7.155 0.558) 9.902 8.139 ( -0.542 4.651 0.191) 4.686 8.553 ( 6.733 -33.630 0.494) 34.301 9.076 ( 4.641 -12.034 0.960) 12.933 9.324 ( 7.262 2.191 -0.408) 7.597 9.689 ( -8.226 -1.162 0.266) 8.312 10.354 ( -3.197 -19.718 -0.841) 19.993 10.639 ( -11.760 -6.170 0.537) 13.291 12.038 ( 0.338 23.089 -0.235) 23.093 12.260 ( 15.999 -5.137 -0.166) 16.804 12.981 ( -13.855 -1.928 0.616) 14.002 14.073 ( 2.799 10.359 0.163) 10.732 15.145 ( -1.103 -36.580 -0.290) 36.597 16.432 ( 6.849 6.283 0.765) 9.326 16.847 ( -12.674 0.534 0.021) 12.685 17.332 ( -2.288 -20.031 0.661) 20.172 19.256 ( -1.111 -3.808 -1.448) 4.223 21.098 ( 4.678 2.795 0.356) 5.461 22.063 ( 0.316 -9.174 0.088) 9.180 23.355 ( -1.093 9.785 -0.439) 9.856 ======================= Grid point 66 (47/267) ======================= q-point: ( 0.64 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.230 ( 0.305 -1.150 0.754) 1.409 2.554 ( -0.858 0.756 -2.430) 2.686 3.040 ( 0.941 -6.118 0.877) 6.252 3.149 ( -0.105 2.636 1.134) 2.871 3.536 ( 0.766 -6.251 -0.947) 6.369 3.943 ( 6.799 -11.421 -4.224) 13.947 4.004 ( -3.709 -8.199 4.358) 9.999 4.549 ( 4.455 -2.232 1.595) 5.232 4.717 ( -1.148 -1.850 -0.758) 2.305 5.263 ( -0.089 -14.412 1.122) 14.456 5.338 ( -5.270 -6.296 -2.525) 8.590 5.695 ( -0.839 -4.833 -0.268) 4.913 6.057 ( 0.185 -2.834 6.286) 6.898 6.157 ( 3.160 1.076 -3.864) 5.106 6.540 ( 5.984 -3.025 0.244) 6.709 6.706 ( -9.355 -10.487 -1.871) 14.177 7.176 ( 2.503 -0.192 0.150) 2.514 7.982 ( -3.669 9.371 0.235) 10.067 9.074 ( 3.467 -18.166 0.334) 18.497 9.294 ( 2.115 -9.471 -0.378) 9.711 9.330 ( -1.183 -4.313 0.473) 4.498 9.874 ( 1.584 -16.374 0.088) 16.450 10.503 ( 4.636 -1.039 0.255) 4.758 10.900 ( -10.160 -18.627 -0.432) 21.222 11.609 ( -0.670 17.737 -0.123) 17.750 12.480 ( 8.046 -8.162 -0.138) 11.462 12.958 ( -6.525 -3.464 0.471) 7.402 13.897 ( 1.257 10.012 0.011) 10.091 15.649 ( -0.884 -17.413 0.131) 17.436 16.339 ( 6.069 8.472 0.116) 10.423 16.806 ( -6.947 -7.312 0.001) 10.086 17.722 ( -1.313 -20.911 0.312) 20.955 19.309 ( -0.250 -2.449 -0.637) 2.543 21.025 ( 2.496 7.414 0.179) 7.825 22.231 ( 0.083 -8.353 0.153) 8.355 23.155 ( -0.692 11.283 -0.157) 11.305 ======================= Grid point 67 (48/267) ======================= q-point: (-0.29 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.249 ( -0.000 -0.638 -0.000) 0.638 2.554 ( -0.000 -1.670 -0.000) 1.670 3.048 ( 0.000 7.309 0.000) 7.309 3.156 ( -0.000 -5.719 -0.000) 5.719 3.658 ( -0.000 -6.071 -0.000) 6.071 3.953 ( 0.000 5.434 0.000) 5.434 4.192 ( -0.000 -6.490 -0.000) 6.490 4.606 ( -0.000 -1.303 -0.000) 1.303 4.752 ( -0.000 -2.242 -0.000) 2.242 5.394 ( -0.000 -2.679 -0.000) 2.679 5.522 ( -0.000 -12.692 -0.000) 12.692 5.745 ( -0.000 -1.006 -0.000) 1.006 6.109 ( -0.000 -1.995 -0.000) 1.995 6.135 ( 0.000 1.270 0.000) 1.270 6.614 ( -0.000 -2.735 -0.000) 2.735 6.850 ( -0.000 -7.205 -0.000) 7.205 7.127 ( 0.000 5.530 0.000) 5.530 7.782 ( 0.000 9.176 0.000) 9.176 9.293 ( -0.000 -5.190 -0.000) 5.190 9.488 ( -0.000 -14.568 -0.000) 14.568 9.537 ( -0.000 -13.371 -0.000) 13.371 10.106 ( -0.000 -4.627 -0.000) 4.627 10.653 ( -0.000 -16.309 -0.000) 16.309 10.735 ( 0.000 26.930 0.000) 26.930 11.604 ( -0.000 -10.158 -0.000) 10.158 12.648 ( -0.000 -5.688 -0.000) 5.688 13.010 ( -0.000 -4.524 -0.000) 4.524 13.735 ( 0.000 7.834 0.000) 7.834 15.812 ( -0.000 -3.340 -0.000) 3.340 16.223 ( 0.000 5.708 0.000) 5.708 17.008 ( -0.000 -14.569 -0.000) 14.569 18.052 ( -0.000 -15.194 -0.000) 15.194 19.332 ( -0.000 -0.094 -0.000) 0.094 20.880 ( 0.000 8.917 0.000) 8.917 22.369 ( -0.000 -6.672 -0.000) 6.672 22.927 ( 0.000 13.073 0.000) 13.073 ======================= Grid point 76 (49/267) ======================= q-point: ( 0.36 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.642 ( 11.344 -0.000 3.712) 11.936 1.906 ( 20.401 -0.000 -2.687) 20.577 2.513 ( 10.212 -0.000 -6.596) 12.157 2.516 ( 3.582 -0.000 -4.064) 5.418 2.829 ( 1.289 -0.000 4.274) 4.464 2.851 ( -7.013 0.000 0.093) 7.013 3.518 ( -2.895 0.000 2.749) 3.992 3.523 ( -3.839 0.000 1.350) 4.070 3.927 ( 1.240 -0.000 -0.837) 1.496 4.322 ( -9.691 0.000 -0.729) 9.719 4.382 ( 2.274 -0.000 0.784) 2.405 5.001 ( -4.492 0.000 0.001) 4.492 5.347 ( -4.105 0.000 8.426) 9.373 5.626 ( 1.243 -0.000 -0.163) 1.254 5.915 ( -0.293 0.000 -7.554) 7.559 6.498 ( 9.654 -0.000 0.707) 9.680 6.571 ( 9.464 -0.000 -1.613) 9.600 7.278 ( -0.201 0.000 -0.039) 0.204 7.458 ( 25.172 -0.000 2.996) 25.350 9.030 ( -9.848 0.000 0.686) 9.872 9.441 ( 10.386 -0.000 1.593) 10.507 9.584 ( -4.015 0.000 -1.740) 4.376 10.670 ( -29.133 0.000 -0.813) 29.145 10.704 ( -2.344 0.000 -0.162) 2.350 11.358 ( -1.393 0.000 0.009) 1.393 12.743 ( 21.480 -0.000 -4.978) 22.049 13.179 ( -5.550 0.000 -1.033) 5.646 14.250 ( 0.404 -0.000 0.068) 0.410 14.325 ( -4.590 0.000 0.114) 4.591 14.699 ( -24.916 0.000 8.023) 26.176 16.854 ( -0.113 0.000 -0.002) 0.113 17.973 ( 0.027 -0.000 0.008) 0.028 19.059 ( 1.356 -0.000 -11.079) 11.161 20.564 ( -4.746 0.000 8.049) 9.344 21.842 ( 3.947 -0.000 -3.819) 5.492 23.919 ( -3.930 0.000 -3.830) 5.488 ======================= Grid point 77 (50/267) ======================= q-point: ( 0.43 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.908 ( 10.220 -16.585 3.670) 19.824 2.060 ( 18.249 -2.824 -3.057) 18.718 2.513 ( 1.318 -1.220 -2.815) 3.339 2.646 ( 3.880 -7.114 -4.133) 9.097 2.820 ( -0.801 0.166 1.870) 2.041 3.091 ( -4.844 -22.594 -0.469) 23.112 3.424 ( 0.621 2.572 1.412) 2.999 3.732 ( -3.779 -19.978 2.435) 20.477 4.088 ( -5.798 -12.691 0.048) 13.952 4.358 ( -0.548 -3.317 0.316) 3.377 4.565 ( 0.824 -24.410 -0.887) 24.440 4.970 ( -3.659 0.129 0.027) 3.661 5.427 ( -2.914 -10.826 6.914) 13.172 5.681 ( 0.456 -5.709 -0.344) 5.738 5.907 ( -0.595 -1.483 -6.493) 6.687 6.530 ( 2.292 0.821 1.252) 2.737 6.668 ( 12.322 -1.454 -1.078) 12.454 7.264 ( 2.422 0.133 0.241) 2.437 7.740 ( 26.423 -7.233 1.463) 27.434 8.916 ( -11.458 2.794 1.672) 11.912 9.492 ( 11.713 3.269 0.997) 12.202 9.555 ( -6.283 -2.114 -2.066) 6.944 10.385 ( -25.657 6.818 -0.635) 26.555 11.052 ( 1.246 -32.218 0.275) 32.243 11.240 ( -1.691 9.992 0.126) 10.135 12.863 ( 11.239 3.161 -2.736) 11.992 13.072 ( -3.393 6.654 -1.666) 7.653 13.877 ( -7.676 10.749 0.392) 13.215 14.473 ( 4.778 2.138 0.624) 5.272 14.976 ( -19.313 -39.047 4.924) 43.840 16.853 ( -0.234 0.220 -0.152) 0.356 17.832 ( 0.485 13.912 -0.105) 13.921 19.075 ( -1.096 -2.774 -6.868) 7.488 20.647 ( -2.777 -10.275 4.632) 11.608 21.857 ( 3.389 0.587 -1.686) 3.831 23.834 ( -2.970 5.245 -2.780) 6.637 ======================= Grid point 78 (51/267) ======================= q-point: ( 0.50 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.176 ( 10.161 -1.543 0.973) 10.324 2.374 ( 11.684 -17.121 1.591) 20.789 2.610 ( -0.730 -10.688 -2.637) 11.033 2.787 ( -1.735 -6.471 -3.818) 7.711 2.836 ( -0.522 -5.018 1.455) 5.250 3.387 ( -3.664 -8.521 0.988) 9.327 3.444 ( 1.824 -6.888 0.199) 7.128 4.216 ( -1.536 -29.272 -0.884) 29.325 4.289 ( -6.038 -14.296 0.880) 15.543 4.424 ( 0.595 -5.379 1.109) 5.525 4.953 ( -3.155 -1.660 0.529) 3.604 5.051 ( -0.196 -21.622 -1.926) 21.709 5.715 ( 6.421 -13.204 5.554) 15.698 5.856 ( -0.269 -8.868 2.784) 9.299 5.996 ( -6.567 -18.102 -7.772) 20.766 6.524 ( 1.568 1.200 0.442) 2.024 6.796 ( 7.969 -4.711 0.263) 9.261 7.378 ( 3.155 -13.269 0.144) 13.640 8.072 ( 21.726 -7.507 0.069) 22.987 8.818 ( -7.268 -0.785 2.233) 7.643 9.478 ( 8.257 5.025 -0.661) 9.689 9.608 ( -5.168 -8.449 -0.788) 9.935 10.046 ( -21.899 10.451 -0.336) 24.267 10.962 ( -2.339 14.901 0.225) 15.086 11.793 ( 15.852 -33.485 1.099) 37.064 12.727 ( -4.800 11.236 0.257) 12.221 12.907 ( -11.199 5.348 -2.367) 12.634 13.892 ( 1.577 -14.959 -1.002) 15.075 14.410 ( 2.704 6.884 0.636) 7.423 15.645 ( -10.688 -41.747 3.014) 43.198 16.832 ( -0.510 1.832 -0.290) 1.924 17.527 ( 0.101 17.950 0.067) 17.950 19.107 ( -2.138 -3.483 -3.288) 5.245 20.880 ( 0.436 -13.449 1.822) 13.579 21.870 ( 2.001 -0.553 -0.523) 2.141 23.687 ( -1.797 7.958 -1.438) 8.284 ======================= Grid point 79 (52/267) ======================= q-point: ( 0.57 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.215 ( 2.324 0.756 0.730) 2.551 2.624 ( 6.345 0.188 -0.840) 6.404 2.811 ( 0.884 -6.918 0.763) 7.016 2.882 ( -4.608 -14.336 -0.659) 15.072 3.125 ( 2.763 -22.409 -1.398) 22.622 3.432 ( 0.660 -0.960 0.300) 1.203 3.658 ( -1.376 -12.763 0.865) 12.866 4.432 ( 0.517 -4.790 0.491) 4.843 4.603 ( -1.147 -10.542 -0.103) 10.605 4.646 ( -1.062 -17.429 -1.063) 17.494 5.027 ( -2.677 -8.988 0.650) 9.401 5.354 ( -0.700 -13.606 -0.517) 13.634 5.948 ( 0.430 -3.386 1.318) 3.658 6.019 ( 10.808 -13.001 2.246) 17.056 6.248 ( -11.867 -10.309 -3.193) 16.040 6.532 ( 1.091 -1.061 -0.090) 1.524 6.962 ( 3.841 -8.119 0.381) 8.990 7.887 ( 3.335 -37.214 0.323) 37.365 8.228 ( 4.354 1.999 -0.397) 4.807 8.911 ( 3.124 -9.747 1.406) 10.331 9.464 ( 12.186 3.876 -0.514) 12.798 9.697 ( -13.488 10.372 0.113) 17.016 9.830 ( -9.809 -21.801 -0.615) 23.914 10.700 ( -1.758 10.849 0.204) 10.992 12.331 ( 21.385 -5.410 0.189) 22.059 12.434 ( 0.961 18.296 0.325) 18.324 12.765 ( -21.661 -6.808 -0.471) 22.711 14.271 ( 1.980 8.622 -0.059) 8.847 14.413 ( -0.150 -37.221 -0.297) 37.223 16.285 ( -2.571 -29.059 1.311) 29.202 16.781 ( -1.989 2.432 -0.141) 3.145 17.236 ( -0.499 10.436 -0.002) 10.447 19.165 ( -1.001 -4.541 -1.175) 4.796 21.090 ( 1.506 -6.815 0.478) 6.996 21.927 ( 0.597 -5.149 -0.044) 5.184 23.518 ( -0.836 8.896 -0.478) 8.948 ======================= Grid point 80 (53/267) ======================= q-point: ( 0.64 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.218 ( -0.000 -0.354 -0.000) 0.354 2.589 ( 0.000 3.159 0.000) 3.159 2.927 ( -0.000 -6.319 -0.000) 6.319 3.105 ( -0.000 -8.288 -0.000) 8.288 3.456 ( -0.000 -2.126 -0.000) 2.126 3.585 ( -0.000 -24.276 -0.000) 24.276 3.868 ( -0.000 -9.583 -0.000) 9.583 4.511 ( -0.000 -3.517 -0.000) 3.517 4.683 ( -0.000 -1.627 -0.000) 1.627 4.968 ( -0.000 -17.253 -0.000) 17.253 5.187 ( -0.000 -8.222 -0.000) 8.222 5.562 ( -0.000 -9.258 -0.000) 9.258 6.012 ( -0.000 -3.072 -0.000) 3.072 6.201 ( 0.000 1.862 0.000) 1.862 6.392 ( -0.000 -16.365 -0.000) 16.365 6.551 ( -0.000 -0.677 -0.000) 0.677 7.122 ( -0.000 -6.576 -0.000) 6.576 8.132 ( 0.000 7.730 0.000) 7.730 8.604 ( -0.000 -34.226 -0.000) 34.226 9.117 ( -0.000 -9.963 -0.000) 9.963 9.395 ( 0.000 9.024 0.000) 9.024 9.616 ( -0.000 -9.738 -0.000) 9.738 10.320 ( -0.000 -32.486 -0.000) 32.486 10.554 ( 0.000 4.277 0.000) 4.277 12.028 ( 0.000 23.691 0.000) 23.691 12.428 ( -0.000 -0.890 -0.000) 0.890 12.842 ( -0.000 -6.626 -0.000) 6.626 14.094 ( 0.000 10.501 0.000) 10.501 15.138 ( -0.000 -36.549 -0.000) 36.549 16.516 ( 0.000 3.802 0.000) 3.802 16.720 ( 0.000 1.156 0.000) 1.156 17.317 ( -0.000 -19.086 -0.000) 19.086 19.244 ( -0.000 -4.195 -0.000) 4.195 21.133 ( 0.000 2.497 0.000) 2.497 22.066 ( -0.000 -9.042 -0.000) 9.042 23.345 ( 0.000 9.666 0.000) 9.666 ======================= Grid point 92 (54/267) ======================= q-point: ( 0.43 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.781 ( 5.871 -0.000 1.772) 6.133 2.187 ( 19.276 -0.000 -3.314) 19.559 2.549 ( -2.510 0.000 -2.609) 3.620 2.557 ( 3.697 -0.000 -2.460) 4.441 2.760 ( -5.334 0.000 0.358) 5.346 2.850 ( -0.180 0.000 2.501) 2.508 3.484 ( -2.111 0.000 0.818) 2.264 3.515 ( 0.440 -0.000 1.219) 1.295 3.935 ( 0.438 -0.000 -0.551) 0.704 4.204 ( -6.228 0.000 1.160) 6.336 4.411 ( 1.235 -0.000 0.461) 1.318 4.951 ( -2.293 0.000 0.011) 2.293 5.301 ( -4.217 0.000 2.890) 5.112 5.640 ( 0.703 -0.000 -0.094) 0.709 5.891 ( 0.149 -0.000 -3.441) 3.444 6.553 ( 1.222 -0.000 1.034) 1.600 6.733 ( 8.586 -0.000 -0.875) 8.631 7.276 ( -0.123 0.000 -0.022) 0.125 7.903 ( 32.580 -0.000 0.834) 32.591 8.836 ( -18.184 0.000 2.309) 18.330 9.487 ( -5.103 0.000 -1.978) 5.473 9.610 ( 9.244 -0.000 0.679) 9.269 10.291 ( -20.242 0.000 -0.740) 20.256 10.676 ( -1.302 0.000 -0.085) 1.305 11.327 ( -2.179 0.000 -0.280) 2.197 13.088 ( 26.915 -0.000 -2.983) 27.080 13.117 ( -2.220 0.000 -0.832) 2.370 14.041 ( -29.571 0.000 3.595) 29.789 14.255 ( 0.220 -0.000 0.035) 0.223 14.570 ( -0.858 0.000 1.812) 2.005 16.853 ( -0.062 0.000 0.001) 0.062 17.974 ( 0.015 -0.000 0.004) 0.015 19.032 ( 0.128 -0.000 -5.480) 5.482 20.523 ( -3.488 0.000 3.490) 4.934 21.884 ( 2.534 -0.000 -0.635) 2.612 23.857 ( -2.498 0.000 -2.221) 3.342 ======================= Grid point 93 (55/267) ======================= q-point: ( 0.50 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.020 ( 3.524 -19.338 1.377) 19.704 2.291 ( 13.283 1.052 -1.599) 13.420 2.473 ( -5.303 -1.323 -0.679) 5.508 2.671 ( 1.223 -6.392 -1.567) 6.694 2.821 ( 0.129 1.631 0.730) 1.792 3.022 ( -3.328 -23.012 -0.125) 23.252 3.446 ( 1.081 0.912 0.229) 1.433 3.703 ( -1.231 -19.417 0.961) 19.479 4.021 ( -2.780 -9.104 0.375) 9.527 4.350 ( -0.392 -6.890 0.032) 6.901 4.576 ( 0.567 -23.889 -0.166) 23.897 4.934 ( -1.229 0.386 0.007) 1.288 5.409 ( -1.517 -14.782 2.152) 15.015 5.684 ( 0.128 -4.520 -0.257) 4.530 5.886 ( 0.042 -0.309 -2.074) 2.097 6.553 ( 0.624 0.844 0.441) 1.138 6.787 ( 4.067 -1.310 -0.177) 4.276 7.281 ( 0.409 -1.426 0.017) 1.483 8.158 ( 25.249 -2.476 -0.275) 25.371 8.709 ( -16.456 -1.848 2.113) 16.694 9.454 ( -4.524 -1.101 -1.497) 4.890 9.642 ( 6.930 3.005 0.441) 7.567 10.092 ( -11.941 7.399 -0.341) 14.051 11.073 ( 1.293 -38.092 0.192) 38.115 11.209 ( -1.878 9.829 -0.112) 10.007 13.010 ( 4.750 14.993 1.162) 15.770 13.044 ( 2.509 13.185 -2.824) 13.715 13.762 ( -6.351 -0.623 0.522) 6.403 14.522 ( 1.578 2.692 0.246) 3.130 14.797 ( -6.686 -40.469 1.561) 41.047 16.850 ( -0.094 0.431 -0.054) 0.444 17.837 ( 0.192 13.659 0.007) 13.660 19.040 ( -0.632 -1.781 -2.350) 3.016 20.628 ( -1.162 -11.829 1.372) 11.965 21.889 ( 1.252 0.750 -0.154) 1.468 23.793 ( -1.222 4.793 -1.030) 5.053 ======================= Grid point 94 (56/267) ======================= q-point: ( 0.57 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.259 ( 0.000 1.806 0.000) 1.806 2.483 ( -0.000 -22.168 -0.000) 22.168 2.586 ( -0.000 -9.888 -0.000) 9.888 2.749 ( -0.000 -1.629 -0.000) 1.629 2.845 ( -0.000 -6.909 -0.000) 6.909 3.355 ( -0.000 -12.575 -0.000) 12.575 3.461 ( -0.000 -3.410 -0.000) 3.410 4.204 ( -0.000 -29.999 -0.000) 29.999 4.242 ( -0.000 -14.797 -0.000) 14.797 4.432 ( -0.000 -5.119 -0.000) 5.119 4.931 ( -0.000 -1.242 -0.000) 1.242 5.044 ( -0.000 -20.859 -0.000) 20.859 5.813 ( -0.000 -9.929 -0.000) 9.929 5.845 ( -0.000 -27.961 -0.000) 27.961 5.907 ( -0.000 -2.610 -0.000) 2.610 6.536 ( 0.000 0.985 0.000) 0.985 6.855 ( -0.000 -4.717 -0.000) 4.717 7.401 ( -0.000 -14.428 -0.000) 14.428 8.276 ( 0.000 0.029 0.000) 0.029 8.749 ( -0.000 -8.181 -0.000) 8.181 9.504 ( -0.000 -8.035 -0.000) 8.035 9.600 ( 0.000 4.249 0.000) 4.249 9.864 ( 0.000 11.828 0.000) 11.828 10.945 ( 0.000 15.175 0.000) 15.175 11.927 ( -0.000 -45.131 -0.000) 45.131 12.691 ( 0.000 15.414 0.000) 15.414 12.809 ( 0.000 14.284 0.000) 14.284 13.903 ( -0.000 -16.449 -0.000) 16.449 14.430 ( 0.000 7.002 0.000) 7.002 15.572 ( -0.000 -42.974 -0.000) 42.974 16.827 ( 0.000 2.091 0.000) 2.091 17.528 ( 0.000 18.321 0.000) 18.321 19.083 ( -0.000 -3.514 -0.000) 3.514 20.886 ( -0.000 -14.445 -0.000) 14.445 21.885 ( -0.000 -0.292 -0.000) 0.292 23.669 ( 0.000 7.716 0.000) 7.716 ======================= Grid point 109 (57/267) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 144 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.828 ( 0.000 -0.000 0.000) 0.000 2.410 ( 0.000 -0.000 -0.000) 0.000 2.437 ( -0.000 0.000 0.000) 0.000 2.585 ( 0.000 -0.000 0.000) 0.000 2.715 ( -0.000 0.000 0.000) 0.000 2.853 ( 0.000 -0.000 0.000) 0.000 3.470 ( 0.000 -0.000 -0.000) 0.000 3.523 ( 0.000 -0.000 -0.000) 0.000 3.937 ( 0.000 -0.000 0.000) 0.000 4.159 ( 0.000 -0.000 0.000) 0.000 4.421 ( 0.000 -0.000 0.000) 0.000 4.934 ( 0.000 -0.000 0.000) 0.000 5.274 ( 0.000 -0.000 0.000) 0.000 5.645 ( 0.000 -0.000 0.000) 0.000 5.885 ( 0.000 -0.000 0.000) 0.000 6.564 ( 0.000 -0.000 0.000) 0.000 6.793 ( 0.000 -0.000 0.000) 0.000 7.275 ( 0.000 -0.000 0.000) 0.000 8.268 ( -0.000 0.000 0.000) 0.000 8.595 ( 0.000 -0.000 0.000) 0.000 9.436 ( 0.000 -0.000 0.000) 0.000 9.697 ( 0.000 -0.000 0.000) 0.000 10.126 ( -0.000 0.000 0.000) 0.000 10.666 ( 0.000 -0.000 0.000) 0.000 11.308 ( 0.000 -0.000 0.000) 0.000 13.097 ( 0.000 -0.000 0.000) 0.000 13.401 ( 0.000 -0.000 0.000) 0.000 13.707 ( 0.000 -0.000 0.000) 0.000 14.256 ( 0.000 -0.000 0.000) 0.000 14.574 ( 0.000 -0.000 0.000) 0.000 16.852 ( 0.000 -0.000 0.000) 0.000 17.974 ( 0.000 -0.000 0.000) 0.000 19.020 ( 0.000 -0.000 0.000) 0.000 20.504 ( 0.000 -0.000 0.000) 0.000 21.902 ( 0.000 -0.000 0.000) 0.000 23.833 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 203 (58/267) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.535 ( 2.325 -0.000 22.865) 22.982 0.580 ( -4.125 0.000 25.393) 25.726 1.033 ( -4.240 0.000 45.723) 45.919 2.395 ( -0.778 0.000 -7.049) 7.092 2.444 ( 7.155 -0.000 -11.152) 13.250 3.472 ( -2.564 0.000 0.170) 2.570 3.588 ( 1.756 -0.000 1.740) 2.472 3.786 ( 1.059 -0.000 -0.730) 1.286 4.082 ( 9.683 -0.000 -17.936) 20.383 4.208 ( -0.103 0.000 0.437) 0.449 4.220 ( 12.302 -0.000 2.649) 12.584 5.132 ( -13.972 0.000 -1.997) 14.114 5.544 ( 0.012 -0.000 -0.327) 0.327 5.794 ( -13.332 0.000 1.931) 13.471 6.073 ( 9.852 -0.000 7.853) 12.599 6.246 ( 2.322 -0.000 1.746) 2.905 6.698 ( -2.816 0.000 -1.595) 3.237 7.289 ( -0.013 0.000 -0.025) 0.028 7.319 ( 40.971 -0.000 -2.701) 41.060 8.950 ( -1.368 0.000 -0.313) 1.404 9.172 ( -9.754 0.000 0.817) 9.788 9.512 ( 0.805 -0.000 -0.681) 1.054 9.642 ( -52.124 0.000 0.119) 52.124 10.864 ( -0.086 0.000 -0.173) 0.193 11.840 ( 0.115 -0.000 0.031) 0.119 11.981 ( 3.534 -0.000 0.164) 3.538 13.640 ( 0.215 -0.000 0.159) 0.267 13.811 ( -0.688 0.000 -0.002) 0.688 14.220 ( 0.036 -0.000 0.099) 0.105 16.701 ( 33.127 -0.000 0.068) 33.127 16.863 ( -0.024 0.000 0.037) 0.044 17.970 ( 0.028 -0.000 -0.062) 0.068 18.544 (-114.721 0.000 0.396) 114.722 19.069 ( 0.145 -0.000 -0.388) 0.414 22.665 ( -0.238 0.000 0.368) 0.439 23.400 ( 50.756 -0.000 -0.451) 50.758 ======================= Grid point 204 (59/267) ======================= q-point: ( 0.07 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.722 ( -3.742 -14.964 19.829) 25.122 0.954 ( 5.428 -15.274 22.754) 27.938 1.450 ( 9.975 -35.652 17.252) 40.843 2.459 ( 2.624 -5.818 -8.681) 10.774 2.523 ( 5.339 -6.599 -2.807) 8.940 3.654 ( -5.519 -1.135 -9.739) 11.251 3.743 ( -3.561 -12.439 -2.559) 13.189 3.985 ( 2.742 -22.386 2.309) 22.671 4.122 ( 1.026 -2.710 0.382) 2.923 4.353 ( -0.140 -15.432 -4.204) 15.995 4.457 ( 10.220 -15.085 -7.794) 19.818 5.076 ( -7.487 -4.413 -2.159) 8.955 5.545 ( -5.373 1.921 3.959) 6.945 5.677 ( -12.399 -2.840 3.148) 13.104 6.116 ( 1.984 9.020 1.172) 9.310 6.203 ( 3.946 5.565 11.895) 13.713 6.377 ( 13.901 -3.837 6.260) 15.721 6.693 ( -4.489 -2.266 -2.878) 5.794 7.980 ( -7.839 2.131 -2.864) 8.614 8.958 ( -23.506 -9.685 -0.339) 25.426 9.153 ( 0.422 0.634 0.667) 1.012 9.550 ( 1.625 -2.967 -0.266) 3.393 9.715 ( 32.537 -2.472 0.563) 32.636 11.766 ( -6.897 5.437 0.046) 8.782 11.859 ( -4.387 6.544 -0.407) 7.889 13.292 ( -0.213 -59.020 -54.512) 80.343 13.691 ( -0.116 -6.797 -4.291) 8.039 14.018 ( -4.552 -24.929 -15.243) 29.572 14.113 ( -9.162 -44.280 -28.630) 53.520 16.831 ( 3.868 -2.075 0.579) 4.427 17.182 ( 34.223 -7.900 -11.132) 36.844 17.855 ( -35.620 -0.060 7.840) 36.472 18.227 ( -37.056 -32.930 -4.936) 49.819 19.257 ( 26.992 -5.062 3.693) 27.710 22.598 ( -16.035 4.235 2.519) 16.775 23.221 ( 39.817 34.276 7.309) 53.044 ======================= Grid point 205 (60/267) ======================= q-point: ( 0.14 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.096 ( 0.859 -22.022 12.169) 25.175 1.323 ( 6.516 -17.530 10.842) 21.617 2.248 ( 6.943 -35.952 -3.142) 36.751 2.572 ( 6.416 -5.273 -8.916) 12.185 2.751 ( 3.678 -13.356 10.333) 17.283 3.558 ( -3.571 2.278 -7.606) 8.706 3.857 ( -7.513 -4.898 -2.542) 9.322 4.031 ( 3.957 1.307 4.047) 5.810 4.534 ( 6.639 -6.779 3.475) 10.105 4.703 ( -7.248 -26.787 -1.965) 27.820 4.843 ( 6.099 -23.181 -2.521) 24.102 5.194 ( 3.045 -8.922 -3.872) 10.192 5.479 ( -7.955 -3.810 2.387) 9.138 5.830 ( -7.760 -16.624 0.114) 18.346 6.114 ( -0.140 -7.622 -2.546) 8.037 6.231 ( 6.196 -2.571 1.806) 6.947 6.611 ( 2.736 -8.362 7.226) 11.385 6.845 ( 4.219 -19.447 -3.678) 20.237 7.797 ( -2.678 9.327 1.305) 9.792 8.947 ( -14.249 -4.288 -0.651) 14.895 9.128 ( -8.173 -1.504 0.918) 8.361 9.637 ( 3.699 -4.612 0.306) 5.920 10.082 ( 24.992 -13.551 0.675) 28.438 11.529 ( -10.985 12.633 0.262) 16.743 11.664 ( -2.390 10.290 0.067) 10.564 13.301 ( -3.816 11.186 -6.067) 13.285 13.690 ( 1.062 5.067 -1.119) 5.297 13.813 ( 6.692 11.665 0.302) 13.452 15.295 ( -42.325 -58.998 -43.016) 84.395 16.854 ( -3.243 3.263 0.779) 4.666 17.386 ( 3.654 -7.023 0.696) 7.947 17.680 ( -25.099 -3.270 7.528) 26.407 18.747 ( 2.594 -28.721 -22.884) 36.814 19.651 ( 31.939 -12.231 3.039) 34.336 22.313 ( -14.352 10.347 5.869) 18.641 23.085 ( 27.953 11.791 2.624) 30.451 ======================= Grid point 206 (61/267) ======================= q-point: ( 0.21 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.537 ( 2.471 -20.117 6.747) 21.362 1.758 ( 6.075 -23.359 1.852) 24.207 2.708 ( 5.098 -9.530 -9.543) 14.418 2.715 ( 2.831 -10.476 -3.140) 11.297 3.150 ( 4.183 -21.456 8.199) 23.347 3.499 ( -5.430 -0.706 -2.712) 6.111 3.874 ( -2.853 -2.649 1.465) 4.160 4.061 ( 2.490 -0.238 2.252) 3.366 4.691 ( 4.599 -6.069 -0.077) 7.615 4.965 ( -5.507 -11.341 -0.405) 12.614 5.232 ( 7.060 -9.511 -2.065) 12.024 5.405 ( 7.206 -13.486 4.120) 15.836 5.588 ( -2.592 -11.738 -8.700) 14.839 5.995 ( -6.135 -7.625 1.430) 9.891 6.178 ( -3.013 -1.299 4.405) 5.493 6.435 ( -3.404 -8.279 -2.440) 9.278 7.027 ( 5.382 -33.383 2.206) 33.886 7.318 ( 15.415 -18.930 -1.311) 24.448 7.699 ( -8.003 -6.928 1.385) 10.675 8.910 ( -3.011 0.683 -0.333) 3.105 9.122 ( -10.598 -5.590 0.181) 11.983 9.805 ( 4.878 -11.107 0.554) 12.143 10.543 ( 13.097 -18.835 1.023) 22.964 11.192 ( -9.127 14.305 0.186) 16.970 11.478 ( -4.609 5.432 0.064) 7.124 12.986 ( -6.899 17.141 -2.184) 18.606 13.535 ( -0.572 8.787 -1.014) 8.864 13.736 ( 10.077 6.570 0.979) 12.070 15.693 ( -33.029 -27.172 -17.715) 46.293 16.661 ( -3.346 13.561 2.830) 14.252 17.469 ( -12.582 -3.325 -4.173) 13.667 17.722 ( -13.614 -15.308 9.360) 22.523 19.107 ( 3.588 -13.131 -10.724) 17.329 20.092 ( 26.385 -9.647 0.875) 28.107 22.132 ( -8.371 0.911 1.852) 8.622 23.098 ( 18.599 7.026 0.681) 19.894 ======================= Grid point 207 (62/267) ======================= q-point: ( 0.29 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.875 ( 1.262 -14.184 2.456) 14.450 2.237 ( 5.146 -21.777 -1.171) 22.408 2.877 ( 7.620 -6.723 -1.470) 10.268 2.881 ( 1.053 -7.288 -4.328) 8.542 3.399 ( -2.511 -1.400 0.787) 2.981 3.560 ( -6.487 -11.977 -0.686) 13.638 3.960 ( 2.982 -6.691 3.242) 8.011 4.075 ( 1.262 0.578 1.880) 2.336 4.821 ( 1.173 -4.773 0.463) 4.936 5.097 ( -2.096 -8.208 -1.948) 8.693 5.394 ( 8.882 -3.951 -3.052) 10.189 5.672 ( -1.768 -10.663 -3.854) 11.476 5.865 ( 4.143 -16.121 -2.568) 16.841 6.097 ( 0.658 -7.144 1.606) 7.352 6.199 ( 1.101 -1.668 6.632) 6.927 6.486 ( -8.855 -4.261 -0.026) 9.827 7.411 ( 9.805 0.175 1.588) 9.934 7.728 ( 8.509 -18.344 0.491) 20.228 8.088 ( -5.368 -32.580 -1.118) 33.038 8.933 ( 0.925 -6.413 0.259) 6.485 9.168 ( -7.379 -6.114 -0.440) 9.593 10.115 ( -0.422 -17.036 0.269) 17.043 10.717 ( -9.806 6.289 1.252) 11.717 11.034 ( 11.292 0.005 0.083) 11.292 11.535 ( -4.965 -18.994 0.041) 19.632 12.562 ( -8.574 22.188 -0.775) 23.800 13.392 ( -0.271 6.001 -0.186) 6.010 13.682 ( 8.677 7.094 0.749) 11.233 15.853 ( -19.992 -15.727 -6.263) 26.197 16.371 ( -2.022 15.384 2.428) 15.705 17.403 ( -12.596 -1.339 -1.635) 12.772 17.939 ( -11.010 -14.641 4.265) 18.809 19.279 ( 0.293 -6.505 -4.317) 7.813 20.374 ( 18.206 -3.347 1.411) 18.565 22.143 ( -4.183 -6.073 -0.597) 7.398 23.082 ( 13.421 7.837 0.760) 15.560 ======================= Grid point 208 (63/267) ======================= q-point: ( 0.36 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.097 ( 0.469 -9.096 -0.248) 9.112 2.565 ( 0.842 -11.481 -2.065) 11.696 2.979 ( 1.103 -3.609 2.037) 4.288 3.069 ( 8.161 -5.333 -5.318) 11.105 3.379 ( -3.973 -1.842 3.840) 5.825 3.714 ( -2.539 -9.772 -2.455) 10.391 4.054 ( 3.897 2.833 1.187) 4.962 4.152 ( -0.608 -9.319 1.950) 9.541 4.870 ( -2.258 -1.196 1.795) 3.123 5.262 ( 0.544 -10.552 -3.342) 11.082 5.497 ( 7.588 -1.913 -7.939) 11.147 5.789 ( -0.222 -3.953 -5.061) 6.426 6.025 ( -4.458 -3.755 2.081) 6.189 6.246 ( -4.267 -6.888 8.622) 11.832 6.394 ( 9.999 -8.927 -0.023) 13.404 6.516 ( -0.622 -6.088 2.774) 6.719 7.429 ( 1.388 1.139 0.924) 2.019 8.001 ( 10.727 -4.697 -0.629) 11.727 8.578 ( -2.553 -22.496 -0.462) 22.645 9.226 ( 4.198 -20.714 -0.071) 21.135 9.237 ( -4.207 -8.531 -0.109) 9.513 10.173 ( -12.490 6.042 0.244) 13.877 10.531 ( -6.076 6.332 0.593) 8.796 11.269 ( 13.785 -14.823 0.124) 20.243 11.883 ( -11.640 -4.574 -0.313) 12.511 12.128 ( -2.794 3.940 0.388) 4.846 13.313 ( -0.183 2.389 0.576) 2.464 13.612 ( 6.408 6.257 0.208) 8.959 15.977 ( -9.321 -10.262 -0.968) 13.897 16.103 ( -0.976 12.337 1.415) 12.457 17.335 ( -9.972 -0.613 -0.382) 9.998 18.103 ( -7.701 -9.865 2.001) 12.674 19.350 ( -1.838 -2.967 -2.326) 4.194 20.512 ( 11.568 -0.116 1.237) 11.634 22.257 ( -1.964 -8.067 -0.857) 8.347 23.014 ( 9.682 8.641 0.930) 13.011 ======================= Grid point 209 (64/267) ======================= q-point: ( 0.43 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.220 ( 0.251 -4.179 -1.657) 4.502 2.702 ( -2.468 -5.752 -2.314) 6.674 3.020 ( -1.029 0.700 -4.558) 4.725 3.112 ( 3.701 1.688 7.597) 8.617 3.474 ( 1.337 -6.688 -0.034) 6.820 3.895 ( 3.958 -8.690 -1.847) 9.726 4.015 ( 0.414 2.923 0.556) 3.004 4.281 ( -1.170 -4.359 0.560) 4.548 4.862 ( -2.975 -0.115 1.658) 3.408 5.458 ( 1.533 -10.411 -4.311) 11.372 5.537 ( 5.077 0.454 -9.940) 11.171 5.809 ( 0.083 0.120 -1.470) 1.477 6.031 ( -2.404 0.520 2.425) 3.454 6.344 ( 0.200 -3.003 5.325) 6.117 6.477 ( -6.275 -3.585 5.826) 9.283 6.737 ( 8.690 -6.986 1.180) 11.212 7.410 ( -1.971 0.479 0.148) 2.034 8.127 ( 9.877 -2.084 -1.274) 10.175 8.855 ( -1.790 -8.866 -0.160) 9.046 9.366 ( -1.883 -9.113 -0.330) 9.312 9.729 ( 0.550 -23.633 -0.005) 23.640 9.973 ( -3.558 1.065 0.106) 3.715 10.339 ( -1.901 9.625 0.454) 9.822 11.256 ( -8.967 26.874 0.227) 28.332 11.805 ( 4.874 -12.889 -0.832) 13.805 12.368 ( -2.994 -12.730 1.045) 13.119 13.302 ( 0.126 -0.639 1.100) 1.278 13.557 ( 3.413 3.317 -0.349) 4.772 15.918 ( -0.709 6.649 0.524) 6.707 16.086 ( -2.654 -5.510 1.125) 6.218 17.281 ( -5.840 -0.024 0.626) 5.874 18.201 ( -3.661 -4.960 0.830) 6.220 19.361 ( -2.292 -0.527 -2.038) 3.112 20.574 ( 6.147 0.215 0.903) 6.216 22.384 ( -1.079 -6.359 -0.191) 6.453 22.922 ( 5.534 7.009 0.610) 8.951 ======================= Grid point 210 (65/267) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.251 ( -0.007 0.296 -2.192) 2.212 2.757 ( -4.012 -3.747 -2.633) 6.088 2.926 ( -1.745 5.765 -2.250) 6.430 3.161 ( 3.319 -1.409 6.774) 7.674 3.587 ( 1.580 -3.661 0.943) 4.097 3.940 ( 0.791 4.530 -0.356) 4.613 4.040 ( 3.519 -2.168 -3.288) 5.281 4.298 ( -1.451 1.082 1.273) 2.213 4.852 ( -2.182 -0.738 0.925) 2.483 5.499 ( 2.342 3.478 -10.410) 11.223 5.651 ( 3.151 -8.401 -2.412) 9.291 5.791 ( -1.085 1.464 -1.448) 2.327 5.997 ( 0.382 2.000 2.514) 3.235 6.370 ( 2.072 2.018 3.232) 4.337 6.494 ( -4.901 -0.492 7.919) 9.326 6.838 ( -0.398 -0.378 1.219) 1.337 7.393 ( -1.406 -0.004 -0.275) 1.433 8.197 ( 1.318 -0.135 -1.397) 1.925 8.915 ( -0.367 0.049 -0.173) 0.408 9.450 ( 0.723 -0.551 -0.136) 0.919 9.878 ( -0.318 1.145 -0.372) 1.245 10.037 ( 0.052 0.036 0.478) 0.482 10.415 ( -0.480 -0.591 -0.601) 0.970 10.750 ( -0.561 0.390 0.710) 0.985 11.979 ( 0.747 -0.369 -0.829) 1.175 12.464 ( -0.609 0.590 1.184) 1.456 13.312 ( 0.384 0.787 1.152) 1.447 13.541 ( -0.324 -0.351 -0.523) 0.708 15.856 ( 0.022 -0.223 0.339) 0.406 16.131 ( -0.596 -0.104 1.472) 1.591 17.261 ( 0.126 0.066 1.100) 1.110 18.239 ( 0.900 -0.207 0.567) 1.084 19.330 ( -2.109 1.581 -2.601) 3.703 20.610 ( 1.142 -1.112 1.068) 1.919 22.449 ( 0.262 -0.277 0.450) 0.590 22.864 ( -0.542 0.611 0.047) 0.818 ======================= Grid point 211 (66/267) ======================= q-point: (-0.43 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.201 ( -0.570 4.446 -2.128) 4.962 2.773 ( -3.755 -0.427 -5.089) 6.339 2.796 ( -2.125 5.386 2.220) 6.201 3.219 ( 3.172 -0.541 2.264) 3.934 3.594 ( -1.877 4.881 3.697) 6.404 3.861 ( -2.212 1.740 -2.522) 3.779 4.033 ( 6.689 4.762 -2.165) 8.492 4.243 ( -0.062 5.064 2.484) 5.641 4.866 ( -1.384 -1.957 0.832) 2.537 5.396 ( 0.111 6.422 -6.977) 9.483 5.703 ( -3.564 5.969 -3.144) 7.630 5.781 ( 4.995 -2.601 -5.771) 8.064 6.017 ( 2.262 -2.582 4.225) 5.443 6.322 ( 5.226 6.687 2.834) 8.948 6.449 ( -3.850 3.447 7.426) 9.046 6.753 ( -9.531 5.860 1.487) 11.287 7.386 ( -0.957 -0.139 -0.423) 1.056 8.149 ( -6.989 1.451 -0.782) 7.180 8.851 ( 1.547 8.555 -0.248) 8.697 9.379 ( 1.894 9.902 -0.108) 10.082 9.717 ( -0.553 23.576 -0.236) 23.584 9.953 ( 3.334 -0.990 -0.279) 3.490 10.342 ( 1.400 -9.233 0.499) 9.352 11.250 ( 8.275 -27.659 0.102) 28.870 11.817 ( -4.134 13.510 -0.608) 14.142 12.349 ( 2.553 13.130 0.729) 13.396 13.285 ( 0.188 1.840 0.733) 1.989 13.561 ( -3.690 -3.513 -0.241) 5.101 15.933 ( 0.696 -7.716 0.800) 7.789 16.087 ( 1.782 5.374 1.135) 5.774 17.285 ( 5.867 0.049 0.716) 5.911 18.229 ( 6.573 4.391 1.552) 8.056 19.257 ( -2.643 3.777 -4.018) 6.115 20.641 ( -3.500 -2.974 1.996) 5.008 22.390 ( 0.703 6.658 -0.083) 6.696 22.899 ( -6.110 -6.324 0.156) 8.795 ======================= Grid point 212 (67/267) ======================= q-point: (-0.36 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.068 ( -1.426 8.884 -1.500) 9.122 2.606 ( -4.804 11.032 1.350) 12.108 2.765 ( -1.637 1.482 -3.426) 4.076 3.188 ( -0.013 6.531 -3.956) 7.636 3.459 ( -2.319 4.454 5.747) 7.632 3.819 ( 0.106 4.060 -2.228) 4.632 3.994 ( 6.372 4.276 -1.126) 7.756 4.118 ( -0.002 7.974 4.564) 9.188 4.900 ( -1.738 -2.173 1.880) 3.358 5.245 ( -1.755 7.235 -5.358) 9.173 5.507 ( -3.793 11.154 -3.968) 12.432 5.805 ( 6.656 2.842 -6.669) 9.842 6.097 ( 0.371 -2.263 4.554) 5.099 6.203 ( 4.714 11.636 3.689) 13.085 6.371 ( 0.154 3.636 2.510) 4.421 6.518 ( -13.395 9.213 2.915) 16.517 7.376 ( -3.451 -0.588 -0.192) 3.506 8.052 ( -8.424 4.340 0.437) 9.486 8.583 ( 2.925 22.268 -0.410) 22.463 9.212 ( -4.038 22.342 0.010) 22.704 9.222 ( 2.991 7.488 -0.749) 8.098 10.161 ( 13.130 -6.309 0.017) 14.567 10.529 ( 5.243 -6.714 0.571) 8.538 11.291 ( -14.256 15.262 0.601) 20.893 11.839 ( 12.101 6.346 -1.154) 13.712 12.136 ( 3.163 -5.984 0.499) 6.787 13.281 ( 0.291 -1.629 -0.023) 1.655 13.613 ( -6.321 -5.900 0.215) 8.650 15.980 ( 7.877 9.646 -0.479) 12.463 16.151 ( 1.664 -14.230 1.819) 14.442 17.339 ( 9.416 0.535 -0.301) 9.436 18.186 ( 14.328 9.183 4.431) 17.585 19.128 ( -5.343 6.002 -6.778) 10.512 20.679 ( -7.559 -4.828 3.919) 9.788 22.236 ( -0.908 9.348 -1.422) 9.499 22.977 ( -9.146 -7.516 0.268) 11.841 ======================= Grid point 213 (68/267) ======================= q-point: (-0.29 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.840 ( -2.711 14.104 -0.536) 14.372 2.276 ( -8.729 20.324 4.723) 22.618 2.683 ( 1.006 5.445 -7.222) 9.100 3.024 ( -3.375 6.851 -2.397) 8.005 3.439 ( 1.185 1.855 1.674) 2.765 3.597 ( 0.125 18.483 -1.576) 18.550 3.965 ( -0.552 0.842 1.959) 2.202 4.043 ( 4.146 3.287 4.208) 6.760 4.877 ( -5.503 4.378 1.611) 7.214 5.131 ( 0.261 2.474 -2.203) 3.322 5.241 ( -1.815 12.982 -4.215) 13.769 5.719 ( 3.029 11.319 -4.362) 12.502 5.970 ( -2.803 9.688 1.551) 10.204 6.117 ( 0.897 4.024 2.436) 4.789 6.290 ( -7.758 4.402 8.076) 12.033 6.349 ( 7.187 5.080 -4.679) 9.967 7.352 ( -7.803 -0.174 0.541) 7.824 7.785 ( -9.058 19.262 1.558) 21.342 8.078 ( 5.301 34.049 -1.313) 34.484 8.946 ( -0.794 4.328 0.589) 4.440 9.132 ( 6.515 6.404 -1.244) 9.220 10.119 ( 1.185 16.638 0.344) 16.684 10.719 ( 9.508 -6.415 1.349) 11.548 11.034 ( -12.261 1.017 0.148) 12.304 11.510 ( 6.403 18.193 -0.527) 19.294 12.578 ( 8.628 -23.229 -0.498) 24.785 13.351 ( 0.538 -5.592 -0.980) 5.703 13.679 ( -8.160 -6.687 0.655) 10.570 15.854 ( 19.644 14.272 -5.042) 24.799 16.467 ( 0.833 -17.543 2.910) 17.802 17.395 ( 11.072 1.463 -1.655) 11.290 18.120 ( 24.529 15.330 10.316) 30.710 18.928 ( -11.122 6.484 -11.975) 17.582 20.730 ( -11.620 -7.214 6.976) 15.353 22.038 ( -2.887 9.796 -3.209) 10.706 23.021 ( -11.331 -4.817 -0.320) 12.316 ======================= Grid point 214 (69/267) ======================= q-point: (-0.21 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.503 ( -3.616 19.757 0.505) 20.091 1.789 ( -11.808 24.431 9.500) 28.750 2.570 ( 2.738 5.890 -9.779) 11.740 2.867 ( -3.178 9.050 -3.899) 10.354 3.037 ( -6.811 30.875 3.848) 31.850 3.521 ( 4.719 -1.212 -1.636) 5.140 3.957 ( -3.270 -0.875 1.526) 3.713 4.038 ( 5.398 2.489 4.641) 7.542 4.671 ( -7.410 11.612 -0.870) 13.802 4.942 ( 5.463 15.832 -1.534) 16.819 5.190 ( -2.267 -3.223 -0.809) 4.023 5.420 ( -5.447 16.250 0.562) 17.148 5.848 ( -6.542 3.491 -1.441) 7.554 5.976 ( 13.469 14.969 3.386) 20.420 6.240 ( -0.362 0.864 5.536) 5.615 6.278 ( -0.106 4.790 -7.318) 8.747 7.008 ( -3.731 38.610 1.477) 38.818 7.329 ( -12.866 19.134 -1.055) 23.081 7.650 ( 7.134 8.044 0.632) 10.770 8.960 ( 1.912 -2.506 0.741) 3.238 9.076 ( 9.594 5.225 -0.853) 10.958 9.813 ( -3.886 11.905 0.730) 12.545 10.551 ( -13.110 18.352 1.246) 22.588 11.183 ( 8.768 -14.571 0.044) 17.006 11.471 ( 5.394 -5.609 -0.112) 7.782 13.024 ( 7.471 -18.712 -1.491) 20.203 13.489 ( 0.903 -9.132 -1.955) 9.383 13.736 ( -8.991 -6.168 0.979) 10.947 15.706 ( 35.806 22.358 -14.818) 44.739 16.771 ( -0.167 -12.872 2.629) 13.139 17.419 ( 11.448 6.023 -2.841) 13.244 18.012 ( 28.233 20.616 16.749) 38.764 18.720 ( -13.056 0.643 -18.429) 22.594 20.810 ( -20.537 -12.237 8.458) 25.358 21.827 ( -3.358 9.346 -3.577) 10.556 22.975 ( -12.503 0.196 -1.212) 12.563 ======================= Grid point 215 (70/267) ======================= q-point: (-0.14 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.080 ( -1.819 23.379 4.967) 23.970 1.293 ( -15.534 20.711 16.476) 30.687 2.232 ( -10.562 42.027 4.110) 43.528 2.488 ( 4.200 4.994 -11.278) 13.030 2.718 ( -2.578 9.838 0.284) 10.174 3.586 ( 4.515 -2.895 -4.490) 6.994 3.964 ( -2.800 -2.229 2.296) 4.252 4.038 ( 4.784 3.103 0.969) 5.784 4.368 ( -2.142 17.002 0.456) 17.142 4.682 ( 5.035 18.416 -3.455) 19.402 4.901 ( -3.757 29.778 -0.398) 30.017 5.297 ( -6.031 -2.457 1.736) 6.740 5.651 ( -5.357 8.054 2.295) 9.942 5.893 ( 11.806 5.989 2.022) 13.391 6.112 ( -8.010 9.216 -4.931) 13.168 6.237 ( -1.193 0.781 1.274) 1.912 6.321 ( 3.568 26.863 1.922) 27.167 6.914 ( -3.241 15.064 -0.154) 15.409 7.738 ( 4.268 -7.855 0.251) 8.943 8.992 ( 15.551 6.355 -0.139) 16.800 9.104 ( 2.430 -2.715 0.825) 3.736 9.638 ( -1.836 5.819 0.288) 6.109 10.117 ( -25.768 11.339 1.454) 28.190 11.524 ( 10.599 -12.975 0.185) 16.754 11.662 ( 3.064 -10.238 0.024) 10.687 13.356 ( 4.202 -12.681 -4.439) 14.077 13.676 ( 0.378 -8.897 -2.115) 9.153 13.801 ( -6.239 -9.246 0.713) 11.177 15.403 ( 56.250 46.029 -38.642) 82.316 16.908 ( 1.280 -0.346 1.111) 1.729 17.213 ( 9.383 24.918 0.467) 26.631 17.919 ( 9.384 5.269 7.679) 13.221 18.689 ( 2.252 -5.234 -16.619) 17.568 20.804 ( -64.198 -13.032 -19.555) 68.363 21.736 ( 19.686 0.943 21.632) 29.264 22.842 ( -10.193 3.894 -0.107) 10.912 ======================= Grid point 216 (71/267) ======================= q-point: (-0.07 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.702 ( 0.452 18.070 17.481) 25.146 0.889 ( -11.938 17.672 22.425) 30.947 1.364 ( -14.114 38.993 20.575) 46.293 2.436 ( 5.316 2.084 -11.973) 13.265 2.518 ( -1.048 9.046 -3.776) 9.858 3.677 ( 4.387 -3.931 -5.684) 8.185 3.856 ( -6.231 26.083 -4.246) 27.151 3.954 ( 3.454 16.083 -2.596) 16.653 4.039 ( 7.434 0.692 4.878) 8.918 4.321 ( -0.292 11.290 2.024) 11.474 4.411 ( 5.712 24.988 -13.582) 29.009 5.241 ( -12.605 0.136 -1.301) 12.672 5.578 ( -1.458 1.879 1.477) 2.799 5.879 ( -10.725 1.640 5.053) 11.968 5.997 ( 9.353 -12.124 9.915) 18.242 6.074 ( 3.587 4.250 5.470) 7.801 6.238 ( 1.847 0.918 1.511) 2.556 6.746 ( -1.965 2.935 -0.159) 3.536 7.897 ( 17.148 2.876 -3.539) 17.744 8.974 ( 18.948 9.094 -0.121) 21.018 9.166 ( -2.597 -3.297 1.083) 4.334 9.546 ( 0.254 3.730 -0.534) 3.776 9.812 ( -40.091 -5.257 2.132) 40.490 11.764 ( 5.870 -5.890 0.034) 8.316 11.870 ( 4.327 -8.173 0.124) 9.249 13.444 ( 4.484 22.219 -34.181) 41.014 13.721 ( -0.381 5.543 -6.639) 8.657 14.023 ( 4.929 -1.635 -7.067) 8.770 14.245 ( 35.242 96.830 -62.633) 120.586 16.718 ( 5.822 18.095 6.017) 19.938 16.940 ( 5.295 8.010 -0.993) 9.653 17.949 ( 1.018 -1.690 0.522) 2.041 18.802 ( 10.364 -3.542 -14.349) 18.051 19.997 (-131.031 12.494 -45.855) 139.384 22.381 ( 55.110 -27.591 37.715) 72.255 22.745 ( -7.555 -3.619 8.007) 11.588 ======================= Grid point 218 (72/267) ======================= q-point: ( 0.07 0.07 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.738 ( 14.306 -0.000 19.889) 24.499 0.753 ( 13.171 -0.000 17.918) 22.238 1.310 ( 12.445 -0.000 29.538) 32.053 2.358 ( 0.297 -0.000 -7.730) 7.736 2.530 ( 9.572 -0.000 -4.954) 10.778 3.368 ( -9.071 0.000 0.834) 9.109 3.673 ( 5.920 -0.000 0.931) 5.993 3.780 ( -1.116 0.000 -0.657) 1.295 4.005 ( -3.677 0.000 -22.852) 23.146 4.222 ( 1.765 -0.000 0.553) 1.849 4.456 ( 13.916 -0.000 -1.146) 13.964 4.973 ( -6.668 0.000 -0.586) 6.694 5.548 ( 0.645 -0.000 -0.344) 0.731 5.574 ( -16.345 0.000 7.847) 18.131 6.168 ( 1.213 -0.000 -0.127) 1.219 6.320 ( -1.252 0.000 13.856) 13.912 6.637 ( -4.618 0.000 -3.347) 5.704 6.948 ( -35.699 0.000 11.208) 37.417 7.288 ( -0.071 0.000 -0.030) 0.077 8.960 ( 7.566 -0.000 -4.126) 8.618 9.181 ( 0.707 -0.000 -0.533) 0.885 9.541 ( 3.060 -0.000 -0.862) 3.179 10.305 ( 74.471 -0.000 -24.841) 78.505 10.853 ( -1.345 0.000 -0.179) 1.357 11.813 ( -1.744 0.000 -1.259) 2.151 12.074 ( 6.349 -0.000 -8.993) 11.008 13.636 ( -2.696 0.000 -0.204) 2.703 13.823 ( 4.620 -0.000 0.059) 4.620 14.223 ( 0.266 -0.000 0.102) 0.284 16.862 ( -0.087 0.000 0.037) 0.095 17.261 ( -45.141 0.000 9.255) 46.080 17.418 ( 39.216 -0.000 -12.125) 41.048 17.971 ( 0.040 -0.000 -0.062) 0.074 19.480 ( 37.599 -0.000 9.591) 38.803 22.503 ( -19.633 0.000 -1.088) 19.663 23.814 ( 15.960 -0.000 -18.101) 24.132 ======================= Grid point 219 (73/267) ======================= q-point: ( 0.14 0.07 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.886 ( 14.571 -8.030 13.818) 21.627 1.157 ( 9.338 -11.930 16.350) 22.289 1.691 ( 14.386 -27.499 4.427) 31.349 2.451 ( 1.488 -8.940 -6.928) 11.408 2.640 ( 9.329 -5.261 4.260) 11.527 3.488 ( -9.703 -8.826 -6.822) 14.785 3.697 ( -3.153 -0.894 -1.837) 3.758 4.025 ( 0.811 -31.673 -2.483) 31.781 4.147 ( 2.836 2.431 3.255) 4.954 4.291 ( -3.143 -23.717 -5.738) 24.603 4.584 ( 8.269 -4.927 -4.215) 10.508 5.016 ( 1.420 -8.001 -1.421) 8.250 5.441 ( -10.321 2.991 7.502) 13.106 5.595 ( -1.589 -4.866 0.044) 5.119 6.121 ( -0.569 5.458 -0.045) 5.488 6.247 ( -4.759 1.134 8.227) 9.572 6.577 ( -2.841 0.694 3.124) 4.279 6.642 ( 11.806 -3.391 -1.422) 12.365 7.707 ( -20.573 -16.812 -0.042) 26.569 8.831 ( 4.367 8.237 -1.220) 9.403 9.144 ( -1.108 2.677 0.902) 3.035 9.587 ( 3.050 -2.766 -0.933) 4.221 10.241 ( 32.787 7.010 0.171) 33.529 11.573 ( -15.748 -1.997 -1.037) 15.908 11.782 ( -7.019 4.815 -0.260) 8.516 12.980 ( -8.832 -82.496 -44.479) 94.138 13.592 ( -12.264 -6.987 -1.183) 14.164 13.878 ( 3.335 -4.345 -2.193) 5.900 14.087 ( 2.691 11.536 -0.431) 11.854 16.854 ( 0.290 -0.682 0.131) 0.752 17.116 ( -51.349 -17.435 24.233) 59.396 17.608 ( 20.610 9.142 -15.038) 27.101 18.257 ( 23.887 -24.670 -24.623) 42.255 19.832 ( 42.018 -3.050 14.506) 44.556 22.297 ( -24.048 3.974 -1.515) 24.421 23.618 ( 17.650 20.835 -8.686) 28.654 ======================= Grid point 220 (74/267) ======================= q-point: ( 0.21 0.07 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.254 ( 13.975 -16.897 8.037) 23.354 1.460 ( 7.441 -14.114 4.480) 16.572 2.329 ( 7.422 -27.728 -7.819) 29.750 2.610 ( 4.125 -7.736 -8.564) 12.256 2.892 ( 6.400 -13.017 14.513) 20.519 3.453 ( -5.614 0.452 -6.231) 8.399 3.757 ( -5.830 -6.433 1.291) 8.778 4.126 ( 6.311 2.718 2.812) 7.424 4.579 ( -7.540 -25.635 -0.108) 26.721 4.615 ( 2.260 -7.043 -2.469) 7.798 4.926 ( 5.530 -27.041 -0.162) 27.602 5.272 ( 9.209 -14.419 -5.196) 17.880 5.383 ( -5.615 -1.996 5.568) 8.155 5.724 ( -6.698 -11.754 0.301) 13.532 6.117 ( 1.900 -3.329 -0.239) 3.840 6.319 ( 4.266 -7.777 1.239) 8.956 6.587 ( -5.901 -10.018 -0.130) 11.627 6.957 ( 9.445 -19.981 0.857) 22.117 7.699 ( -9.856 1.691 0.620) 10.019 8.818 ( 0.526 -3.623 -0.738) 3.735 9.076 ( -2.027 3.443 1.273) 4.194 9.687 ( 3.018 -6.096 -0.508) 6.821 10.448 ( 23.023 -5.284 1.514) 23.670 11.347 ( -13.318 10.930 -0.140) 17.229 11.577 ( -9.267 8.861 0.144) 12.822 13.204 ( -6.105 11.847 -3.922) 13.892 13.681 ( -1.774 6.785 -3.126) 7.679 13.943 ( 9.696 6.186 1.115) 11.555 14.489 ( -41.144 -61.755 -23.211) 77.751 16.818 ( -3.046 5.290 0.563) 6.130 17.235 ( -31.668 -22.720 17.782) 42.840 17.478 ( 1.567 8.576 -3.961) 9.576 18.797 ( 14.440 -20.658 -26.252) 36.393 20.229 ( 36.545 -3.595 14.548) 39.499 22.066 ( -17.743 1.904 -2.194) 17.979 23.424 ( 17.783 13.079 -4.208) 22.473 ======================= Grid point 221 (75/267) ======================= q-point: ( 0.29 0.07 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.660 ( 10.197 -13.445 5.428) 17.726 1.857 ( 8.309 -22.820 -3.733) 24.571 2.715 ( 2.863 -12.702 -4.718) 13.850 2.771 ( 5.069 -8.436 -6.927) 12.035 3.231 ( 1.590 -15.791 6.153) 17.022 3.403 ( -5.491 -0.093 -0.726) 5.540 3.848 ( -2.798 -6.594 4.893) 8.675 4.141 ( 6.670 1.789 1.689) 7.109 4.736 ( 1.842 -5.671 -1.898) 6.257 4.878 ( -5.877 -13.524 -0.412) 14.752 5.311 ( 4.102 -11.269 -5.198) 13.070 5.471 ( -1.136 -9.065 3.788) 9.890 5.610 ( 8.708 -14.609 -0.399) 17.013 5.883 ( -8.579 -11.877 -0.637) 14.665 6.194 ( 4.676 -2.980 3.594) 6.607 6.412 ( 0.625 -0.455 -0.712) 1.051 7.104 ( 1.525 -38.556 0.691) 38.592 7.468 ( -0.657 -28.122 -0.833) 28.142 7.609 ( 4.302 0.758 0.431) 4.390 8.890 ( 1.422 -1.617 -0.503) 2.211 9.031 ( -2.682 -1.928 0.731) 3.383 9.870 ( 3.496 -11.416 -0.052) 11.939 10.696 ( 3.981 -3.765 1.736) 5.747 11.102 ( -0.080 3.065 -0.414) 3.094 11.365 ( -10.620 4.708 0.145) 11.618 12.862 ( -8.887 17.833 -1.047) 19.952 13.511 ( -2.183 7.871 -1.761) 8.355 13.899 ( 10.821 7.809 1.309) 13.409 15.113 ( -33.678 -41.447 -11.127) 54.551 16.626 ( -3.191 12.476 2.124) 13.051 17.343 ( -4.462 3.965 -1.763) 6.224 17.504 ( -20.601 -22.419 10.376) 32.166 19.104 ( 4.332 -11.305 -15.984) 20.052 20.521 ( 25.273 -0.115 10.821) 27.492 21.994 ( -8.411 -4.877 -2.601) 10.065 23.335 ( 13.162 9.100 -2.164) 16.147 ======================= Grid point 222 (76/267) ======================= q-point: ( 0.36 0.07 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.936 ( 5.840 -9.925 1.504) 11.614 2.305 ( 5.849 -18.203 -4.304) 19.598 2.894 ( 2.648 -6.650 -2.291) 7.515 2.972 ( 7.244 -10.016 -4.706) 13.227 3.359 ( -4.690 1.006 4.121) 6.324 3.483 ( -2.849 -12.044 -1.406) 12.456 3.987 ( -1.551 -8.290 5.553) 10.097 4.158 ( 7.918 2.429 1.471) 8.411 4.821 ( -1.247 -2.985 -0.151) 3.239 5.055 ( -2.257 -10.767 -2.001) 11.182 5.465 ( 3.048 -5.561 -10.364) 12.150 5.661 ( 3.139 -8.538 1.311) 9.190 5.855 ( -5.986 -10.290 2.401) 12.144 6.050 ( -4.326 -10.335 3.185) 11.648 6.382 ( 15.615 -6.033 1.527) 16.809 6.418 ( -0.022 -3.348 2.855) 4.400 7.404 ( -12.222 -2.530 0.017) 12.481 7.869 ( 11.379 -19.347 -0.258) 22.446 8.095 ( 7.239 -29.864 -0.536) 30.733 8.954 ( 1.380 -8.333 0.558) 8.465 9.100 ( -1.230 -5.491 -0.377) 5.639 10.090 ( -3.903 -7.440 0.049) 8.402 10.566 ( -9.952 5.841 0.739) 11.563 11.211 ( 8.747 -1.669 0.045) 8.905 11.446 ( -3.866 -22.484 0.262) 22.815 12.423 ( -9.695 21.575 -0.479) 23.658 13.370 ( -2.703 4.979 -0.589) 5.696 13.816 ( 8.687 8.976 0.845) 12.520 15.533 ( -19.065 -27.623 -3.358) 33.731 16.355 ( -1.454 14.676 2.072) 14.893 17.255 ( -7.275 0.683 -1.208) 7.406 17.774 ( -14.282 -18.429 5.613) 23.981 19.245 ( -0.277 -6.092 -8.957) 10.836 20.660 ( 16.923 3.254 6.477) 18.410 22.083 ( -2.746 -8.689 -1.679) 9.266 23.248 ( 8.766 9.013 -0.657) 12.590 ======================= Grid point 223 (77/267) ======================= q-point: ( 0.43 0.07 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.123 ( 3.197 -6.607 -0.476) 7.356 2.554 ( -0.430 -8.414 -3.832) 9.255 2.995 ( 1.739 -2.868 -1.325) 3.607 3.165 ( 5.533 -2.034 -1.018) 5.982 3.364 ( -0.059 -5.586 3.533) 6.610 3.688 ( 0.502 -12.876 -3.003) 13.231 4.084 ( -0.510 -0.470 3.295) 3.367 4.211 ( 6.649 -2.630 2.043) 7.436 4.834 ( -3.209 -0.757 0.646) 3.360 5.250 ( -0.025 -11.629 -3.166) 12.052 5.530 ( 2.206 -2.243 -10.773) 11.223 5.785 ( 1.034 -2.864 -1.894) 3.586 5.969 ( -3.345 -5.925 3.119) 7.485 6.213 ( -4.275 -9.621 7.079) 12.686 6.406 ( -1.957 -0.891 2.246) 3.109 6.706 ( 16.326 -7.938 2.651) 18.346 7.347 ( -11.743 -2.045 -0.625) 11.936 8.125 ( 5.498 -4.087 -1.309) 6.974 8.628 ( 9.200 -19.674 0.451) 21.723 9.194 ( -1.044 -8.008 -0.135) 8.077 9.293 ( 4.517 -22.249 0.047) 22.703 9.995 ( -11.396 5.766 0.234) 12.774 10.458 ( -3.917 4.159 0.527) 5.737 11.445 ( 8.629 -14.114 -0.360) 16.547 11.681 ( -14.080 6.190 -0.494) 15.388 12.108 ( 0.302 -5.828 0.604) 5.867 13.290 ( -3.321 1.192 0.385) 3.549 13.710 ( 6.468 8.343 0.226) 10.559 15.843 ( -8.184 -16.678 0.143) 18.579 16.105 ( 0.678 11.562 1.310) 11.656 17.204 ( -7.911 -1.568 -0.272) 8.070 17.991 ( -8.920 -13.379 2.561) 16.283 19.305 ( -1.508 -3.142 -5.145) 6.214 20.697 ( 11.548 4.837 3.379) 12.968 22.234 ( -0.666 -8.705 -0.571) 8.749 23.126 ( 5.118 9.679 0.041) 10.949 ======================= Grid point 224 (78/267) ======================= q-point: ( 0.50 0.07 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.224 ( 1.278 -2.866 -1.635) 3.539 2.642 ( -3.699 -4.650 -3.143) 6.722 3.004 ( 1.059 2.947 -2.454) 3.978 3.179 ( 0.983 0.152 6.548) 6.623 3.517 ( 4.079 -6.313 0.247) 7.521 3.925 ( 1.482 -9.239 -3.114) 9.862 4.063 ( 5.469 2.719 0.682) 6.145 4.294 ( 2.260 -1.186 1.489) 2.956 4.822 ( -2.977 -0.589 0.536) 3.082 5.452 ( 0.883 -9.539 -7.436) 12.127 5.548 ( 1.491 -1.627 -4.900) 5.374 5.799 ( -0.970 0.262 -1.874) 2.126 6.023 ( 0.141 -0.401 2.381) 2.418 6.356 ( -2.609 -6.344 6.217) 9.258 6.424 ( -2.794 -2.021 4.063) 5.329 6.880 ( 8.716 -0.013 2.020) 8.947 7.317 ( -9.710 -3.453 -0.621) 10.324 8.174 ( -2.977 -0.786 -1.220) 3.312 8.914 ( 8.772 -4.551 0.011) 9.882 9.364 ( 2.063 -9.159 -0.142) 9.390 9.687 ( -5.052 -14.654 0.012) 15.500 9.984 ( 3.777 -11.246 -0.151) 11.864 10.338 ( 1.963 3.870 0.642) 4.386 11.119 ( -9.577 29.787 -0.092) 31.289 11.824 ( -2.228 -15.189 -1.036) 15.387 12.369 ( 3.002 -11.416 1.128) 11.858 13.276 ( -4.110 -2.072 1.014) 4.714 13.615 ( 4.317 6.001 -0.316) 7.399 15.904 ( -1.865 4.388 0.529) 4.798 16.073 ( 0.706 -5.562 1.297) 5.755 17.204 ( -5.229 -3.797 0.741) 6.504 18.149 ( -3.907 -8.491 0.928) 9.393 19.321 ( -1.211 -0.689 -3.192) 3.482 20.680 ( 7.080 4.706 1.643) 8.659 22.375 ( -0.257 -6.603 0.228) 6.612 22.973 ( 1.254 9.139 0.085) 9.225 ======================= Grid point 225 (79/267) ======================= q-point: (-0.43 0.07 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.242 ( 0.097 0.892 -2.321) 2.489 2.682 ( -4.052 -3.834 -2.066) 5.949 2.911 ( -0.147 6.503 0.089) 6.505 3.221 ( 1.728 -1.795 3.611) 4.388 3.633 ( 3.557 -2.197 2.056) 4.659 3.910 ( -3.153 5.029 1.815) 6.207 4.145 ( 11.395 -0.175 -6.679) 13.209 4.293 ( -0.417 1.630 1.908) 2.544 4.824 ( -1.809 -1.461 0.392) 2.358 5.468 ( -0.570 2.669 -9.379) 9.768 5.685 ( 1.940 -7.834 -1.766) 8.261 5.760 ( -1.103 2.348 -1.819) 3.169 6.022 ( 1.099 0.438 1.738) 2.102 6.424 ( -2.926 -1.476 7.352) 8.049 6.441 ( -0.111 0.015 2.764) 2.766 6.851 ( 0.841 7.193 1.612) 7.419 7.321 ( -7.566 -3.458 -0.075) 8.319 8.098 ( -12.498 1.667 -0.683) 12.628 8.993 ( 10.024 2.410 -0.490) 10.321 9.505 ( 5.887 -1.549 -0.069) 6.088 9.864 ( -1.338 -5.501 -0.426) 5.678 10.051 ( 1.522 0.795 0.513) 1.792 10.362 ( -5.305 17.845 -0.577) 18.626 10.820 ( 8.460 -20.237 0.535) 21.941 11.924 ( -7.001 1.300 -0.474) 7.137 12.505 ( 4.908 0.352 0.864) 4.996 13.282 ( -4.808 -1.235 1.205) 5.109 13.552 ( 1.860 3.273 -0.545) 3.804 15.858 ( 0.044 -0.798 0.360) 0.876 16.137 ( 0.399 -0.478 1.453) 1.581 17.270 ( 0.318 -4.731 1.052) 4.857 18.256 ( 0.991 -4.275 0.528) 4.420 19.296 ( -0.821 2.133 -2.313) 3.252 20.644 ( 2.650 3.193 0.885) 4.243 22.458 ( 0.564 -1.266 0.351) 1.429 22.829 ( -4.032 4.317 0.140) 5.909 ======================= Grid point 226 (80/267) ======================= q-point: (-0.36 0.07 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.185 ( -0.211 4.755 -2.153) 5.224 2.711 ( -2.467 -1.178 -1.798) 3.272 2.777 ( -1.748 6.754 2.242) 7.328 3.261 ( 2.179 0.455 -1.347) 2.602 3.589 ( -1.417 8.803 5.595) 10.526 3.842 ( 0.249 0.147 0.504) 0.581 4.146 ( 10.473 5.848 -6.663) 13.722 4.243 ( -1.575 4.408 2.187) 5.167 4.851 ( -0.915 -2.244 1.114) 2.667 5.353 ( -1.959 6.709 -6.027) 9.229 5.635 ( -3.222 6.477 -3.811) 8.176 5.824 ( 4.006 -2.877 -4.923) 6.969 6.055 ( 0.578 -2.701 2.748) 3.897 6.395 ( -7.332 1.730 9.227) 11.912 6.441 ( 8.139 4.745 -0.165) 9.422 6.644 ( -5.070 12.305 1.411) 13.383 7.315 ( -8.042 -1.582 0.597) 8.217 7.989 ( -12.861 -1.037 0.430) 12.910 8.953 ( 11.117 11.767 -0.828) 16.209 9.410 ( 2.138 11.223 -0.395) 11.432 9.666 ( -4.931 29.050 -0.168) 29.466 10.055 ( 8.856 -12.986 -0.065) 15.718 10.374 ( 2.362 -12.414 0.287) 12.640 11.357 ( 5.601 -15.733 0.342) 16.704 11.734 ( -5.695 3.958 -0.079) 6.935 12.408 ( 4.234 14.585 0.409) 15.192 13.261 ( -3.637 -0.297 0.927) 3.765 13.521 ( -1.526 -0.095 -0.336) 1.566 15.941 ( 0.107 -7.765 0.907) 7.818 16.126 ( 2.380 2.166 0.784) 3.312 17.374 ( 5.575 -3.656 0.584) 6.692 18.332 ( 6.124 -1.202 1.137) 6.344 19.211 ( -1.352 6.003 -2.066) 6.491 20.610 ( -1.815 0.902 0.738) 2.157 22.397 ( 0.567 7.969 -0.657) 8.016 22.793 ( -8.123 -4.838 0.948) 9.502 ======================= Grid point 227 (81/267) ======================= q-point: (-0.29 0.07 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.050 ( -0.064 9.557 -1.067) 9.616 2.557 ( -3.217 13.452 2.897) 14.132 2.734 ( -1.049 0.836 -0.977) 1.659 3.162 ( -0.643 9.881 -4.665) 10.946 3.473 ( 0.029 2.203 5.444) 5.873 3.835 ( 2.751 4.422 -1.340) 5.378 4.054 ( 2.634 9.388 -3.540) 10.374 4.141 ( 1.123 4.089 2.468) 4.907 4.884 ( -1.559 -0.919 2.780) 3.317 5.186 ( -2.631 7.024 -4.982) 9.005 5.449 ( -2.248 10.370 -2.665) 10.940 5.848 ( 3.868 1.658 -7.541) 8.636 6.116 ( -0.905 -2.289 2.083) 3.224 6.204 ( -5.410 18.563 -0.053) 19.335 6.315 ( -7.824 3.030 7.939) 11.551 6.540 ( 13.179 4.082 0.397) 13.802 7.257 ( -11.952 -0.208 1.501) 12.048 7.921 ( -8.982 2.401 1.277) 9.385 8.674 ( 7.821 25.467 -0.749) 26.651 9.155 ( -3.306 19.744 0.104) 20.019 9.282 ( 5.074 5.594 -1.219) 7.650 10.355 ( 13.240 -4.186 0.147) 13.887 10.611 ( 5.005 -10.356 0.537) 11.515 11.076 ( -15.027 19.194 0.859) 24.392 11.974 ( 6.509 16.640 -0.654) 17.880 12.190 ( 3.738 -17.328 0.301) 17.729 13.270 ( -1.619 -2.939 0.328) 3.372 13.534 ( -4.235 -3.506 0.122) 5.499 16.069 ( 4.359 0.332 -0.445) 4.394 16.188 ( 2.297 -11.382 0.726) 11.634 17.480 ( 9.491 -1.666 -0.212) 9.638 18.406 ( 11.558 0.344 2.314) 11.793 19.030 ( -3.594 11.631 -2.149) 12.362 20.586 ( -6.846 -1.356 0.529) 6.999 22.212 ( -0.977 10.787 -0.938) 10.872 22.846 ( -8.596 -6.233 1.113) 10.677 ======================= Grid point 228 (82/267) ======================= q-point: (-0.21 0.07 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.820 ( 0.090 15.388 0.736) 15.406 2.194 ( -6.061 23.087 6.708) 24.794 2.676 ( 1.832 4.826 -4.682) 6.969 2.975 ( -1.905 7.449 -2.864) 8.205 3.448 ( -0.264 7.559 -0.162) 7.566 3.618 ( 3.410 15.570 -1.483) 16.008 3.948 ( -2.343 1.540 2.224) 3.579 4.109 ( 2.025 1.959 1.256) 3.085 4.806 ( -4.462 7.936 1.780) 9.277 5.113 ( -0.337 -1.759 -2.125) 2.779 5.226 ( 0.541 12.145 -1.634) 12.266 5.709 ( -1.999 18.007 -2.949) 18.357 5.870 ( -4.606 5.140 -4.323) 8.144 6.153 ( 0.512 0.686 0.200) 0.879 6.235 ( -4.765 1.320 5.805) 7.626 6.531 ( 17.525 11.036 0.092) 20.710 7.189 ( -13.565 -3.206 1.661) 14.038 7.656 ( -7.926 22.704 1.119) 24.073 8.170 ( 5.616 31.774 -0.573) 32.272 8.939 ( -0.690 2.918 0.755) 3.093 9.249 ( 9.024 3.864 -1.736) 9.969 10.132 ( 0.444 25.519 1.097) 25.546 10.781 ( -4.546 6.940 1.043) 8.361 10.946 ( 2.656 -15.609 0.124) 15.834 11.567 ( 1.753 16.867 -0.177) 16.959 12.681 ( 5.511 -23.604 -0.977) 24.259 13.348 ( -0.132 -6.211 -0.267) 6.218 13.580 ( -5.251 -4.945 0.491) 7.230 16.075 ( 13.363 4.248 -6.762) 15.567 16.476 ( -1.481 -17.068 2.680) 17.341 17.570 ( 12.659 0.707 -1.088) 12.725 18.509 ( 15.561 -0.405 2.300) 15.735 18.703 ( -7.177 19.453 -1.702) 20.804 20.544 ( -15.571 -2.271 -2.254) 15.897 22.009 ( 1.132 10.396 1.623) 10.583 22.877 ( -7.844 -3.051 0.615) 8.439 ======================= Grid point 229 (83/267) ======================= q-point: (-0.14 0.07 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.493 ( 0.316 20.463 3.953) 20.844 1.687 ( -7.927 26.899 10.585) 29.974 2.582 ( 4.390 5.972 -7.544) 10.576 2.801 ( -2.755 12.884 -6.271) 14.591 3.001 ( -0.748 29.482 5.995) 30.095 3.567 ( 2.668 -0.884 -3.050) 4.147 3.927 ( -2.014 -0.349 2.175) 2.985 4.090 ( -0.333 1.454 1.161) 1.891 4.596 ( -2.163 11.210 1.412) 11.504 5.013 ( 4.752 12.808 -2.100) 13.822 5.158 ( -1.434 -0.267 -0.780) 1.654 5.330 ( -5.507 15.853 0.404) 16.787 5.751 ( -4.762 6.164 -2.270) 8.113 6.119 ( 3.131 3.172 -0.569) 4.493 6.197 ( -3.938 2.437 -2.208) 5.131 6.382 ( 12.048 16.235 3.477) 20.514 6.970 ( -2.645 39.867 1.951) 40.002 7.147 ( -8.718 6.530 -1.594) 11.009 7.734 ( 3.336 13.142 1.121) 13.606 8.968 ( -0.901 -4.643 1.030) 4.840 9.261 ( 12.405 2.996 -1.632) 12.865 9.755 ( -4.577 12.223 1.958) 13.198 10.381 ( -8.162 26.490 0.179) 27.719 11.301 ( 5.530 -17.266 0.410) 18.135 11.507 ( 0.172 -5.824 0.100) 5.828 13.094 ( 2.820 -17.929 -2.920) 18.383 13.499 ( 1.885 -9.785 -0.583) 9.982 13.636 ( -4.761 -4.977 0.576) 6.912 16.062 ( 20.535 9.082 -18.248) 28.934 16.761 ( -3.142 -13.916 3.432) 14.673 17.609 ( 15.089 7.991 -2.565) 17.266 18.208 ( -18.113 20.572 -5.863) 28.030 18.666 ( 21.790 -0.415 4.514) 22.256 20.352 ( -34.992 4.642 -14.363) 38.108 21.922 ( 12.140 2.963 13.053) 18.070 22.842 ( -5.111 1.572 -0.082) 5.348 ======================= Grid point 230 (84/267) ======================= q-point: (-0.07 0.07 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.100 ( -4.851 22.436 11.597) 25.718 1.206 ( -1.920 21.505 15.795) 26.751 2.179 ( 0.899 42.832 3.118) 42.954 2.516 ( 6.107 4.604 -10.022) 12.606 2.702 ( -0.253 11.257 2.855) 11.616 3.606 ( 1.188 -3.028 -6.272) 7.065 3.951 ( -1.447 -2.912 1.598) 3.623 4.017 ( -4.455 5.547 -2.570) 7.565 4.415 ( 5.906 9.732 5.054) 12.455 4.748 ( 4.622 27.793 -1.998) 28.245 4.829 ( -4.469 21.083 -3.340) 21.808 5.212 ( -3.848 3.081 -1.328) 5.105 5.577 ( -6.942 4.651 3.922) 9.230 5.948 ( -6.650 17.744 -3.447) 19.261 6.079 ( 8.072 7.640 -3.083) 11.534 6.188 ( -3.118 2.999 1.384) 4.542 6.464 ( 9.689 15.569 8.368) 20.157 6.863 ( -2.592 13.623 -2.745) 14.137 7.786 ( 2.191 -10.975 0.946) 11.231 9.055 ( -2.363 -5.026 0.956) 5.636 9.278 ( 4.586 4.635 -1.392) 6.668 9.599 ( -3.532 2.980 2.570) 5.288 9.845 ( -1.505 23.538 -0.403) 23.589 11.639 ( 1.900 -15.538 0.293) 15.656 11.653 ( -1.857 -8.890 0.165) 9.083 13.361 ( -0.213 -10.953 -6.511) 12.744 13.676 ( 0.790 -3.742 -0.554) 3.865 13.760 ( 0.406 -14.434 -0.026) 14.440 15.784 ( 13.544 38.942 -51.068) 65.634 16.911 ( -3.443 -1.656 1.964) 4.296 17.302 ( 7.401 26.111 -6.281) 27.857 17.911 ( -9.077 -1.064 -1.695) 9.295 18.817 ( 10.893 1.832 -1.098) 11.100 19.686 ( -48.834 27.525 -24.516) 61.183 22.244 ( 21.294 -20.403 27.116) 40.062 22.771 ( 4.270 3.759 -0.306) 5.697 ======================= Grid point 233 (85/267) ======================= q-point: ( 0.14 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.038 ( 15.864 -0.000 12.264) 20.052 1.082 ( 19.868 -0.000 10.942) 22.682 1.587 ( 14.753 -0.000 6.724) 16.214 2.339 ( 1.704 -0.000 -7.173) 7.372 2.677 ( 10.016 -0.000 4.351) 10.920 3.236 ( -9.448 0.000 1.369) 9.546 3.705 ( -2.521 0.000 -0.757) 2.632 3.794 ( 4.216 -0.000 0.158) 4.219 3.832 ( -7.014 0.000 -16.185) 17.640 4.260 ( 2.869 -0.000 0.716) 2.957 4.578 ( 3.134 -0.000 -6.137) 6.891 4.975 ( 8.149 -0.000 4.085) 9.116 5.413 ( -10.369 0.000 8.872) 13.646 5.560 ( 1.181 -0.000 -0.341) 1.229 6.159 ( -1.082 0.000 -3.032) 3.219 6.188 ( -19.975 0.000 9.040) 21.925 6.557 ( -3.006 0.000 1.776) 3.491 6.837 ( 6.601 -0.000 2.799) 7.169 7.286 ( -0.131 0.000 -0.030) 0.134 9.058 ( 7.220 -0.000 -1.271) 7.331 9.184 ( 0.690 -0.000 -1.542) 1.690 9.582 ( 2.920 -0.000 -1.585) 3.322 10.825 ( -2.342 0.000 -0.124) 2.346 10.968 ( 30.204 -0.000 -10.505) 31.979 11.760 ( -7.027 0.000 -0.754) 7.067 12.070 ( 3.305 -0.000 -15.386) 15.737 13.543 ( -8.628 0.000 -0.727) 8.658 13.956 ( 11.734 -0.000 0.168) 11.735 14.229 ( 0.435 -0.000 0.077) 0.442 16.557 ( -49.810 0.000 19.885) 53.632 16.861 ( -0.133 0.000 0.045) 0.141 17.971 ( 0.049 -0.000 -0.066) 0.083 18.033 ( 43.416 -0.000 -35.481) 56.070 20.163 ( 43.021 -0.000 20.574) 47.687 22.136 ( -26.371 0.000 -4.637) 26.775 23.865 ( 4.520 -0.000 -17.247) 17.830 ======================= Grid point 234 (86/267) ======================= q-point: ( 0.21 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.199 ( 19.786 -4.696 6.572) 21.371 1.354 ( 10.190 -7.940 8.363) 15.390 1.902 ( 15.635 -21.317 -6.554) 27.236 2.448 ( 2.181 -9.451 -6.455) 11.651 2.805 ( 7.410 -5.362 10.651) 14.040 3.336 ( -7.686 -9.726 -3.019) 12.758 3.627 ( -5.406 -0.245 -0.983) 5.500 3.976 ( -4.352 -25.697 -4.784) 26.498 4.210 ( 1.377 -26.730 1.374) 26.800 4.257 ( 2.491 -2.002 -0.503) 3.235 4.619 ( -0.133 -6.362 -4.943) 8.058 5.124 ( 9.469 -6.438 0.993) 11.493 5.366 ( -1.631 0.259 9.432) 9.575 5.589 ( 0.376 -2.401 -0.393) 2.462 6.093 ( -8.769 -3.470 2.018) 9.644 6.149 ( -3.756 -2.688 -2.826) 5.415 6.525 ( -1.581 1.932 0.957) 2.674 6.854 ( 13.215 -1.183 2.648) 13.529 7.490 ( -9.013 -13.348 -0.010) 16.106 8.958 ( 11.565 11.760 -1.076) 16.529 9.132 ( -1.236 3.026 1.117) 3.454 9.621 ( 1.993 -2.719 -1.664) 3.760 10.639 ( 21.420 5.628 1.119) 22.175 11.349 ( -13.932 -2.128 -0.822) 14.118 11.630 ( -13.866 5.386 0.249) 14.877 12.712 ( -6.633 -62.737 -23.363) 67.274 13.409 ( -11.687 5.760 0.213) 13.031 13.948 ( 4.134 9.153 -0.751) 10.071 14.156 ( 6.965 5.615 0.491) 8.960 16.511 ( -43.670 -24.558 16.639) 52.792 16.858 ( -0.011 0.225 -0.289) 0.366 17.746 ( 6.001 15.559 -3.586) 17.057 18.500 ( 22.560 -19.128 -27.378) 40.304 20.511 ( 35.143 -0.099 23.787) 42.437 21.931 ( -21.362 0.375 -6.112) 22.222 23.740 ( 7.317 10.828 -12.775) 18.276 ======================= Grid point 235 (87/267) ======================= q-point: ( 0.29 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.532 ( 17.774 -15.834 0.189) 23.805 1.600 ( 12.593 -8.527 2.748) 15.455 2.406 ( 7.616 -22.094 -7.119) 24.430 2.625 ( 3.057 -9.018 -7.928) 12.390 3.014 ( 1.245 -10.272 11.194) 15.244 3.370 ( -2.202 -0.853 -2.470) 3.417 3.685 ( -5.860 -8.385 3.540) 10.825 4.224 ( 5.364 0.711 0.857) 5.478 4.466 ( -6.745 -24.611 -1.196) 25.547 4.604 ( -2.212 -10.141 -1.723) 10.522 4.988 ( 2.833 -27.939 -0.207) 28.083 5.250 ( -6.304 -7.627 -0.685) 9.919 5.521 ( 13.871 -7.431 8.256) 17.770 5.649 ( -1.697 -5.848 -3.477) 7.012 6.177 ( 6.483 -3.224 0.694) 7.273 6.340 ( -3.183 -23.922 -0.829) 24.147 6.496 ( -3.562 -4.183 -1.015) 5.587 7.092 ( 8.159 -14.746 1.517) 16.920 7.588 ( -3.578 -4.615 -0.232) 5.844 8.914 ( 9.841 2.360 -0.459) 10.131 9.063 ( -0.147 3.849 1.598) 4.170 9.715 ( 1.117 -7.065 -1.183) 7.250 10.758 ( 17.312 1.586 1.764) 17.474 11.146 ( -13.496 6.379 -0.573) 14.938 11.411 ( -12.148 7.079 0.244) 14.062 13.092 ( -7.627 13.547 -1.241) 15.596 13.555 ( -14.583 -13.544 -8.071) 21.477 13.952 ( -13.158 -33.643 -5.617) 36.559 14.131 ( 7.477 3.833 -0.100) 8.403 16.689 ( -22.102 -9.875 8.159) 25.546 16.916 ( -12.031 -16.096 4.254) 20.541 17.498 ( 1.577 13.320 -0.461) 13.421 18.879 ( 10.744 -14.079 -21.948) 28.202 20.756 ( 22.340 1.825 20.501) 30.376 21.831 ( -10.149 -4.026 -5.295) 12.135 23.585 ( 8.594 9.718 -7.603) 15.036 ======================= Grid point 236 (88/267) ======================= q-point: ( 0.36 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.846 ( 11.487 -7.719 0.757) 13.861 2.000 ( 14.588 -20.001 -3.070) 24.946 2.750 ( 3.426 -12.177 -1.427) 12.730 2.804 ( 4.534 -10.278 -8.333) 13.986 3.215 ( -6.322 -10.887 3.381) 13.036 3.374 ( 1.088 -0.703 1.888) 2.289 3.825 ( -3.651 -9.097 5.388) 11.186 4.252 ( 7.181 1.201 0.295) 7.287 4.733 ( -1.038 -6.183 -0.797) 6.320 4.791 ( -5.526 -15.596 -0.975) 16.575 5.277 ( -3.641 -9.713 -5.813) 11.891 5.502 ( -0.073 -17.777 2.673) 17.977 5.653 ( -2.375 -3.641 2.872) 5.211 5.851 ( 5.454 -10.594 -0.400) 11.922 6.355 ( 14.002 -7.865 3.517) 16.441 6.434 ( 2.476 1.690 0.243) 3.007 6.981 ( -16.380 -31.644 -1.365) 35.658 7.493 ( 8.248 -24.409 0.555) 25.771 7.757 ( 11.361 -14.360 -0.824) 18.330 8.915 ( 0.176 1.792 0.595) 1.897 9.053 ( 5.899 -0.660 0.254) 5.941 9.895 ( -0.232 -11.181 -0.582) 11.198 10.641 ( -10.270 10.668 0.527) 14.817 11.119 ( -11.131 -4.791 0.440) 12.126 11.288 ( 12.462 -1.496 0.157) 12.553 12.722 ( -9.548 18.632 -0.187) 20.936 13.443 ( -6.283 5.964 -2.330) 8.971 14.052 ( 8.979 8.898 1.212) 12.699 14.669 ( -20.976 -46.579 -5.166) 51.345 16.581 ( -4.644 9.164 2.752) 10.636 17.239 ( -19.356 -26.322 6.191) 33.254 17.293 ( -2.629 8.168 -0.348) 8.588 19.092 ( 3.184 -8.585 -14.587) 17.223 20.874 ( 14.924 3.734 12.975) 20.125 21.896 ( -2.799 -8.294 -2.633) 9.141 23.462 ( 6.283 8.574 -3.789) 11.284 ======================= Grid point 237 (89/267) ======================= q-point: ( 0.43 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( 7.788 -5.947 -0.172) 9.800 2.377 ( 6.443 -11.720 -3.555) 13.839 2.930 ( 1.935 -5.941 1.211) 6.365 3.060 ( 9.575 -13.222 -8.875) 18.581 3.298 ( -6.099 -2.830 5.581) 8.738 3.466 ( 0.698 -8.952 -0.281) 8.983 3.979 ( -2.412 -8.364 4.470) 9.785 4.285 ( 8.223 1.369 -0.042) 8.336 4.789 ( -2.916 -1.976 0.590) 3.572 5.016 ( -1.917 -12.799 -1.314) 13.008 5.407 ( -3.235 -8.263 -9.905) 13.298 5.708 ( -6.145 -5.687 -0.195) 8.375 5.798 ( 5.745 -11.055 3.189) 12.860 6.036 ( -0.614 -8.001 4.336) 9.121 6.412 ( 0.696 1.298 1.532) 2.125 6.673 ( 17.841 -10.186 2.956) 20.755 7.142 ( -19.843 -8.201 -1.252) 21.508 8.029 ( 9.403 -13.387 -1.173) 16.401 8.247 ( 12.121 -29.308 0.583) 31.721 8.976 ( 1.693 -10.431 0.939) 10.609 9.128 ( 4.625 -3.305 -0.396) 5.698 9.988 ( -9.599 0.866 -0.035) 9.638 10.454 ( -5.587 0.529 0.229) 5.617 11.127 ( -15.391 -12.876 -0.648) 20.078 11.587 ( 18.331 -11.160 0.722) 21.473 12.284 ( -8.757 20.013 -0.194) 21.846 13.301 ( -6.447 3.654 -0.778) 7.451 13.935 ( 6.923 10.057 0.685) 12.229 15.296 ( -11.469 -34.666 -0.947) 36.526 16.351 ( -0.033 13.265 2.012) 13.417 17.155 ( -6.633 3.061 -0.689) 7.338 17.581 ( -14.078 -22.541 3.491) 26.804 19.205 ( 0.347 -5.509 -8.674) 10.281 20.904 ( 11.887 5.948 7.020) 15.032 22.055 ( -0.353 -9.903 -0.827) 9.944 23.331 ( 3.450 9.076 -1.488) 9.823 ======================= Grid point 238 (90/267) ======================= q-point: ( 0.50 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.175 ( 3.727 -3.734 -0.961) 5.363 2.530 ( -0.312 -4.786 -2.711) 5.509 3.020 ( 1.768 -2.343 0.020) 2.935 3.213 ( 1.057 1.409 1.290) 2.183 3.407 ( 4.208 -9.303 0.995) 10.258 3.703 ( 3.556 -14.662 -3.337) 15.452 4.091 ( -0.543 -3.479 3.482) 4.952 4.326 ( 7.892 0.594 -0.787) 7.953 4.789 ( -3.185 -0.758 0.828) 3.377 5.238 ( 0.276 -12.168 -2.677) 12.462 5.481 ( -2.759 -4.677 -7.875) 9.566 5.757 ( -3.581 -3.384 -1.590) 5.177 5.990 ( 3.532 -4.680 0.859) 5.926 6.190 ( -2.630 -8.726 7.649) 11.898 6.408 ( 1.253 -0.248 1.512) 1.979 6.926 ( 9.843 -4.058 2.362) 10.906 7.137 ( -13.246 -6.114 -0.718) 14.607 8.142 ( -2.184 -0.140 -1.053) 2.429 8.806 ( 13.047 -17.864 0.563) 22.129 9.206 ( 2.410 -8.375 -0.073) 8.715 9.347 ( 2.242 -17.937 0.034) 18.076 9.866 ( -5.447 -1.018 0.112) 5.543 10.425 ( -0.811 2.604 0.584) 2.789 11.368 ( -16.556 -17.711 -1.492) 24.290 11.609 ( 2.205 17.556 0.240) 17.696 12.164 ( 7.339 -12.033 0.561) 14.106 13.217 ( -6.737 0.060 0.293) 6.744 13.797 ( 5.214 9.481 0.121) 10.821 15.746 ( -5.355 -19.276 0.790) 20.021 16.143 ( 4.036 9.779 1.171) 10.644 17.087 ( -8.486 -2.243 -0.133) 8.778 17.871 ( -8.279 -17.126 1.395) 19.073 19.272 ( 0.085 -3.256 -4.760) 5.768 20.867 ( 9.251 7.512 3.448) 12.405 22.230 ( 0.089 -8.837 0.001) 8.838 23.168 ( 1.041 10.260 -0.413) 10.321 ======================= Grid point 239 (91/267) ======================= q-point: ( 0.57 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( 0.862 -1.300 -1.838) 2.411 2.584 ( -2.323 -3.442 -0.762) 4.221 3.022 ( 1.974 4.170 -0.787) 4.681 3.199 ( -1.196 -1.156 3.765) 4.116 3.586 ( 4.616 -6.234 1.272) 7.861 3.929 ( 0.824 -4.319 -1.186) 4.554 4.152 ( 5.673 -3.395 -0.561) 6.635 4.353 ( 5.807 2.239 -2.414) 6.675 4.787 ( -1.903 -1.155 0.900) 2.401 5.411 ( -1.335 -5.974 -9.871) 11.615 5.552 ( 0.226 -6.965 1.435) 7.115 5.768 ( -1.589 -0.337 -1.765) 2.399 6.034 ( -0.084 -0.026 -1.749) 1.751 6.317 ( -5.576 -5.198 9.257) 11.991 6.458 ( 5.064 -2.189 0.740) 5.566 6.978 ( 1.779 2.572 1.691) 3.555 7.170 ( -7.762 -4.938 0.558) 9.216 8.053 ( -11.497 3.700 -0.494) 12.088 9.069 ( 11.263 -3.231 -0.277) 11.720 9.418 ( 4.533 -10.523 -0.060) 11.458 9.613 ( -4.578 -14.689 -0.116) 15.386 10.042 ( 3.631 -8.628 -0.234) 9.364 10.413 ( 7.700 -4.464 0.794) 8.935 10.977 ( -9.574 27.310 -0.227) 28.941 11.744 ( -6.981 -14.108 -0.744) 15.758 12.457 ( 7.738 -9.791 0.699) 12.499 13.197 ( -7.000 -2.727 0.907) 7.568 13.673 ( 3.617 7.252 -0.315) 8.110 15.869 ( -2.852 0.154 0.564) 2.911 16.119 ( 4.450 -1.469 1.235) 4.846 17.129 ( -5.553 -7.860 0.616) 9.643 18.098 ( -3.226 -11.943 0.261) 12.374 19.304 ( 0.531 -0.729 -2.213) 2.390 20.786 ( 6.102 7.716 1.299) 9.923 22.374 ( -0.155 -6.653 0.286) 6.661 22.968 ( -1.472 10.949 0.036) 11.048 ======================= Grid point 240 (92/267) ======================= q-point: (-0.36 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.233 ( -0.009 1.240 -2.016) 2.367 2.635 ( -1.741 -3.716 1.140) 4.259 2.914 ( 0.045 7.504 0.822) 7.549 3.244 ( 0.165 -2.676 0.302) 2.698 3.701 ( 3.773 -0.842 2.961) 4.869 3.879 ( -2.449 5.206 2.559) 6.296 4.260 ( 2.211 -1.759 -2.005) 3.465 4.318 ( 8.815 5.240 -6.661) 12.228 4.812 ( -0.056 -1.936 1.476) 2.435 5.405 ( -2.645 1.578 -7.366) 7.984 5.669 ( -1.522 -0.847 -3.657) 4.051 5.774 ( 2.495 -3.275 0.808) 4.195 6.024 ( -1.196 -0.691 -2.113) 2.524 6.347 ( -7.069 -1.545 8.052) 10.825 6.537 ( 7.648 -0.662 0.989) 7.741 6.864 ( -0.442 11.161 1.918) 11.333 7.200 ( -8.201 -4.236 1.407) 9.337 7.886 ( -14.463 1.916 0.356) 14.593 9.160 ( 11.738 2.262 -0.998) 11.996 9.592 ( 5.176 0.846 -0.167) 5.247 9.839 ( -1.556 -12.817 -0.301) 12.915 10.087 ( 3.062 4.034 0.570) 5.097 10.276 ( -5.824 19.117 -0.397) 19.989 10.964 ( 9.830 -26.099 0.437) 27.892 11.800 ( -8.737 2.462 -0.011) 9.077 12.591 ( 5.755 1.521 0.453) 5.970 13.199 ( -6.536 -2.434 1.074) 7.057 13.580 ( 1.926 5.234 -0.463) 5.596 15.859 ( -0.176 -1.655 0.333) 1.697 16.154 ( 0.969 0.261 1.494) 1.799 17.275 ( -0.170 -9.212 0.732) 9.243 18.269 ( 0.639 -7.809 -0.335) 7.842 19.291 ( 0.993 2.605 -0.139) 2.791 20.685 ( 2.456 6.494 -0.196) 6.946 22.468 ( 0.808 -2.569 -0.019) 2.694 22.759 ( -5.161 8.051 0.630) 9.585 ======================= Grid point 241 (93/267) ======================= q-point: (-0.29 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.180 ( 0.665 4.567 -1.067) 4.737 2.690 ( -0.254 -1.565 1.408) 2.120 2.765 ( -1.252 7.946 2.433) 8.404 3.268 ( 0.487 1.302 -4.295) 4.515 3.598 ( -1.480 10.416 7.034) 12.655 3.859 ( 1.115 -1.549 1.009) 2.159 4.206 ( -4.202 4.198 -0.023) 5.940 4.270 ( 10.713 7.901 -9.633) 16.432 4.857 ( 0.648 -1.898 2.948) 3.566 5.297 ( -2.002 6.611 -4.135) 8.050 5.575 ( -2.484 6.198 -4.878) 8.269 5.859 ( 3.465 -1.604 -4.017) 5.542 6.047 ( -2.356 -3.309 -0.646) 4.113 6.311 ( -6.809 1.761 6.391) 9.503 6.533 ( 1.657 15.014 1.346) 15.165 6.657 ( 6.391 2.168 1.868) 7.003 7.187 ( -9.125 -0.082 2.589) 9.486 7.821 ( -9.469 -3.833 1.118) 10.276 9.116 ( 10.036 13.579 -1.178) 16.927 9.434 ( 1.488 10.845 -0.698) 10.969 9.594 ( -4.208 29.244 0.135) 29.545 10.174 ( 6.557 -19.042 0.159) 20.140 10.404 ( 1.507 -14.130 0.094) 14.210 11.403 ( 0.409 10.359 0.647) 10.387 11.679 ( -1.548 -18.868 0.302) 18.934 12.462 ( 2.637 16.307 0.237) 16.521 13.205 ( -3.772 -2.479 0.935) 4.610 13.509 ( -0.182 2.590 -0.320) 2.616 15.945 ( -0.128 -7.576 0.897) 7.630 16.156 ( 1.260 -0.036 0.564) 1.381 17.445 ( 3.508 -7.359 0.556) 8.171 18.397 ( 2.265 -5.089 -1.590) 5.793 19.215 ( 1.992 7.313 2.696) 8.044 20.585 ( -1.663 4.535 -1.777) 5.147 22.410 ( 1.941 9.933 -0.097) 10.121 22.682 ( -7.229 -4.697 1.162) 8.699 ======================= Grid point 242 (94/267) ======================= q-point: (-0.21 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.060 ( 1.532 9.566 0.452) 9.698 2.534 ( -1.910 15.033 3.542) 15.562 2.733 ( 0.987 0.606 1.643) 2.010 3.129 ( -1.051 10.668 -5.256) 11.938 3.491 ( -0.893 1.709 4.370) 4.776 3.877 ( 3.173 2.850 -0.597) 4.306 4.031 ( -4.464 11.038 -0.694) 11.926 4.173 ( 3.934 5.199 -5.478) 8.516 4.881 ( -1.180 1.356 4.315) 4.675 5.150 ( 0.983 6.188 -3.059) 6.972 5.408 ( -1.853 8.870 -3.289) 9.640 5.863 ( 2.697 2.103 -7.176) 7.949 6.056 ( -4.481 7.049 -2.504) 8.720 6.151 ( -1.581 8.149 -0.180) 8.303 6.281 ( -2.993 6.049 8.219) 10.635 6.769 ( 15.595 -1.400 1.218) 15.705 7.073 ( -13.200 3.704 3.384) 14.121 7.820 ( -4.970 1.396 1.061) 5.270 8.758 ( 3.210 27.928 -0.686) 28.121 9.121 ( -1.240 17.856 0.441) 17.904 9.344 ( 3.610 2.772 -1.524) 4.800 10.546 ( 11.689 -7.338 0.203) 13.802 10.658 ( 0.236 -13.363 0.220) 13.367 10.878 ( -10.964 26.786 1.383) 28.976 12.029 ( 1.799 24.282 -0.185) 24.349 12.237 ( 1.907 -24.988 0.070) 25.061 13.251 ( -0.839 -4.239 0.686) 4.375 13.493 ( -1.427 -1.559 -0.016) 2.113 16.109 ( 1.379 -6.785 0.303) 6.930 16.211 ( 0.479 -7.579 -0.687) 7.626 17.594 ( 5.028 -5.126 0.614) 7.207 18.466 ( -2.855 -2.163 -6.442) 7.371 19.070 ( 7.339 12.542 8.737) 16.955 20.475 ( -6.721 3.815 -4.801) 9.098 22.222 ( 2.415 10.878 2.148) 11.349 22.749 ( -4.733 -5.796 0.500) 7.499 ======================= Grid point 243 (95/267) ======================= q-point: (-0.14 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.843 ( 1.387 15.606 2.445) 15.857 2.155 ( -2.964 24.666 6.440) 25.665 2.702 ( 3.931 4.453 -2.174) 6.325 2.936 ( -1.482 7.842 -4.000) 8.927 3.441 ( -0.407 8.879 -0.661) 8.912 3.662 ( 2.333 15.476 -0.743) 15.669 3.918 ( -2.790 0.283 1.825) 3.346 4.112 ( -1.038 2.081 -1.558) 2.799 4.774 ( -1.006 8.693 2.273) 9.042 5.120 ( 1.955 -0.773 -0.875) 2.277 5.226 ( 0.880 9.118 -1.405) 9.268 5.673 ( 0.138 20.818 -2.156) 20.929 5.819 ( -0.210 5.156 -5.985) 7.903 6.133 ( -2.195 -0.677 -3.484) 4.173 6.205 ( -2.366 2.270 6.043) 6.875 6.772 ( 7.168 14.999 4.640) 17.259 7.024 ( -3.521 -8.619 -0.089) 9.311 7.587 ( -1.654 23.642 0.645) 23.709 8.214 ( 0.454 30.592 -0.168) 30.596 8.931 ( -0.709 2.907 0.722) 3.078 9.334 ( 2.213 0.910 -1.552) 2.852 10.137 ( -1.019 30.788 1.613) 30.847 10.722 ( -0.581 7.435 0.055) 7.458 10.990 ( 0.333 -18.429 0.692) 18.445 11.577 ( 0.227 17.019 0.010) 17.021 12.718 ( 0.002 -23.402 -1.285) 23.437 13.356 ( 1.343 -7.035 0.504) 7.180 13.538 ( -0.540 -3.780 0.169) 3.822 16.176 ( 4.494 -0.271 -8.020) 9.197 16.446 ( -4.272 -16.321 3.226) 17.177 17.707 ( 3.615 -3.404 1.379) 5.153 18.310 ( -17.518 10.833 -12.921) 24.314 18.977 ( 19.085 9.237 14.611) 25.749 20.290 ( -12.110 8.168 -11.345) 18.495 22.095 ( 6.356 6.324 6.896) 11.311 22.810 ( -0.637 -2.836 -0.076) 2.907 ======================= Grid point 244 (96/267) ======================= q-point: (-0.07 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.512 ( -1.669 21.510 6.851) 22.636 1.674 ( 1.328 25.836 7.303) 26.881 2.634 ( 6.656 5.707 -6.201) 10.739 2.742 ( -1.080 14.341 -6.909) 15.955 3.055 ( 3.380 26.470 7.803) 27.803 3.564 ( -1.261 -0.027 -3.553) 3.770 3.908 ( -2.031 -0.602 1.138) 2.404 4.059 ( -2.684 2.454 0.524) 3.675 4.620 ( 3.670 8.510 1.942) 9.469 5.032 ( -2.143 9.464 -1.256) 9.784 5.157 ( 3.183 6.273 -1.501) 7.193 5.311 ( 3.044 15.399 0.764) 15.716 5.673 ( -4.177 8.317 -4.668) 10.412 6.076 ( -4.664 4.220 -3.511) 7.203 6.185 ( -0.219 0.225 3.879) 3.892 6.496 ( -0.892 18.181 1.727) 18.285 6.959 ( 1.552 33.457 2.312) 33.573 7.132 ( 8.221 9.526 -2.138) 12.763 7.757 ( -1.125 12.288 1.515) 12.432 8.949 ( -2.103 -4.031 0.565) 4.582 9.296 ( -8.361 2.491 -0.926) 8.773 9.738 ( 2.391 12.622 1.701) 12.958 10.374 ( 7.314 26.839 0.022) 27.818 11.307 ( -5.189 -17.238 0.502) 18.009 11.507 ( -0.132 -5.682 0.097) 5.685 13.075 ( -3.216 -17.141 -3.165) 17.725 13.535 ( 1.532 -10.697 0.077) 10.806 13.621 ( 3.740 -4.215 0.224) 5.639 16.094 ( -6.569 9.594 -20.265) 23.364 16.710 ( -5.452 -14.231 4.229) 15.815 17.766 ( -2.263 -0.881 4.172) 4.827 17.795 ( -19.856 23.130 -11.365) 32.534 19.016 ( 14.453 6.393 6.916) 17.251 19.921 ( -5.333 19.965 -17.307) 26.955 22.146 ( 5.129 -5.015 11.689) 13.714 22.861 ( 9.686 -0.495 0.296) 9.703 ======================= Grid point 248 (97/267) ======================= q-point: ( 0.21 0.21 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.312 ( 15.100 -0.000 7.627) 16.917 1.355 ( 13.401 -0.000 2.031) 13.554 1.844 ( 21.321 -0.000 -7.053) 22.458 2.347 ( 3.226 -0.000 -5.451) 6.334 2.835 ( 6.325 -0.000 9.941) 11.782 3.106 ( -9.065 0.000 1.800) 9.242 3.642 ( -4.552 0.000 -1.805) 4.897 3.680 ( -5.926 0.000 -8.887) 10.681 3.859 ( 3.813 -0.000 0.469) 3.842 4.308 ( 3.125 -0.000 0.668) 3.196 4.533 ( -3.750 0.000 -3.811) 5.347 5.135 ( 3.156 -0.000 2.127) 3.806 5.415 ( 9.131 -0.000 12.202) 15.240 5.578 ( 1.523 -0.000 -0.314) 1.555 5.911 ( -17.582 0.000 -3.767) 17.981 6.152 ( 1.794 -0.000 -1.527) 2.355 6.546 ( -0.712 0.000 3.549) 3.620 6.995 ( 12.135 -0.000 1.534) 12.231 7.284 ( -0.184 0.000 -0.025) 0.185 9.146 ( 2.094 -0.000 2.501) 3.262 9.201 ( 5.292 -0.000 -3.446) 6.315 9.604 ( 1.004 -0.000 -2.340) 2.546 10.785 ( -2.891 0.000 -0.028) 2.891 11.207 ( 7.363 -0.000 -1.115) 7.447 11.556 ( -19.250 0.000 0.570) 19.259 12.122 ( 13.100 -0.000 -13.985) 19.162 13.404 ( -9.413 0.000 -0.335) 9.419 14.130 ( 11.137 -0.000 0.318) 11.142 14.236 ( 0.515 -0.000 0.035) 0.516 15.944 ( -44.324 0.000 13.451) 46.319 16.859 ( -0.157 0.000 0.054) 0.166 17.972 ( 0.054 -0.000 -0.073) 0.091 18.392 ( 26.285 -0.000 -27.857) 38.300 20.795 ( 23.119 -0.000 29.272) 37.301 21.772 ( -15.472 0.000 -8.559) 17.681 23.837 ( 2.087 -0.000 -15.653) 15.792 ======================= Grid point 249 (98/267) ======================= q-point: ( 0.29 0.21 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.461 ( 15.010 -3.721 -3.564) 15.870 1.574 ( 15.860 -10.490 6.456) 20.081 2.106 ( 16.809 -13.697 -8.978) 23.468 2.460 ( 3.134 -8.710 -5.498) 10.767 2.918 ( 0.998 -3.661 10.283) 10.961 3.242 ( -4.397 -13.417 0.861) 14.145 3.536 ( -6.237 -0.093 -0.641) 6.271 3.882 ( -5.366 -23.141 -3.625) 24.030 4.204 ( -1.327 -26.463 0.499) 26.501 4.325 ( 4.398 -0.765 1.069) 4.591 4.584 ( -1.550 -10.938 -1.655) 11.171 5.140 ( -5.182 -1.222 1.606) 5.562 5.556 ( 12.893 -2.336 12.593) 18.173 5.598 ( 3.243 -1.104 -2.157) 4.048 5.885 ( -12.804 -12.282 -7.382) 19.216 6.186 ( 7.752 -1.505 -0.774) 7.934 6.528 ( 0.493 2.210 2.229) 3.177 7.047 ( 11.860 0.140 1.504) 11.956 7.419 ( -1.076 -9.894 -0.256) 9.956 9.092 ( 0.601 7.265 -0.845) 7.339 9.155 ( 9.633 4.898 1.839) 10.962 9.624 ( -0.416 -2.770 -2.339) 3.650 10.889 ( 11.662 -6.952 0.961) 13.610 11.135 ( -16.524 7.216 -0.727) 18.046 11.405 ( -14.454 2.711 0.576) 14.717 12.589 ( 0.589 -40.419 -12.262) 42.242 13.256 ( -9.278 8.533 0.314) 12.610 13.975 ( 0.215 14.405 -0.698) 14.424 14.281 ( 8.729 1.842 1.025) 8.980 15.967 ( -38.789 -28.897 10.639) 49.525 16.856 ( -0.129 0.260 -0.236) 0.374 17.794 ( 2.379 15.132 -0.710) 15.334 18.667 ( 15.265 -13.118 -22.072) 29.870 20.950 ( 5.714 0.785 25.825) 26.461 21.708 ( -1.744 -1.930 -5.795) 6.352 23.757 ( 3.289 6.062 -12.188) 14.004 ======================= Grid point 250 (99/267) ======================= q-point: ( 0.36 0.21 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.718 ( 14.342 -12.398 -6.938) 20.188 1.901 ( 20.922 -8.745 5.565) 23.349 2.486 ( 6.543 -17.903 -4.754) 19.645 2.636 ( 3.292 -9.297 -7.518) 12.401 3.017 ( -5.342 -6.502 6.586) 10.686 3.372 ( 2.221 -1.763 0.794) 2.945 3.608 ( -6.978 -11.226 3.612) 13.702 4.264 ( -0.626 -10.931 -2.223) 11.172 4.392 ( -1.910 -15.617 -0.299) 15.737 4.553 ( -4.530 -12.047 2.254) 13.066 5.009 ( 0.815 -25.624 -1.477) 25.680 5.145 ( -7.829 -6.433 1.185) 10.202 5.616 ( 1.667 -2.230 -0.648) 2.858 5.769 ( 10.917 -5.620 5.135) 13.309 6.191 ( -9.345 -29.732 -3.552) 31.368 6.360 ( 14.031 -9.979 0.171) 17.219 6.494 ( 1.636 2.502 0.972) 3.143 7.214 ( 7.775 -10.785 1.129) 13.343 7.605 ( 6.084 -10.192 -0.849) 11.901 8.981 ( -1.399 4.826 0.716) 5.076 9.155 ( 11.563 3.895 0.995) 12.242 9.704 ( -1.677 -7.687 -1.748) 8.060 10.784 ( -18.658 13.367 -0.494) 22.958 11.064 ( 1.480 2.569 1.298) 3.236 11.315 ( 4.726 -4.423 0.217) 6.476 12.968 ( -9.194 14.876 0.617) 17.498 13.259 ( -16.899 -29.472 -7.898) 34.879 13.852 ( -1.252 -11.817 -1.094) 11.934 14.266 ( 8.323 6.629 1.392) 10.731 16.323 ( -28.619 -30.252 7.865) 42.380 16.851 ( -1.702 -1.545 -0.371) 2.329 17.515 ( 0.785 15.526 0.232) 15.548 18.920 ( 6.722 -9.984 -16.914) 20.759 21.013 ( 1.717 -0.649 16.850) 16.949 21.766 ( 3.179 -3.934 -1.367) 5.239 23.634 ( 3.418 7.392 -7.275) 10.920 ======================= Grid point 251 (100/267) ======================= q-point: ( 0.43 0.21 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.993 ( 10.210 -7.465 -4.162) 13.315 2.243 ( 17.336 -10.600 1.402) 20.368 2.788 ( 1.719 -11.672 0.916) 11.834 2.851 ( 7.284 -12.919 -8.314) 17.002 3.118 ( -7.989 -9.205 2.976) 12.546 3.411 ( 1.995 -1.087 2.274) 3.214 3.782 ( -4.833 -10.961 2.935) 12.333 4.339 ( 4.928 -0.871 -2.011) 5.393 4.700 ( -4.341 -9.216 0.994) 10.236 4.722 ( -2.471 -14.685 0.635) 14.905 5.191 ( -5.209 -8.434 -3.072) 10.378 5.418 ( -7.916 -17.183 -1.089) 18.950 5.725 ( 8.950 -6.232 -0.473) 10.916 5.934 ( 3.570 -5.532 4.466) 7.955 6.460 ( 1.748 2.249 1.518) 3.228 6.587 ( 7.800 -13.839 0.338) 15.889 6.740 ( -8.381 -19.693 -0.743) 21.415 7.654 ( 11.653 -30.647 0.715) 32.795 7.918 ( 11.599 -15.479 -1.437) 19.396 8.905 ( -1.382 0.852 1.410) 2.150 9.174 ( 9.189 2.589 -0.047) 9.547 9.860 ( -3.717 -9.028 -0.876) 9.802 10.432 ( -18.313 6.721 -0.525) 19.514 10.911 ( -13.336 3.281 0.437) 13.740 11.584 ( 23.981 -8.040 0.586) 25.299 12.589 ( -8.367 19.103 0.369) 20.858 13.293 ( -12.815 1.373 -2.593) 13.147 14.163 ( 5.499 8.264 0.593) 9.944 14.458 ( -6.657 -43.410 -0.848) 43.926 16.510 ( -6.981 -0.508 3.505) 7.828 17.001 ( -14.774 -21.529 2.100) 26.195 17.262 ( -1.585 10.023 -0.875) 10.186 19.075 ( 2.372 -7.138 -11.084) 13.395 21.069 ( 5.366 1.312 10.178) 11.580 21.887 ( 1.732 -7.430 -0.162) 7.631 23.501 ( 1.827 7.949 -3.513) 8.880 ======================= Grid point 252 (101/267) ======================= q-point: ( 0.50 0.21 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.139 ( 5.223 -3.600 -2.330) 6.758 2.467 ( 6.861 -3.880 -0.216) 7.885 2.950 ( -0.243 -5.761 2.124) 6.145 3.185 ( 12.096 -12.459 -9.256) 19.678 3.240 ( -4.560 -8.470 5.662) 11.162 3.488 ( 1.807 -7.919 0.986) 8.183 3.953 ( -3.093 -9.970 1.713) 10.578 4.385 ( 6.089 -0.283 -2.928) 6.762 4.750 ( -2.970 -1.577 1.945) 3.885 4.995 ( -0.741 -14.386 1.089) 14.446 5.303 ( -5.778 -8.440 -6.481) 12.109 5.598 ( -5.674 -9.628 -1.711) 11.306 5.926 ( 7.098 -6.242 -1.573) 9.582 6.069 ( 3.063 -6.351 7.032) 9.958 6.436 ( 1.579 1.494 1.048) 2.413 6.805 ( -12.326 -9.786 -0.323) 15.741 6.962 ( 7.206 -9.028 1.513) 11.650 8.117 ( 3.497 -3.736 -1.211) 5.258 8.428 ( 11.245 -32.280 0.666) 34.189 9.023 ( 4.064 -12.120 0.801) 12.808 9.212 ( 6.780 -1.458 -0.268) 6.940 9.833 ( -10.636 3.380 -0.031) 11.160 10.390 ( -3.642 -6.932 -0.164) 7.832 10.868 ( -17.805 -13.774 -0.750) 22.524 11.883 ( 19.775 -1.279 0.569) 19.825 12.179 ( -4.596 14.794 0.092) 15.492 13.170 ( -10.994 1.205 -0.799) 11.089 14.023 ( 4.776 10.481 0.457) 11.527 15.183 ( -4.374 -37.095 0.379) 37.354 16.379 ( 2.878 10.732 1.693) 11.239 17.029 ( -10.913 3.229 -0.324) 11.385 17.417 ( -8.812 -23.699 0.684) 25.294 19.184 ( 1.366 -5.432 -6.289) 8.422 21.069 ( 6.864 5.662 5.738) 10.588 22.058 ( 0.601 -9.657 0.043) 9.676 23.349 ( 0.279 8.975 -1.342) 9.079 ======================= Grid point 253 (102/267) ======================= q-point: ( 0.57 0.21 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.207 ( 1.278 -1.985 -2.250) 3.261 2.535 ( 1.732 -1.344 1.218) 2.508 3.039 ( 0.585 -3.593 0.100) 3.641 3.215 ( -1.584 2.963 2.419) 4.140 3.480 ( 4.695 -9.114 0.257) 10.256 3.763 ( 6.444 -14.626 -3.595) 16.382 4.093 ( -1.275 -6.223 2.267) 6.744 4.422 ( 6.682 0.564 -4.885) 8.297 4.756 ( -1.906 -1.101 2.104) 3.045 5.231 ( -0.036 -10.501 -3.341) 11.020 5.400 ( -4.296 -8.448 -1.693) 9.628 5.702 ( -2.281 -5.118 -1.601) 5.827 6.003 ( -1.357 -1.754 -5.232) 5.683 6.232 ( 2.700 -4.730 9.844) 11.250 6.457 ( 4.874 -1.695 0.360) 5.173 6.860 ( -12.849 -8.090 0.178) 15.184 7.132 ( 6.072 -2.190 2.057) 6.775 8.070 ( -6.270 5.082 -0.352) 8.079 8.980 ( 9.625 -17.197 0.060) 19.708 9.249 ( 2.935 -8.915 -0.167) 9.387 9.353 ( -0.937 -9.449 -0.012) 9.495 9.843 ( 1.493 -11.582 -0.075) 11.678 10.444 ( 3.197 0.192 0.631) 3.265 11.102 ( -17.303 -16.423 -1.193) 23.886 11.621 ( -0.569 17.813 0.218) 17.823 12.316 ( 12.057 -11.682 0.245) 16.790 13.098 ( -9.405 -1.671 0.248) 9.556 13.861 ( 3.428 10.058 -0.015) 10.626 15.689 ( -3.126 -18.632 0.828) 18.911 16.234 ( 7.551 7.994 0.874) 11.032 16.946 ( -10.449 -4.211 -0.128) 11.266 17.773 ( -5.292 -19.769 0.138) 20.465 19.267 ( 1.447 -3.438 -2.971) 4.769 20.991 ( 5.689 8.498 2.733) 10.585 22.232 ( 0.032 -8.601 0.072) 8.601 23.165 ( -0.743 10.661 -0.252) 10.689 ======================= Grid point 254 (103/267) ======================= q-point: ( 0.64 0.21 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.230 ( -0.157 -0.811 -2.276) 2.421 2.579 ( 0.841 -2.199 3.454) 4.180 3.046 ( 1.356 5.234 -0.272) 5.414 3.180 ( -2.722 -2.510 0.874) 3.804 3.652 ( 3.013 -6.472 2.015) 7.418 3.941 ( 1.099 -0.415 -0.643) 1.339 4.199 ( 0.426 -5.231 0.480) 5.270 4.435 ( 7.907 2.072 -8.349) 11.684 4.783 ( 0.385 -1.923 2.608) 3.263 5.335 ( -2.906 -4.457 -8.284) 9.846 5.568 ( 0.557 -9.017 3.448) 9.670 5.744 ( -1.122 -1.463 -1.325) 2.271 5.990 ( -2.651 -0.755 -6.647) 7.196 6.302 ( -2.206 -1.279 8.830) 9.191 6.554 ( 6.685 -2.859 0.528) 7.290 6.925 ( -6.468 -5.263 1.561) 8.483 7.142 ( 0.705 3.189 2.325) 4.009 7.879 ( -10.516 7.416 0.322) 12.872 9.216 ( 8.199 -4.165 -0.843) 9.234 9.473 ( 2.583 -12.479 -0.027) 12.743 9.556 ( -2.970 -14.804 -0.295) 15.102 10.085 ( 2.344 -5.343 -0.283) 5.841 10.551 ( 9.770 -8.262 0.815) 12.821 10.838 ( -9.156 22.078 0.052) 23.901 11.645 ( -5.398 -11.826 -0.408) 13.006 12.579 ( 7.661 -7.393 0.282) 10.650 13.090 ( -7.467 -3.740 0.799) 8.390 13.715 ( 2.123 7.815 -0.359) 8.107 15.834 ( -2.107 -2.346 0.430) 3.183 16.196 ( 4.486 2.932 1.183) 5.488 17.051 ( -4.844 -12.345 0.310) 13.265 18.061 ( -1.765 -14.237 -0.439) 14.352 19.315 ( 1.625 -0.938 -0.427) 1.925 20.860 ( 3.213 9.394 0.503) 9.941 22.371 ( -0.331 -6.660 -0.022) 6.668 22.944 ( -1.574 12.298 0.379) 12.404 ======================= Grid point 256 (104/267) ======================= q-point: (-0.29 0.21 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.229 ( 0.607 0.708 -1.442) 1.717 2.646 ( 1.497 -3.061 4.768) 5.860 2.916 ( -0.293 8.112 1.094) 8.191 3.228 ( -1.523 -3.409 -2.780) 4.655 3.755 ( 1.089 0.313 3.508) 3.686 3.858 ( -1.963 4.937 2.248) 5.769 4.224 ( -3.689 1.234 -2.085) 4.414 4.432 ( 9.064 3.533 -10.351) 14.205 4.839 ( 1.891 -2.078 3.838) 4.757 5.343 ( -1.104 0.299 -5.677) 5.791 5.632 ( -0.807 2.713 -4.543) 5.352 5.803 ( -0.152 -5.822 1.681) 6.062 5.984 ( -0.580 -1.443 -5.249) 5.475 6.306 ( -3.521 0.332 7.448) 8.245 6.644 ( 5.203 -2.182 0.323) 5.651 6.856 ( -1.363 11.596 2.041) 11.853 7.121 ( -3.179 -2.078 3.337) 5.055 7.721 ( -7.219 1.068 1.006) 7.367 9.288 ( 5.427 1.379 -1.522) 5.803 9.641 ( 1.470 4.799 -0.418) 5.036 9.823 ( -0.377 -19.473 -0.001) 19.477 10.146 ( 4.545 13.050 0.699) 13.836 10.192 ( -5.341 11.023 -0.186) 12.251 11.082 ( 4.932 -28.622 0.428) 29.047 11.696 ( -4.602 4.156 0.321) 6.209 12.662 ( 3.031 3.439 0.248) 4.591 13.121 ( -3.981 -3.840 0.922) 5.607 13.599 ( 0.946 6.056 -0.426) 6.144 15.856 ( -0.278 -2.450 0.274) 2.481 16.172 ( 0.371 1.483 1.563) 2.187 17.272 ( -0.522 -12.310 0.415) 12.328 18.269 ( -0.297 -9.244 -1.378) 9.351 19.321 ( 2.163 2.035 2.350) 3.787 20.703 ( 0.244 8.668 -1.547) 8.808 22.480 ( 0.751 -5.206 -0.200) 5.264 22.701 ( -2.669 12.001 1.059) 12.340 ======================= Grid point 257 (105/267) ======================= q-point: (-0.21 0.21 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( 1.784 3.977 -0.164) 4.362 2.713 ( 1.626 0.809 2.887) 3.411 2.768 ( 0.461 6.367 4.110) 7.592 3.237 ( -1.443 1.655 -6.682) 7.033 3.595 ( -3.508 10.260 6.887) 12.846 3.873 ( -0.167 -2.293 1.248) 2.617 4.125 ( -4.894 4.839 -3.908) 7.915 4.357 ( 6.064 8.572 -9.167) 13.939 4.888 ( 0.465 -0.845 5.219) 5.308 5.283 ( 2.917 5.586 -2.756) 6.878 5.519 ( -1.558 6.224 -6.726) 9.295 5.880 ( 0.867 -1.549 -3.208) 3.666 6.011 ( 0.090 -2.504 -2.639) 3.639 6.266 ( -3.388 3.174 5.523) 7.215 6.548 ( 0.447 18.160 2.651) 18.358 6.743 ( 0.842 -4.635 0.688) 4.761 7.124 ( 0.620 2.522 4.379) 5.091 7.740 ( -1.935 -4.882 1.014) 5.349 9.191 ( -0.077 14.789 -1.449) 14.860 9.446 ( 0.447 9.287 -0.827) 9.335 9.565 ( 0.696 29.473 0.551) 29.487 10.227 ( -0.026 -21.631 0.262) 21.632 10.417 ( 0.159 -14.692 0.020) 14.693 11.402 ( 0.018 24.531 0.890) 24.547 11.673 ( -0.320 -31.213 0.396) 31.217 12.483 ( 0.154 17.233 0.222) 17.235 13.176 ( -0.323 -3.687 0.901) 3.809 13.508 ( 0.218 3.551 -0.283) 3.569 15.944 ( -0.531 -7.432 0.830) 7.497 16.166 ( -0.175 -0.573 0.496) 0.778 17.474 ( -0.124 -9.388 0.650) 9.411 18.381 ( -2.438 -4.083 -3.628) 5.982 19.286 ( 4.281 5.000 6.302) 9.112 20.541 ( -2.360 7.421 -4.021) 8.764 22.456 ( 2.766 11.897 1.744) 12.339 22.607 ( -2.129 -6.570 0.036) 6.906 ======================= Grid point 258 (106/267) ======================= q-point: (-0.14 0.21 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.089 ( 1.497 9.496 0.974) 9.663 2.532 ( -0.300 15.441 3.001) 15.733 2.784 ( 4.223 1.019 4.487) 6.246 3.084 ( -1.218 10.078 -6.981) 12.320 3.479 ( -3.119 1.606 3.695) 5.096 3.894 ( -4.470 -0.153 0.882) 4.559 3.955 ( -0.183 10.104 -3.737) 10.774 4.194 ( 1.589 8.729 -4.963) 10.167 4.883 ( -1.214 2.799 4.647) 5.559 5.195 ( 5.733 5.997 -1.365) 8.407 5.374 ( 0.478 7.026 -4.943) 8.604 5.860 ( 0.921 3.193 -7.381) 8.094 6.037 ( 3.755 4.581 -1.876) 6.214 6.124 ( -1.800 9.288 -0.177) 9.462 6.283 ( -1.718 8.142 7.568) 11.248 6.815 ( -12.101 -4.079 1.456) 12.853 7.083 ( 14.115 5.701 3.730) 15.673 7.795 ( 1.172 1.417 0.591) 1.931 8.752 ( -3.476 27.405 -0.782) 27.635 9.126 ( 1.645 18.427 0.501) 18.507 9.359 ( -0.959 2.367 -1.207) 2.825 10.539 ( -11.397 -7.765 0.073) 13.791 10.674 ( -0.438 -13.947 0.541) 13.964 10.866 ( 9.493 28.008 1.136) 29.595 12.038 ( -0.479 25.121 0.011) 25.126 12.235 ( -2.256 -25.697 0.019) 25.796 13.260 ( 1.582 -4.797 0.888) 5.129 13.491 ( 1.257 -1.346 -0.064) 1.843 16.118 ( -0.226 -9.752 0.619) 9.775 16.189 ( -3.038 -4.169 -1.227) 5.302 17.608 ( -4.049 -6.234 1.005) 7.501 18.336 ( -8.220 4.364 -6.444) 11.319 19.247 ( 8.267 5.793 10.233) 14.374 20.372 ( -2.369 7.900 -7.333) 11.036 22.281 ( 2.347 9.024 3.203) 9.859 22.734 ( 3.455 -6.146 0.126) 7.052 ======================= Grid point 259 (107/267) ======================= q-point: (-0.07 0.21 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.863 ( -0.353 15.850 2.862) 16.111 2.173 ( 2.308 23.980 3.569) 24.353 2.773 ( 6.543 4.804 -0.667) 8.145 2.899 ( -0.602 7.789 -4.842) 9.192 3.427 ( -1.234 5.690 -0.573) 5.850 3.650 ( -4.233 14.161 -0.055) 14.780 3.907 ( 1.539 1.403 0.805) 2.233 4.083 ( -1.870 2.590 0.082) 3.195 4.791 ( 1.687 7.041 1.657) 7.428 5.129 ( -0.787 4.623 -1.583) 4.950 5.276 ( 6.951 5.088 -0.550) 8.632 5.692 ( 1.965 16.731 -2.438) 17.021 5.809 ( 3.713 11.847 -6.920) 14.214 6.086 ( -1.595 0.560 -1.092) 2.013 6.204 ( -2.318 1.912 6.551) 7.207 6.665 ( -14.525 7.355 1.709) 16.371 7.192 ( 16.869 -1.538 1.633) 17.017 7.617 ( 5.291 21.651 0.469) 22.293 8.181 ( -4.819 30.357 -0.371) 30.739 8.927 ( -0.194 4.247 0.437) 4.273 9.288 ( -6.942 3.129 -0.897) 7.667 10.121 ( -1.242 26.247 0.919) 26.293 10.766 ( 3.570 6.050 0.729) 7.062 10.961 ( -2.316 -15.080 0.370) 15.261 11.575 ( -0.890 17.364 0.025) 17.387 12.672 ( -5.364 -22.696 -1.125) 23.349 13.383 ( 1.415 -7.114 0.423) 7.266 13.573 ( 5.211 -4.678 0.325) 7.010 16.112 ( -9.056 3.890 -8.491) 13.010 16.397 ( -3.641 -15.881 3.535) 16.672 17.624 ( -14.356 -1.722 -0.209) 14.460 18.072 ( -9.183 14.633 -3.557) 17.638 19.231 ( 7.555 5.614 7.126) 11.805 20.188 ( 6.461 10.921 -8.910) 15.505 22.178 ( 0.023 4.044 3.808) 5.555 22.886 ( 10.711 -4.929 0.801) 11.818 ======================= Grid point 264 (108/267) ======================= q-point: ( 0.29 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.541 ( 12.555 -0.000 4.045) 13.190 1.545 ( 15.597 -0.000 -5.634) 16.583 2.131 ( 21.133 -0.000 -8.448) 22.759 2.385 ( 4.512 -0.000 -3.155) 5.505 2.933 ( 1.049 -0.000 9.776) 9.832 2.988 ( -8.262 0.000 2.224) 8.556 3.565 ( -4.475 0.000 -2.817) 5.288 3.580 ( -4.132 0.000 -3.985) 5.740 3.907 ( 2.377 -0.000 0.944) 2.558 4.355 ( 2.755 -0.000 0.339) 2.776 4.466 ( -4.702 0.000 1.839) 5.049 5.097 ( -5.745 0.000 2.187) 6.147 5.595 ( -10.932 0.000 7.363) 13.181 5.600 ( 1.595 -0.000 -0.260) 1.616 5.736 ( 10.641 -0.000 -5.322) 11.898 6.237 ( 12.083 -0.000 -1.380) 12.162 6.558 ( 0.174 -0.000 2.827) 2.832 7.199 ( 15.578 -0.000 0.224) 15.580 7.281 ( -0.211 0.000 -0.016) 0.212 9.128 ( -3.787 0.000 0.648) 3.842 9.320 ( 10.035 -0.000 0.183) 10.037 9.587 ( -1.736 0.000 -2.853) 3.340 10.742 ( -2.884 0.000 0.080) 2.885 11.080 ( -24.940 0.000 -0.577) 24.946 11.377 ( -2.583 0.000 0.430) 2.619 12.319 ( 19.961 -0.000 -8.088) 21.538 13.276 ( -7.796 0.000 0.471) 7.811 14.244 ( 0.495 -0.000 -0.010) 0.495 14.272 ( 7.571 -0.000 0.279) 7.576 15.370 ( -40.387 0.000 8.369) 41.245 16.857 ( -0.156 0.000 0.060) 0.167 17.972 ( 0.053 -0.000 -0.080) 0.096 18.596 ( 16.917 -0.000 -20.390) 26.494 20.967 ( -12.413 0.000 19.898) 23.452 21.725 ( 9.522 -0.000 1.326) 9.614 23.801 ( 1.660 -0.000 -12.335) 12.447 ======================= Grid point 265 (109/267) ======================= q-point: ( 0.36 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( 18.711 -3.571 -6.548) 20.143 1.819 ( 13.187 -15.915 4.326) 21.116 2.302 ( 14.138 -6.003 -7.570) 17.124 2.493 ( 4.268 -7.187 -3.986) 9.260 2.929 ( -3.638 -1.320 6.749) 7.780 3.200 ( -3.819 -19.247 4.054) 20.036 3.449 ( -4.469 1.603 -1.506) 4.981 3.793 ( -4.713 -21.311 -2.937) 22.022 4.178 ( -2.991 -20.155 1.786) 20.454 4.375 ( 1.642 -1.282 0.910) 2.273 4.571 ( -0.238 -16.383 1.569) 16.460 5.061 ( -5.992 -0.335 2.128) 6.368 5.559 ( -5.767 -4.801 -2.299) 7.848 5.687 ( -4.150 -11.011 -0.535) 11.779 5.818 ( 8.030 -0.426 3.054) 8.602 6.375 ( 17.667 -3.395 -1.559) 18.057 6.548 ( 0.832 1.718 1.689) 2.549 7.205 ( 7.926 1.642 0.597) 8.116 7.470 ( 10.001 -9.731 -0.868) 13.981 9.049 ( -5.011 4.300 0.763) 6.647 9.338 ( 12.567 4.943 1.191) 13.557 9.586 ( -3.361 -2.864 -2.643) 5.146 10.778 ( -26.408 5.163 -0.278) 26.909 11.030 ( 3.274 -21.093 0.303) 21.347 11.273 ( -4.235 8.649 0.071) 9.630 12.620 ( 9.012 -18.654 -6.276) 21.647 13.143 ( -6.442 8.555 0.813) 10.740 13.954 ( -2.740 15.211 -0.254) 15.458 14.404 ( 7.112 0.962 1.080) 7.257 15.472 ( -33.191 -33.566 5.775) 47.557 16.853 ( -0.175 0.434 -0.176) 0.500 17.817 ( 1.208 14.372 -0.021) 14.423 18.766 ( 10.273 -8.590 -16.463) 21.221 20.940 ( -12.493 -4.680 13.219) 18.780 21.799 ( 8.674 0.746 5.119) 10.100 23.746 ( 1.852 4.366 -8.912) 10.096 ======================= Grid point 266 (110/267) ======================= q-point: ( 0.43 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.919 ( 16.367 -8.100 -6.218) 19.291 2.212 ( 17.757 -11.256 4.430) 21.486 2.545 ( 3.458 -14.879 -2.385) 15.461 2.660 ( 4.293 -9.294 -6.793) 12.287 2.948 ( -6.623 -3.580 4.599) 8.823 3.410 ( 1.440 -1.057 0.426) 1.836 3.519 ( -6.356 -14.208 3.223) 15.895 4.206 ( -3.833 -21.913 -3.893) 22.584 4.387 ( -0.199 -8.200 -0.194) 8.205 4.496 ( -5.422 -12.993 5.583) 15.145 5.007 ( -0.317 -22.615 -2.820) 22.792 5.044 ( -5.550 -2.861 1.776) 6.492 5.661 ( 4.809 -6.541 -1.984) 8.357 5.896 ( 3.280 -2.955 4.134) 6.048 6.035 ( -8.511 -30.881 -1.170) 32.053 6.517 ( 1.741 2.037 1.621) 3.132 6.602 ( 15.339 -7.083 -1.528) 16.965 7.323 ( 5.980 -11.098 0.984) 12.645 7.762 ( 16.249 -11.972 -1.751) 20.259 8.937 ( -4.698 3.581 1.446) 6.082 9.333 ( 11.171 5.630 0.423) 12.517 9.654 ( -3.801 -8.407 -1.695) 9.381 10.420 ( -27.405 9.791 -0.339) 29.104 11.020 ( -4.880 13.042 0.234) 13.927 11.538 ( 19.558 -19.305 0.732) 27.491 12.832 ( -9.066 9.636 0.101) 13.231 13.025 ( -11.712 -13.300 -3.946) 18.156 13.858 ( 1.770 -10.742 0.253) 10.890 14.373 ( 5.352 6.668 1.372) 8.660 15.961 ( -23.452 -37.588 3.710) 44.459 16.833 ( -0.678 1.142 -0.482) 1.413 17.523 ( 0.251 17.119 0.050) 17.120 18.937 ( 4.693 -7.435 -12.002) 14.878 21.026 ( -5.143 -8.038 9.408) 13.400 21.848 ( 4.864 -0.151 3.735) 6.134 23.638 ( 1.245 6.683 -4.989) 8.432 ======================= Grid point 267 (111/267) ======================= q-point: ( 0.50 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.108 ( 7.650 -3.680 -4.581) 9.646 2.483 ( 13.487 -3.653 2.228) 14.149 2.816 ( 1.390 -10.076 1.843) 10.337 2.933 ( 6.389 -18.021 -4.994) 19.761 3.023 ( -5.161 -10.554 1.631) 11.861 3.441 ( 0.751 -1.236 1.693) 2.226 3.715 ( -4.816 -11.897 0.359) 12.840 4.377 ( 2.210 -3.424 -4.097) 5.779 4.642 ( -3.069 -13.270 0.197) 13.622 4.709 ( -1.696 -12.538 5.509) 13.800 5.096 ( -6.288 -7.628 -1.362) 9.979 5.329 ( -2.217 -14.960 -3.749) 15.581 5.850 ( 7.412 -7.638 -2.155) 10.859 6.002 ( 3.617 -5.901 5.131) 8.616 6.419 ( -11.964 -11.953 0.292) 16.914 6.515 ( -0.129 -3.912 0.454) 3.941 6.857 ( 10.415 -9.840 0.106) 14.329 7.810 ( 8.540 -34.627 0.737) 35.673 8.084 ( 11.394 -8.863 -1.824) 14.550 8.903 ( 0.582 -3.526 1.293) 3.800 9.307 ( 9.099 4.529 -0.156) 10.165 9.795 ( -4.264 -4.701 -0.595) 6.374 10.109 ( -23.985 -3.689 -0.717) 24.277 10.767 ( -6.727 8.671 0.278) 10.978 11.962 ( 26.502 -7.794 0.371) 27.627 12.489 ( -5.428 19.285 0.738) 20.048 13.049 ( -18.723 -3.939 -2.224) 19.262 14.228 ( 3.637 4.589 0.191) 5.859 14.423 ( -0.082 -35.298 1.251) 35.320 16.406 ( -8.678 -17.670 2.266) 19.816 16.840 ( -7.397 -7.438 -0.346) 10.496 17.238 ( -1.035 10.646 -0.925) 10.736 19.070 ( 2.666 -6.610 -7.335) 10.227 21.146 ( 0.727 -3.259 6.916) 7.680 21.920 ( 1.762 -5.068 1.304) 5.521 23.501 ( 0.257 7.899 -2.226) 8.211 ======================= Grid point 268 (112/267) ======================= q-point: ( 0.57 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.176 ( 1.788 -1.678 -3.459) 4.240 2.568 ( 5.798 1.065 2.739) 6.500 2.943 ( -1.609 -5.615 0.888) 5.908 3.190 ( -4.039 -7.605 4.751) 9.835 3.338 ( 10.806 -12.722 -5.805) 17.673 3.525 ( 2.739 -11.219 0.589) 11.563 3.905 ( -3.681 -11.671 -0.629) 12.254 4.433 ( 2.964 -1.979 -5.700) 6.723 4.726 ( -1.572 -1.715 3.104) 3.879 5.003 ( 0.178 -15.011 3.909) 15.513 5.196 ( -4.770 -8.308 -3.957) 10.365 5.541 ( -0.948 -10.340 -2.712) 10.732 5.945 ( -1.001 -1.851 -5.332) 5.732 6.209 ( 9.712 -6.054 7.630) 13.755 6.451 ( -1.459 -3.058 0.989) 3.530 6.599 ( -10.523 -7.714 0.127) 13.049 7.090 ( 5.710 -7.734 1.054) 9.671 8.136 ( 0.119 4.164 -0.473) 4.193 8.560 ( 6.110 -33.800 0.098) 34.347 9.086 ( 3.526 -10.811 -0.144) 11.373 9.319 ( 7.554 1.641 -0.033) 7.730 9.692 ( -8.286 -1.039 -0.044) 8.351 10.337 ( -3.243 -21.417 -0.498) 21.667 10.643 ( -11.232 -4.673 -0.204) 12.167 12.044 ( 0.173 23.571 0.705) 23.583 12.258 ( 15.970 -5.252 -0.057) 16.811 12.980 ( -13.711 -2.890 -0.706) 14.030 14.079 ( 2.495 10.668 0.287) 10.960 15.151 ( -0.937 -36.902 0.833) 36.923 16.452 ( 5.973 7.022 0.817) 9.255 16.842 ( -12.991 0.951 -0.471) 13.034 17.333 ( -3.119 -20.915 -0.581) 21.155 19.189 ( 2.251 -5.499 -3.821) 7.064 21.159 ( 2.447 4.440 4.443) 6.741 22.065 ( 0.245 -9.028 0.109) 9.032 23.342 ( -0.260 9.076 -0.669) 9.104 ======================= Grid point 269 (113/267) ======================= q-point: ( 0.64 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.200 ( -0.230 -1.392 -3.016) 3.330 2.588 ( 3.346 0.458 5.111) 6.126 3.032 ( -1.174 -5.162 -1.526) 5.510 3.194 ( -2.713 3.560 2.378) 5.069 3.539 ( 2.825 -7.895 1.610) 8.538 3.843 ( 6.197 -12.407 -4.710) 14.647 4.068 ( -3.236 -8.692 1.701) 9.429 4.465 ( 2.446 -0.911 -8.334) 8.733 4.755 ( 0.031 -1.873 3.657) 4.109 5.198 ( -0.960 -6.700 -4.768) 8.279 5.374 ( 0.111 -12.679 3.858) 13.254 5.680 ( 0.150 -5.120 -1.341) 5.295 5.929 ( -3.599 -1.085 -8.730) 9.505 6.306 ( 0.633 0.011 8.368) 8.392 6.550 ( 6.101 -2.497 0.260) 6.597 6.707 ( -6.705 -11.890 1.913) 13.784 7.199 ( 1.571 -0.609 1.692) 2.388 7.988 ( -3.773 9.084 0.243) 9.839 9.072 ( 2.831 -17.701 -0.562) 17.935 9.282 ( 1.843 -9.385 -0.547) 9.580 9.337 ( -1.122 -4.474 0.058) 4.613 9.871 ( 1.421 -16.265 -0.291) 16.330 10.511 ( 3.940 -1.203 0.314) 4.131 10.891 ( -8.890 -19.188 -0.295) 21.149 11.611 ( -0.505 18.272 0.320) 18.281 12.478 ( 7.979 -8.295 -0.049) 11.510 12.966 ( -7.207 -3.973 0.176) 8.232 13.896 ( 1.228 10.283 -0.112) 10.357 15.659 ( -1.390 -17.365 0.610) 17.431 16.346 ( 5.494 8.385 0.408) 10.034 16.805 ( -6.855 -7.684 -0.070) 10.298 17.720 ( -1.923 -20.879 -0.497) 20.973 19.283 ( 1.905 -3.578 -1.395) 4.286 21.053 ( 1.286 8.749 2.067) 9.082 22.230 ( -0.253 -8.367 -0.215) 8.374 23.155 ( -0.286 10.956 0.150) 10.961 ======================= Grid point 270 (114/267) ======================= q-point: (-0.29 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.218 ( 0.263 -1.370 -2.358) 2.740 2.636 ( 3.591 -1.434 6.987) 7.985 3.055 ( -0.077 5.780 -0.242) 5.786 3.131 ( -3.608 -3.512 -1.698) 5.313 3.689 ( 0.527 -6.165 2.833) 6.806 3.941 ( -1.073 2.066 -1.026) 2.544 4.181 ( -1.986 -3.822 -0.922) 4.404 4.475 ( 2.053 -0.912 -9.992) 10.241 4.816 ( 1.306 -2.829 4.519) 5.489 5.284 ( 1.679 -4.322 -7.017) 8.410 5.603 ( 1.877 -8.727 4.429) 9.965 5.711 ( -1.968 -0.210 -2.689) 3.338 5.933 ( -0.226 -2.999 -7.584) 8.158 6.309 ( -2.182 0.448 7.575) 7.895 6.615 ( -0.031 -2.811 -0.040) 2.812 6.890 ( 1.584 -6.889 3.038) 7.693 7.158 ( -0.354 4.819 2.458) 5.421 7.789 ( -1.066 8.921 0.571) 9.003 9.278 ( 0.213 -4.899 -1.250) 5.060 9.487 ( -0.754 -14.512 -0.040) 14.532 9.533 ( 0.496 -13.455 -0.361) 13.469 10.101 ( -0.198 -4.612 -0.409) 4.634 10.655 ( -1.823 -16.180 0.258) 16.284 10.749 ( 2.368 26.605 1.022) 26.730 11.601 ( -0.025 -10.453 -0.279) 10.456 12.650 ( 0.392 -5.800 0.165) 5.816 13.018 ( -1.272 -4.779 0.602) 4.982 13.730 ( 0.222 7.929 -0.370) 7.941 15.816 ( -0.429 -3.192 0.279) 3.233 16.238 ( -0.053 5.149 1.220) 5.291 17.009 ( -0.505 -14.704 0.061) 14.713 18.042 ( -0.367 -14.883 -0.796) 14.909 19.341 ( 1.528 -1.432 0.726) 2.216 20.879 ( -0.771 10.219 -0.062) 10.249 22.365 ( -0.311 -6.714 -0.276) 6.727 22.935 ( 0.183 12.793 0.661) 12.811 ======================= Grid point 271 (115/267) ======================= q-point: (-0.21 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.239 ( 1.514 -0.194 -1.426) 2.089 2.717 ( 4.076 -2.154 7.323) 8.654 2.918 ( -0.056 7.732 1.833) 7.947 3.176 ( -3.160 -3.683 -5.325) 7.204 3.745 ( -5.027 3.702 3.809) 7.314 3.844 ( -0.821 1.902 1.345) 2.470 4.159 ( -2.366 2.785 -4.913) 6.123 4.466 ( 1.171 1.988 -8.519) 8.826 4.879 ( -0.024 -1.847 5.644) 5.938 5.347 ( 5.501 -0.885 -6.373) 8.465 5.608 ( 0.528 5.551 -5.353) 7.729 5.788 ( -1.808 -6.665 1.520) 7.071 5.982 ( 2.596 -2.326 -4.648) 5.810 6.295 ( -2.557 1.073 7.055) 7.580 6.659 ( -3.293 -3.168 0.586) 4.607 6.857 ( 0.186 12.236 2.098) 12.416 7.150 ( 4.692 -2.313 3.696) 6.405 7.703 ( 4.522 1.386 0.664) 4.776 9.289 ( -4.330 1.351 -1.489) 4.774 9.630 ( -2.550 4.016 -0.615) 4.796 9.831 ( 1.360 -18.896 0.141) 18.945 10.120 ( -4.178 9.186 0.141) 10.092 10.225 ( 5.451 14.803 0.497) 15.782 11.089 ( -4.431 -29.005 0.547) 29.346 11.690 ( 3.793 4.501 0.239) 5.891 12.666 ( -2.728 3.534 0.321) 4.476 13.111 ( 2.342 -4.253 0.746) 4.913 13.602 ( -0.307 6.030 -0.370) 6.049 15.854 ( -0.134 -2.496 0.230) 2.510 16.175 ( -1.024 1.651 1.613) 2.526 17.266 ( -0.423 -12.527 0.303) 12.538 18.251 ( -0.994 -8.310 -1.634) 8.527 19.364 ( 1.649 0.484 3.165) 3.601 20.679 ( -2.153 9.649 -2.072) 10.101 22.480 ( -0.842 -6.100 -0.188) 6.161 22.706 ( 2.722 12.490 1.128) 12.832 ======================= Grid point 272 (116/267) ======================= q-point: (-0.14 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.220 ( 1.383 3.725 -0.645) 4.026 2.734 ( 0.064 6.441 0.922) 6.507 2.844 ( 5.570 1.040 8.698) 10.381 3.172 ( -2.574 1.144 -8.469) 8.925 3.551 ( -5.857 8.792 4.923) 11.655 3.861 ( -1.831 -0.880 1.499) 2.525 4.054 ( -1.558 4.893 -5.432) 7.475 4.363 ( -0.226 7.732 -6.104) 9.853 4.903 ( -1.679 -0.143 5.598) 5.846 5.357 ( 7.712 4.575 -2.566) 9.327 5.480 ( 1.154 6.241 -8.556) 10.653 5.857 ( -1.406 -2.056 -3.100) 3.977 6.034 ( 3.137 -1.918 -1.675) 4.041 6.256 ( -1.011 3.442 5.935) 6.935 6.577 ( 1.678 17.718 2.562) 17.980 6.680 ( -7.854 -2.838 1.728) 8.528 7.234 ( 9.479 0.290 3.288) 10.037 7.780 ( 7.134 -3.351 0.337) 7.889 9.110 ( -8.941 14.571 -1.208) 17.138 9.437 ( -1.308 9.339 -0.674) 9.455 9.612 ( 4.534 28.981 0.446) 29.337 10.178 ( -6.149 -18.541 0.211) 19.535 10.407 ( -1.565 -14.557 0.161) 14.642 11.411 ( -0.349 13.683 0.786) 13.710 11.672 ( 0.867 -22.025 0.200) 22.043 12.468 ( -2.351 16.307 0.355) 16.479 13.204 ( 3.326 -3.450 0.933) 4.882 13.512 ( 0.501 2.884 -0.260) 2.939 15.937 ( -0.869 -7.184 0.734) 7.273 16.155 ( -1.637 0.307 0.574) 1.762 17.445 ( -4.070 -8.129 0.573) 9.109 18.315 ( -3.966 -0.819 -2.659) 4.845 19.367 ( 2.353 1.719 5.431) 6.164 20.497 ( -0.647 7.956 -3.801) 8.841 22.455 ( -3.027 7.834 0.661) 8.424 22.665 ( 8.572 -4.227 0.911) 9.601 ======================= Grid point 273 (117/267) ======================= q-point: (-0.07 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.100 ( -0.280 9.810 0.273) 9.818 2.550 ( 1.272 14.013 0.875) 14.098 2.892 ( 6.345 1.900 7.233) 9.808 3.042 ( 0.972 8.690 -9.546) 12.945 3.434 ( -4.974 1.141 3.418) 6.142 3.789 ( -6.299 6.134 -2.163) 9.055 3.990 ( 4.095 1.805 -0.839) 4.553 4.176 ( -1.732 9.490 -1.295) 9.733 4.884 ( -1.289 2.192 3.524) 4.345 5.256 ( 2.496 8.837 -2.300) 9.466 5.407 ( 7.305 3.661 -5.595) 9.903 5.827 ( -0.654 3.513 -7.357) 8.179 6.069 ( -2.150 1.164 0.761) 2.561 6.174 ( 10.288 9.688 1.146) 14.178 6.289 ( -1.503 11.956 6.504) 13.693 6.630 ( -12.277 1.195 1.890) 12.479 7.309 ( 12.668 0.407 2.354) 12.891 7.861 ( 7.479 2.605 0.118) 7.920 8.665 ( -7.046 24.981 -0.856) 25.970 9.167 ( 3.458 20.493 0.274) 20.784 9.310 ( -4.668 4.667 -0.630) 6.631 10.356 ( -12.659 -3.980 0.160) 13.270 10.620 ( -5.934 -10.031 0.745) 11.678 11.059 ( 14.296 19.062 0.461) 23.832 12.005 ( -4.753 18.419 0.003) 19.022 12.181 ( -4.344 -18.850 0.105) 19.344 13.294 ( 2.033 -4.012 0.824) 4.573 13.531 ( 4.218 -3.311 0.043) 5.363 16.102 ( -4.576 0.292 -2.129) 5.056 16.118 ( -3.527 -9.795 1.764) 10.559 17.494 ( -10.667 -2.620 0.057) 10.984 18.207 ( -7.030 7.536 -1.470) 10.410 19.354 ( 1.702 2.905 4.280) 5.446 20.376 ( 6.579 6.056 -3.746) 9.694 22.290 ( -1.784 7.702 0.504) 7.922 22.851 ( 10.750 -7.167 1.237) 12.979 ======================= Grid point 279 (118/267) ======================= q-point: ( 0.36 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.711 ( 8.799 -0.000 1.738) 8.969 1.792 ( 21.564 -0.000 -5.980) 22.378 2.360 ( 14.128 -0.000 -6.967) 15.752 2.448 ( 5.200 -0.000 -1.203) 5.337 2.885 ( -7.096 0.000 2.770) 7.618 2.958 ( -2.399 0.000 7.243) 7.630 3.491 ( -3.489 0.000 -3.950) 5.270 3.513 ( -3.252 0.000 -2.961) 4.398 3.939 ( 1.241 -0.000 1.647) 2.062 4.390 ( 1.942 -0.000 -0.161) 1.948 4.403 ( -6.647 0.000 6.354) 9.196 5.024 ( -5.149 0.000 2.082) 5.554 5.396 ( -10.841 0.000 -5.908) 12.347 5.621 ( 1.357 -0.000 -0.188) 1.370 5.883 ( 4.717 -0.000 6.532) 8.057 6.475 ( 18.373 -0.000 -2.752) 18.578 6.571 ( 0.176 -0.000 1.582) 1.592 7.278 ( -0.189 0.000 -0.002) 0.189 7.477 ( 23.597 -0.000 -1.313) 23.633 9.045 ( -8.473 0.000 0.387) 8.482 9.478 ( 10.296 -0.000 1.423) 10.394 9.530 ( -3.659 0.000 -2.533) 4.450 10.659 ( -29.187 0.000 -0.100) 29.188 10.704 ( -2.314 0.000 0.177) 2.321 11.352 ( -1.951 0.000 -0.573) 2.033 12.626 ( 25.200 -0.000 -4.160) 25.541 13.183 ( -5.218 0.000 1.054) 5.323 14.250 ( 0.385 -0.000 -0.047) 0.388 14.327 ( -2.521 0.000 0.172) 2.527 14.858 ( -30.874 0.000 4.744) 31.236 16.855 ( -0.129 0.000 0.062) 0.143 17.972 ( 0.048 -0.000 -0.085) 0.098 18.727 ( 11.763 -0.000 -14.673) 18.806 20.804 ( -14.718 0.000 9.666) 17.608 21.883 ( 6.099 -0.000 8.119) 10.154 23.781 ( 1.677 -0.000 -7.727) 7.907 ======================= Grid point 280 (119/267) ======================= q-point: ( 0.43 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.936 ( 16.281 -5.878 -4.186) 17.809 1.999 ( 12.145 -15.941 0.959) 20.063 2.430 ( 6.325 -1.703 -4.197) 7.780 2.556 ( 6.440 -5.680 -2.690) 8.998 2.896 ( -3.738 0.001 4.682) 5.991 3.145 ( -6.208 -21.357 4.651) 22.722 3.399 ( -1.124 0.630 -3.373) 3.610 3.717 ( -3.749 -20.073 -3.446) 20.709 4.132 ( -4.675 -14.512 3.164) 15.571 4.384 ( -0.728 -1.371 1.181) 1.951 4.585 ( 0.580 -20.888 2.810) 21.084 4.993 ( -4.328 -0.010 1.991) 4.764 5.431 ( -6.478 -13.328 -7.052) 16.412 5.669 ( 0.640 -4.743 -0.589) 4.822 5.919 ( 2.677 -0.093 7.995) 8.432 6.561 ( 0.364 1.329 1.308) 1.899 6.616 ( 14.001 -2.702 -3.405) 14.661 7.271 ( 1.825 -0.487 0.394) 1.929 7.731 ( 25.199 -6.693 -2.143) 26.161 8.943 ( -10.803 2.257 0.341) 11.042 9.497 ( -1.114 1.440 -1.596) 2.421 9.532 ( 7.066 0.186 1.290) 7.185 10.378 ( -25.542 6.721 0.129) 26.412 11.058 ( 1.110 -32.840 0.204) 32.859 11.235 ( -2.005 9.367 -0.510) 9.593 12.782 ( 14.946 1.451 -3.304) 15.375 13.073 ( -3.792 8.137 1.187) 9.056 13.889 ( -6.366 11.656 0.592) 13.294 14.494 ( 4.319 0.970 1.006) 4.539 15.063 ( -24.010 -37.813 1.984) 44.835 16.850 ( -0.115 0.583 -0.100) 0.603 17.830 ( 0.597 13.894 -0.015) 13.907 18.834 ( 7.722 -5.306 -11.743) 15.023 20.812 ( -9.883 -8.864 7.597) 15.296 21.915 ( 2.979 1.716 6.905) 7.714 23.739 ( 1.571 4.116 -5.059) 6.709 ======================= Grid point 281 (120/267) ======================= q-point: ( 0.50 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.111 ( 11.905 -2.348 -5.342) 13.258 2.443 ( 10.778 -17.343 3.189) 20.667 2.565 ( 0.499 -13.125 -1.192) 13.189 2.701 ( 4.675 -7.097 -3.603) 9.231 2.879 ( -4.668 -1.752 2.939) 5.787 3.381 ( -3.958 -6.554 -1.294) 7.764 3.489 ( -0.442 -9.469 3.503) 10.106 4.144 ( -1.637 -24.514 -4.097) 24.908 4.366 ( -3.304 -13.432 2.669) 14.088 4.450 ( -3.230 -9.948 2.613) 10.780 4.955 ( -3.100 -5.077 -0.775) 5.999 5.035 ( 1.256 -15.060 0.785) 15.133 5.720 ( 3.948 -13.533 -4.120) 14.687 5.850 ( -5.934 -16.967 -4.245) 18.470 6.015 ( 1.015 -10.838 9.580) 14.501 6.538 ( 0.548 1.547 0.663) 1.771 6.770 ( 8.116 -6.204 -2.442) 10.503 7.391 ( 2.652 -13.511 0.898) 13.798 8.044 ( 21.339 -7.488 -2.368) 22.739 8.850 ( -8.391 -1.117 0.200) 8.468 9.464 ( 5.550 3.435 -0.362) 6.537 9.602 ( -1.087 -6.215 0.310) 6.317 10.044 ( -21.475 10.411 0.202) 23.866 10.963 ( -2.629 14.505 -0.115) 14.742 11.807 ( 14.892 -33.944 -0.049) 37.067 12.720 ( -5.392 7.816 -1.023) 9.550 12.872 ( -7.636 8.053 -0.301) 11.102 13.895 ( 2.389 -14.183 1.239) 14.436 14.432 ( 1.858 6.914 1.121) 7.247 15.687 ( -14.556 -41.684 0.293) 44.153 16.825 ( -0.139 1.996 -0.263) 2.018 17.524 ( -0.009 18.213 -0.327) 18.216 18.960 ( 4.599 -5.958 -8.058) 11.027 20.987 ( -4.305 -12.470 6.163) 14.561 21.911 ( 1.237 1.113 4.082) 4.408 23.637 ( 1.135 6.865 -2.624) 7.437 ======================= Grid point 282 (121/267) ======================= q-point: ( 0.57 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.165 ( 2.675 -0.097 -4.378) 5.131 2.643 ( 6.681 0.192 1.416) 6.832 2.837 ( -0.825 -4.597 2.240) 5.180 2.914 ( -4.033 -18.647 3.430) 19.384 3.060 ( 6.989 -20.113 -4.151) 21.694 3.445 ( -0.747 -2.579 0.441) 2.721 3.657 ( -2.725 -10.755 -0.475) 11.105 4.377 ( 0.818 -4.430 -5.007) 6.736 4.621 ( -0.384 -13.230 1.719) 13.347 4.714 ( -1.309 -15.524 6.550) 16.900 5.012 ( -3.484 -7.052 -1.963) 8.107 5.312 ( 1.456 -13.148 -3.359) 13.648 5.895 ( 0.458 -3.214 -3.793) 4.993 6.081 ( 2.506 -15.691 1.204) 15.936 6.277 ( -5.219 -8.780 5.405) 11.556 6.531 ( 0.925 -0.428 -0.037) 1.020 6.955 ( 3.036 -9.397 -0.954) 9.921 7.896 ( 2.487 -37.036 0.422) 37.122 8.211 ( 5.904 1.253 -1.033) 6.124 8.917 ( -0.212 -9.431 -0.903) 9.477 9.459 ( 12.704 3.978 0.141) 13.313 9.700 ( -13.042 10.172 0.161) 16.541 9.819 ( -8.275 -21.140 -0.258) 22.704 10.704 ( -2.204 10.619 0.122) 10.846 12.331 ( 20.373 -4.590 -0.099) 20.884 12.449 ( 1.560 18.308 0.862) 18.394 12.740 ( -20.930 -8.176 -1.541) 22.523 14.274 ( 2.046 6.712 0.370) 7.027 14.432 ( -0.008 -34.811 1.712) 34.853 16.297 ( -5.850 -29.263 -0.389) 29.844 16.776 ( -1.531 2.430 -0.191) 2.879 17.225 ( -0.209 10.696 -0.915) 10.737 19.089 ( 3.471 -6.238 -4.736) 8.566 21.165 ( -1.520 -6.050 5.289) 8.178 21.941 ( 0.205 -3.897 1.273) 4.105 23.500 ( 0.780 8.229 -1.040) 8.331 ======================= Grid point 283 (122/267) ======================= q-point: (-0.36 -0.64 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.169 ( -0.355 -0.784 -3.624) 3.724 2.652 ( 3.327 1.949 4.783) 6.144 2.912 ( -2.381 -5.451 -0.988) 6.030 3.150 ( -4.061 -7.747 3.744) 9.515 3.438 ( 4.879 -7.474 -1.236) 9.010 3.574 ( 3.901 -17.917 -1.260) 18.380 3.843 ( -3.975 -11.541 -1.590) 12.310 4.418 ( -1.084 -2.081 -7.641) 7.993 4.734 ( 0.535 -1.895 4.304) 4.733 5.024 ( 0.178 -13.420 4.031) 14.014 5.156 ( 1.539 -10.671 -1.891) 10.946 5.537 ( 1.639 -10.666 -2.962) 11.190 5.881 ( -3.265 0.761 -7.100) 7.852 6.318 ( -6.457 -1.864 6.880) 9.618 6.425 ( 5.080 -14.928 2.305) 15.937 6.553 ( 2.598 -1.192 -0.038) 2.859 7.127 ( -0.913 -7.501 0.469) 7.571 8.132 ( -0.171 7.387 -0.027) 7.389 8.600 ( -0.583 -33.881 -0.351) 33.888 9.104 ( -1.006 -10.311 -1.016) 10.409 9.397 ( 0.573 9.047 0.208) 9.068 9.613 ( -0.469 -9.529 -0.274) 9.544 10.315 ( 1.429 -32.443 -0.372) 32.477 10.556 ( -0.732 4.307 0.170) 4.372 12.039 ( 0.126 23.843 0.897) 23.860 12.426 ( 0.383 -0.933 -0.222) 1.033 12.833 ( -0.735 -7.219 -0.740) 7.294 14.097 ( -0.223 10.718 0.209) 10.723 15.150 ( -0.023 -36.129 0.940) 36.142 16.510 ( -1.838 3.420 -0.512) 3.916 16.721 ( 0.886 1.150 0.031) 1.452 17.306 ( -0.370 -19.308 -0.890) 19.332 19.212 ( 2.555 -5.265 -2.534) 6.377 21.182 ( -1.641 3.745 3.884) 5.640 22.065 ( -0.205 -8.690 -0.092) 8.692 23.342 ( 0.676 9.335 -0.189) 9.362 ======================= Grid point 284 (123/267) ======================= q-point: (-0.29 -0.64 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.182 ( -0.256 -1.782 -2.964) 3.468 2.670 ( 3.688 0.111 7.322) 8.200 2.992 ( -2.651 -5.435 -3.471) 6.972 3.159 ( -3.240 2.891 1.814) 4.706 3.577 ( 0.994 -6.709 3.094) 7.455 3.886 ( 2.432 -7.852 -6.116) 10.246 4.020 ( -3.982 -12.077 2.920) 13.047 4.407 ( -4.820 -1.633 -10.050) 11.265 4.784 ( 1.319 -2.167 4.700) 5.341 5.197 ( 3.728 -6.261 -4.393) 8.509 5.416 ( 2.803 -12.904 3.920) 13.774 5.698 ( 3.003 -3.986 -0.156) 4.993 5.839 ( -2.692 -2.409 -9.860) 10.501 6.311 ( -4.505 -0.233 7.196) 8.493 6.541 ( -4.647 -3.098 0.083) 5.586 6.764 ( 9.638 -10.401 2.675) 14.430 7.194 ( -3.008 -0.994 1.644) 3.569 7.980 ( 2.717 9.348 0.094) 9.736 9.061 ( -3.778 -17.989 -0.764) 18.397 9.292 ( -0.731 -11.425 -0.549) 11.462 9.324 ( -0.039 -2.504 -0.000) 2.504 9.869 ( -1.585 -16.443 -0.347) 16.523 10.502 ( -4.591 -0.832 0.158) 4.668 10.905 ( 10.105 -19.773 -0.038) 22.206 11.615 ( 0.860 18.687 0.415) 18.711 12.482 ( -7.711 -8.324 0.032) 11.347 12.950 ( 5.475 -3.935 -0.112) 6.744 13.895 ( -1.207 10.169 -0.118) 10.241 15.654 ( 0.536 -17.116 0.524) 17.132 16.342 ( -6.021 7.550 0.334) 9.663 16.805 ( 6.777 -7.106 -0.070) 9.820 17.710 ( 0.878 -21.062 -0.682) 21.091 19.304 ( 1.386 -3.519 -1.031) 3.920 21.048 ( -3.138 8.873 1.979) 9.618 22.225 ( -0.160 -8.303 -0.311) 8.311 23.160 ( 0.753 11.041 0.247) 11.070 ======================= Grid point 285 (124/267) ======================= q-point: (-0.21 -0.64 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.218 ( 1.022 -2.274 -2.267) 3.370 2.733 ( 4.334 -1.571 8.338) 9.528 3.039 ( -1.875 1.465 -3.282) 4.054 3.069 ( -2.856 0.064 -0.172) 2.862 3.690 ( -2.430 -4.478 3.884) 6.406 3.898 ( -3.259 2.544 -2.109) 4.641 4.156 ( -0.006 -2.074 -2.863) 3.535 4.402 ( -6.197 -4.736 -7.554) 10.858 4.847 ( 0.168 -2.397 4.878) 5.438 5.324 ( 6.967 -4.560 -7.659) 11.313 5.641 ( 0.156 -8.446 1.589) 8.595 5.704 ( 3.953 3.465 -0.463) 5.277 5.910 ( 0.794 -5.798 -6.409) 8.679 6.299 ( -3.593 -0.147 7.138) 7.993 6.568 ( -5.089 -3.468 0.900) 6.224 6.964 ( 4.405 -2.343 2.066) 5.401 7.162 ( 0.411 0.780 2.709) 2.849 7.859 ( 9.648 7.848 -0.093) 12.437 9.212 ( -7.761 -4.745 -0.903) 9.142 9.462 ( -2.499 -11.566 -0.290) 11.837 9.558 ( 2.653 -15.697 -0.227) 15.921 10.079 ( -2.280 -4.706 -0.391) 5.244 10.546 ( -9.375 -9.795 0.696) 13.576 10.865 ( 8.971 22.674 0.576) 24.391 11.642 ( 5.496 -11.621 -0.443) 12.863 12.584 ( -8.096 -7.521 0.380) 11.057 13.066 ( 6.222 -3.932 0.351) 7.369 13.718 ( -1.695 7.620 -0.296) 7.812 15.825 ( 1.503 -2.641 0.274) 3.051 16.204 ( -4.793 2.867 1.332) 5.742 17.039 ( 4.190 -12.102 0.067) 12.807 18.044 ( 1.159 -14.085 -0.737) 14.152 19.359 ( 0.350 -1.961 0.381) 2.028 20.841 ( -4.096 10.267 0.154) 11.055 22.362 ( 0.037 -6.651 -0.194) 6.654 22.952 ( 1.539 12.113 0.535) 12.222 ======================= Grid point 286 (125/267) ======================= q-point: (-0.14 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.254 ( 1.380 -0.521 -1.815) 2.339 2.799 ( 1.885 0.324 4.904) 5.264 2.951 ( 3.221 4.346 5.558) 7.756 3.093 ( -4.210 -3.483 -6.525) 8.510 3.659 ( -7.159 5.474 2.231) 9.284 3.849 ( 0.953 -0.243 1.048) 1.437 4.116 ( -0.759 3.776 -5.829) 6.987 4.409 ( -4.199 -0.212 -4.284) 6.003 4.886 ( -1.774 -1.287 4.805) 5.281 5.424 ( 8.164 -1.915 -8.581) 11.998 5.603 ( 1.977 6.715 -5.087) 8.653 5.782 ( -0.075 -4.181 2.047) 4.656 5.997 ( 1.423 -3.794 -2.990) 5.036 6.299 ( -0.827 0.256 6.905) 6.959 6.588 ( -6.001 -2.436 2.303) 6.874 6.864 ( -0.764 11.237 1.922) 11.425 7.259 ( 7.254 -4.150 2.361) 8.684 7.851 ( 14.433 2.673 -0.354) 14.683 9.166 ( -10.812 2.066 -0.864) 11.042 9.569 ( -5.115 0.704 -0.596) 5.198 9.856 ( 1.681 -13.300 -0.002) 13.406 10.071 ( -2.590 2.677 0.249) 3.733 10.306 ( 5.342 20.608 0.190) 21.290 10.978 ( -10.082 -26.759 0.680) 28.603 11.788 ( 8.558 3.000 -0.202) 9.071 12.598 ( -6.072 1.322 0.575) 6.240 13.180 ( 5.769 -3.246 0.697) 6.656 13.588 ( -1.398 5.222 -0.295) 5.414 15.854 ( -0.037 -1.660 0.239) 1.678 16.159 ( -1.835 0.624 1.605) 2.517 17.262 ( -0.434 -9.611 0.463) 9.632 18.232 ( -0.589 -6.086 -1.006) 6.197 19.387 ( -0.287 -0.856 1.689) 1.915 20.634 ( -2.514 8.722 -1.224) 9.159 22.461 ( -1.237 -3.449 -0.112) 3.666 22.774 ( 5.110 8.089 0.869) 9.607 ======================= Grid point 287 (126/267) ======================= q-point: (-0.07 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.226 ( 0.102 4.216 -1.409) 4.447 2.731 ( -0.770 6.532 -0.317) 6.584 2.978 ( 6.068 0.896 9.886) 11.634 3.096 ( -2.163 -1.163 -8.496) 8.844 3.488 ( -3.788 7.274 1.830) 8.403 3.856 ( 0.837 3.127 1.137) 3.431 4.024 ( -0.238 2.381 -3.428) 4.181 4.317 ( -2.768 6.285 -2.293) 7.240 4.892 ( -2.562 -0.112 3.766) 4.557 5.443 ( 3.426 8.384 -1.657) 9.207 5.488 ( 6.627 1.775 -11.346) 13.259 5.825 ( -1.075 -1.041 -2.468) 2.886 6.052 ( -0.738 -1.751 0.641) 2.006 6.297 ( 2.237 2.263 6.498) 7.236 6.557 ( -7.481 3.097 3.661) 8.886 6.638 ( 3.779 12.276 1.319) 12.912 7.370 ( 6.398 -1.816 1.641) 6.850 7.941 ( 13.796 -0.085 -0.563) 13.808 8.956 ( -10.089 12.536 -0.710) 16.107 9.405 ( -2.557 9.566 -0.493) 9.914 9.683 ( 4.553 28.708 0.160) 29.067 10.069 ( -8.102 -12.338 0.184) 14.762 10.375 ( -2.768 -12.793 0.312) 13.092 11.368 ( -5.987 -13.481 0.543) 14.761 11.721 ( 5.606 1.852 -0.296) 5.911 12.422 ( -4.069 14.423 0.650) 15.000 13.266 ( 3.713 -1.839 1.040) 4.272 13.524 ( 1.433 0.458 -0.301) 1.534 15.927 ( -0.856 -6.927 0.623) 7.007 16.125 ( -2.841 2.582 0.802) 3.922 17.369 ( -6.159 -4.207 0.491) 7.475 18.252 ( -3.617 2.023 -0.529) 4.178 19.391 ( -1.068 0.429 1.494) 1.886 20.504 ( 3.246 4.829 -1.309) 5.964 22.411 ( -2.491 6.172 -0.342) 6.665 22.808 ( 9.101 -4.780 1.208) 10.350 ======================= Grid point 294 (127/267) ======================= q-point: ( 0.43 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.811 ( 3.954 -0.000 0.607) 4.000 2.102 ( 22.259 -0.000 -3.736) 22.570 2.473 ( 4.302 -0.000 -3.343) 5.448 2.521 ( 4.941 -0.000 -0.249) 4.947 2.807 ( -5.285 0.000 3.619) 6.405 2.934 ( -4.265 0.000 4.472) 6.180 3.432 ( -1.719 0.000 -5.049) 5.334 3.453 ( -2.356 0.000 -5.703) 6.170 3.960 ( 0.460 -0.000 2.326) 2.371 4.329 ( -7.329 0.000 8.493) 11.218 4.409 ( 0.871 -0.000 -0.657) 1.091 4.972 ( -2.949 0.000 1.732) 3.419 5.253 ( -4.862 0.000 -6.816) 8.372 5.637 ( 0.835 -0.000 -0.118) 0.843 5.954 ( 1.225 -0.000 8.625) 8.711 6.574 ( -0.469 0.000 0.527) 0.705 6.677 ( 10.338 -0.000 -3.853) 11.033 7.275 ( -0.106 0.000 0.012) 0.106 7.878 ( 30.960 -0.000 -2.707) 31.078 8.849 ( -19.136 0.000 -1.483) 19.193 9.460 ( -2.932 0.000 -0.018) 2.932 9.641 ( 9.290 -0.000 1.784) 9.460 10.284 ( -20.189 0.000 0.155) 20.190 10.678 ( -1.284 0.000 0.248) 1.308 11.319 ( -1.739 0.000 -0.400) 1.785 13.004 ( 27.229 -0.000 -2.841) 27.377 13.133 ( -1.852 0.000 1.067) 2.137 14.096 ( -27.462 0.000 1.096) 27.484 14.254 ( 0.206 -0.000 -0.073) 0.218 14.617 ( -5.360 0.000 1.817) 5.660 16.853 ( -0.081 0.000 0.060) 0.101 17.973 ( 0.037 -0.000 -0.089) 0.096 18.822 ( 9.109 -0.000 -10.664) 14.025 20.661 ( -9.329 0.000 6.713) 11.493 21.961 ( 0.375 -0.000 7.114) 7.124 23.782 ( 2.059 -0.000 -3.926) 4.433 ======================= Grid point 295 (128/267) ======================= q-point: ( 0.50 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.029 ( 1.133 -17.933 -0.965) 17.994 2.228 ( 14.182 -0.852 -3.157) 14.554 2.461 ( 0.469 -1.381 0.057) 1.459 2.637 ( 5.029 -5.269 -1.453) 7.428 2.866 ( -2.897 1.379 3.283) 4.590 3.082 ( -4.111 -21.818 5.112) 22.783 3.378 ( 0.699 -2.718 -5.498) 6.173 3.654 ( -2.250 -19.751 -5.014) 20.501 4.081 ( -3.813 -10.403 3.949) 11.762 4.376 ( -0.819 -2.093 1.240) 2.567 4.606 ( 0.261 -24.294 3.732) 24.580 4.955 ( -1.886 0.196 1.737) 2.571 5.329 ( -2.859 -13.896 -8.168) 16.370 5.679 ( 0.747 -4.142 -0.181) 4.212 5.982 ( 1.017 -0.709 9.404) 9.485 6.562 ( -0.631 0.866 0.127) 1.079 6.741 ( 5.321 -1.788 -3.875) 6.820 7.285 ( 0.244 -1.822 0.321) 1.866 8.120 ( 25.470 -2.646 -2.739) 25.753 8.706 ( -19.841 -2.437 -2.432) 20.138 9.447 ( -0.802 -0.488 0.988) 1.363 9.670 ( 6.071 3.255 1.818) 7.124 10.090 ( -11.825 7.233 0.165) 13.863 11.075 ( 0.835 -38.375 -0.092) 38.384 11.203 ( -1.435 10.191 -0.315) 10.297 12.980 ( 10.574 17.673 -2.243) 20.717 13.041 ( -0.487 8.863 1.227) 8.961 13.787 ( -6.549 0.679 1.610) 6.778 14.537 ( 0.939 1.988 0.936) 2.390 14.810 ( -10.333 -39.553 -0.585) 40.884 16.849 ( 0.037 0.594 -0.029) 0.596 17.835 ( 0.169 13.752 -0.157) 13.754 18.897 ( 7.080 -3.311 -8.603) 11.623 20.727 ( -5.771 -11.084 5.871) 13.807 21.955 ( -0.750 1.675 5.716) 6.003 23.750 ( 2.285 4.328 -2.480) 5.487 ======================= Grid point 296 (129/267) ======================= q-point: (-0.43 -0.57 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.184 ( 0.542 0.757 -5.453) 5.532 2.492 ( -5.134 -21.434 0.878) 22.057 2.606 ( 5.097 -10.028 1.351) 11.330 2.765 ( 4.359 -7.433 -1.834) 8.809 2.841 ( -1.356 -1.200 2.454) 3.050 3.335 ( -0.774 -8.147 -1.856) 8.392 3.497 ( -0.891 -7.079 3.319) 7.869 4.131 ( 2.221 -27.558 -3.700) 27.894 4.332 ( -2.628 -17.514 4.315) 18.228 4.422 ( -1.354 -6.640 -0.488) 6.794 4.931 ( -0.055 -1.325 0.336) 1.368 5.066 ( 1.978 -16.213 1.718) 16.423 5.673 ( -5.519 -22.366 -8.693) 24.623 5.817 ( 1.923 -10.329 0.164) 10.508 6.083 ( 2.381 -8.959 9.283) 13.119 6.539 ( -0.620 0.875 0.124) 1.080 6.819 ( 0.336 -5.569 -3.139) 6.401 7.411 ( -0.376 -14.528 0.791) 14.555 8.256 ( 2.143 -0.585 -1.638) 2.760 8.712 ( -4.480 -8.902 -2.876) 10.372 9.517 ( 4.310 -7.229 1.091) 8.486 9.616 ( -2.236 4.609 1.200) 5.261 9.865 ( 0.333 11.853 0.145) 11.859 10.942 ( -0.144 15.048 -0.206) 15.050 11.913 ( -1.431 -44.697 -1.114) 44.733 12.680 ( 0.527 14.777 -0.733) 14.804 12.825 ( 2.126 14.710 1.080) 14.902 13.927 ( 0.686 -16.574 1.987) 16.707 14.441 ( -1.051 7.097 0.779) 7.217 15.553 ( -3.020 -43.088 -1.617) 43.224 16.827 ( 0.391 2.109 -0.081) 2.146 17.522 ( 0.017 18.605 -0.532) 18.613 19.003 ( 5.438 -4.971 -6.061) 9.540 20.957 ( -3.277 -14.157 5.204) 15.435 21.927 ( -0.911 1.243 3.625) 3.939 23.653 ( 2.174 7.326 -1.363) 7.763 ======================= Grid point 297 (130/267) ======================= q-point: (-0.36 -0.57 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.146 ( -2.581 0.121 -4.458) 5.153 2.676 ( -3.520 -3.404 2.674) 5.579 2.793 ( -4.066 -6.739 -0.241) 7.874 2.927 ( 2.717 -10.781 2.615) 11.421 3.123 ( 2.981 -23.473 -0.922) 23.679 3.432 ( -0.886 -3.916 -0.190) 4.019 3.633 ( -0.379 -8.571 -0.490) 8.594 4.357 ( -0.580 -2.208 -5.701) 6.141 4.647 ( 2.175 -13.254 3.613) 13.909 4.731 ( 0.301 -19.112 5.789) 19.972 4.989 ( 1.786 -6.916 -2.395) 7.534 5.327 ( 2.101 -11.838 -3.358) 12.483 5.839 ( -4.998 -3.733 -4.795) 7.868 6.054 ( -3.842 -14.055 2.664) 14.812 6.348 ( 8.218 -9.220 4.901) 13.288 6.534 ( -0.511 -1.317 0.006) 1.413 6.941 ( -4.120 -9.380 -1.346) 10.333 7.885 ( -3.960 -36.107 0.216) 36.324 8.223 ( -4.371 1.130 -0.834) 4.591 8.873 ( -3.434 -10.731 -1.615) 11.382 9.476 ( -11.909 4.227 0.433) 12.644 9.697 ( 12.904 10.644 0.084) 16.728 9.838 ( 10.853 -21.227 0.057) 23.840 10.698 ( 1.238 10.768 0.010) 10.839 12.324 ( -23.140 -7.124 -0.376) 24.215 12.440 ( 1.146 17.773 0.763) 17.826 12.756 ( 21.247 -4.769 -1.214) 21.810 14.277 ( -2.110 9.374 0.483) 9.621 14.441 ( 0.428 -37.093 1.861) 37.142 16.253 ( 0.940 -29.993 -1.261) 30.034 16.781 ( 1.947 2.586 -0.064) 3.238 17.225 ( 0.753 10.602 -0.923) 10.669 19.126 ( 4.001 -5.493 -4.133) 7.954 21.151 ( -3.527 -6.611 5.087) 9.057 21.942 ( -0.530 -3.659 1.306) 3.921 23.515 ( 1.752 8.703 -0.723) 8.907 ======================= Grid point 298 (131/267) ======================= q-point: (-0.29 -0.57 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( -2.175 -1.786 -3.542) 4.524 2.699 ( -0.659 -0.955 5.824) 5.938 2.868 ( -2.522 -5.154 -2.348) 6.200 3.105 ( -3.106 -6.266 1.001) 7.065 3.483 ( 1.509 -5.754 2.123) 6.316 3.609 ( 0.404 -22.325 0.655) 22.338 3.782 ( -2.522 -8.309 -2.882) 9.149 4.337 ( -4.897 0.241 -8.296) 9.637 4.780 ( 2.665 -1.695 5.356) 6.218 5.052 ( 1.739 -12.453 2.343) 12.790 5.213 ( 6.483 -12.828 -1.336) 14.435 5.546 ( 1.386 -11.762 -5.418) 13.024 5.814 ( -1.648 1.058 -3.750) 4.231 6.211 ( -8.943 -7.021 5.507) 12.633 6.478 ( -0.523 -0.886 1.068) 1.483 6.672 ( 11.636 -9.331 1.505) 14.991 7.072 ( -6.735 -8.353 0.741) 10.756 8.129 ( -0.367 4.201 -0.614) 4.261 8.544 ( -6.662 -32.909 -0.226) 33.578 9.056 ( -4.352 -12.872 -0.658) 13.604 9.332 ( -7.160 2.594 0.194) 7.618 9.683 ( 8.231 -1.063 -0.226) 8.303 10.365 ( 4.082 -20.148 0.037) 20.557 10.626 ( 10.519 -5.553 -0.534) 11.906 12.051 ( -0.930 22.576 0.829) 22.610 12.263 ( -15.252 -4.762 0.078) 15.979 12.960 ( 13.360 -2.310 -1.105) 13.603 14.073 ( -3.034 10.457 0.208) 10.890 15.161 ( 1.245 -35.661 1.003) 35.697 16.426 ( -5.895 5.690 0.298) 8.199 16.842 ( 12.001 -0.077 -0.452) 12.010 17.311 ( 1.680 -19.926 -1.015) 20.022 19.235 ( 2.087 -4.564 -3.001) 5.848 21.148 ( -5.350 3.921 4.296) 7.903 22.063 ( 0.026 -8.599 0.068) 8.600 23.356 ( 1.063 9.634 -0.387) 9.700 ======================= Grid point 299 (132/267) ======================= q-point: (-0.21 -0.57 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.165 ( -0.561 -3.185 -2.561) 4.125 2.743 ( 1.047 -2.053 6.839) 7.216 2.932 ( -2.812 -4.454 -4.670) 7.039 3.124 ( -1.803 1.428 1.573) 2.787 3.593 ( -1.262 -5.379 4.035) 6.842 3.858 ( -1.655 -3.498 -5.358) 6.609 3.998 ( -1.370 -16.739 3.644) 17.185 4.254 ( -9.034 0.133 -9.691) 13.249 4.833 ( 2.263 -1.073 4.672) 5.301 5.246 ( 4.537 -7.329 -3.982) 9.495 5.486 ( 5.577 -10.769 0.387) 12.134 5.746 ( 0.171 -10.199 -7.244) 12.511 5.792 ( 4.496 1.837 0.506) 4.883 6.248 ( -7.508 -3.119 6.051) 10.135 6.480 ( -4.054 -1.881 1.333) 4.664 6.918 ( 8.263 -7.010 1.048) 10.886 7.139 ( -4.159 -3.563 2.220) 5.910 8.053 ( 6.463 5.542 -0.680) 8.541 8.958 ( -9.508 -17.836 -0.337) 20.215 9.259 ( -3.107 -9.591 0.008) 10.081 9.336 ( 1.185 -8.839 -0.314) 8.924 9.837 ( -1.638 -11.887 -0.212) 12.001 10.440 ( -2.975 0.996 0.530) 3.182 11.112 ( 16.665 -18.055 -0.993) 24.590 11.634 ( 0.966 18.773 0.494) 18.805 12.316 ( -12.808 -11.605 0.245) 17.285 13.068 ( 8.904 -1.644 -0.323) 9.061 13.860 ( -3.468 9.691 -0.036) 10.293 15.682 ( 2.910 -17.864 0.700) 18.113 16.233 ( -7.471 6.957 0.854) 10.245 16.944 ( 10.462 -3.557 -0.198) 11.052 17.742 ( 3.998 -20.606 -0.497) 20.996 19.309 ( 0.139 -3.217 -2.177) 3.887 20.985 ( -6.577 8.836 2.657) 11.331 22.225 ( 0.350 -8.314 -0.060) 8.322 23.172 ( 0.388 10.825 -0.125) 10.833 ======================= Grid point 300 (133/267) ======================= q-point: (-0.14 -0.57 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.223 ( 0.698 -3.128 -2.045) 3.802 2.808 ( 0.880 -2.027 6.011) 6.404 2.960 ( -4.420 -2.865 -7.206) 8.926 3.078 ( 2.079 3.239 4.700) 6.075 3.653 ( -4.513 -1.495 4.061) 6.253 3.859 ( 0.348 0.338 -3.161) 3.198 4.137 ( -1.684 0.758 -6.319) 6.583 4.267 ( -7.242 -9.758 -0.307) 12.155 4.867 ( 0.070 -0.662 3.507) 3.570 5.386 ( 5.482 -5.346 -7.841) 10.960 5.656 ( 3.117 -3.369 -2.435) 5.196 5.780 ( 3.653 2.127 0.854) 4.313 5.902 ( 1.878 -6.274 -3.171) 7.276 6.274 ( -3.534 -3.100 6.517) 8.036 6.502 ( -4.416 -3.189 2.776) 6.114 6.975 ( -4.181 2.552 1.677) 5.178 7.229 ( 7.124 -4.798 1.562) 8.730 8.031 ( 12.481 4.085 -0.947) 13.166 9.067 ( -10.845 -4.029 -0.300) 11.574 9.412 ( -3.732 -9.534 -0.183) 10.240 9.606 ( 4.066 -15.366 -0.250) 15.897 10.036 ( -3.384 -8.272 -0.342) 8.944 10.417 ( -7.913 -5.986 0.851) 9.958 10.997 ( 8.748 27.683 0.139) 29.032 11.741 ( 7.604 -13.697 -0.766) 15.685 12.455 ( -8.873 -10.206 0.648) 13.539 13.167 ( 6.579 -3.013 0.335) 7.244 13.680 ( -3.285 6.893 -0.187) 7.638 15.860 ( 2.920 -0.280 0.418) 2.963 16.131 ( -5.216 -1.224 1.439) 5.548 17.115 ( 5.542 -7.475 0.327) 9.311 18.073 ( 3.185 -12.130 -0.255) 12.543 19.350 ( -1.233 -2.274 -1.321) 2.904 20.771 ( -5.558 9.113 1.053) 10.726 22.366 ( 0.545 -6.407 0.126) 6.431 22.973 ( 0.667 10.477 0.126) 10.499 ======================= Grid point 301 (134/267) ======================= q-point: (-0.07 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.259 ( 0.391 -0.256 -2.042) 2.095 2.806 ( -1.841 3.082 0.430) 3.615 2.986 ( -3.333 -5.105 -4.797) 7.758 3.068 ( 4.272 2.094 7.421) 8.815 3.589 ( -2.720 4.967 0.826) 5.723 3.887 ( 3.795 -1.703 0.421) 4.181 4.071 ( -2.269 3.292 -4.812) 6.256 4.333 ( -3.910 -1.486 -0.392) 4.201 4.875 ( -1.960 -0.266 2.633) 3.293 5.487 ( 5.700 -3.107 -10.213) 12.101 5.620 ( 2.926 7.359 -3.966) 8.857 5.795 ( 0.389 -1.112 1.173) 1.663 5.995 ( -0.474 -3.795 -0.132) 3.827 6.330 ( 0.988 -1.763 5.616) 5.968 6.526 ( -4.325 -1.223 4.922) 6.665 6.851 ( -1.784 7.378 1.595) 7.756 7.361 ( 5.050 -3.333 0.745) 6.097 8.074 ( 14.388 2.237 -1.191) 14.610 9.001 ( -9.928 2.179 -0.311) 10.170 9.488 ( -4.870 -0.743 -0.401) 4.943 9.875 ( 0.897 -7.328 -0.208) 7.386 10.044 ( -1.282 0.330 0.375) 1.376 10.380 ( 4.509 19.111 -0.230) 19.637 10.830 ( -9.361 -21.013 0.711) 23.015 11.913 ( 7.725 1.892 -0.648) 7.980 12.511 ( -5.664 -0.441 0.947) 5.759 13.266 ( 4.841 -2.374 0.855) 5.459 13.562 ( -1.821 3.535 -0.325) 3.990 15.855 ( -0.059 -0.535 0.288) 0.611 16.141 ( -1.504 -0.178 1.540) 2.160 17.258 ( -0.360 -4.979 0.820) 5.058 18.228 ( 0.352 -3.280 -0.084) 3.300 19.370 ( -1.972 -1.355 -0.870) 2.546 20.605 ( -0.963 5.553 0.212) 5.640 22.449 ( -0.444 -1.164 0.176) 1.258 22.842 ( 3.296 3.442 0.395) 4.782 ======================= Grid point 309 (135/267) ======================= q-point: (-0.50 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.828 ( -1.902 0.000 0.034) 1.902 2.329 ( 4.340 -0.000 -5.858) 7.291 2.499 ( 4.641 -0.000 5.022) 6.838 2.580 ( 2.687 -0.000 -0.127) 2.690 2.772 ( -1.566 0.000 4.655) 4.912 2.879 ( -4.661 0.000 1.746) 4.977 3.400 ( 0.696 -0.000 -5.786) 5.828 3.401 ( 0.280 -0.000 -9.424) 9.428 3.973 ( -0.184 0.000 2.703) 2.709 4.283 ( -3.687 0.000 9.672) 10.351 4.409 ( -0.273 0.000 -0.986) 1.023 4.953 ( -0.614 0.000 1.496) 1.617 5.188 ( -0.194 0.000 -6.834) 6.836 5.644 ( 0.130 -0.000 -0.072) 0.148 6.005 ( 0.339 -0.000 9.691) 9.697 6.562 ( -1.254 0.000 -0.404) 1.317 6.747 ( 1.938 -0.000 -4.033) 4.474 7.275 ( 0.019 -0.000 0.022) 0.029 8.236 ( 3.185 -0.000 -2.533) 4.070 8.542 ( -5.266 0.000 -4.118) 6.685 9.462 ( 2.449 -0.000 2.016) 3.172 9.723 ( -1.855 0.000 2.024) 2.746 10.127 ( 1.150 -0.000 0.089) 1.154 10.670 ( 0.009 -0.000 0.290) 0.290 11.308 ( 0.477 -0.000 -0.042) 0.479 13.111 ( -0.378 0.000 1.136) 1.197 13.351 ( 10.619 -0.000 -3.694) 11.243 13.735 ( -10.615 0.000 1.949) 10.792 14.255 ( -0.012 0.000 -0.088) 0.089 14.586 ( -1.727 0.000 0.908) 1.951 16.853 ( -0.019 0.000 0.058) 0.061 17.973 ( 0.023 -0.000 -0.090) 0.093 18.905 ( 8.043 -0.000 -8.614) 11.785 20.587 ( -4.739 0.000 5.910) 7.576 21.975 ( -1.730 0.000 6.103) 6.344 23.808 ( 3.245 -0.000 -2.082) 3.855 ======================= Grid point 310 (136/267) ======================= q-point: (-0.43 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.988 ( -5.905 -16.906 -1.399) 17.962 2.256 ( -8.137 0.749 -4.010) 9.102 2.516 ( 5.397 -1.493 3.150) 6.425 2.676 ( 0.942 -4.378 -1.851) 4.846 2.843 ( -1.626 -0.119 3.145) 3.542 3.093 ( 2.278 -21.972 5.723) 22.820 3.367 ( 0.856 -3.887 -5.566) 6.843 3.613 ( 0.574 -20.059 -6.853) 21.205 4.072 ( 0.658 -9.843 4.026) 10.655 4.372 ( -0.533 -1.150 0.874) 1.539 4.626 ( -0.249 -27.369 5.437) 27.905 4.952 ( 0.532 0.290 1.413) 1.538 5.270 ( -0.251 -11.105 -9.028) 14.314 5.686 ( 0.219 -4.799 -0.118) 4.806 6.037 ( 0.764 -1.441 9.995) 10.127 6.545 ( -1.562 0.532 -0.509) 1.727 6.746 ( -2.121 -1.109 -3.865) 4.546 7.285 ( -0.534 -1.753 0.318) 1.860 8.127 ( -26.513 -2.974 -2.816) 26.827 8.643 ( 17.478 -2.278 -3.153) 17.906 9.493 ( 5.218 -0.853 1.640) 5.536 9.655 ( -8.757 3.221 1.460) 9.444 10.101 ( 12.853 7.534 0.401) 14.904 11.068 ( -1.348 -37.303 -0.199) 37.328 11.207 ( 1.783 10.200 -0.250) 10.358 12.983 ( -4.872 15.665 -1.213) 16.450 13.090 ( 1.772 12.540 1.010) 12.704 13.773 ( 4.382 -2.482 1.553) 5.270 14.529 ( -2.409 3.016 0.821) 3.947 14.758 ( 3.721 -39.827 -1.668) 40.035 16.851 ( 0.217 0.410 0.014) 0.465 17.835 ( -0.065 13.820 -0.171) 13.822 18.966 ( 7.237 -2.406 -7.711) 10.845 20.690 ( -2.958 -11.705 5.645) 13.327 21.959 ( -1.714 1.637 5.666) 6.142 23.785 ( 3.572 4.713 -1.753) 6.168 ======================= Grid point 311 (137/267) ======================= q-point: (-0.36 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.087 ( -9.603 -1.892 -5.416) 11.186 2.376 ( -10.662 -18.321 1.009) 21.221 2.658 ( 0.626 -6.353 0.718) 6.424 2.772 ( -0.094 -12.408 -3.223) 12.820 2.889 ( 4.024 -2.312 4.707) 6.610 3.338 ( 1.947 -5.592 -2.805) 6.552 3.492 ( -1.667 -7.934 4.144) 9.105 4.159 ( 3.112 -30.932 -4.424) 31.402 4.345 ( 1.172 -9.510 2.511) 9.905 4.415 ( 1.947 -12.455 1.788) 12.733 4.953 ( 2.635 -0.388 0.602) 2.731 5.101 ( 1.280 -16.415 2.303) 16.625 5.545 ( -6.374 -19.312 -7.741) 21.760 5.849 ( 1.993 -11.650 0.222) 11.822 6.166 ( 3.749 -11.209 7.741) 14.129 6.521 ( -1.948 0.495 0.021) 2.010 6.757 ( -6.749 -4.937 -3.140) 8.932 7.386 ( -3.656 -13.296 0.804) 13.813 8.040 ( -22.729 -8.462 -2.569) 24.389 8.779 ( 9.928 -1.446 -0.966) 10.080 9.491 ( -10.138 5.354 0.587) 11.480 9.622 ( 5.111 -7.877 0.243) 9.393 10.055 ( 22.117 10.680 0.404) 24.564 10.956 ( 2.077 14.966 -0.241) 15.111 11.771 ( -15.495 -33.368 -0.730) 36.798 12.718 ( 4.984 10.400 -0.507) 11.544 12.940 ( 11.675 7.795 0.282) 14.041 13.931 ( -1.146 -16.141 2.188) 16.329 14.411 ( -3.506 6.944 0.684) 7.809 15.587 ( 8.636 -42.305 -1.725) 43.212 16.835 ( 0.802 1.795 -0.026) 1.966 17.521 ( 0.250 18.327 -0.423) 18.334 19.061 ( 5.897 -4.050 -6.580) 9.719 20.935 ( -3.071 -13.859 5.643) 15.275 21.927 ( -1.191 1.311 4.290) 4.641 23.685 ( 2.829 7.979 -1.632) 8.621 ======================= Grid point 312 (138/267) ======================= q-point: (-0.29 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.054 ( -7.093 -2.948 -4.543) 8.925 2.576 ( -11.535 -11.086 4.190) 16.538 2.735 ( -2.746 -5.695 -3.966) 7.463 2.983 ( 3.352 -5.240 0.492) 6.240 3.153 ( 1.156 -23.267 3.250) 23.522 3.419 ( -1.248 -4.195 0.592) 4.417 3.637 ( 1.144 -7.140 -0.358) 7.240 4.303 ( -3.348 0.838 -5.997) 6.919 4.697 ( 2.214 -16.570 2.593) 16.917 4.793 ( 4.587 -16.010 6.973) 18.055 5.038 ( 6.208 -8.482 -2.794) 10.876 5.333 ( 1.272 -10.382 -5.812) 11.965 5.731 ( -7.104 -8.375 -1.286) 11.057 6.037 ( -0.331 -7.008 3.983) 8.067 6.476 ( 2.330 -2.036 1.537) 3.455 6.540 ( 5.173 -13.031 0.678) 14.037 6.828 ( -9.967 -10.078 -0.672) 14.191 7.788 ( -9.269 -33.020 0.186) 34.297 8.086 ( -11.750 -10.508 -1.749) 15.860 8.855 ( 1.525 -3.655 0.398) 3.980 9.321 ( -9.965 4.069 0.189) 10.765 9.797 ( 4.505 -2.777 -0.510) 5.316 10.137 ( 24.270 -5.065 -0.221) 24.794 10.744 ( 5.313 9.170 -0.112) 10.598 11.944 ( -26.471 -8.751 0.025) 27.880 12.501 ( 5.833 18.136 0.943) 19.074 13.050 ( 18.824 -0.922 -2.208) 18.975 14.224 ( -4.979 8.111 0.339) 9.523 14.467 ( 2.470 -37.475 1.904) 37.604 16.319 ( 8.104 -23.576 0.416) 24.934 16.826 ( 4.243 -3.279 -0.536) 5.389 17.238 ( 1.600 10.473 -0.951) 10.638 19.162 ( 3.528 -4.335 -5.766) 8.030 21.108 ( -5.641 -5.419 6.288) 10.036 21.943 ( -0.053 -3.697 1.898) 4.156 23.535 ( 1.171 9.251 -1.548) 9.453 ======================= Grid point 313 (139/267) ======================= q-point: (-0.21 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.074 ( -4.215 -4.491 -2.958) 6.832 2.668 ( -6.765 -6.165 4.314) 10.118 2.817 ( -2.834 -5.773 -3.941) 7.543 3.089 ( 1.153 -3.906 -0.489) 4.102 3.493 ( -2.726 -4.956 2.840) 6.329 3.603 ( -1.352 -23.250 5.254) 23.875 3.756 ( 1.077 -5.337 -3.786) 6.631 4.216 ( -6.456 2.705 -7.108) 9.976 4.852 ( 3.512 -1.068 5.725) 6.801 5.089 ( 2.075 -12.219 0.815) 12.420 5.322 ( 9.176 -13.244 -2.727) 16.341 5.515 ( -0.735 -11.039 -9.618) 14.659 5.814 ( 1.080 -4.331 3.144) 5.460 6.126 ( -5.036 -4.059 4.335) 7.787 6.450 ( -3.641 0.765 1.570) 4.039 6.814 ( 0.255 -9.620 0.041) 9.623 6.989 ( 1.573 -10.476 1.597) 10.713 8.101 ( -3.306 -4.891 -1.549) 6.104 8.415 ( -10.526 -30.840 0.382) 32.589 8.994 ( -3.371 -12.920 0.292) 13.356 9.225 ( -7.106 -1.109 -0.017) 7.192 9.822 ( 10.397 3.407 -0.265) 10.944 10.418 ( 3.204 -5.179 0.431) 6.105 10.838 ( 17.623 -15.346 -1.347) 23.406 11.876 ( -20.381 -2.504 0.445) 20.539 12.202 ( 4.812 15.818 0.539) 16.543 13.140 ( 11.138 1.635 -1.391) 11.343 14.012 ( -5.425 9.939 0.268) 11.326 15.209 ( 5.414 -34.754 0.862) 35.184 16.376 ( -1.551 10.348 1.730) 10.606 17.020 ( 11.721 0.925 -0.460) 11.767 17.356 ( 5.561 -23.308 -0.778) 23.975 19.239 ( 0.673 -3.618 -5.146) 6.326 21.068 ( -8.263 4.676 5.722) 11.086 22.069 ( 0.688 -8.461 0.359) 8.497 23.358 ( -0.762 9.791 -1.199) 9.893 ======================= Grid point 314 (140/267) ======================= q-point: (-0.14 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.139 ( -1.674 -5.247 -1.820) 5.801 2.742 ( -3.810 -5.356 2.967) 7.211 2.870 ( -2.776 -2.915 -4.966) 6.393 3.137 ( 2.289 -0.044 2.082) 3.095 3.568 ( -4.604 -5.074 3.719) 7.795 3.834 ( 1.911 -3.071 -3.797) 5.244 3.971 ( -6.036 -16.108 2.762) 17.422 4.113 ( -3.236 0.611 -5.019) 6.003 4.882 ( 1.664 0.651 3.700) 4.108 5.280 ( 2.186 -7.761 -3.687) 8.865 5.586 ( 8.559 -7.835 -2.384) 11.846 5.678 ( -2.809 -10.211 -8.801) 13.770 5.918 ( 8.616 -0.474 4.348) 9.663 6.164 ( -6.543 -5.078 4.722) 9.534 6.430 ( -4.048 -1.714 2.902) 5.268 6.908 ( -9.945 -4.995 1.849) 11.281 7.195 ( 10.157 -5.888 0.480) 11.750 8.131 ( 3.737 0.072 -1.269) 3.948 8.794 ( -12.267 -18.108 0.336) 21.875 9.213 ( -2.645 -9.133 0.071) 9.509 9.334 ( -1.939 -17.507 -0.220) 17.616 9.853 ( 4.931 -1.223 -0.147) 5.082 10.427 ( 0.714 3.288 0.628) 3.423 11.355 ( 16.403 -18.674 -1.691) 24.912 11.629 ( -2.560 17.048 0.629) 17.250 12.156 ( -7.879 -11.106 0.407) 13.623 13.183 ( 6.670 -0.089 -0.348) 6.680 13.795 ( -5.309 8.873 0.083) 10.340 15.749 ( 5.810 -18.157 0.846) 19.083 16.154 ( -3.840 9.662 1.389) 10.489 17.087 ( 9.008 -1.668 -0.134) 9.162 17.827 ( 7.861 -18.978 0.415) 20.546 19.285 ( -1.549 -2.961 -4.355) 5.489 20.887 ( -8.437 8.287 3.784) 12.416 22.234 ( 0.749 -8.313 0.108) 8.347 23.159 ( -2.233 10.221 -0.610) 10.480 ======================= Grid point 315 (141/267) ======================= q-point: (-0.07 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.217 ( -0.326 -3.844 -1.861) 4.283 2.815 ( -1.972 -2.631 3.223) 4.604 2.862 ( -4.340 -2.071 -7.264) 8.711 3.150 ( 3.775 1.592 5.219) 6.635 3.612 ( -2.945 -1.382 3.277) 4.618 3.877 ( 3.203 -1.180 -4.230) 5.436 4.033 ( -5.957 -3.399 -3.321) 7.621 4.231 ( -0.316 -7.075 2.530) 7.520 4.876 ( -0.617 0.969 1.864) 2.190 5.410 ( 2.415 -6.017 -7.339) 9.792 5.708 ( 4.796 -0.839 -2.845) 5.640 5.779 ( -1.330 -2.657 -5.031) 5.843 5.954 ( 3.946 0.509 3.083) 5.034 6.267 ( -0.133 -6.523 4.776) 8.086 6.467 ( -3.033 -3.472 5.402) 7.102 6.884 ( -8.696 -0.146 1.997) 8.924 7.342 ( 6.480 -3.165 -0.101) 7.212 8.166 ( 5.253 -0.471 -1.346) 5.443 8.915 ( -8.863 -4.957 0.029) 10.155 9.371 ( -1.201 -8.690 -0.020) 8.772 9.674 ( 4.991 -14.521 -0.249) 15.357 9.974 ( -4.313 -11.819 -0.340) 12.586 10.343 ( -2.472 3.068 0.728) 4.006 11.124 ( 8.700 30.011 -0.011) 31.246 11.828 ( 3.536 -14.945 -0.940) 15.386 12.355 ( -4.321 -11.999 0.891) 12.785 13.249 ( 4.095 -2.622 0.481) 4.886 13.623 ( -4.241 5.681 -0.149) 7.091 15.906 ( 2.601 4.368 0.596) 5.119 16.081 ( -2.072 -5.009 1.421) 5.603 17.199 ( 5.558 -3.490 0.631) 6.593 18.136 ( 5.226 -8.966 0.641) 10.398 19.313 ( -2.401 -2.634 -3.288) 4.849 20.697 ( -5.154 6.551 1.926) 8.555 22.377 ( 0.853 -6.262 0.288) 6.327 22.962 ( -2.423 8.398 -0.139) 8.742 ======================= Grid point 324 (142/267) ======================= q-point: (-0.43 -0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( -8.132 0.000 -0.438) 8.144 2.170 ( -17.299 0.000 -4.993) 18.005 2.593 ( -0.684 0.000 0.544) 0.874 2.635 ( 4.980 -0.000 4.895) 6.983 2.807 ( 3.238 -0.000 4.509) 5.551 2.828 ( -2.457 0.000 1.080) 2.684 3.382 ( 2.508 -0.000 -9.371) 9.701 3.403 ( 3.319 -0.000 -5.834) 6.712 3.977 ( -0.997 0.000 2.593) 2.778 4.322 ( 3.258 -0.000 10.652) 11.139 4.393 ( -1.316 0.000 -1.021) 1.665 4.965 ( 1.441 -0.000 0.816) 1.656 5.172 ( 1.685 -0.000 -7.557) 7.742 5.640 ( -0.593 0.000 -0.062) 0.596 6.052 ( 0.390 -0.000 9.944) 9.951 6.534 ( -2.236 0.000 -1.006) 2.452 6.707 ( -4.998 0.000 -3.122) 5.893 7.276 ( 0.139 -0.000 0.026) 0.142 7.849 ( -33.970 0.000 -3.426) 34.143 8.778 ( 20.698 -0.000 -2.484) 20.847 9.525 ( 3.784 -0.000 1.287) 3.997 9.616 ( -10.717 0.000 1.026) 10.766 10.308 ( 20.781 -0.000 0.623) 20.790 10.681 ( 1.304 -0.000 0.301) 1.338 11.328 ( 2.017 -0.000 -0.201) 2.027 13.072 ( -14.052 0.000 -1.927) 14.183 13.187 ( -7.379 0.000 2.249) 7.714 13.981 ( 28.126 -0.000 -0.900) 28.141 14.253 ( -0.233 0.000 -0.095) 0.251 14.558 ( -2.380 0.000 0.646) 2.466 16.853 ( 0.047 -0.000 0.059) 0.076 17.972 ( 0.008 -0.000 -0.091) 0.091 18.981 ( 7.480 -0.000 -8.861) 11.596 20.569 ( -1.643 0.000 6.321) 6.531 21.978 ( -1.526 0.000 7.123) 7.284 23.857 ( 4.496 -0.000 -2.331) 5.064 ======================= Grid point 325 (143/267) ======================= q-point: (-0.36 -0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.845 ( -12.613 -13.539 -1.864) 18.598 2.040 ( -16.994 -5.085 -4.297) 18.251 2.576 ( 0.436 -1.817 2.794) 3.361 2.651 ( -2.088 -0.997 -4.076) 4.687 2.854 ( -0.050 -4.525 5.286) 6.958 3.178 ( 4.596 -21.855 6.674) 23.309 3.345 ( -0.495 -0.997 -4.505) 4.641 3.619 ( 4.624 -20.459 -7.488) 22.271 4.135 ( 5.048 -14.199 3.688) 15.514 4.360 ( -1.490 0.713 -0.300) 1.679 4.657 ( 0.980 -26.588 8.265) 27.860 4.980 ( 2.480 0.030 0.285) 2.497 5.230 ( -0.022 -7.642 -9.746) 12.384 5.684 ( -0.401 -5.709 -0.200) 5.726 6.096 ( 1.451 -2.413 9.683) 10.084 6.508 ( -3.289 0.220 -1.142) 3.489 6.652 ( -8.183 -0.207 -2.410) 8.533 7.263 ( -3.554 0.016 0.219) 3.561 7.683 ( -26.538 -8.093 -3.074) 27.914 8.886 ( 14.345 2.095 -0.889) 14.525 9.491 ( -13.093 3.074 0.883) 13.478 9.576 ( 4.710 -1.606 -0.244) 4.982 10.399 ( 25.427 7.082 0.508) 26.400 11.048 ( -1.286 -31.852 -0.016) 31.878 11.232 ( 1.461 10.893 -0.519) 11.003 12.867 ( -7.968 4.926 -1.856) 9.550 13.127 ( 3.268 5.936 2.076) 7.087 13.879 ( 7.293 8.513 0.733) 11.233 14.475 ( -5.509 2.685 0.784) 6.178 14.900 ( 16.268 -39.332 -1.388) 42.586 16.855 ( 0.349 0.075 0.026) 0.358 17.834 ( -0.049 13.864 0.016) 13.864 19.034 ( 6.819 -2.091 -9.387) 11.789 20.687 ( -1.339 -11.027 6.881) 13.067 21.967 ( -0.847 1.911 7.520) 7.805 23.832 ( 3.829 5.404 -3.114) 7.319 ======================= Grid point 326 (144/267) ======================= q-point: (-0.29 -0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.879 ( -14.772 -6.389 -5.573) 17.032 2.192 ( -15.030 -17.803 1.230) 23.331 2.633 ( -2.257 -2.685 -3.783) 5.159 2.759 ( -0.961 -15.528 -0.603) 15.570 2.968 ( 2.876 -5.109 5.793) 8.243 3.344 ( -0.077 -2.324 -2.239) 3.228 3.507 ( 1.948 -9.620 4.460) 10.781 4.185 ( 3.908 -28.603 -5.509) 29.389 4.324 ( -3.571 -2.728 -0.780) 4.561 4.542 ( 10.429 -19.581 6.748) 23.189 5.008 ( 4.369 -1.018 -0.752) 4.548 5.112 ( -0.978 -16.043 1.601) 16.152 5.428 ( -5.242 -16.056 -5.722) 17.833 5.881 ( 1.944 -14.162 1.486) 14.372 6.257 ( 4.471 -13.420 5.200) 15.071 6.478 ( -4.275 -0.288 -0.148) 4.287 6.603 ( -11.693 -3.710 -1.926) 12.417 7.298 ( -9.004 -11.906 0.379) 14.933 7.732 ( -14.974 -13.133 -2.158) 20.034 8.913 ( 7.697 3.384 0.771) 8.444 9.322 ( -12.766 4.318 0.347) 13.481 9.681 ( 3.063 -6.893 -1.094) 7.622 10.438 ( 27.636 9.691 -0.018) 29.286 10.996 ( 3.174 13.653 -0.188) 14.019 11.509 ( -18.206 -19.624 0.153) 26.769 12.822 ( 9.218 8.824 -0.138) 12.762 13.136 ( 15.174 -4.821 -2.112) 16.062 13.926 ( -0.099 -15.172 1.773) 15.276 14.341 ( -6.517 6.496 0.868) 9.242 15.783 ( 18.170 -40.272 0.033) 44.181 16.848 ( 0.972 1.300 -0.067) 1.624 17.527 ( 0.656 17.689 0.018) 17.701 19.107 ( 4.797 -3.097 -9.568) 11.142 20.917 ( -3.411 -11.995 7.977) 14.804 21.938 ( -0.054 1.761 5.789) 6.051 23.706 ( 0.995 8.906 -3.718) 9.702 ======================= Grid point 327 (145/267) ======================= q-point: (-0.21 -0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.908 ( -9.856 -7.536 -3.962) 13.024 2.389 ( -15.635 -15.560 3.194) 22.288 2.676 ( -1.983 -5.078 -6.746) 8.673 3.014 ( 0.448 -7.456 -0.329) 7.477 3.201 ( 2.586 -19.257 5.301) 20.140 3.393 ( -2.651 -4.229 1.138) 5.119 3.672 ( 3.736 -5.634 1.521) 6.929 4.211 ( -5.521 2.948 -5.043) 8.037 4.737 ( 2.601 -20.687 0.459) 20.855 4.894 ( 3.345 -8.433 7.121) 11.533 5.141 ( 8.916 -9.945 -2.817) 13.651 5.323 ( 2.935 -9.783 -8.153) 13.068 5.627 ( -7.236 -12.328 1.827) 14.411 6.079 ( 3.105 -3.501 5.468) 7.197 6.440 ( -5.340 0.252 1.082) 5.454 6.558 ( -11.229 -10.544 -0.604) 15.415 6.773 ( 9.040 -20.711 -0.118) 22.598 7.628 ( -11.707 -30.108 -0.104) 32.304 7.911 ( -10.726 -16.944 -1.291) 20.095 8.899 ( 3.125 1.656 1.256) 3.753 9.175 ( -9.960 1.801 -0.023) 10.122 9.854 ( 3.455 -8.171 -0.958) 8.923 10.458 ( 17.781 6.043 -0.033) 18.780 10.869 ( 12.464 3.545 -0.338) 12.963 11.573 ( -23.465 -8.193 0.398) 24.858 12.613 ( 8.673 18.516 0.799) 20.462 13.276 ( 13.357 3.361 -2.965) 14.089 14.138 ( -6.984 8.279 0.328) 10.836 14.557 ( 10.172 -40.501 0.777) 41.766 16.481 ( 11.926 -10.471 3.653) 16.286 16.907 ( 7.775 -14.818 -0.698) 16.748 17.263 ( 2.466 10.234 -0.839) 10.561 19.168 ( 1.371 -3.146 -9.197) 9.816 21.045 ( -7.397 -2.947 9.296) 12.240 21.959 ( 0.850 -3.465 2.026) 4.103 23.519 ( -2.556 9.549 -3.393) 10.451 ======================= Grid point 328 (146/267) ======================= q-point: (-0.14 -0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.989 ( -5.694 -7.978 -1.745) 9.956 2.552 ( -10.381 -11.600 2.657) 15.792 2.755 ( -1.794 -6.103 -7.118) 9.547 3.113 ( 1.238 -3.951 -1.224) 4.318 3.438 ( -4.857 -4.640 3.180) 7.432 3.622 ( -0.291 -20.046 4.320) 20.508 3.786 ( 4.537 -3.634 0.439) 5.830 4.102 ( -5.203 2.540 -4.130) 7.112 4.918 ( 1.747 -0.041 5.006) 5.302 5.112 ( 0.981 -11.582 -0.457) 11.633 5.394 ( 0.330 -13.949 -10.149) 17.253 5.514 ( 8.607 -7.725 -2.749) 11.888 5.842 ( 0.481 -13.018 3.879) 13.592 6.114 ( 0.642 1.391 3.872) 4.164 6.393 ( -4.792 0.439 1.456) 5.028 6.657 ( -16.264 -11.265 2.844) 19.987 7.161 ( 15.549 -9.075 -0.929) 18.028 8.012 ( -7.667 -15.199 -1.512) 17.091 8.253 ( -11.378 -28.267 0.686) 30.479 8.965 ( -1.106 -9.529 0.745) 9.622 9.131 ( -5.189 -3.464 -0.341) 6.248 9.972 ( 9.531 0.926 -0.367) 9.583 10.474 ( 4.649 1.161 0.679) 4.839 11.092 ( 16.537 -14.210 -1.351) 21.845 11.577 ( -19.236 -10.879 0.555) 22.106 12.308 ( 8.574 20.616 0.262) 22.330 13.266 ( 6.879 3.828 -1.480) 8.010 13.919 ( -7.390 9.227 0.394) 11.828 15.342 ( 12.684 -31.634 -0.105) 34.083 16.388 ( 1.498 14.508 2.820) 14.855 17.163 ( 7.930 2.804 -0.496) 8.426 17.491 ( 13.194 -26.036 1.381) 29.221 19.202 ( -1.954 -3.037 -8.194) 8.954 20.963 ( -9.937 5.715 7.810) 13.871 22.082 ( 0.784 -8.172 -0.129) 8.210 23.310 ( -5.095 9.313 -2.055) 10.812 ======================= Grid point 329 (147/267) ======================= q-point: (-0.07 -0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( -2.268 -7.348 -1.323) 7.803 2.679 ( -5.331 -8.229 0.833) 9.841 2.811 ( -2.162 -2.173 -4.930) 5.805 3.182 ( 2.340 -2.125 -0.364) 3.182 3.501 ( -5.810 -6.299 3.822) 9.383 3.853 ( -0.503 -3.941 -6.663) 7.758 3.909 ( 1.326 -5.691 5.371) 7.937 4.100 ( 0.547 -6.807 1.345) 6.960 4.907 ( -0.227 2.020 2.430) 3.168 5.278 ( 0.108 -7.587 -4.371) 8.757 5.591 ( -4.273 -10.621 -6.190) 13.015 5.708 ( 9.491 -5.513 -4.616) 11.907 6.056 ( 6.394 2.543 3.342) 7.650 6.118 ( -0.844 -9.606 4.462) 10.625 6.388 ( -3.567 -3.098 3.600) 5.940 6.726 ( -15.099 -7.729 3.096) 17.243 7.342 ( 7.912 -2.459 -0.815) 8.325 8.136 ( -2.444 -4.118 -1.043) 4.900 8.630 ( -8.913 -19.275 0.494) 21.241 9.194 ( 0.318 -9.210 -0.099) 9.216 9.281 ( -4.555 -21.742 -0.217) 22.215 9.978 ( 11.321 5.836 -0.114) 12.737 10.462 ( 3.465 4.731 0.604) 5.896 11.463 ( -6.798 -16.395 -0.137) 17.749 11.653 ( 11.634 5.430 -0.864) 12.868 12.105 ( 0.089 -3.178 0.496) 3.218 13.256 ( 3.383 0.794 -0.248) 3.483 13.708 ( -6.507 7.675 0.185) 10.064 15.857 ( 8.280 -15.807 0.410) 17.849 16.131 ( -0.394 12.957 1.799) 13.088 17.211 ( 8.302 -1.099 -0.131) 8.375 17.977 ( 11.676 -15.344 2.387) 19.429 19.224 ( -3.527 -3.502 -6.427) 8.124 20.779 ( -8.600 6.993 4.588) 11.996 22.243 ( 0.362 -8.495 -0.402) 8.512 23.094 ( -6.241 9.082 -0.604) 11.036 ======================= Grid point 340 (148/267) ======================= q-point: (-0.36 -0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.590 ( -13.761 0.000 -0.617) 13.775 1.837 ( -23.336 0.000 -8.005) 24.671 2.577 ( -1.761 0.000 0.914) 1.984 2.644 ( -3.406 0.000 -1.046) 3.563 2.803 ( -6.416 0.000 7.705) 10.027 2.893 ( 5.641 -0.000 3.795) 6.799 3.399 ( 5.840 -0.000 -7.090) 9.185 3.444 ( 5.442 -0.000 -5.169) 7.506 3.964 ( -2.189 0.000 2.003) 2.967 4.364 ( -2.109 0.000 -0.712) 2.226 4.474 ( 10.155 -0.000 12.151) 15.835 4.989 ( 1.231 -0.000 -3.348) 3.568 5.155 ( 0.567 -0.000 -6.514) 6.539 5.627 ( -1.160 0.000 -0.089) 1.164 6.105 ( 1.022 -0.000 9.044) 9.102 6.471 ( -6.673 0.000 -2.141) 7.008 6.596 ( -7.379 0.000 0.358) 7.387 7.279 ( 0.211 -0.000 0.022) 0.212 7.378 ( -26.410 0.000 -3.310) 26.616 9.016 ( 12.842 -0.000 -0.670) 12.859 9.428 ( -12.764 0.000 0.662) 12.781 9.591 ( 2.804 -0.000 -1.035) 2.989 10.685 ( 28.622 -0.000 0.384) 28.625 10.710 ( 2.333 -0.000 0.278) 2.350 11.352 ( 1.076 -0.000 -0.545) 1.206 12.778 ( -18.191 0.000 -1.925) 18.293 13.223 ( 5.360 -0.000 2.121) 5.764 14.248 ( -0.414 0.000 -0.089) 0.424 14.320 ( 9.569 -0.000 -0.132) 9.570 14.601 ( 16.287 -0.000 0.124) 16.288 16.855 ( 0.102 -0.000 0.063) 0.120 17.972 ( -0.004 0.000 -0.090) 0.090 19.040 ( 6.298 -0.000 -11.599) 13.198 20.591 ( 0.145 -0.000 8.816) 8.817 22.005 ( 0.489 -0.000 10.030) 10.042 23.906 ( 3.888 -0.000 -5.247) 6.530 ======================= Grid point 341 (149/267) ======================= q-point: (-0.29 -0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.598 ( -19.258 -8.328 -4.329) 21.424 1.757 ( -18.225 -14.403 -3.976) 23.567 2.556 ( -4.973 -3.036 3.037) 6.570 2.591 ( -2.747 0.394 -6.206) 6.798 2.846 ( -6.410 -8.286 6.995) 12.597 3.245 ( 0.509 -20.772 6.667) 21.821 3.369 ( 7.545 1.300 -3.456) 8.400 3.687 ( 9.025 -20.382 -6.525) 23.226 4.218 ( 3.059 -23.733 2.498) 24.059 4.322 ( -3.151 2.203 -0.821) 3.932 4.738 ( 3.538 -16.822 11.244) 20.541 5.006 ( 1.693 -3.107 -5.897) 6.877 5.192 ( 0.994 -5.023 -5.263) 7.343 5.673 ( -0.862 -6.680 -0.109) 6.736 6.161 ( 1.654 -3.677 7.846) 8.822 6.401 ( -10.820 -0.164 -2.345) 11.072 6.538 ( -5.087 1.509 1.045) 5.408 7.129 ( -14.151 1.069 -1.222) 14.244 7.434 ( -5.643 -10.642 -1.182) 12.103 9.048 ( 8.006 4.403 0.211) 9.140 9.294 ( -13.788 3.537 0.540) 14.245 9.621 ( 2.071 -1.974 -1.639) 3.298 10.792 ( 25.344 4.502 -0.024) 25.741 11.014 ( -3.762 -17.358 -0.092) 17.761 11.264 ( 4.635 7.858 -0.069) 9.124 12.787 ( -0.210 -14.088 -3.292) 14.470 13.207 ( 6.470 5.995 1.551) 8.956 13.964 ( 3.866 13.504 0.184) 14.047 14.376 ( -8.339 2.395 0.801) 8.713 15.208 ( 25.383 -36.613 0.546) 44.555 16.861 ( 0.403 -0.312 0.025) 0.511 17.835 ( 0.211 13.614 0.375) 13.621 19.073 ( 4.845 -1.791 -13.487) 14.442 20.712 ( -0.454 -9.391 11.122) 14.563 22.010 ( 1.665 2.833 10.151) 10.669 23.849 ( 0.754 6.638 -7.465) 10.018 ======================= Grid point 342 (150/267) ======================= q-point: (-0.21 -0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.622 ( -16.256 -11.601 -6.049) 20.867 1.955 ( -18.013 -17.641 2.617) 25.348 2.576 ( -1.840 -2.592 -7.321) 7.981 2.724 ( -3.899 -17.760 -0.311) 18.186 2.984 ( -5.742 -9.687 6.353) 12.930 3.348 ( 3.232 -0.356 -0.991) 3.400 3.591 ( 6.345 -8.770 4.955) 11.905 4.210 ( -0.628 -4.583 -5.177) 6.943 4.275 ( 1.209 -22.308 -1.079) 22.366 4.722 ( 7.744 -18.231 7.563) 21.202 5.014 ( -2.869 -16.221 -5.382) 17.329 5.142 ( 5.919 -5.234 2.012) 8.153 5.355 ( -1.660 -11.595 -1.958) 11.876 5.921 ( 1.545 -18.700 4.408) 19.275 6.298 ( -5.847 -2.712 -0.403) 6.458 6.382 ( -3.631 -16.918 0.363) 17.307 6.468 ( -5.253 2.001 0.118) 5.622 7.145 ( -10.355 -13.960 -0.323) 17.384 7.596 ( -3.821 -10.200 -0.789) 10.921 8.998 ( 2.215 4.538 0.854) 5.122 9.136 ( -11.442 2.965 0.693) 11.840 9.705 ( 1.087 -6.798 -1.630) 7.074 10.797 ( 16.952 13.421 -0.209) 21.623 11.017 ( -0.446 2.274 0.265) 2.332 11.317 ( -4.171 -4.022 0.303) 5.802 12.978 ( 11.462 12.010 0.631) 16.614 13.365 ( 18.266 -11.546 -5.830) 22.382 13.965 ( 5.866 -21.007 0.374) 21.814 14.228 ( -9.365 5.957 1.119) 11.156 16.109 ( 24.920 -37.966 3.493) 45.548 16.862 ( 0.931 0.813 -0.110) 1.241 17.543 ( 1.472 16.897 0.859) 16.983 19.104 ( 1.524 -2.158 -14.258) 14.501 20.911 ( -3.413 -8.797 13.651) 16.594 21.976 ( 1.400 3.275 5.916) 6.905 23.656 ( -5.330 9.696 -7.938) 13.618 ======================= Grid point 343 (151/267) ======================= q-point: (-0.14 -0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.742 ( -10.324 -12.258 -2.828) 16.274 2.163 ( -16.498 -18.796 3.337) 25.231 2.622 ( -0.491 -5.137 -9.146) 10.501 2.992 ( -2.722 -9.376 -1.309) 9.850 3.227 ( -3.966 -21.557 4.312) 22.339 3.383 ( 2.286 -0.980 1.011) 2.685 3.766 ( 6.981 -4.268 4.977) 9.577 4.107 ( -5.963 3.240 -3.068) 7.448 4.781 ( 3.208 -21.483 -0.611) 21.730 4.919 ( -3.183 -6.109 2.711) 7.403 5.217 ( 3.204 -2.806 -4.923) 6.510 5.426 ( 14.518 -13.195 -1.806) 19.701 5.537 ( -5.930 -16.051 1.954) 17.222 6.158 ( 3.326 -0.672 4.940) 5.993 6.296 ( -15.781 -10.612 2.198) 19.144 6.397 ( -6.670 0.511 -0.022) 6.690 6.948 ( 12.297 -30.634 -2.229) 33.085 7.477 ( -7.468 -26.790 -0.060) 27.811 7.755 ( -10.378 -14.582 -0.547) 17.906 8.939 ( 0.923 2.830 1.103) 3.174 9.045 ( -6.604 -1.038 -0.009) 6.686 9.881 ( 0.498 -11.201 -0.839) 11.243 10.645 ( 8.083 9.869 0.744) 12.779 11.081 ( 13.271 -3.772 -0.459) 13.805 11.289 ( -12.847 -1.625 0.247) 12.952 12.755 ( 10.001 18.992 0.449) 21.469 13.414 ( 7.354 6.877 -3.062) 10.524 14.020 ( -9.268 8.107 0.612) 12.329 14.799 ( 23.786 -41.153 -2.783) 47.614 16.656 ( 7.807 7.108 4.700) 11.557 17.080 ( 15.889 -29.361 1.952) 33.441 17.313 ( 5.479 8.968 0.498) 10.521 19.110 ( -2.792 -2.425 -13.284) 13.789 20.981 ( -8.081 0.828 14.105) 16.277 21.975 ( 0.226 -2.812 -0.276) 2.835 23.414 ( -9.414 8.455 -5.429) 13.769 ======================= Grid point 344 (152/267) ======================= q-point: (-0.07 -0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( -5.114 -11.415 -0.857) 12.537 2.405 ( -10.677 -16.515 2.563) 19.832 2.708 ( 0.076 -5.879 -8.324) 10.191 3.089 ( -3.245 -5.944 -2.430) 7.195 3.414 ( -0.171 -1.271 3.232) 3.477 3.616 ( -1.558 -18.831 0.168) 18.896 3.889 ( 6.790 -2.699 5.112) 8.918 4.032 ( -2.858 -0.258 -0.651) 2.943 4.932 ( -2.673 -0.539 3.125) 4.148 5.123 ( 1.166 -9.393 -0.987) 9.516 5.315 ( -3.528 -11.918 -8.835) 15.249 5.652 ( 8.768 -7.418 -2.780) 11.817 5.891 ( 4.960 -16.175 4.266) 17.448 6.142 ( -0.407 1.620 1.774) 2.437 6.334 ( -2.489 -0.480 -1.052) 2.744 6.432 ( -15.586 -11.116 5.930) 20.042 7.353 ( 8.696 -4.068 -1.128) 9.666 7.890 ( -7.308 -20.095 0.004) 21.383 8.104 ( -7.980 -30.023 -0.187) 31.066 8.957 ( -0.847 -6.521 0.678) 6.611 9.087 ( 0.043 -5.662 -0.714) 5.707 10.079 ( 4.876 -7.092 -0.163) 8.608 10.573 ( 8.549 5.478 0.946) 10.198 11.212 ( -6.929 -2.425 0.036) 7.341 11.408 ( 2.999 -21.831 -0.475) 22.041 12.443 ( 9.503 22.343 -0.092) 24.280 13.331 ( 3.082 4.941 -1.350) 5.978 13.802 ( -8.634 8.175 0.564) 11.903 15.575 ( 19.235 -24.704 -2.342) 31.397 16.431 ( 2.079 16.953 3.168) 17.371 17.266 ( 7.605 0.688 -1.138) 7.720 17.753 ( 20.045 -22.397 5.977) 30.646 19.104 ( -5.968 -3.633 -10.899) 12.946 20.851 ( -10.439 6.900 9.275) 15.576 22.080 ( -0.794 -8.271 -2.022) 8.552 23.189 ( -9.985 7.530 -1.940) 12.656 ======================= Grid point 355 (153/267) ======================= q-point: (-0.29 -0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.352 ( -18.211 0.000 0.056) 18.211 1.433 ( -25.368 0.000 -11.791) 27.974 2.552 ( -1.952 0.000 0.220) 1.964 2.561 ( -8.914 0.000 2.542) 9.269 2.646 ( -17.786 0.000 4.229) 18.281 3.002 ( 7.069 -0.000 3.200) 7.760 3.513 ( 6.570 -0.000 -4.091) 7.740 3.515 ( 13.283 -0.000 -4.733) 14.101 3.928 ( -3.752 0.000 1.159) 3.927 4.327 ( -2.575 0.000 -0.177) 2.581 4.687 ( 6.862 -0.000 12.195) 13.993 4.925 ( -1.605 0.000 -11.674) 11.783 5.183 ( 5.205 -0.000 1.482) 5.412 5.607 ( -1.453 0.000 -0.140) 1.460 6.141 ( -2.550 0.000 5.613) 6.165 6.327 ( -8.702 0.000 -0.312) 8.708 6.535 ( -2.427 0.000 2.518) 3.497 7.059 ( -15.959 0.000 -2.665) 16.180 7.282 ( 0.217 -0.000 0.013) 0.218 9.157 ( 6.637 -0.000 0.304) 6.644 9.246 ( -11.716 0.000 -0.628) 11.733 9.611 ( 0.862 -0.000 -2.091) 2.262 10.750 ( 2.885 -0.000 0.216) 2.893 11.093 ( 23.936 -0.000 -0.367) 23.939 11.367 ( 3.218 -0.000 0.107) 3.220 12.558 ( -9.870 0.000 -4.183) 10.720 13.334 ( 8.391 -0.000 1.184) 8.474 14.240 ( -0.518 0.000 -0.069) 0.522 14.282 ( -8.453 0.000 0.538) 8.471 15.010 ( 32.529 -0.000 1.855) 32.582 16.857 ( 0.133 -0.000 0.066) 0.149 17.972 ( -0.011 0.000 -0.088) 0.088 19.054 ( 3.852 -0.000 -16.710) 17.149 20.655 ( 1.604 -0.000 16.057) 16.136 22.090 ( 4.388 -0.000 12.826) 13.556 23.898 ( -0.865 0.000 -12.724) 12.753 ======================= Grid point 356 (154/267) ======================= q-point: (-0.21 -0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.261 ( -21.979 -8.864 -7.838) 24.962 1.478 ( -18.658 -19.797 -0.237) 27.205 2.430 ( -17.363 -5.017 7.835) 19.699 2.522 ( -1.839 -0.079 -9.285) 9.466 2.727 ( -10.500 -11.830 3.726) 16.250 3.317 ( 6.695 -16.258 3.687) 17.965 3.488 ( 8.747 -1.224 -0.678) 8.858 3.822 ( 12.220 -19.092 -4.881) 23.188 4.211 ( -4.465 -18.588 -0.929) 19.139 4.289 ( -1.324 -9.500 1.653) 9.733 4.739 ( -9.390 -5.513 -1.598) 11.006 5.070 ( 12.924 -11.091 1.303) 17.080 5.243 ( 5.613 -1.612 2.830) 6.489 5.659 ( -1.188 -7.818 0.574) 7.928 6.148 ( -9.330 -4.610 1.477) 10.511 6.274 ( -2.086 0.844 1.170) 2.536 6.490 ( -3.242 3.468 1.063) 4.865 6.923 ( -11.826 -1.389 -0.764) 11.931 7.418 ( 2.065 -10.126 -0.187) 10.336 9.074 ( -9.572 7.327 -1.794) 12.187 9.155 ( 0.118 3.131 2.376) 3.932 9.627 ( 0.030 -2.175 -2.171) 3.074 10.867 ( -11.136 -5.278 0.501) 12.334 11.147 ( 17.485 7.035 -0.529) 18.855 11.401 ( 13.822 2.896 0.325) 14.126 12.853 ( 12.929 -35.525 -7.507) 38.543 13.323 ( 8.508 7.348 0.066) 11.242 13.998 ( 0.792 13.184 -0.154) 13.209 14.243 ( -9.886 2.859 0.802) 10.322 15.630 ( 30.061 -33.502 4.221) 45.209 16.867 ( 0.434 -0.694 0.037) 0.820 17.845 ( 0.730 12.742 0.884) 12.793 19.047 ( 1.206 -1.063 -19.150) 19.217 20.785 ( 1.804 -6.903 20.912) 22.096 22.104 ( 4.598 5.385 10.434) 12.609 23.752 ( -8.312 8.419 -16.531) 20.329 ======================= Grid point 357 (155/267) ======================= q-point: (-0.14 -0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.364 ( -14.842 -17.278 -5.654) 23.469 1.701 ( -18.745 -17.882 6.392) 26.683 2.522 ( -0.082 -3.090 -10.644) 11.084 2.626 ( -10.436 -24.615 1.021) 26.755 2.876 ( -9.929 -11.321 4.229) 15.641 3.427 ( 7.048 1.355 -1.241) 7.284 3.729 ( 8.862 -8.265 6.229) 13.625 4.124 ( -6.592 4.253 -1.625) 8.011 4.346 ( 6.948 -26.886 -3.113) 27.943 4.757 ( -5.688 -8.421 0.364) 10.168 4.966 ( -0.651 -35.384 -0.589) 35.395 5.257 ( 6.802 1.320 0.743) 6.968 5.399 ( 9.162 -7.379 1.993) 11.931 5.931 ( -6.059 -18.370 8.099) 20.971 6.167 ( -4.091 -3.404 -3.292) 6.258 6.350 ( -5.296 -9.084 1.809) 10.669 6.420 ( -1.015 -8.856 -4.490) 9.981 7.022 ( -6.186 -17.023 0.400) 18.117 7.587 ( 2.510 -4.541 -0.207) 5.193 8.917 ( -9.145 0.002 -0.325) 9.150 9.083 ( 0.466 5.222 1.954) 5.595 9.699 ( -0.959 -6.848 -1.501) 7.076 10.742 ( -16.587 1.638 1.504) 16.735 11.154 ( 14.049 6.731 -0.463) 15.585 11.398 ( 11.430 7.295 -0.104) 13.560 13.145 ( 10.405 14.924 0.546) 18.201 13.582 ( 12.822 0.911 -6.858) 14.569 14.079 ( -10.337 5.839 0.467) 11.882 14.171 ( 25.970 -43.189 -5.556) 50.701 16.529 ( 28.244 -35.845 7.577) 46.260 16.875 ( 0.850 0.421 -0.047) 0.950 17.585 ( 3.721 15.316 2.553) 15.967 19.018 ( -3.413 -1.150 -19.091) 19.428 20.955 ( -1.015 -3.501 23.595) 23.875 22.006 ( -1.005 6.656 0.402) 6.744 23.454 ( -16.380 8.180 -13.059) 22.489 ======================= Grid point 358 (156/267) ======================= q-point: (-0.07 -0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.594 ( -8.096 -16.654 -1.603) 18.587 1.951 ( -14.806 -21.690 5.954) 26.928 2.585 ( 1.334 -5.540 -10.467) 11.918 2.933 ( -3.838 -8.527 -2.457) 9.668 3.141 ( -8.575 -26.882 3.338) 28.414 3.450 ( 5.237 0.718 -0.036) 5.286 3.906 ( 7.831 -3.257 6.782) 10.859 4.018 ( -4.772 1.773 -0.854) 5.161 4.784 ( -5.067 -14.138 -1.363) 15.081 4.884 ( 1.733 -14.076 -0.680) 14.198 5.220 ( -0.407 2.889 -2.465) 3.819 5.475 ( -3.374 -16.817 0.771) 17.170 5.678 ( 18.230 -13.954 2.334) 23.076 6.050 ( -14.050 -6.957 -1.578) 15.757 6.227 ( -0.700 -3.433 7.957) 8.694 6.322 ( -2.692 0.324 -3.630) 4.531 7.044 ( 0.674 -39.013 -0.950) 39.030 7.442 ( 0.800 -29.454 -1.107) 29.485 7.610 ( -6.897 -2.003 0.516) 7.201 8.930 ( -0.151 -1.915 -0.027) 1.921 9.013 ( 0.988 0.194 0.622) 1.184 9.861 ( -2.604 -12.168 -0.205) 12.445 10.689 ( -4.249 -3.970 1.701) 6.059 11.103 ( -0.115 3.396 -0.381) 3.419 11.346 ( 11.373 5.175 -0.310) 12.499 12.901 ( 9.565 19.122 -0.262) 21.383 13.474 ( 2.964 8.514 -2.684) 9.406 13.878 ( -10.350 7.251 0.901) 12.670 15.217 ( 35.454 -35.233 -8.692) 50.733 16.743 ( 2.475 12.409 3.032) 13.012 17.289 ( 9.245 -10.876 -1.144) 14.320 17.538 ( 24.271 -13.583 11.024) 29.918 18.962 ( -8.510 -2.236 -16.657) 18.838 20.933 ( -8.785 6.991 18.081) 21.283 21.937 ( -4.350 -3.776 -6.021) 8.332 23.203 ( -15.163 4.442 -5.088) 16.600 ======================= Grid point 370 (157/267) ======================= q-point: (-0.21 -0.21 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.001 ( -25.717 0.000 -12.251) 28.486 1.066 ( -21.153 0.000 2.354) 21.283 2.252 ( -36.997 0.000 20.426) 42.261 2.498 ( -1.585 0.000 -13.515) 13.607 2.521 ( -1.950 0.000 -1.321) 2.355 3.127 ( 8.144 -0.000 2.669) 8.571 3.596 ( 6.586 -0.000 -2.901) 7.197 3.719 ( 16.193 -0.000 -4.665) 16.852 3.864 ( -5.395 0.000 0.428) 5.412 4.288 ( -2.734 0.000 0.307) 2.751 4.574 ( -15.087 0.000 -8.773) 17.452 5.089 ( 18.103 -0.000 9.440) 20.416 5.291 ( 6.876 -0.000 4.381) 8.153 5.584 ( -1.432 0.000 -0.198) 1.445 6.043 ( -10.337 0.000 1.162) 10.402 6.274 ( -1.109 0.000 0.818) 1.378 6.528 ( -0.802 0.000 2.836) 2.947 6.866 ( -9.728 0.000 -0.725) 9.755 7.285 ( 0.175 -0.000 0.002) 0.175 9.086 ( -9.083 0.000 -1.572) 9.219 9.221 ( 2.198 -0.000 0.141) 2.203 9.600 ( -0.981 0.000 -2.400) 2.593 10.793 ( 2.850 -0.000 0.119) 2.853 11.261 ( 2.510 -0.000 -0.004) 2.510 11.550 ( 17.548 -0.000 0.240) 17.550 12.447 ( -1.395 0.000 -10.068) 10.164 13.467 ( 9.073 -0.000 -0.583) 9.092 14.134 ( -11.564 0.000 0.574) 11.578 14.233 ( -0.517 0.000 -0.031) 0.518 15.515 ( 33.354 -0.000 6.082) 33.904 16.859 ( 0.133 -0.000 0.063) 0.147 17.971 ( -0.009 0.000 -0.082) 0.082 18.999 ( 0.400 -0.000 -22.827) 22.831 20.810 ( 7.287 -0.000 30.141) 31.009 22.242 ( 8.328 -0.000 11.996) 14.603 23.722 ( -13.010 0.000 -28.476) 31.307 ======================= Grid point 371 (158/267) ======================= q-point: (-0.14 -0.21 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.916 ( -19.725 -14.287 -5.822) 25.041 1.215 ( -18.154 -22.714 5.160) 29.532 2.101 ( -32.257 -13.604 13.423) 37.493 2.462 ( 0.175 -0.866 -11.711) 11.745 2.622 ( -4.870 -10.159 -0.940) 11.306 3.458 ( 10.501 -13.234 0.807) 16.913 3.612 ( 8.325 -5.408 1.282) 10.010 3.962 ( 7.390 -17.020 -4.818) 19.171 4.126 ( -5.856 -7.021 0.529) 9.158 4.281 ( 0.433 -22.110 -0.296) 22.116 4.553 ( -10.276 -8.742 -7.350) 15.364 5.328 ( 14.682 -3.365 1.155) 15.107 5.355 ( 8.817 -4.288 11.855) 15.384 5.643 ( -1.852 -8.750 2.843) 9.385 5.996 ( -9.010 -3.446 -1.761) 9.806 6.266 ( -1.279 -0.250 0.545) 1.412 6.416 ( -8.010 7.389 -1.683) 11.027 6.796 ( -5.503 -3.467 1.943) 6.788 7.483 ( 7.261 -12.752 -0.145) 14.675 8.914 ( -8.902 7.704 -1.471) 11.865 9.177 ( 0.256 4.131 1.890) 4.550 9.605 ( -1.659 -2.397 -2.077) 3.579 10.657 ( -18.028 6.896 1.450) 19.356 11.376 ( 15.228 1.003 -0.226) 15.263 11.615 ( 13.310 5.314 -0.244) 14.334 13.109 ( 29.594 -60.619 -18.687) 69.998 13.446 ( 8.269 8.736 -1.401) 12.111 13.978 ( -4.059 6.762 -0.415) 7.898 14.116 ( -6.490 7.283 0.681) 9.779 16.106 ( 29.863 -31.256 8.628) 44.081 16.875 ( 0.636 -1.196 0.104) 1.359 17.867 ( 1.674 10.607 1.603) 10.857 18.940 ( -2.428 0.277 -23.983) 24.108 20.991 ( 11.007 -2.499 36.222) 37.940 22.197 ( 1.092 12.660 1.689) 12.819 23.409 ( -25.988 8.279 -29.224) 39.975 ======================= Grid point 372 (159/267) ======================= q-point: (-0.07 -0.21 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.160 ( -9.801 -22.122 -2.090) 24.286 1.474 ( -17.538 -18.857 11.837) 28.342 2.423 ( -14.669 -31.990 0.263) 35.194 2.493 ( 0.683 -6.935 -8.778) 11.207 2.773 ( -5.478 -9.836 0.986) 11.301 3.520 ( 6.462 2.362 -2.808) 7.432 3.895 ( 9.692 -6.775 5.421) 13.009 4.028 ( -5.781 3.500 0.935) 6.823 4.404 ( 1.324 -22.711 -3.309) 22.989 4.666 ( -2.427 -10.705 -3.019) 11.384 4.946 ( -2.629 -35.050 1.062) 35.165 5.324 ( 1.079 3.930 2.931) 5.020 5.605 ( 14.486 -8.611 0.094) 16.852 5.823 ( -9.308 -6.554 6.995) 13.362 6.176 ( 3.649 -13.386 0.600) 13.888 6.254 ( -7.803 -2.309 -0.261) 8.142 6.363 ( -3.367 -18.276 -6.115) 19.564 6.959 ( -3.435 -17.774 0.985) 18.130 7.656 ( 6.217 1.640 -0.133) 6.431 8.847 ( 1.764 -4.951 -0.262) 5.262 9.095 ( -0.118 5.199 1.738) 5.483 9.669 ( -2.082 -6.634 -0.867) 7.007 10.464 ( -21.919 -4.101 1.889) 22.379 11.348 ( 12.841 11.415 -0.123) 17.182 11.565 ( 9.868 8.760 -0.189) 13.197 13.279 ( 7.865 14.742 -1.411) 16.768 13.667 ( 3.398 9.893 -4.111) 11.239 13.924 ( -10.408 6.462 0.977) 12.290 14.703 ( 51.780 -54.355 -20.777) 77.893 16.888 ( 0.977 0.078 0.262) 1.015 16.959 ( 23.081 -31.429 7.868) 39.779 17.701 ( 10.372 8.711 6.795) 15.154 18.844 ( -7.054 0.806 -21.910) 23.032 21.101 ( 1.885 9.397 34.235) 35.551 21.858 ( -17.495 6.463 -17.571) 25.624 23.097 ( -21.560 0.387 -10.111) 23.816 ======================= Grid point 385 (160/267) ======================= q-point: (-0.14 -0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.605 ( -21.881 0.000 -1.581) 21.938 0.768 ( -21.585 0.000 7.653) 22.902 1.743 ( -44.129 0.000 23.813) 50.144 2.435 ( 1.155 -0.000 -13.713) 13.762 2.483 ( -1.815 0.000 -3.353) 3.812 3.262 ( 8.748 -0.000 2.114) 9.000 3.673 ( 4.788 -0.000 -1.563) 5.036 3.778 ( -5.992 0.000 -0.108) 5.993 3.915 ( 12.905 -0.000 -7.221) 14.788 4.251 ( -2.554 0.000 0.523) 2.607 4.316 ( -13.030 0.000 -9.136) 15.914 5.393 ( 4.670 -0.000 0.579) 4.706 5.422 ( 17.543 -0.000 16.673) 24.202 5.564 ( -1.127 0.000 -0.252) 1.155 5.916 ( -5.623 0.000 1.578) 5.840 6.253 ( -1.774 0.000 -1.226) 2.156 6.516 ( -2.837 0.000 3.741) 4.695 6.766 ( -4.209 0.000 1.655) 4.523 7.287 ( 0.112 -0.000 -0.009) 0.113 8.972 ( -5.022 0.000 -2.815) 5.757 9.234 ( -0.290 0.000 0.578) 0.647 9.564 ( -2.347 0.000 -2.110) 3.156 10.831 ( 2.243 -0.000 0.002) 2.243 11.281 ( 0.527 -0.000 -2.278) 2.338 11.741 ( 7.767 -0.000 -1.334) 7.880 12.394 ( 0.799 -0.000 -21.794) 21.808 13.579 ( 6.563 -0.000 -2.156) 6.908 13.963 ( -11.352 0.000 0.612) 11.368 14.226 ( -0.406 0.000 0.019) 0.406 16.016 ( 28.418 -0.000 10.627) 30.340 16.861 ( 0.100 -0.000 0.055) 0.114 17.971 ( -0.000 0.000 -0.074) 0.074 18.880 ( -0.767 0.000 -25.992) 26.003 21.194 ( 24.477 -0.000 43.833) 50.204 22.386 ( 3.237 -0.000 -4.079) 5.207 23.188 ( -37.624 0.000 -47.396) 60.514 ======================= Grid point 386 (161/267) ======================= q-point: (-0.07 -0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.688 ( -9.405 -19.580 6.642) 22.715 1.008 ( -14.796 -24.121 12.571) 30.964 1.666 ( -33.840 -25.066 17.409) 45.569 2.430 ( 2.901 -1.615 -12.734) 13.160 2.561 ( -2.615 -8.968 -2.988) 9.807 3.602 ( 8.911 -2.379 -3.927) 10.024 3.768 ( 12.225 -18.866 3.964) 22.827 3.958 ( -3.034 -19.614 -5.177) 20.512 4.052 ( -5.767 1.472 2.605) 6.497 4.319 ( 4.055 -23.726 -2.565) 24.206 4.415 ( -2.943 -13.835 -8.164) 16.331 5.381 ( -4.023 1.866 1.816) 4.792 5.573 ( 3.227 -1.956 0.916) 3.883 5.711 ( 12.675 -11.088 14.347) 22.123 5.912 ( -0.565 -2.829 0.831) 3.002 6.223 ( -10.706 4.413 -6.147) 13.110 6.250 ( -6.154 4.913 3.610) 8.663 6.763 ( -1.389 -3.814 2.000) 4.525 7.644 ( 15.377 -15.250 -1.057) 21.683 8.836 ( 0.453 4.060 -0.753) 4.154 9.180 ( -0.807 3.964 1.688) 4.383 9.567 ( -2.001 -2.860 -1.448) 3.779 10.330 ( -28.843 12.656 1.988) 31.560 11.602 ( 14.873 3.125 0.041) 15.198 11.771 ( 8.541 4.594 -0.604) 9.717 13.448 ( 20.464 -40.500 -35.810) 57.805 13.612 ( 24.542 -30.107 -9.794) 40.058 13.904 ( 0.748 -12.471 -4.828) 13.394 14.076 ( 0.753 8.811 -0.597) 8.864 16.526 ( 19.167 -28.006 9.846) 35.336 16.892 ( 1.898 -2.868 0.319) 3.454 17.909 ( 2.766 6.047 2.319) 7.042 18.802 ( 0.118 2.452 -23.798) 23.924 21.484 ( 31.328 3.041 43.027) 53.310 21.827 ( -57.896 30.850 -43.782) 78.871 22.880 ( -20.232 -2.901 -7.540) 21.785 ======================= Grid point 400 (162/267) ======================= q-point: (-0.07 -0.07 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.466 ( -2.017 0.000 25.748) 25.827 0.539 ( -15.065 0.000 17.452) 23.054 1.226 ( -40.471 0.000 33.712) 52.673 2.414 ( 4.289 -0.000 -13.429) 14.098 2.439 ( -1.462 0.000 -5.430) 5.624 3.397 ( 8.288 -0.000 1.391) 8.404 3.652 ( -6.914 0.000 0.746) 6.954 3.756 ( 3.132 -0.000 -1.263) 3.377 3.996 ( 1.861 -0.000 -3.279) 3.770 4.172 ( 0.576 -0.000 -9.131) 9.149 4.220 ( -1.759 0.000 0.493) 1.827 5.344 ( -10.414 0.000 -2.688) 10.756 5.550 ( -0.613 0.000 -0.296) 0.681 5.742 ( 14.362 -0.000 14.181) 20.183 5.949 ( 6.898 -0.000 -0.369) 6.908 6.225 ( -0.189 0.000 -0.469) 0.506 6.577 ( 14.705 -0.000 19.011) 24.035 6.735 ( -1.776 0.000 0.788) 1.943 7.288 ( 0.047 -0.000 -0.018) 0.051 8.922 ( 0.149 -0.000 -2.444) 2.448 9.226 ( -1.126 0.000 0.645) 1.297 9.523 ( -1.735 0.000 -1.327) 2.184 10.857 ( 1.193 -0.000 -0.106) 1.198 11.057 ( -40.972 0.000 -33.837) 53.138 11.794 ( 2.989 -0.000 -2.136) 3.674 12.158 ( -18.480 0.000 -21.887) 28.646 13.633 ( 1.739 -0.000 -0.703) 1.876 13.839 ( -4.858 0.000 0.420) 4.876 14.221 ( -0.207 0.000 0.067) 0.218 16.390 ( 15.257 -0.000 11.421) 19.058 16.862 ( 0.043 -0.000 0.044) 0.061 17.970 ( 0.013 -0.000 -0.067) 0.068 18.806 ( 7.271 -0.000 -21.436) 22.636 21.113 (-115.073 0.000 -84.089) 142.523 22.226 ( 42.610 -0.000 22.529) 48.199 22.812 ( 3.874 -0.000 17.497) 17.921 ======================= Grid point 401 (163/267) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.920 ( 1.124 -0.000 10.851) 10.909 1.028 ( -1.661 0.000 13.614) 13.715 1.872 ( -16.529 0.000 27.983) 32.500 2.182 ( 19.218 -0.000 -10.634) 21.964 2.235 ( -0.636 0.000 -5.634) 5.670 3.478 ( -1.266 0.000 0.235) 1.288 3.581 ( 0.546 -0.000 -19.644) 19.652 3.620 ( 0.667 -0.000 0.954) 1.164 3.770 ( 0.751 -0.000 -0.536) 0.922 4.216 ( -0.055 0.000 0.271) 0.276 4.356 ( 5.045 -0.000 4.908) 7.039 5.074 ( -5.927 0.000 -2.352) 6.377 5.538 ( 0.007 -0.000 -0.203) 0.203 5.820 ( -4.565 0.000 0.546) 4.598 6.214 ( -3.981 0.000 3.367) 5.214 6.297 ( 12.123 -0.000 2.365) 12.351 6.670 ( -3.612 0.000 -0.662) 3.672 7.256 ( 9.417 -0.000 -2.197) 9.670 7.288 ( -0.008 0.000 -0.016) 0.018 8.945 ( -0.826 0.000 -0.165) 0.842 9.189 ( -2.946 0.000 0.550) 2.997 9.497 ( 0.656 -0.000 -0.473) 0.809 9.645 ( -12.047 0.000 0.098) 12.047 10.861 ( -0.053 0.000 -0.107) 0.119 11.840 ( 0.073 -0.000 0.006) 0.073 11.984 ( 0.832 -0.000 0.100) 0.838 13.643 ( 0.135 -0.000 0.096) 0.166 13.811 ( -0.428 0.000 -0.002) 0.428 14.222 ( 0.022 -0.000 0.061) 0.065 16.702 ( 8.287 -0.000 0.040) 8.287 16.864 ( -0.015 0.000 0.023) 0.028 17.969 ( 0.017 -0.000 -0.038) 0.042 18.552 ( -27.424 0.000 0.255) 27.426 19.061 ( 0.113 -0.000 -0.250) 0.274 22.673 ( -0.151 0.000 0.230) 0.275 23.390 ( 12.106 -0.000 -0.282) 12.109 ======================= Grid point 402 (164/267) ======================= q-point: ( 0.07 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.116 ( -1.046 -10.519 13.379) 17.051 1.385 ( 6.492 -29.106 11.220) 31.863 1.640 ( -10.215 4.591 3.023) 11.600 2.214 ( 8.944 -2.295 -11.427) 14.692 2.631 ( 7.858 -21.392 8.825) 24.439 3.364 ( -1.840 2.950 -12.519) 12.993 3.722 ( -2.046 -10.405 0.444) 10.614 3.992 ( -1.024 -35.146 -1.113) 35.178 4.152 ( 1.307 2.204 1.062) 2.774 4.175 ( 1.696 -31.867 -4.879) 32.283 4.449 ( 3.992 -4.193 0.176) 5.792 5.061 ( -2.477 -2.551 1.444) 3.838 5.578 ( -0.377 -5.170 0.322) 5.194 5.786 ( -10.557 -0.008 5.071) 11.712 6.146 ( -3.819 10.068 2.032) 10.958 6.330 ( 9.954 19.605 -0.961) 22.008 6.472 ( 2.199 -6.735 -0.282) 7.091 6.649 ( -1.337 0.297 1.217) 1.832 7.895 ( -6.137 -6.743 -3.779) 9.869 8.957 ( -21.381 -9.279 0.216) 23.308 9.174 ( 1.356 1.714 1.041) 2.421 9.541 ( 0.277 -4.334 -0.510) 4.373 9.764 ( 30.957 -1.481 3.250) 31.162 11.767 ( -7.144 5.059 0.100) 8.755 11.846 ( -7.204 -0.719 -0.447) 7.253 12.325 ( 9.933 -96.899 -19.196) 99.280 13.659 ( -0.407 -2.903 -0.296) 2.946 13.855 ( -2.617 -11.145 -1.012) 11.493 14.053 ( 0.882 15.422 -0.343) 15.451 16.843 ( 1.452 -4.867 0.496) 5.103 17.014 ( 15.035 -13.438 -5.604) 20.929 17.940 ( -0.624 2.655 1.062) 2.927 18.319 ( -50.736 -11.804 8.453) 52.773 19.349 ( 45.183 -6.019 5.038) 45.859 22.622 ( -17.858 0.666 0.321) 17.874 23.215 ( 15.994 22.036 -4.745) 27.639 ======================= Grid point 403 (165/267) ======================= q-point: ( 0.14 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.385 ( 2.240 -13.910 7.539) 15.979 1.539 ( -7.846 -9.573 9.915) 15.859 2.112 ( 5.016 -31.719 -4.556) 32.434 2.338 ( 9.245 -6.800 -10.618) 15.636 3.043 ( 4.894 -14.940 8.983) 18.107 3.344 ( -1.073 -3.696 -7.925) 8.810 3.856 ( -2.493 -7.798 2.607) 8.592 4.084 ( 3.260 3.699 0.419) 4.948 4.537 ( 0.061 -7.976 -3.398) 8.670 4.649 ( -5.153 -25.688 -2.245) 26.296 4.824 ( 7.578 -28.774 0.991) 29.771 5.159 ( 3.582 -7.305 2.089) 8.400 5.627 ( -9.369 3.408 9.040) 13.458 5.827 ( -5.865 -20.706 -0.555) 21.528 6.047 ( 6.656 -3.682 -3.402) 8.333 6.268 ( 3.068 0.443 1.201) 3.324 6.633 ( -7.273 -12.382 -6.174) 15.631 6.829 ( 10.757 -16.698 3.254) 20.128 7.799 ( -2.845 7.024 -1.075) 7.655 8.949 ( -16.349 -5.085 0.808) 17.141 9.138 ( -4.614 0.647 -0.003) 4.659 9.644 ( 1.284 -6.333 0.218) 6.465 10.112 ( 26.235 -12.229 1.722) 28.996 11.533 ( -11.142 12.567 0.063) 16.795 11.664 ( -2.651 10.204 -0.038) 10.543 13.168 ( -0.601 0.235 -3.881) 3.935 13.660 ( -1.516 5.758 -1.455) 6.130 13.816 ( 8.064 10.015 0.081) 12.858 14.642 ( -27.051 -69.199 -13.304) 75.480 16.885 ( -4.536 0.480 1.780) 4.896 17.336 ( 8.264 -7.873 -3.734) 12.009 17.909 ( -3.829 -1.020 10.714) 11.424 18.394 ( -24.439 -26.662 -9.392) 37.367 19.858 ( 48.073 -7.566 13.621) 50.535 22.344 ( -23.984 8.613 -2.308) 25.588 23.051 ( 20.221 8.819 -4.887) 22.596 ======================= Grid point 404 (166/267) ======================= q-point: ( 0.21 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.648 ( 1.763 -13.316 -1.467) 13.512 1.854 ( -3.615 -22.925 10.535) 25.487 2.474 ( 6.609 -9.177 -11.532) 16.152 2.660 ( 4.294 -18.736 0.028) 19.221 3.290 ( 2.025 -8.443 1.394) 8.793 3.435 ( -2.633 -8.109 -1.382) 8.637 3.971 ( -0.079 -4.135 6.675) 7.853 4.067 ( 3.356 0.859 -1.604) 3.818 4.678 ( 2.438 -7.782 -1.070) 8.225 4.948 ( -5.008 -12.906 -1.397) 13.914 5.182 ( 4.721 -5.520 -1.488) 7.414 5.406 ( 6.476 -15.990 -2.323) 17.408 5.595 ( 0.845 -3.129 7.317) 8.003 6.037 ( -2.996 -6.943 2.755) 8.048 6.264 ( -8.754 -8.492 1.154) 12.251 6.331 ( 2.010 -7.180 -5.267) 9.129 7.063 ( 3.559 -34.320 0.592) 34.509 7.295 ( 15.304 -20.269 -0.435) 25.401 7.710 ( -7.950 -5.380 -0.530) 9.614 8.919 ( -4.684 -0.165 1.102) 4.815 9.111 ( -8.010 -3.522 -1.144) 8.825 9.820 ( 3.267 -11.780 0.629) 12.241 10.568 ( 14.368 -18.610 0.973) 23.531 11.192 ( -9.791 14.429 -0.128) 17.438 11.476 ( -4.777 5.586 -0.201) 7.352 12.955 ( -5.562 15.756 -0.321) 16.712 13.498 ( -1.346 7.611 -2.010) 7.986 13.755 ( 10.260 6.654 0.545) 12.241 15.387 ( -27.257 -38.160 -7.370) 47.471 16.738 ( -4.084 12.133 3.376) 13.239 17.403 ( -9.434 -3.241 -1.969) 10.168 17.977 ( -8.958 -7.701 13.796) 18.163 18.766 ( -5.163 -24.128 -17.544) 30.276 20.305 ( 36.385 -2.190 15.393) 39.568 22.099 ( -13.749 0.486 -4.798) 14.570 23.070 ( 15.299 4.159 -2.940) 16.125 ======================= Grid point 405 (167/267) ======================= q-point: ( 0.29 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.889 ( 1.078 -11.553 -2.057) 11.784 2.274 ( -1.759 -20.459 6.321) 21.486 2.665 ( 5.855 -9.625 -10.171) 15.178 2.942 ( 2.767 -9.783 2.021) 10.365 3.421 ( 0.614 -4.900 1.306) 5.108 3.555 ( -5.963 -7.855 -0.010) 9.863 4.047 ( 5.864 -0.247 2.307) 6.306 4.091 ( 0.468 -2.971 1.043) 3.184 4.840 ( 0.698 -7.485 1.153) 7.605 5.088 ( -3.030 -5.821 1.153) 6.663 5.250 ( 3.486 -3.105 -7.300) 8.665 5.631 ( 0.006 -7.088 -0.756) 7.128 5.874 ( 9.053 -16.402 2.729) 18.932 6.146 ( 4.123 -5.316 2.927) 7.337 6.316 ( -5.908 -4.287 2.541) 7.729 6.446 ( -3.233 -7.353 -2.821) 8.513 7.423 ( 8.506 0.021 -0.676) 8.532 7.760 ( 7.619 -17.758 2.071) 19.434 8.062 ( -5.821 -33.579 -0.967) 34.094 8.941 ( 0.673 -6.073 0.474) 6.129 9.146 ( -6.134 -5.814 -1.373) 8.563 10.122 ( -1.287 -16.658 0.315) 16.711 10.743 ( -10.447 7.179 0.861) 12.705 11.036 ( 12.084 -0.954 0.074) 12.122 11.526 ( -5.160 -18.900 -0.781) 19.607 12.553 ( -8.224 21.776 -0.016) 23.277 13.373 ( -0.589 4.695 -1.363) 4.924 13.695 ( 8.765 7.484 0.332) 11.531 15.744 ( -16.826 -21.551 -2.596) 27.465 16.442 ( -2.703 16.599 3.280) 17.134 17.370 ( -11.838 -2.563 -1.046) 12.158 18.088 ( -10.274 -8.742 8.681) 16.042 19.061 ( -3.113 -14.724 -13.408) 20.156 20.531 ( 21.945 3.111 10.729) 24.625 22.096 ( -4.951 -7.326 -3.460) 9.495 23.075 ( 11.747 5.894 -1.284) 13.205 ======================= Grid point 406 (168/267) ======================= q-point: ( 0.36 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.069 ( 0.829 -7.591 -2.107) 7.921 2.551 ( -2.480 -10.415 1.611) 10.826 2.851 ( 3.619 -7.060 -6.664) 10.361 3.120 ( 3.869 -7.303 1.982) 8.499 3.483 ( -1.997 -1.896 5.998) 6.600 3.668 ( -3.441 -9.512 -1.712) 10.259 4.057 ( 4.675 2.613 -1.071) 5.462 4.197 ( 1.827 -5.432 2.054) 6.088 4.924 ( -3.976 -2.069 2.476) 5.121 5.173 ( 1.504 -5.540 -5.134) 7.702 5.347 ( 3.571 -5.329 -2.165) 6.771 5.736 ( 0.887 -3.899 -1.222) 4.181 6.077 ( -3.519 -3.859 2.544) 5.809 6.356 ( -0.337 -3.401 -0.462) 3.448 6.403 ( 4.321 -13.803 2.125) 14.619 6.572 ( 5.608 -6.270 2.008) 8.649 7.429 ( 0.349 1.055 -1.014) 1.504 8.007 ( 7.955 -4.107 1.196) 9.032 8.571 ( -1.469 -22.574 -0.132) 22.622 9.214 ( 1.145 -12.881 -0.659) 12.949 9.234 ( -0.250 -16.333 -0.374) 16.340 10.174 ( -12.552 6.022 -0.199) 13.923 10.542 ( -5.966 6.822 0.317) 9.068 11.279 ( 13.228 -15.038 0.734) 20.041 11.860 ( -11.738 -3.464 -1.519) 12.332 12.139 ( -2.703 2.465 0.468) 3.688 13.312 ( -0.254 1.261 -0.617) 1.427 13.617 ( 6.465 6.804 0.169) 9.387 15.964 ( -7.857 -12.814 -0.089) 15.031 16.143 ( -1.383 13.860 1.852) 14.051 17.329 ( -9.816 -1.822 -0.123) 9.985 18.177 ( -8.027 -6.520 4.174) 11.152 19.217 ( -3.040 -7.768 -8.405) 11.842 20.601 ( 12.464 3.957 5.712) 14.270 22.231 ( -1.092 -9.173 -1.285) 9.326 23.019 ( 8.650 7.834 -0.500) 11.681 ======================= Grid point 407 (169/267) ======================= q-point: ( 0.43 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.172 ( 0.711 -3.528 -2.069) 4.152 2.666 ( -3.473 -5.134 -0.532) 6.221 2.921 ( 1.765 -0.412 -3.767) 4.180 3.250 ( 2.715 -2.540 3.106) 4.845 3.530 ( -1.316 -3.811 5.484) 6.806 3.842 ( 0.087 -10.013 -2.869) 10.417 4.023 ( 3.118 4.000 -0.194) 5.075 4.285 ( 0.911 -2.281 0.310) 2.476 4.905 ( -4.169 0.236 1.387) 4.400 5.261 ( 2.681 -3.021 -7.548) 8.561 5.490 ( 3.475 -7.131 1.995) 8.180 5.774 ( -0.727 -0.477 -1.867) 2.060 6.079 ( -1.597 1.042 1.639) 2.515 6.407 ( -1.696 -3.000 0.547) 3.489 6.591 ( -2.764 -5.985 3.346) 7.393 6.769 ( 9.962 -5.590 1.383) 11.506 7.404 ( -2.472 0.303 -0.722) 2.593 8.110 ( 8.035 -1.657 -0.089) 8.204 8.850 ( -0.973 -8.528 -0.257) 8.588 9.365 ( -1.733 -9.391 0.170) 9.551 9.724 ( 0.684 -23.817 -0.376) 23.829 9.968 ( -3.572 1.683 -0.551) 3.987 10.349 ( -1.556 9.627 0.347) 9.758 11.258 ( -9.152 27.091 -0.039) 28.595 11.792 ( 3.982 -13.450 -0.168) 14.028 12.382 ( -2.298 -13.059 0.096) 13.260 13.317 ( 0.018 -1.523 0.124) 1.529 13.552 ( 3.541 3.921 -0.066) 5.284 15.934 ( -0.974 7.413 0.739) 7.514 16.109 ( -2.087 -6.144 0.731) 6.530 17.296 ( -5.707 -0.849 0.524) 5.793 18.230 ( -4.133 -3.435 1.542) 5.591 19.280 ( -2.309 -2.949 -4.503) 5.857 20.618 ( 6.143 2.211 2.525) 7.000 22.382 ( -0.369 -7.172 0.047) 7.181 22.926 ( 5.010 7.015 -0.339) 8.627 ======================= Grid point 408 (170/267) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.201 ( 0.088 0.185 -1.703) 1.715 2.703 ( -2.353 -1.740 -1.601) 3.336 2.904 ( 0.152 2.142 -0.282) 2.166 3.282 ( 0.192 0.233 3.458) 3.471 3.609 ( 1.275 -3.091 0.853) 3.450 3.938 ( 2.682 5.609 0.067) 6.218 3.985 ( -0.844 -3.137 -1.515) 3.585 4.304 ( 0.342 0.183 -0.206) 0.439 4.882 ( -2.486 -0.395 1.328) 2.846 5.286 ( 2.385 0.613 -6.701) 7.139 5.635 ( 2.386 -4.270 0.247) 4.898 5.740 ( -1.661 2.120 -2.246) 3.507 6.054 ( 0.499 0.763 1.811) 2.027 6.426 ( 0.282 0.938 1.561) 1.843 6.638 ( -1.812 -0.173 4.036) 4.427 6.863 ( -0.248 -0.222 0.773) 0.842 7.387 ( -0.921 0.015 -0.200) 0.942 8.168 ( 0.849 -0.099 -0.886) 1.231 8.911 ( -0.227 0.025 -0.133) 0.264 9.448 ( 0.441 -0.337 -0.064) 0.558 9.871 ( -0.195 0.686 -0.238) 0.752 10.047 ( 0.038 0.066 0.302) 0.311 10.403 ( -0.295 -0.371 -0.381) 0.608 10.764 ( -0.340 0.235 0.421) 0.590 11.962 ( 0.431 -0.223 -0.498) 0.695 12.487 ( -0.349 0.346 0.704) 0.859 13.336 ( 0.266 0.536 0.765) 0.971 13.530 ( -0.233 -0.267 -0.365) 0.509 15.863 ( 0.013 -0.145 0.229) 0.271 16.160 ( -0.362 -0.054 0.872) 0.946 17.283 ( 0.080 0.036 0.703) 0.709 18.251 ( 0.605 -0.148 0.403) 0.742 19.278 ( -1.320 0.971 -1.628) 2.310 20.631 ( 0.671 -0.656 0.623) 1.126 22.458 ( 0.171 -0.182 0.284) 0.378 22.865 ( -0.343 0.390 0.020) 0.520 ======================= Grid point 409 (171/267) ======================= q-point: (-0.43 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.159 ( -0.707 3.828 -1.064) 4.036 2.689 ( 0.481 2.265 -2.606) 3.486 2.852 ( -2.346 2.951 2.864) 4.734 3.258 ( -1.325 3.158 1.264) 3.650 3.636 ( 1.280 2.171 -1.511) 2.939 3.807 ( 1.801 8.019 -1.075) 8.289 4.009 ( -0.786 -0.584 0.481) 1.091 4.285 ( 0.192 2.653 0.825) 2.785 4.895 ( -0.735 -1.915 1.732) 2.684 5.242 ( 1.173 4.197 -5.204) 6.788 5.583 ( -2.920 6.561 -6.128) 9.441 5.741 ( 2.249 -0.135 0.723) 2.366 6.083 ( 2.072 -2.086 1.502) 3.302 6.381 ( 3.006 5.565 2.523) 6.809 6.588 ( -0.968 5.610 3.814) 6.852 6.780 ( -10.629 4.839 0.587) 11.693 7.387 ( 0.615 -0.044 0.556) 0.831 8.124 ( -6.180 1.245 -1.238) 6.425 8.847 ( 0.797 8.335 -0.027) 8.374 9.372 ( 1.743 9.877 -0.451) 10.040 9.717 ( -0.691 23.785 0.229) 23.796 9.955 ( 3.452 -1.627 0.467) 3.845 10.351 ( 1.249 -9.394 0.231) 9.479 11.255 ( 8.741 -27.550 0.254) 28.905 11.800 ( -3.524 13.797 -0.771) 14.261 12.371 ( 2.012 13.307 1.004) 13.496 13.306 ( 0.174 2.247 1.012) 2.470 13.555 ( -3.719 -4.022 -0.278) 5.485 15.943 ( 0.987 -8.053 0.025) 8.114 16.110 ( 1.532 6.053 0.669) 6.279 17.298 ( 5.715 0.860 0.326) 5.788 18.250 ( 6.113 2.914 0.030) 6.772 19.215 ( -0.842 4.981 0.663) 5.095 20.657 ( -4.565 -3.789 -0.699) 5.974 22.385 ( 0.092 7.386 -0.263) 7.391 22.911 ( -5.330 -6.599 0.847) 8.525 ======================= Grid point 410 (172/267) ======================= q-point: (-0.36 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.043 ( -1.158 8.050 -0.198) 8.136 2.614 ( 0.866 5.642 -2.535) 6.246 2.740 ( -2.973 9.652 2.857) 10.496 3.137 ( -2.835 7.479 -0.854) 8.043 3.545 ( -0.466 5.718 1.939) 6.056 3.708 ( 4.232 6.007 -6.126) 9.567 4.014 ( -1.539 -0.619 2.324) 2.855 4.205 ( -0.435 5.648 2.058) 6.027 4.939 ( 0.180 -1.746 1.376) 2.230 5.134 ( -1.333 5.446 -3.076) 6.395 5.399 ( -1.212 10.026 -5.175) 11.348 5.728 ( 1.483 3.023 -0.912) 3.488 6.128 ( 2.664 0.910 -1.753) 3.317 6.283 ( 1.550 8.103 4.883) 9.587 6.424 ( -1.075 10.746 0.858) 10.834 6.578 ( -12.291 6.120 1.726) 13.839 7.395 ( -1.480 -0.723 1.681) 2.353 8.040 ( -6.504 3.909 -1.408) 7.718 8.573 ( 1.605 22.415 -0.334) 22.474 9.207 ( -1.116 12.780 -0.142) 12.829 9.222 ( -0.401 16.803 0.567) 16.818 10.166 ( 12.943 -6.183 0.405) 14.349 10.541 ( 5.437 -7.062 0.377) 8.921 11.294 ( -13.458 15.309 -0.371) 20.387 11.833 ( 11.957 4.654 0.657) 12.848 12.144 ( 2.952 -3.818 0.095) 4.827 13.293 ( 0.304 -0.816 0.942) 1.283 13.617 ( -6.411 -6.547 0.136) 9.165 15.970 ( 7.389 12.450 -0.446) 14.485 16.168 ( 1.381 -15.001 -0.257) 15.066 17.331 ( 9.481 1.778 -0.311) 9.651 18.240 ( 12.530 5.353 -0.493) 13.635 19.075 ( -1.750 9.920 2.835) 10.464 20.699 ( -10.024 -6.733 -2.278) 12.288 22.216 ( -0.730 10.115 -0.118) 10.142 22.997 ( -8.292 -7.135 1.288) 11.015 ======================= Grid point 411 (173/267) ======================= q-point: (-0.29 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.840 ( -1.314 13.175 1.252) 13.300 2.429 ( -5.178 20.121 4.992) 21.367 2.493 ( 1.943 7.770 -6.020) 10.019 2.978 ( -3.165 7.600 -1.715) 8.410 3.449 ( -1.029 6.656 -0.809) 6.783 3.561 ( 2.631 10.507 -0.906) 10.869 4.016 ( -2.361 -0.424 2.687) 3.602 4.120 ( 0.743 3.318 1.172) 3.596 4.873 ( -3.449 7.950 -1.685) 8.828 5.106 ( -0.459 -3.626 0.355) 3.672 5.175 ( 1.639 13.294 -1.330) 13.460 5.642 ( 1.224 8.052 -2.116) 8.415 5.946 ( -9.845 11.795 -3.176) 15.689 6.197 ( -5.910 -0.296 0.918) 5.988 6.282 ( 16.392 12.942 1.198) 20.920 6.405 ( -7.133 5.055 2.496) 9.092 7.387 ( -7.071 -0.078 2.231) 7.415 7.795 ( -8.060 18.405 -0.744) 20.106 8.056 ( 5.682 34.466 -0.473) 34.934 8.950 ( -0.465 4.750 -0.229) 4.778 9.123 ( 5.525 6.056 0.498) 8.212 10.125 ( 1.736 16.396 0.094) 16.488 10.745 ( 10.261 -7.356 0.711) 12.645 11.037 ( -12.700 1.664 0.054) 12.809 11.510 ( 6.086 18.416 0.505) 19.402 12.562 ( 8.229 -22.390 -0.759) 23.866 13.347 ( 0.754 -4.408 0.702) 4.526 13.693 ( -8.433 -7.228 0.496) 11.118 15.755 ( 17.046 20.410 -3.257) 26.791 16.489 ( 1.622 -17.635 -0.804) 17.728 17.366 ( 11.213 2.626 -0.733) 11.540 18.241 ( 19.624 6.671 -2.357) 20.860 18.822 ( -5.018 16.209 5.078) 17.712 20.736 ( -18.544 -8.989 -6.204) 21.522 22.024 ( 1.223 10.139 2.150) 10.436 23.038 ( -10.475 -4.093 1.696) 11.374 ======================= Grid point 412 (174/267) ======================= q-point: (-0.21 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.554 ( -0.302 16.964 4.527) 17.560 2.001 ( -5.597 21.484 4.798) 22.714 2.347 ( 1.477 7.849 -5.980) 9.978 2.737 ( -4.267 16.915 -6.327) 18.557 3.182 ( -4.884 16.967 8.056) 19.407 3.473 ( 3.188 2.920 -2.723) 5.109 4.009 ( -2.651 -0.275 3.016) 4.025 4.083 ( 0.990 2.497 -1.721) 3.190 4.660 ( -3.882 11.134 0.218) 11.793 4.923 ( 4.622 15.894 0.207) 16.554 5.176 ( -2.623 -1.158 -0.511) 2.913 5.404 ( -4.397 12.899 -1.356) 13.695 5.755 ( -6.055 1.507 -6.583) 9.070 6.110 ( 17.405 19.711 3.855) 26.577 6.137 ( -6.729 2.416 -0.737) 7.188 6.318 ( -1.062 2.588 1.022) 2.978 7.048 ( -2.923 38.178 1.745) 38.330 7.303 ( -13.437 19.911 -1.024) 24.042 7.681 ( 7.255 6.037 1.820) 9.612 8.950 ( 4.860 -0.361 -1.425) 5.077 9.082 ( 6.620 2.704 1.199) 7.251 9.825 ( -2.705 12.246 0.220) 12.543 10.574 ( -14.452 18.304 0.518) 23.328 11.187 ( 9.583 -14.586 0.279) 17.455 11.472 ( 5.329 -5.696 0.151) 7.802 12.978 ( 5.872 -16.793 -2.189) 17.924 13.469 ( 1.717 -7.697 0.312) 7.892 13.755 ( -9.563 -6.492 0.537) 11.571 15.417 ( 29.274 35.196 -9.361) 46.726 16.787 ( 2.022 -11.870 -0.958) 12.079 17.385 ( 9.739 4.448 -0.322) 10.711 18.281 ( 24.056 5.004 -8.054) 25.857 18.425 ( -8.700 21.914 7.853) 24.851 20.667 ( -38.165 -5.883 -16.192) 41.873 21.936 ( 12.105 3.401 9.462) 15.736 22.998 ( -11.959 -0.251 2.946) 12.319 ======================= Grid point 413 (175/267) ======================= q-point: (-0.14 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.281 ( 1.515 13.804 11.424) 17.982 1.617 ( -5.778 16.425 9.212) 19.698 2.169 ( 1.025 20.261 -9.724) 22.497 2.273 ( -6.990 15.395 -4.910) 17.606 2.873 ( -3.649 16.401 13.907) 21.811 3.447 ( 1.999 0.675 -8.612) 8.867 3.952 ( -0.745 7.508 -4.874) 8.982 4.054 ( -2.440 -2.425 2.530) 4.270 4.438 ( 3.131 13.575 4.821) 14.742 4.626 ( 4.578 21.019 -0.757) 21.525 4.868 ( -6.214 30.332 -2.417) 31.056 5.253 ( -6.486 2.644 -4.987) 8.598 5.739 ( 1.677 2.278 3.427) 4.443 5.841 ( 8.101 11.047 -5.143) 14.633 6.017 ( -8.967 2.830 -2.008) 9.615 6.267 ( -2.763 1.619 1.354) 3.477 6.458 ( 8.583 21.853 8.527) 24.979 6.893 ( -6.694 13.529 -1.994) 15.225 7.763 ( 3.860 -6.173 1.813) 7.503 8.973 ( 16.911 6.149 -1.236) 18.037 9.127 ( 1.365 -3.089 0.978) 3.515 9.644 ( -0.286 7.128 0.195) 7.137 10.135 ( -26.741 10.816 -0.075) 28.846 11.530 ( 10.874 -12.788 0.286) 16.789 11.663 ( 3.169 -10.170 0.038) 10.652 13.210 ( 1.519 -3.051 -7.012) 7.796 13.645 ( 2.464 -7.550 -0.371) 7.951 13.815 ( -7.512 -8.864 0.312) 11.623 14.713 ( 32.673 66.340 -19.380) 76.447 16.915 ( 3.547 0.150 -0.641) 3.608 17.256 ( -1.694 15.943 3.240) 16.357 18.028 ( -11.638 8.758 1.356) 14.628 18.384 ( 32.505 4.823 -9.335) 34.161 20.240 ( -64.744 6.414 -22.788) 68.936 22.191 ( 29.002 -11.358 13.481) 33.939 22.918 ( -13.277 -1.675 6.230) 14.761 ======================= Grid point 414 (176/267) ======================= q-point: (-0.07 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.103 ( -3.532 8.892 15.461) 18.182 1.278 ( 0.550 27.962 12.505) 30.636 1.753 ( -8.639 0.230 6.315) 10.704 2.152 ( 3.632 2.968 -9.851) 10.911 2.544 ( -1.515 20.391 9.567) 22.575 3.446 ( 0.210 -3.193 -14.732) 15.076 3.755 ( -2.122 12.150 -2.832) 12.655 3.962 ( 4.782 33.690 1.357) 34.055 4.138 ( -0.076 -3.974 2.526) 4.709 4.185 ( 0.350 33.829 -5.569) 34.286 4.395 ( 0.918 6.781 4.319) 8.092 5.146 ( -7.063 1.560 -5.605) 9.151 5.584 ( -0.366 5.591 -0.270) 5.609 5.874 ( -0.351 3.304 -3.255) 4.651 6.157 ( 4.679 -20.816 4.829) 21.875 6.234 ( -3.089 0.384 4.000) 5.069 6.349 ( 7.765 -6.032 8.910) 13.269 6.718 ( -4.611 1.707 -2.758) 5.637 7.853 ( 11.312 8.206 -0.166) 13.976 8.966 ( 18.899 8.826 -0.508) 20.865 9.184 ( -2.751 -2.979 0.289) 4.065 9.536 ( 0.726 4.668 -0.189) 4.728 9.821 ( -35.879 -2.052 -1.423) 35.966 11.766 ( 5.540 -5.732 0.176) 7.974 11.863 ( 7.536 -4.184 -1.070) 8.686 12.401 ( -5.816 102.376 -27.644) 106.202 13.660 ( 0.596 3.403 -0.527) 3.495 13.860 ( 2.752 11.439 -1.471) 11.857 14.053 ( -0.558 -14.863 -0.405) 14.879 16.823 ( -0.780 12.329 3.298) 12.786 16.936 ( -0.766 9.178 1.137) 9.280 17.950 ( -1.531 -1.613 -0.211) 2.234 18.526 ( 30.120 2.958 -10.917) 32.174 19.504 ( -71.494 9.734 -10.745) 72.949 22.614 ( 23.280 -1.472 1.360) 23.366 23.046 ( -0.813 -21.043 11.569) 24.027 ======================= Grid point 416 (177/267) ======================= q-point: ( 0.07 0.07 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.026 ( 8.129 -0.000 4.769) 9.425 1.153 ( 11.104 -0.000 12.090) 16.415 1.686 ( -17.245 0.000 6.804) 18.539 2.221 ( 1.305 -0.000 -2.671) 2.973 2.495 ( 23.554 -0.000 -2.102) 23.647 3.394 ( -8.284 0.000 1.287) 8.383 3.517 ( 1.014 -0.000 -13.839) 13.876 3.689 ( 5.454 -0.000 0.427) 5.471 3.754 ( -1.782 0.000 -1.540) 2.356 4.233 ( 1.967 -0.000 0.255) 1.983 4.426 ( 3.577 -0.000 -3.801) 5.220 5.036 ( 0.246 -0.000 6.077) 6.082 5.542 ( 0.633 -0.000 -0.136) 0.648 5.723 ( -9.967 0.000 6.054) 11.662 6.156 ( -4.153 0.000 -0.315) 4.165 6.392 ( -0.683 0.000 -7.343) 7.374 6.659 ( 1.275 -0.000 5.560) 5.704 7.010 ( -26.016 0.000 -2.805) 26.166 7.287 ( -0.069 0.000 -0.000) 0.069 8.880 ( 2.651 -0.000 -1.799) 3.204 9.205 ( 0.091 -0.000 1.868) 1.870 9.515 ( 2.042 -0.000 -1.253) 2.396 10.170 ( 56.474 -0.000 5.453) 56.737 10.851 ( -1.274 0.000 0.008) 1.274 11.789 ( -4.806 0.000 -0.926) 4.894 11.996 ( -1.270 0.000 -1.001) 1.617 13.634 ( -3.304 0.000 -0.150) 3.307 13.830 ( 4.918 -0.000 0.545) 4.948 14.224 ( 0.236 -0.000 0.007) 0.236 16.863 ( -0.073 0.000 0.034) 0.080 16.888 ( 13.321 -0.000 -14.158) 19.439 17.892 ( -40.430 0.000 21.898) 45.980 17.969 ( 0.027 -0.000 -0.046) 0.053 19.703 ( 57.856 -0.000 11.943) 59.076 22.480 ( -23.769 0.000 -1.237) 23.802 23.490 ( 5.735 -0.000 -13.138) 14.336 ======================= Grid point 417 (178/267) ======================= q-point: ( 0.14 0.07 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.223 ( 8.079 -9.188 11.242) 16.615 1.473 ( -11.230 5.665 3.057) 12.944 1.565 ( 12.670 -29.023 -2.296) 31.751 2.281 ( 5.785 -4.221 -6.507) 9.676 2.823 ( 13.717 -14.911 2.224) 20.382 3.298 ( -2.496 1.541 -4.182) 5.108 3.692 ( -3.031 -9.776 2.400) 10.512 3.934 ( -4.278 -31.869 -4.568) 32.478 4.183 ( 1.668 -34.871 -2.179) 34.978 4.197 ( 3.834 4.027 0.189) 5.564 4.495 ( 3.519 -6.100 -4.546) 8.382 5.097 ( 4.320 -3.287 7.461) 9.227 5.578 ( 0.053 -3.740 1.233) 3.938 5.650 ( -10.701 1.507 8.030) 13.463 6.118 ( -0.753 2.683 0.223) 2.795 6.314 ( -13.795 2.355 -4.505) 14.702 6.473 ( 6.186 8.810 -5.488) 12.083 6.739 ( 8.539 -3.163 4.584) 10.195 7.681 ( -16.492 -16.608 -1.965) 23.488 8.808 ( 1.658 4.520 -0.422) 4.833 9.179 ( -0.645 2.752 1.893) 3.402 9.559 ( 2.003 -3.483 -1.364) 4.243 10.284 ( 31.678 6.061 3.230) 32.414 11.564 ( -16.022 -6.100 0.624) 17.155 11.766 ( -6.018 2.008 -1.070) 6.434 12.397 ( 5.860 -72.484 -8.549) 73.221 13.583 ( -10.089 -1.119 -0.092) 10.151 13.866 ( 5.139 0.925 0.261) 5.228 14.078 ( 3.140 12.524 -0.404) 12.918 16.853 ( 0.088 -1.130 -0.168) 1.146 17.130 ( -8.349 -20.486 -14.856) 26.648 17.750 ( -18.337 -0.357 22.368) 28.926 18.022 ( 6.670 -6.791 -3.887) 10.282 20.204 ( 58.488 -2.394 20.481) 62.017 22.245 ( -29.774 3.422 -3.670) 30.193 23.364 ( 10.038 11.426 -13.517) 20.348 ======================= Grid point 418 (179/267) ======================= q-point: ( 0.21 0.07 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( 0.264 -8.744 -7.005) 11.207 1.526 ( 5.660 -14.278 14.825) 21.347 2.189 ( 7.353 -26.830 -3.799) 28.077 2.422 ( 7.113 -8.240 -6.233) 12.544 3.145 ( 6.274 -10.680 1.067) 12.433 3.302 ( -2.491 -3.876 -1.602) 4.878 3.836 ( -3.393 -9.102 5.613) 11.219 4.145 ( 4.906 3.387 -1.148) 6.071 4.477 ( -4.352 -21.865 -5.932) 23.070 4.601 ( -0.601 -14.235 -0.806) 14.270 4.933 ( 5.987 -29.297 0.855) 29.915 5.242 ( 3.719 -6.663 2.664) 8.082 5.584 ( -0.434 -0.925 10.944) 10.992 5.715 ( -8.187 -12.306 -1.014) 14.816 6.124 ( 4.888 -3.483 0.792) 6.055 6.327 ( 3.418 -4.542 -0.708) 5.728 6.501 ( -6.006 -16.634 -7.061) 19.042 6.983 ( 8.824 -16.001 1.028) 18.302 7.696 ( -9.333 0.745 -0.882) 9.404 8.813 ( -0.094 -3.660 0.375) 3.681 9.109 ( -1.313 4.196 1.390) 4.611 9.669 ( 1.929 -7.390 -0.886) 7.689 10.488 ( 22.976 -4.824 1.626) 23.533 11.344 ( -13.951 11.036 -0.057) 17.789 11.575 ( -9.153 8.792 -0.353) 12.697 13.137 ( -2.431 3.632 -0.819) 4.447 13.602 ( -6.420 1.954 -3.161) 7.418 13.962 ( 11.049 6.365 0.392) 12.757 14.177 ( -26.526 -55.378 -4.170) 61.544 16.845 ( -2.517 2.714 1.715) 4.080 17.323 ( -11.438 -9.731 -6.892) 16.523 17.679 ( -23.698 -5.413 17.600) 30.011 18.349 ( 15.561 -18.382 -13.217) 27.472 20.654 ( 44.987 2.166 23.565) 50.831 21.974 ( -22.094 1.187 -6.765) 23.137 23.262 ( 13.469 6.230 -9.474) 17.606 ======================= Grid point 419 (180/267) ======================= q-point: ( 0.29 0.07 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.677 ( 4.698 -13.313 -5.589) 15.183 1.911 ( 5.546 -19.438 10.793) 22.914 2.520 ( 6.678 -9.344 -11.047) 15.936 2.726 ( 3.824 -16.416 1.962) 16.969 3.330 ( 2.608 -6.531 1.030) 7.107 3.378 ( -4.256 -6.806 -0.234) 8.031 3.976 ( -3.447 -7.044 5.150) 9.383 4.131 ( 6.010 2.124 -2.283) 6.771 4.712 ( 2.638 -8.943 -0.115) 9.324 4.865 ( -5.431 -14.579 -0.741) 15.576 5.213 ( 0.140 -1.891 -2.840) 3.415 5.455 ( 4.345 -13.189 -1.155) 13.935 5.748 ( 9.381 -6.741 8.322) 14.237 5.879 ( -13.939 -16.415 -0.145) 21.535 6.245 ( 6.014 -4.197 0.252) 7.339 6.389 ( 4.855 -1.100 -0.600) 5.014 7.096 ( -1.743 -40.580 -1.508) 40.645 7.444 ( 2.292 -27.010 -1.089) 27.129 7.619 ( 2.354 0.114 0.351) 2.382 8.891 ( 1.471 -2.634 0.572) 3.071 9.042 ( -1.996 0.368 0.159) 2.035 9.866 ( 2.485 -12.263 -0.293) 12.516 10.730 ( 3.560 -3.326 0.981) 4.970 11.094 ( 0.170 2.737 -0.213) 2.751 11.360 ( -10.642 5.070 -0.585) 11.803 12.855 ( -7.965 17.691 0.526) 19.408 13.461 ( -2.775 6.263 -2.326) 7.235 13.915 ( 10.888 7.981 0.048) 13.500 14.949 ( -26.980 -46.118 -2.384) 53.484 16.697 ( -3.700 11.394 3.596) 12.508 17.304 ( -4.166 2.296 -1.708) 5.054 17.740 ( -26.569 -16.850 9.501) 32.865 18.744 ( 8.342 -16.579 -13.855) 23.161 20.852 ( 25.792 8.543 17.143) 32.126 21.909 ( -7.701 -7.025 -5.002) 11.561 23.250 ( 11.430 4.514 -4.984) 13.261 ======================= Grid point 420 (181/267) ======================= q-point: ( 0.36 0.07 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.921 ( 4.793 -9.858 -2.806) 11.315 2.309 ( 3.019 -15.892 5.783) 17.179 2.719 ( 7.847 -9.530 -9.683) 15.689 2.985 ( 1.933 -9.813 1.954) 10.191 3.448 ( 1.514 -3.537 2.898) 4.817 3.474 ( -5.367 -8.040 1.355) 9.761 4.083 ( -2.698 -6.127 2.077) 7.009 4.140 ( 6.566 1.035 -2.937) 7.267 4.851 ( -0.368 -4.308 3.010) 5.268 5.051 ( -2.649 -8.547 1.899) 9.147 5.248 ( 1.092 -5.114 -8.198) 9.724 5.659 ( 3.759 -5.979 -1.208) 7.165 5.914 ( -6.653 -9.807 2.765) 12.169 6.127 ( -3.026 -13.280 2.884) 13.923 6.360 ( 8.626 -1.989 -2.343) 9.157 6.511 ( 10.299 -7.577 3.881) 13.363 7.386 ( -13.219 -3.263 -1.505) 13.699 7.868 ( 8.280 -18.167 0.195) 19.966 8.092 ( 9.271 -31.036 0.247) 32.392 8.964 ( 1.865 -7.841 0.349) 8.068 9.088 ( -0.789 -5.142 -0.610) 5.238 10.087 ( -4.331 -7.587 -0.285) 8.741 10.583 ( -10.350 6.018 0.705) 11.993 11.211 ( 6.871 -1.654 -0.034) 7.068 11.438 ( -2.024 -22.377 -0.953) 22.488 12.421 ( -9.420 21.611 0.335) 23.577 13.344 ( -2.745 3.614 -1.534) 4.790 13.827 ( 8.661 9.199 0.038) 12.635 15.487 ( -16.009 -30.571 -0.357) 34.511 16.419 ( -2.325 15.833 3.092) 16.298 17.234 ( -6.823 0.105 -0.488) 6.842 17.895 ( -18.634 -15.479 4.250) 24.594 19.012 ( 2.807 -11.250 -9.827) 15.199 20.852 ( 15.296 9.528 9.051) 20.166 22.043 ( -0.776 -10.118 -1.606) 10.274 23.214 ( 8.021 6.576 -2.203) 10.603 ======================= Grid point 421 (182/267) ======================= q-point: ( 0.43 0.07 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.092 ( 3.240 -5.974 -1.921) 7.063 2.532 ( -0.946 -7.483 2.312) 7.889 2.898 ( 6.184 -4.225 -5.599) 9.351 3.172 ( 2.611 -8.280 0.399) 8.691 3.495 ( -0.713 -1.594 7.410) 7.613 3.631 ( -0.217 -11.105 -2.108) 11.305 4.113 ( 3.435 2.257 -1.402) 4.342 4.220 ( 0.888 -5.284 -1.028) 5.456 4.879 ( -3.644 -0.449 3.310) 4.943 5.173 ( 1.100 -5.827 -3.778) 7.031 5.379 ( 2.142 -8.047 -1.450) 8.452 5.743 ( -0.007 -2.365 -2.288) 3.290 6.028 ( -3.755 -5.293 2.315) 6.890 6.292 ( -2.841 -7.838 -0.347) 8.345 6.454 ( 0.272 -5.122 2.002) 5.506 6.773 ( 15.449 -6.584 2.664) 17.003 7.331 ( -11.841 -2.386 -0.641) 12.096 8.102 ( 4.124 -4.073 -0.471) 5.815 8.638 ( 9.779 -19.117 0.359) 21.476 9.191 ( -0.556 -7.796 -0.091) 7.816 9.289 ( 4.596 -22.308 -0.343) 22.779 9.994 ( -11.318 5.735 -0.387) 12.694 10.470 ( -3.818 4.334 0.445) 5.793 11.443 ( 6.213 -16.277 0.129) 17.423 11.663 ( -12.051 8.621 -0.968) 14.849 12.119 ( 0.294 -6.501 0.223) 6.512 13.285 ( -3.181 0.101 -0.798) 3.281 13.714 ( 6.388 8.694 0.096) 10.789 15.852 ( -7.247 -17.805 0.550) 19.231 16.140 ( 0.180 12.759 1.542) 12.853 17.202 ( -7.844 -2.530 0.043) 8.242 18.043 ( -11.298 -11.657 1.538) 16.306 19.171 ( 0.820 -6.661 -5.640) 8.766 20.792 ( 10.381 8.471 4.260) 14.060 22.225 ( 0.389 -9.430 -0.146) 9.439 23.115 ( 4.795 8.702 -0.941) 9.980 ======================= Grid point 422 (183/267) ======================= q-point: ( 0.50 0.07 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.181 ( 1.402 -2.407 -1.666) 3.246 2.627 ( -1.814 -4.236 1.959) 5.008 2.946 ( 3.311 0.999 -2.920) 4.527 3.274 ( -0.745 -1.750 1.686) 2.542 3.569 ( 3.256 -3.820 4.428) 6.693 3.845 ( 2.383 -10.362 -3.726) 11.266 4.070 ( 3.742 4.929 -0.860) 6.248 4.289 ( -0.307 -2.038 -1.276) 2.424 4.862 ( -2.924 -0.123 2.942) 4.150 5.256 ( 0.946 -3.397 -6.788) 7.649 5.550 ( 3.095 -7.408 2.752) 8.487 5.748 ( -1.390 0.352 -2.492) 2.875 6.053 ( -2.849 -0.507 0.047) 2.894 6.403 ( 1.886 -4.362 -0.268) 4.760 6.544 ( -5.612 -5.423 4.217) 8.871 6.924 ( 8.876 0.809 1.489) 9.037 7.314 ( -8.580 -3.810 0.382) 9.396 8.146 ( -2.932 -0.673 -0.986) 3.166 8.915 ( 8.657 -4.170 0.008) 9.609 9.364 ( 1.902 -8.982 0.121) 9.182 9.683 ( -4.965 -14.766 -0.402) 15.584 9.977 ( 3.849 -10.844 -0.394) 11.514 10.352 ( 2.299 3.759 0.536) 4.439 11.119 ( -9.666 29.527 0.084) 31.069 11.805 ( -2.473 -15.406 -0.491) 15.611 12.386 ( 3.174 -11.810 0.264) 12.231 13.286 ( -4.051 -2.793 -0.231) 4.926 13.612 ( 4.263 6.351 0.080) 7.650 15.915 ( -2.112 4.860 0.414) 5.315 16.102 ( 1.009 -5.746 1.000) 5.919 17.218 ( -5.373 -4.506 0.306) 7.018 18.164 ( -5.090 -7.756 0.221) 9.280 19.254 ( 0.796 -2.807 -2.205) 3.657 20.718 ( 6.176 6.672 1.451) 9.206 22.380 ( -0.117 -6.950 0.225) 6.954 22.970 ( 1.374 8.816 -0.299) 8.927 ======================= Grid point 423 (184/267) ======================= q-point: (-0.43 0.07 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.198 ( 0.298 0.786 -1.148) 1.423 2.685 ( -0.294 -2.358 2.228) 3.258 2.911 ( 0.832 3.737 -0.181) 3.833 3.275 ( -2.261 0.113 0.991) 2.471 3.665 ( 5.480 -1.564 0.341) 5.709 3.956 ( -1.849 2.710 1.744) 3.715 4.001 ( 6.460 2.055 -5.715) 8.866 4.299 ( -1.089 -0.215 -0.759) 1.344 4.865 ( -1.091 -1.236 3.484) 3.854 5.279 ( 0.701 0.037 -6.382) 6.421 5.631 ( -1.879 1.855 -2.999) 3.996 5.743 ( 2.539 -1.565 0.854) 3.103 6.048 ( -2.173 -1.885 0.053) 2.877 6.461 ( 3.353 0.352 0.333) 3.388 6.581 ( -6.726 -2.474 4.507) 8.466 6.885 ( 1.683 7.884 1.108) 8.137 7.336 ( -5.763 -3.606 1.288) 6.919 8.075 ( -11.442 1.481 -1.195) 11.599 8.986 ( 9.360 2.648 -0.056) 9.728 9.497 ( 5.643 -1.289 -0.567) 5.816 9.859 ( -1.208 -5.873 0.086) 5.997 10.059 ( 1.479 0.474 0.120) 1.558 10.357 ( -4.941 17.721 0.179) 18.398 10.835 ( 8.421 -19.899 0.610) 21.616 11.910 ( -6.466 1.056 -0.614) 6.581 12.525 ( 4.443 0.315 0.686) 4.506 13.300 ( -4.932 -1.736 0.218) 5.233 13.545 ( 1.945 3.492 -0.014) 3.997 15.864 ( 0.029 -0.827 0.128) 0.837 16.167 ( 0.649 -0.284 0.998) 1.224 17.287 ( 0.022 -4.781 0.306) 4.791 18.255 ( -0.008 -4.266 -0.612) 4.310 19.278 ( 1.587 1.011 0.885) 2.079 20.647 ( 1.453 4.069 -0.579) 4.359 22.461 ( 0.156 -0.791 -0.071) 0.809 22.837 ( -3.438 3.625 0.498) 5.020 ======================= Grid point 424 (185/267) ======================= q-point: (-0.36 0.07 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.154 ( 0.507 4.165 -0.264) 4.204 2.701 ( 1.633 2.296 0.522) 2.865 2.838 ( -1.378 3.784 3.431) 5.291 3.232 ( -2.211 3.659 -1.339) 4.480 3.667 ( 3.210 5.750 -0.276) 6.591 3.844 ( 3.195 6.247 -0.149) 7.018 4.008 ( 2.122 0.511 -3.958) 4.520 4.266 ( -3.299 2.466 -0.392) 4.137 4.907 ( 0.684 -2.332 4.237) 4.884 5.229 ( 0.072 4.652 -4.422) 6.419 5.512 ( -3.055 6.217 -5.981) 9.152 5.776 ( 2.404 1.027 -0.073) 2.615 6.092 ( -1.793 -3.622 0.396) 4.061 6.436 ( 0.332 4.677 -0.374) 4.703 6.560 ( -2.397 2.479 5.036) 6.103 6.674 ( -2.923 12.605 0.930) 12.973 7.349 ( -6.054 -1.671 2.154) 6.639 7.980 ( -11.134 -1.368 -1.230) 11.285 8.937 ( 10.171 11.822 -0.397) 15.600 9.400 ( 1.958 11.225 -0.413) 11.402 9.669 ( -4.728 28.993 0.431) 29.379 10.059 ( 8.730 -13.173 0.398) 15.808 10.380 ( 2.192 -12.664 0.203) 12.854 11.369 ( 5.947 -15.616 0.561) 16.720 11.727 ( -4.829 4.046 -0.469) 6.318 12.422 ( 3.624 14.714 0.678) 15.168 13.282 ( -3.724 -0.281 0.758) 3.811 13.515 ( -1.507 -0.355 -0.141) 1.554 15.953 ( 0.511 -8.456 0.067) 8.472 16.142 ( 2.069 3.747 0.511) 4.311 17.384 ( 5.609 -3.162 0.213) 6.443 18.319 ( 3.624 -1.573 -2.095) 4.472 19.240 ( 2.828 5.608 4.392) 7.664 20.587 ( -4.051 1.139 -2.625) 4.960 22.390 ( 0.905 8.129 0.085) 8.180 22.818 ( -7.772 -5.110 1.013) 9.356 ======================= Grid point 425 (186/267) ======================= q-point: (-0.29 0.07 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( 1.195 8.622 0.822) 8.744 2.618 ( -0.053 7.035 0.758) 7.076 2.734 ( 0.690 10.264 2.335) 10.549 3.091 ( -2.803 7.957 -1.709) 8.607 3.553 ( 0.310 6.289 1.128) 6.397 3.764 ( 6.370 7.636 -3.806) 10.647 4.006 ( 0.220 0.070 -0.715) 0.751 4.165 ( -5.502 3.680 -0.574) 6.644 4.957 ( 0.687 0.356 3.497) 3.582 5.104 ( -0.938 5.620 -1.340) 5.853 5.357 ( -1.669 7.375 -5.230) 9.194 5.745 ( 1.926 3.495 -2.000) 4.464 6.130 ( -2.795 -2.018 -0.878) 3.558 6.182 ( -10.047 18.138 -0.960) 20.757 6.439 ( -3.535 5.107 2.611) 6.738 6.584 ( 12.663 4.966 3.035) 13.936 7.307 ( -10.591 0.110 2.459) 10.873 7.924 ( -7.587 2.147 -1.019) 7.951 8.656 ( 7.788 25.332 -0.694) 26.512 9.160 ( -2.972 19.338 0.355) 19.569 9.269 ( 3.872 6.015 0.175) 7.155 10.359 ( 13.118 -4.074 0.135) 13.737 10.625 ( 5.051 -11.157 0.594) 12.262 11.086 ( -14.149 19.390 -0.033) 24.003 11.973 ( 6.345 15.533 0.584) 16.789 12.193 ( 3.622 -15.346 -0.087) 15.768 13.286 ( -1.533 -2.433 0.970) 3.035 13.536 ( -4.431 -4.021 -0.008) 5.983 16.062 ( 5.140 6.269 -0.127) 8.107 16.186 ( 1.208 -14.469 -0.780) 14.540 17.480 ( 10.431 -0.779 0.257) 10.463 18.353 ( 3.772 0.333 -5.716) 6.856 19.127 ( 5.591 11.715 9.189) 15.904 20.522 ( -11.455 -0.629 -5.741) 12.829 22.225 ( 1.885 9.916 1.922) 10.275 22.870 ( -9.233 -6.224 0.850) 11.168 ======================= Grid point 426 (187/267) ======================= q-point: (-0.21 0.07 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.853 ( 1.617 13.630 2.211) 13.903 2.385 ( -5.591 19.960 9.743) 22.904 2.517 ( 5.685 10.504 -9.035) 14.976 2.927 ( -2.834 8.383 -1.461) 8.969 3.431 ( -0.469 8.963 -1.025) 9.034 3.612 ( 3.772 10.914 0.959) 11.587 3.998 ( -1.534 0.457 1.965) 2.535 4.093 ( -3.315 0.056 -2.930) 4.425 4.828 ( -2.269 10.183 0.152) 10.433 5.108 ( 0.246 -2.973 1.817) 3.493 5.187 ( 0.738 9.692 -1.665) 9.862 5.652 ( 0.526 11.681 -1.470) 11.785 5.777 ( -7.992 11.250 -4.139) 14.407 6.117 ( -3.861 0.505 -2.419) 4.584 6.335 ( -3.982 3.985 2.638) 6.220 6.581 ( 20.724 10.974 3.543) 23.716 7.223 ( -14.931 -1.467 1.039) 15.039 7.665 ( -7.438 22.710 -0.407) 23.900 8.163 ( 6.214 30.778 0.025) 31.399 8.949 ( 0.046 2.941 0.021) 2.941 9.229 ( 7.587 3.673 0.178) 8.431 10.150 ( 1.862 24.942 0.347) 25.014 10.795 ( -6.412 7.680 0.143) 10.006 10.955 ( 3.941 -16.112 0.534) 16.596 11.566 ( 1.695 16.947 0.177) 17.032 12.658 ( 5.063 -22.095 -0.846) 22.684 13.356 ( 0.216 -5.484 0.918) 5.564 13.587 ( -5.672 -5.302 0.074) 7.765 15.954 ( 11.145 11.787 -3.451) 16.585 16.500 ( 0.198 -17.874 -0.269) 17.878 17.563 ( 14.995 2.202 0.583) 15.167 18.302 ( -6.701 3.744 -11.411) 13.752 18.948 ( 15.341 17.357 14.280) 27.212 20.377 ( -23.416 2.042 -11.089) 25.989 22.105 ( 6.874 5.892 5.742) 10.721 22.894 ( -9.362 -3.153 0.710) 9.904 ======================= Grid point 427 (188/267) ======================= q-point: (-0.14 0.07 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.593 ( 1.943 15.918 4.521) 16.662 1.950 ( -6.549 22.424 10.337) 25.546 2.365 ( 5.652 8.548 -9.477) 13.958 2.654 ( -2.961 20.162 -5.663) 21.151 3.187 ( 0.164 15.772 9.277) 18.299 3.488 ( 0.951 4.747 -3.983) 6.269 3.986 ( -2.509 -0.144 2.939) 3.867 4.059 ( -1.413 2.070 -4.120) 4.822 4.632 ( -0.554 9.136 1.574) 9.287 4.992 ( 4.212 13.121 0.507) 13.790 5.129 ( -2.717 4.137 -1.571) 5.193 5.323 ( -4.166 13.679 -0.894) 14.327 5.688 ( -1.957 -0.647 -3.113) 3.733 6.044 ( -3.228 3.648 -3.143) 5.797 6.243 ( -0.090 5.855 3.297) 6.720 6.445 ( 13.158 20.282 2.090) 24.266 7.014 ( -2.542 35.673 1.830) 35.811 7.102 ( -10.077 8.876 -2.237) 13.614 7.765 ( 2.837 11.239 1.380) 11.674 8.982 ( 0.217 -4.600 0.063) 4.606 9.240 ( 10.494 2.490 0.027) 10.786 9.789 ( -2.381 12.178 0.744) 12.431 10.382 ( -9.131 26.592 -0.107) 28.116 11.312 ( 5.561 -17.076 0.421) 17.963 11.508 ( 0.311 -5.884 0.022) 5.892 13.027 ( 2.097 -14.943 -2.371) 15.275 13.500 ( 2.464 -9.109 0.655) 9.460 13.641 ( -5.439 -4.920 -0.167) 7.336 15.719 ( 15.131 26.034 -10.180) 31.786 16.803 ( -0.003 -13.540 0.496) 13.549 17.580 ( 16.704 12.554 0.118) 20.896 18.024 ( -23.452 8.480 -8.375) 26.307 18.841 ( 28.576 14.132 9.215) 33.185 19.998 ( -37.424 12.440 -15.047) 42.210 22.195 ( 13.955 -6.804 9.434) 18.167 22.849 ( -8.092 1.045 0.642) 8.184 ======================= Grid point 428 (189/267) ======================= q-point: (-0.07 0.07 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.341 ( 0.208 14.194 8.560) 16.577 1.589 ( -6.531 11.641 15.647) 20.567 2.107 ( -1.356 32.782 -7.046) 33.558 2.258 ( 7.367 6.574 -11.035) 14.808 2.931 ( 2.365 16.941 14.611) 22.496 3.407 ( -0.965 2.292 -11.358) 11.627 3.898 ( -3.197 7.722 -2.511) 8.727 4.050 ( 0.567 -3.185 1.886) 3.745 4.508 ( 3.346 6.165 2.791) 7.549 4.710 ( 6.081 24.142 -0.646) 24.905 4.759 ( -6.034 31.534 -2.650) 32.215 5.155 ( -3.163 5.033 -2.438) 6.424 5.728 ( -7.744 -3.377 8.380) 11.900 5.890 ( -1.836 19.173 -2.536) 19.427 5.961 ( 6.468 5.513 -5.691) 10.228 6.245 ( -0.881 1.591 2.054) 2.743 6.637 ( 10.286 13.666 7.315) 18.603 6.774 ( -6.831 13.231 -5.369) 15.829 7.803 ( 1.353 -8.701 0.474) 8.819 9.076 ( -1.734 -5.211 0.714) 5.538 9.250 ( 2.752 4.542 -0.881) 5.384 9.651 ( -1.685 2.685 1.626) 3.563 9.837 ( -1.177 23.950 -0.272) 23.980 11.646 ( 1.713 -15.462 0.268) 15.559 11.655 ( -1.700 -8.817 0.009) 8.979 13.192 ( 0.373 0.325 -6.470) 6.489 13.671 ( 0.847 -2.238 0.003) 2.392 13.751 ( -0.167 -14.707 -0.497) 14.716 14.925 ( 3.691 70.480 -20.895) 73.605 16.948 ( -2.062 -0.689 1.146) 2.458 17.225 ( 3.070 22.531 -1.557) 22.793 17.888 ( -2.982 -2.864 -0.501) 4.164 18.796 ( 4.328 11.819 -0.606) 12.601 19.407 ( -17.321 18.047 -4.809) 25.473 22.600 ( 4.005 -23.788 7.411) 25.235 22.764 ( 4.589 3.473 -0.315) 5.764 ======================= Grid point 431 (190/267) ======================= q-point: ( 0.14 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.186 ( 12.026 -0.000 -0.722) 12.048 1.423 ( 16.306 -0.000 -8.053) 18.186 1.464 ( -10.125 0.000 11.051) 14.988 2.250 ( 3.124 -0.000 0.665) 3.194 2.811 ( 19.804 -0.000 -1.162) 19.838 3.272 ( -8.923 0.000 1.681) 9.080 3.482 ( 0.149 -0.000 -7.524) 7.525 3.679 ( -4.797 0.000 -1.469) 5.017 3.791 ( 5.733 -0.000 -0.418) 5.748 4.271 ( 2.911 -0.000 0.112) 2.914 4.441 ( 2.663 -0.000 -6.588) 7.106 5.126 ( 5.927 -0.000 8.461) 10.330 5.555 ( 1.167 -0.000 -0.069) 1.169 5.612 ( -8.075 0.000 8.897) 12.015 6.080 ( -7.918 0.000 -5.887) 9.867 6.216 ( -12.770 0.000 -2.656) 13.043 6.657 ( -5.375 0.000 4.551) 7.043 6.858 ( 5.707 -0.000 -0.889) 5.776 7.286 ( -0.130 0.000 0.015) 0.131 8.972 ( 10.046 -0.000 -4.209) 10.892 9.208 ( -0.765 0.000 2.426) 2.544 9.539 ( 1.977 -0.000 -1.894) 2.738 10.825 ( -2.257 0.000 0.127) 2.260 10.905 ( 35.357 -0.000 4.923) 35.698 11.724 ( -3.539 0.000 -1.966) 4.049 11.922 ( -6.343 0.000 -0.543) 6.366 13.538 ( -8.480 0.000 0.131) 8.481 13.965 ( 11.613 -0.000 0.517) 11.624 14.229 ( 0.401 -0.000 -0.046) 0.404 16.654 ( -34.104 0.000 -10.508) 35.686 16.862 ( -0.119 0.000 0.044) 0.127 17.832 ( 14.213 -0.000 13.089) 19.322 17.970 ( 0.034 -0.000 -0.054) 0.064 20.678 ( 58.536 -0.000 27.776) 64.792 22.035 ( -32.325 0.000 -5.086) 32.723 23.481 ( 3.728 -0.000 -17.750) 18.137 ======================= Grid point 432 (191/267) ======================= q-point: ( 0.21 0.14 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.333 ( -3.596 0.114 -8.875) 9.576 1.429 ( 13.973 -10.700 5.191) 18.349 1.771 ( 14.477 -20.595 2.099) 25.262 2.338 ( 4.646 -5.241 -1.611) 7.187 3.025 ( 12.539 -8.298 -0.312) 15.039 3.238 ( -4.647 -0.985 -0.074) 4.751 3.644 ( -5.888 -9.935 3.916) 12.194 3.844 ( -4.361 -28.907 -6.407) 29.928 4.199 ( 1.558 -27.496 -1.093) 27.562 4.264 ( 5.078 -2.733 0.002) 5.767 4.523 ( 3.309 -8.680 -3.579) 9.954 5.198 ( 2.753 -2.000 4.919) 5.981 5.568 ( -3.107 -0.276 1.927) 3.666 5.613 ( 2.956 -2.625 8.703) 9.559 6.033 ( -16.005 -7.997 -7.407) 19.364 6.140 ( 0.711 1.181 2.239) 2.629 6.528 ( 3.202 7.697 -1.170) 8.418 6.890 ( 10.104 -2.471 0.282) 10.405 7.488 ( -8.640 -13.048 -0.184) 15.651 8.916 ( 11.395 8.588 -1.995) 14.408 9.178 ( -0.796 2.995 2.395) 3.916 9.578 ( 1.236 -3.391 -1.810) 4.038 10.672 ( 20.071 4.795 1.445) 20.686 11.344 ( -14.394 -2.343 0.424) 14.589 11.627 ( -12.626 5.218 -0.539) 13.672 12.421 ( 1.499 -57.449 -1.856) 57.499 13.418 ( -11.259 5.428 0.457) 12.508 13.944 ( 3.629 10.295 0.341) 10.921 14.157 ( 8.032 5.482 -0.402) 9.733 16.647 ( -38.818 -27.183 -5.812) 47.744 16.859 ( -0.821 0.410 0.495) 1.042 17.776 ( 2.243 11.125 7.682) 13.705 18.185 ( 15.645 -12.290 -2.747) 20.083 21.109 ( 44.421 3.669 31.300) 54.464 21.786 ( -26.809 -0.122 -7.893) 27.947 23.422 ( 7.784 4.723 -15.449) 17.932 ======================= Grid point 433 (192/267) ======================= q-point: ( 0.29 0.14 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( 6.166 -12.423 -7.321) 15.683 1.746 ( 15.157 -10.708 9.426) 20.814 2.284 ( 8.156 -21.837 -5.409) 23.930 2.493 ( 4.923 -9.408 -1.040) 10.669 3.222 ( -2.943 -5.450 7.522) 9.744 3.264 ( 4.516 -4.994 -7.462) 10.051 3.788 ( -6.652 -10.168 4.910) 13.105 4.200 ( 3.053 -0.143 -2.955) 4.252 4.388 ( -3.880 -24.251 -4.666) 24.999 4.617 ( 2.075 -10.676 2.562) 11.173 4.989 ( 1.008 -30.044 0.064) 30.061 5.246 ( -3.312 -4.607 0.624) 5.708 5.572 ( -5.635 -3.894 -3.471) 7.679 5.755 ( 11.075 -4.367 11.915) 16.843 6.198 ( 3.141 -7.121 0.007) 7.783 6.293 ( -4.347 -29.716 -2.443) 30.132 6.463 ( 3.201 1.397 -1.952) 4.002 7.101 ( 7.689 -13.616 -0.834) 15.659 7.584 ( -4.140 -4.645 -0.125) 6.224 8.906 ( 9.867 1.421 -0.181) 9.971 9.103 ( -0.097 4.829 1.621) 5.095 9.684 ( 0.460 -8.170 -1.321) 8.289 10.790 ( 16.353 1.574 0.759) 16.446 11.137 ( -13.442 6.281 -0.140) 14.838 11.410 ( -11.882 7.318 -0.384) 13.960 13.086 ( -4.864 10.003 1.204) 11.188 13.402 ( -17.630 -22.927 -4.035) 29.202 13.911 ( -8.590 -25.038 1.525) 26.514 14.132 ( 11.124 6.360 -0.194) 12.815 16.795 ( -10.599 -0.201 2.683) 10.935 16.956 ( -24.019 -26.920 -3.620) 36.259 17.562 ( -4.008 12.100 5.782) 13.996 18.530 ( 13.655 -13.407 -7.491) 20.551 21.250 ( 15.799 10.718 21.885) 29.042 21.715 ( -4.189 -6.545 -4.399) 8.930 23.387 ( 9.867 3.569 -9.291) 14.015 ======================= Grid point 434 (193/267) ======================= q-point: ( 0.36 0.14 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.750 ( 8.863 -13.402 -5.553) 16.999 2.098 ( 13.015 -13.591 8.904) 20.818 2.576 ( 7.595 -9.793 -10.410) 16.185 2.789 ( 3.218 -14.597 3.794) 15.421 3.289 ( -7.060 -7.058 3.137) 10.464 3.393 ( 4.021 -4.680 -0.409) 6.184 3.915 ( -6.738 -8.241 1.970) 10.826 4.202 ( 5.281 1.344 -4.573) 7.114 4.751 ( 0.417 -16.258 0.913) 16.289 4.793 ( -2.916 -8.548 2.667) 9.417 5.175 ( -2.571 -1.672 -2.931) 4.242 5.542 ( 2.589 -18.783 1.221) 19.000 5.603 ( -10.205 -6.919 -5.381) 13.452 5.968 ( 7.457 -7.143 8.033) 13.083 6.384 ( 11.234 -4.800 -1.019) 12.258 6.462 ( 5.794 -3.434 1.951) 7.012 6.939 ( -15.805 -32.630 -2.060) 36.315 7.498 ( 8.530 -24.693 -0.255) 26.126 7.740 ( 10.146 -14.239 -0.376) 17.488 8.933 ( 1.456 1.384 0.922) 2.210 9.057 ( 5.077 0.691 -0.008) 5.124 9.878 ( -0.766 -12.051 -0.789) 12.101 10.653 ( -11.586 10.530 0.492) 15.664 11.113 ( -11.451 -3.515 -0.970) 12.018 11.292 ( 13.767 -2.235 0.185) 13.948 12.731 ( -9.113 19.099 0.904) 21.181 13.384 ( -6.698 3.652 -2.491) 8.026 14.061 ( 8.802 8.725 -0.405) 12.400 14.622 ( -16.397 -47.166 1.206) 49.950 16.654 ( -4.596 9.817 3.435) 11.371 17.234 ( -6.710 -7.600 -2.553) 10.455 17.381 ( -21.943 -10.332 2.862) 24.422 18.822 ( 7.871 -11.394 -7.303) 15.656 21.165 ( 8.498 10.182 10.665) 17.018 21.858 ( 2.020 -8.787 0.025) 9.016 23.365 ( 7.316 4.648 -4.241) 9.649 ======================= Grid point 435 (194/267) ======================= q-point: ( 0.43 0.14 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.994 ( 6.310 -7.952 -3.269) 10.664 2.406 ( 6.376 -8.623 5.730) 12.159 2.819 ( 11.546 -10.225 -8.677) 17.696 3.015 ( 0.742 -9.190 2.453) 9.541 3.411 ( -4.642 -9.271 4.176) 11.177 3.486 ( 1.830 -3.530 2.393) 4.641 4.027 ( -5.167 -8.819 -0.502) 10.233 4.210 ( 5.801 0.996 -6.432) 8.718 4.851 ( -2.274 -1.379 4.957) 5.626 5.041 ( -0.013 -11.112 3.942) 11.790 5.217 ( -0.703 -7.025 -7.307) 10.161 5.651 ( -6.093 -5.973 -4.552) 9.671 5.850 ( 1.542 -12.084 2.102) 12.362 6.133 ( 0.627 -6.950 3.172) 7.665 6.432 ( 2.868 0.174 0.355) 2.895 6.735 ( 15.098 -10.503 1.982) 18.499 7.123 ( -18.609 -8.726 -0.263) 20.555 7.998 ( 8.466 -13.117 -1.350) 15.671 8.262 ( 12.339 -29.953 0.624) 32.401 8.990 ( 1.779 -9.587 0.210) 9.752 9.121 ( 4.958 -3.183 -0.151) 5.894 9.981 ( -9.465 0.372 -0.530) 9.487 10.466 ( -6.097 0.266 0.794) 6.155 11.100 ( -15.730 -12.233 -1.517) 19.984 11.598 ( 18.623 -11.214 0.159) 21.739 12.289 ( -8.540 20.332 0.631) 22.062 13.272 ( -6.266 2.254 -1.569) 6.841 13.942 ( 6.938 10.169 -0.102) 12.311 15.296 ( -9.922 -35.541 0.877) 36.911 16.404 ( -1.107 14.431 2.299) 14.654 17.143 ( -6.266 2.977 -0.257) 6.942 17.623 ( -18.062 -22.399 -0.385) 28.776 19.036 ( 4.283 -8.512 -4.895) 10.713 21.060 ( 8.995 10.224 5.626) 14.734 22.047 ( 1.162 -10.059 0.278) 10.130 23.292 ( 4.021 7.149 -1.708) 8.378 ======================= Grid point 436 (195/267) ======================= q-point: ( 0.50 0.14 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.130 ( 2.709 -4.203 -2.361) 5.530 2.553 ( 2.097 -4.087 4.487) 6.421 2.970 ( 5.864 -1.236 -4.144) 7.286 3.202 ( 1.698 -6.855 -0.770) 7.104 3.521 ( -0.245 -4.808 7.627) 9.019 3.649 ( 3.694 -11.488 -1.717) 12.188 4.134 ( -0.604 -3.345 0.198) 3.404 4.226 ( 3.320 -1.442 -7.750) 8.554 4.849 ( -2.762 0.032 4.598) 5.364 5.170 ( 0.262 -4.409 -3.165) 5.434 5.401 ( 1.199 -11.439 0.943) 11.540 5.701 ( -3.319 -3.764 -3.411) 6.067 5.990 ( -3.266 -3.502 -0.576) 4.823 6.294 ( 3.300 -8.670 1.096) 9.341 6.457 ( -0.894 -1.548 2.652) 3.199 6.966 ( 6.404 -4.183 0.765) 7.687 7.147 ( -9.235 -6.302 1.567) 11.290 8.116 ( -1.733 -0.355 -1.002) 2.033 8.813 ( 12.442 -17.271 -0.028) 21.286 9.207 ( 2.447 -8.414 0.177) 8.764 9.342 ( 2.239 -17.680 -0.386) 17.826 9.863 ( -5.345 -1.045 -0.321) 5.455 10.438 ( -0.755 2.599 0.450) 2.744 11.333 ( -16.183 -18.131 -1.283) 24.337 11.621 ( 1.932 18.018 0.752) 18.137 12.172 ( 7.294 -12.469 0.095) 14.446 13.210 ( -6.436 -0.941 -0.861) 6.561 13.799 ( 5.072 9.742 0.026) 10.983 15.763 ( -5.215 -19.433 0.564) 20.128 16.171 ( 3.458 10.357 1.057) 10.970 17.085 ( -8.588 -2.934 -0.065) 9.075 17.883 ( -9.971 -16.857 -0.509) 19.592 19.183 ( 2.917 -5.597 -2.344) 6.733 20.941 ( 7.835 10.342 2.576) 13.228 22.232 ( 0.258 -9.003 0.140) 9.008 23.156 ( 1.481 9.437 -0.563) 9.570 ======================= Grid point 437 (196/267) ======================= q-point: ( 0.57 0.14 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.189 ( 0.415 -1.658 -1.715) 2.421 2.640 ( 1.454 -3.108 5.477) 6.463 2.984 ( 3.283 2.317 -2.660) 4.819 3.246 ( -3.505 -0.704 0.213) 3.582 3.650 ( 4.517 -4.905 4.376) 7.975 3.877 ( 3.658 -8.456 -3.234) 9.765 4.130 ( 5.847 4.132 -3.470) 7.957 4.265 ( -1.528 -2.134 -3.094) 4.057 4.849 ( -1.064 -0.721 4.629) 4.804 5.228 ( -0.850 -3.399 -5.970) 6.922 5.596 ( 1.334 -6.105 2.270) 6.649 5.725 ( -0.004 -1.696 -1.538) 2.290 5.981 ( -6.180 -1.502 -3.013) 7.038 6.461 ( 5.056 -3.117 -1.007) 6.024 6.483 ( -4.058 -4.111 5.457) 7.946 7.010 ( 0.887 1.667 0.952) 2.115 7.205 ( -4.985 -4.383 2.227) 7.001 8.035 ( -10.348 3.606 -0.999) 11.003 9.063 ( 10.531 -2.990 -0.233) 10.949 9.415 ( 4.343 -9.952 -0.204) 10.860 9.608 ( -4.533 -14.968 -0.298) 15.642 10.035 ( 3.620 -8.574 -0.321) 9.312 10.430 ( 7.778 -4.558 0.601) 9.035 10.980 ( -9.381 26.943 0.425) 28.533 11.729 ( -6.616 -14.242 -0.510) 15.712 12.470 ( 7.468 -10.077 0.342) 12.548 13.204 ( -6.729 -3.285 -0.371) 7.497 13.670 ( 3.388 7.422 0.027) 8.158 15.877 ( -2.938 0.580 0.085) 2.996 16.148 ( 4.390 -1.920 1.099) 4.916 17.136 ( -5.822 -8.351 -0.051) 10.180 18.093 ( -4.044 -11.617 -0.652) 12.318 19.278 ( 2.741 -2.728 0.103) 3.868 20.806 ( 5.042 9.691 0.350) 10.929 22.376 ( -0.496 -6.698 -0.077) 6.717 22.971 ( -0.931 10.465 0.157) 10.508 ======================= Grid point 438 (197/267) ======================= q-point: (-0.36 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.199 ( 0.296 0.467 -0.771) 0.949 2.716 ( 2.113 -2.053 5.861) 6.560 2.923 ( 0.862 5.124 0.046) 5.196 3.227 ( -3.932 -0.579 -2.074) 4.483 3.756 ( 5.618 -0.990 1.685) 5.948 3.934 ( -2.005 2.438 1.598) 3.538 4.088 ( 9.360 4.644 -9.732) 14.279 4.262 ( -3.374 0.184 -0.276) 3.390 4.886 ( 1.287 -1.949 5.413) 5.896 5.250 ( -0.904 -0.846 -6.019) 6.145 5.582 ( -2.350 4.762 -3.516) 6.369 5.794 ( 3.314 -2.025 1.046) 4.022 5.986 ( -5.506 -4.493 -1.552) 7.274 6.458 ( -4.126 0.646 1.450) 4.420 6.579 ( 4.478 -2.181 2.666) 5.649 6.902 ( -0.179 11.039 1.193) 11.105 7.251 ( -6.208 -4.267 2.625) 7.977 7.880 ( -12.697 1.616 -0.829) 12.826 9.142 ( 10.633 2.586 -0.454) 10.952 9.580 ( 5.199 1.004 -0.806) 5.356 9.840 ( -1.447 -13.153 0.311) 13.236 10.092 ( 3.111 2.854 -0.135) 4.224 10.280 ( -5.604 20.160 0.677) 20.935 10.978 ( 9.671 -26.154 0.664) 27.892 11.795 ( -7.955 2.049 -0.355) 8.223 12.603 ( 5.308 1.565 0.501) 5.556 13.214 ( -6.335 -2.827 0.055) 6.937 13.574 ( 1.739 5.266 -0.012) 5.546 15.864 ( -0.160 -1.814 0.063) 1.822 16.186 ( 1.172 0.537 1.075) 1.679 17.285 ( -0.376 -9.419 0.036) 9.426 18.247 ( -0.361 -7.024 -1.394) 7.170 19.325 ( 3.320 0.336 2.866) 4.399 20.663 ( 1.112 8.088 -1.676) 8.334 22.465 ( 0.634 -2.326 -0.198) 2.419 22.777 ( -4.666 7.312 0.806) 8.711 ======================= Grid point 439 (198/267) ======================= q-point: (-0.29 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.169 ( 1.296 3.565 0.188) 3.798 2.734 ( 1.691 4.117 1.752) 4.783 2.849 ( 0.618 3.014 5.599) 6.389 3.178 ( -3.503 3.159 -4.383) 6.438 3.712 ( 1.709 9.061 2.057) 9.448 3.884 ( 1.629 1.414 1.531) 2.645 4.048 ( 6.865 3.507 -9.258) 12.047 4.189 ( -6.130 4.125 -0.560) 7.410 4.953 ( 2.385 -2.077 5.972) 6.757 5.209 ( -0.105 4.028 -3.791) 5.532 5.439 ( -3.354 6.376 -5.991) 9.370 5.814 ( 2.886 2.129 -0.494) 3.620 6.032 ( -5.473 -4.196 -0.717) 6.933 6.375 ( -4.491 6.493 0.154) 7.896 6.599 ( 0.706 11.384 3.502) 11.931 6.694 ( 4.880 1.904 0.931) 5.321 7.255 ( -7.158 -0.046 2.877) 7.715 7.829 ( -7.869 -3.882 -0.490) 8.788 9.090 ( 9.346 13.198 -0.899) 16.197 9.421 ( 1.165 11.193 -0.360) 11.259 9.604 ( -3.978 29.358 0.606) 29.632 10.179 ( 6.602 -19.151 0.210) 20.258 10.407 ( 1.252 -14.377 0.142) 14.432 11.419 ( 0.698 10.575 0.663) 10.618 11.682 ( -0.916 -19.110 -0.049) 19.132 12.469 ( 2.295 16.396 0.357) 16.559 13.224 ( -3.766 -2.636 0.585) 4.633 13.504 ( -0.249 2.437 -0.098) 2.452 15.959 ( 0.203 -8.508 0.250) 8.514 16.168 ( 1.131 2.091 0.384) 2.409 17.457 ( 3.787 -7.479 0.364) 8.391 18.335 ( 0.355 -2.712 -3.253) 4.250 19.327 ( 4.991 3.868 6.253) 8.887 20.515 ( -3.719 6.483 -3.998) 8.476 22.424 ( 3.694 8.515 1.226) 9.362 22.700 ( -8.261 -4.270 0.276) 9.303 ======================= Grid point 440 (199/267) ======================= q-point: (-0.21 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.074 ( 1.796 8.352 0.820) 8.582 2.615 ( -1.346 8.810 2.655) 9.300 2.779 ( 3.788 10.386 2.463) 11.326 3.035 ( -3.349 6.928 -2.865) 8.211 3.558 ( -0.521 7.280 1.215) 7.399 3.849 ( 5.875 7.483 -1.168) 9.585 4.023 ( 1.936 3.342 -1.504) 4.145 4.049 ( -7.491 1.143 -3.352) 8.286 4.978 ( -0.369 4.599 3.557) 5.825 5.113 ( 2.849 3.509 0.981) 4.625 5.297 ( -2.934 4.875 -6.205) 8.419 5.765 ( 1.722 4.374 -1.850) 5.051 6.011 ( -5.844 7.270 -1.323) 9.421 6.132 ( -0.896 10.278 -1.088) 10.374 6.409 ( -2.040 6.547 3.205) 7.569 6.804 ( 13.114 -2.859 1.555) 13.512 7.144 ( -11.114 5.491 2.352) 12.617 7.833 ( -3.994 1.600 -0.064) 4.303 8.743 ( 3.421 27.337 -0.574) 27.556 9.131 ( -1.107 17.737 0.390) 17.775 9.319 ( 2.576 3.057 -0.485) 4.026 10.548 ( 11.670 -7.243 -0.068) 13.735 10.668 ( -0.721 -14.170 0.574) 14.200 10.902 ( -9.419 26.918 0.509) 28.523 12.029 ( 1.610 23.670 0.159) 23.725 12.238 ( 1.891 -23.371 -0.005) 23.448 13.269 ( -0.893 -4.056 0.762) 4.223 13.492 ( -1.500 -1.836 -0.075) 2.372 16.116 ( 2.022 1.841 0.312) 2.752 16.192 ( -0.051 -13.156 -0.905) 13.187 17.613 ( 5.920 -5.387 0.946) 8.059 18.317 ( -3.383 3.248 -5.747) 7.418 19.288 ( 8.620 7.318 9.302) 14.642 20.334 ( -8.985 7.482 -6.825) 13.538 22.286 ( 4.099 8.458 3.031) 9.875 22.753 ( -5.865 -5.819 -0.192) 8.264 ======================= Grid point 441 (200/267) ======================= q-point: (-0.14 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.887 ( 1.334 13.299 1.200) 13.419 2.343 ( -6.287 20.532 10.317) 23.823 2.572 ( 6.957 11.591 -9.385) 16.458 2.889 ( -1.355 8.739 -0.448) 8.855 3.425 ( -0.142 8.021 -0.515) 8.039 3.663 ( 1.765 13.105 0.608) 13.237 3.970 ( -4.059 -0.271 2.972) 5.038 4.048 ( 1.020 -0.784 -3.968) 4.172 4.810 ( -0.352 10.363 0.799) 10.399 5.129 ( 1.071 0.596 1.831) 2.203 5.184 ( 0.653 4.934 -2.493) 5.566 5.645 ( 0.728 17.924 0.169) 17.940 5.703 ( -1.235 6.675 -4.166) 7.965 6.070 ( -0.862 1.348 -1.756) 2.376 6.310 ( -1.125 3.860 2.917) 4.967 6.859 ( 5.342 15.268 2.559) 16.377 7.016 ( -3.560 -7.105 -0.492) 7.962 7.601 ( -0.983 23.546 0.466) 23.572 8.211 ( 0.264 29.682 -0.055) 29.683 8.947 ( -0.514 2.626 0.505) 2.723 9.302 ( 1.431 0.920 -1.016) 1.982 10.169 ( -0.592 29.993 0.964) 30.015 10.723 ( -0.346 7.554 0.041) 7.562 11.004 ( 0.161 -18.191 0.416) 18.196 11.577 ( 0.159 16.953 -0.011) 16.954 12.694 ( 0.008 -21.711 -0.733) 21.723 13.367 ( 0.874 -6.572 0.360) 6.640 13.540 ( -0.379 -3.927 0.065) 3.945 16.034 ( 1.605 8.065 -4.004) 9.146 16.492 ( -1.546 -17.869 1.091) 17.969 17.743 ( 3.491 -4.391 1.426) 5.788 18.104 ( -8.431 14.297 -5.454) 17.471 19.228 ( 10.289 9.303 7.403) 15.722 20.057 ( -8.938 13.519 -7.625) 17.911 22.222 ( 3.422 1.699 3.603) 5.252 22.808 ( -0.509 -2.633 -0.076) 2.683 ======================= Grid point 442 (201/267) ======================= q-point: (-0.07 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.630 ( 0.915 14.947 2.124) 15.125 1.894 ( -7.513 22.708 11.864) 26.700 2.421 ( 7.546 8.718 -11.415) 16.225 2.619 ( 1.288 20.887 -2.957) 21.135 3.245 ( 1.988 12.174 6.562) 13.972 3.470 ( -0.702 7.610 -4.124) 8.684 3.959 ( -2.224 1.056 3.835) 4.557 4.043 ( 1.182 1.007 -2.029) 2.555 4.648 ( 1.769 7.564 0.338) 7.776 5.014 ( -2.426 10.498 -0.748) 10.800 5.118 ( 3.406 8.219 -1.140) 8.969 5.315 ( 3.854 15.192 -0.367) 15.677 5.632 ( -5.125 0.182 1.308) 5.293 6.024 ( 1.360 3.470 -1.082) 3.881 6.261 ( 1.544 2.349 2.040) 3.473 6.487 ( -9.142 24.322 -1.812) 26.046 7.018 ( 1.934 28.407 2.229) 28.560 7.085 ( 10.081 13.382 -1.539) 16.825 7.779 ( -1.547 10.770 0.248) 10.883 8.969 ( -2.344 -4.155 1.060) 4.886 9.263 ( -7.686 2.150 -1.747) 8.171 9.779 ( 0.980 12.383 1.573) 12.521 10.377 ( 8.560 26.838 0.263) 28.172 11.315 ( -5.376 -17.069 0.148) 17.896 11.508 ( -0.247 -5.789 0.043) 5.795 13.017 ( -2.207 -14.496 -1.517) 14.741 13.522 ( -0.540 -9.566 -1.101) 9.645 13.631 ( 5.003 -4.483 0.631) 6.747 15.718 ( -9.536 26.995 -10.524) 30.503 16.783 ( -3.390 -13.606 2.274) 14.205 17.626 ( -18.354 16.582 -4.488) 25.139 17.874 ( 12.690 3.056 5.752) 14.263 19.019 ( -12.989 17.442 -6.045) 22.572 19.777 ( 20.566 15.381 3.838) 25.967 22.287 ( -6.941 -8.281 1.092) 10.861 22.861 ( 11.073 -0.374 -0.315) 11.084 ======================= Grid point 446 (202/267) ======================= q-point: ( 0.21 0.21 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( 0.536 -0.000 -13.150) 13.161 1.364 ( 13.391 -0.000 -3.657) 13.881 1.762 ( 19.659 -0.000 8.434) 21.391 2.314 ( 4.291 -0.000 3.067) 5.274 3.048 ( 11.307 -0.000 2.997) 11.698 3.152 ( -8.524 0.000 2.005) 8.756 3.446 ( -0.535 0.000 -7.289) 7.309 3.589 ( -5.940 0.000 -2.623) 6.493 3.868 ( 4.701 -0.000 0.282) 4.710 4.314 ( 2.900 -0.000 -0.212) 2.907 4.468 ( 3.944 -0.000 -2.237) 4.535 5.201 ( -0.958 0.000 3.248) 3.386 5.574 ( 1.512 -0.000 -0.008) 1.512 5.585 ( -3.183 0.000 -0.188) 3.188 5.861 ( -9.213 0.000 2.503) 9.547 6.162 ( 1.108 -0.000 2.397) 2.641 6.619 ( -1.933 0.000 2.052) 2.819 6.984 ( 10.871 -0.000 -2.405) 11.134 7.284 ( -0.184 0.000 0.028) 0.186 9.110 ( 9.832 -0.000 -3.945) 10.594 9.208 ( 0.120 -0.000 2.616) 2.619 9.550 ( 0.511 -0.000 -1.921) 1.987 10.788 ( -2.814 0.000 0.220) 2.822 11.211 ( 5.536 -0.000 1.337) 5.695 11.566 ( -17.453 0.000 0.069) 17.453 11.970 ( 14.165 -0.000 0.916) 14.195 13.411 ( -8.726 0.000 0.817) 8.764 14.140 ( 11.171 -0.000 0.446) 11.180 14.235 ( 0.489 -0.000 -0.085) 0.496 16.032 ( -42.352 0.000 -6.094) 42.788 16.860 ( -0.148 0.000 0.048) 0.155 17.970 ( 0.040 -0.000 -0.059) 0.072 18.137 ( 18.615 -0.000 4.414) 19.131 21.482 ( 3.490 -0.000 27.660) 27.879 21.598 ( 4.005 -0.000 -2.081) 4.513 23.478 ( 6.941 -0.000 -16.190) 17.615 ======================= Grid point 447 (203/267) ======================= q-point: ( 0.29 0.21 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.336 ( 10.262 -3.847 -9.108) 14.249 1.652 ( 14.345 -15.984 -0.086) 21.478 2.001 ( 15.243 -10.905 2.384) 18.893 2.405 ( 4.517 -4.768 1.594) 6.758 3.139 ( -5.083 -2.533 9.144) 10.764 3.199 ( 6.598 -5.938 -6.888) 11.235 3.550 ( -8.909 -9.699 3.503) 13.627 3.755 ( -3.596 -26.200 -7.564) 27.506 4.214 ( 0.717 -22.233 -0.061) 22.245 4.337 ( 4.223 -6.717 0.136) 7.936 4.571 ( 4.107 -8.902 0.641) 9.825 5.188 ( -4.717 -0.331 2.118) 5.181 5.516 ( -5.185 -0.540 -6.548) 8.370 5.692 ( -2.042 -11.632 -2.068) 11.989 5.883 ( 3.679 -2.555 9.951) 10.913 6.200 ( 6.058 -2.079 2.019) 6.716 6.560 ( 1.483 4.521 0.162) 4.761 7.039 ( 11.096 -1.070 -2.208) 11.364 7.413 ( -1.926 -9.634 -0.189) 9.827 9.066 ( 6.761 6.753 -1.342) 9.650 9.196 ( 4.571 3.559 1.518) 5.988 9.575 ( -0.647 -3.302 -1.551) 3.705 10.901 ( 10.676 -7.937 -0.035) 13.303 11.125 ( -16.860 7.240 -0.106) 18.349 11.414 ( -14.173 3.394 0.068) 14.573 12.455 ( 4.244 -38.282 1.081) 38.532 13.274 ( -8.750 8.338 1.113) 12.137 13.970 ( 0.123 14.675 0.314) 14.679 14.290 ( 9.460 1.658 -0.223) 9.607 16.042 ( -39.079 -30.641 -4.596) 49.871 16.855 ( -0.264 0.521 0.216) 0.623 17.817 ( 0.654 13.155 2.673) 13.440 18.400 ( 13.823 -10.426 -1.318) 17.364 21.341 ( -21.408 -0.785 1.412) 21.469 21.780 ( 21.287 3.627 18.961) 28.737 23.485 ( 9.175 2.002 -11.142) 14.571 ======================= Grid point 448 (204/267) ======================= q-point: ( 0.36 0.21 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.574 ( 14.804 -11.996 -5.529) 19.840 2.022 ( 17.237 -10.666 5.094) 20.901 2.379 ( 8.210 -17.350 -6.009) 20.113 2.561 ( 3.877 -10.101 2.911) 11.205 3.147 ( -8.098 -3.119 4.919) 9.975 3.341 ( 6.052 -4.621 -3.617) 8.430 3.691 ( -8.473 -10.778 3.220) 14.083 4.187 ( -2.634 -13.637 -4.255) 14.526 4.344 ( 0.327 -13.344 -3.426) 13.781 4.666 ( 0.365 -11.124 7.481) 13.411 4.968 ( -2.241 -26.457 -2.802) 26.699 5.168 ( -7.063 -2.834 0.759) 7.648 5.528 ( 2.547 -3.812 -5.526) 7.180 5.935 ( 3.494 -7.358 6.984) 10.730 6.132 ( -4.005 -28.202 -0.679) 28.493 6.376 ( 11.598 -10.328 1.024) 15.564 6.509 ( 2.897 2.619 0.070) 3.906 7.216 ( 8.732 -11.317 -1.197) 14.344 7.584 ( 4.354 -9.851 -0.758) 10.797 8.999 ( 0.265 4.039 0.747) 4.116 9.170 ( 10.005 4.664 0.156) 11.040 9.669 ( -1.690 -8.483 -1.071) 8.715 10.778 ( -19.451 12.928 0.079) 23.356 11.073 ( 0.911 3.138 -0.678) 3.337 11.320 ( 5.780 -4.651 0.238) 7.423 12.987 ( -10.053 14.290 0.749) 17.488 13.144 ( -13.267 -28.785 -1.345) 31.723 13.864 ( -0.653 -11.730 2.090) 11.932 14.281 ( 8.977 6.196 -0.065) 10.908 16.400 ( -31.462 -33.062 -1.923) 45.680 16.841 ( -1.335 -0.526 -0.234) 1.454 17.542 ( -1.529 16.151 1.729) 16.315 18.673 ( 9.325 -10.345 -3.649) 14.398 21.263 ( -9.880 -2.213 3.029) 10.568 21.853 ( 10.444 3.017 9.781) 14.623 23.482 ( 7.508 3.470 -5.276) 9.810 ======================= Grid point 449 (205/267) ======================= q-point: ( 0.43 0.21 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.878 ( 10.834 -9.959 -4.371) 15.351 2.340 ( 14.289 -8.708 6.201) 17.846 2.660 ( 9.799 -12.394 -8.706) 18.039 2.853 ( 2.694 -12.437 4.980) 13.665 3.193 ( -7.892 -8.801 3.516) 12.334 3.444 ( 2.542 -3.537 0.428) 4.377 3.808 ( -7.677 -8.743 -0.652) 11.653 4.244 ( 3.620 -0.021 -5.819) 6.853 4.700 ( -4.057 -19.405 0.343) 19.827 4.833 ( 1.620 -6.351 7.644) 10.069 5.127 ( -2.569 -1.520 -2.195) 3.706 5.348 ( -12.353 -17.436 -5.664) 22.106 5.695 ( 9.532 -9.572 -1.261) 13.567 6.058 ( 1.295 -4.108 5.504) 6.989 6.474 ( 2.711 1.049 -0.146) 2.911 6.590 ( 2.081 -16.752 -0.473) 16.887 6.743 ( -2.866 -18.541 0.917) 18.784 7.657 ( 12.068 -29.385 -0.605) 31.772 7.888 ( 10.583 -16.724 -0.876) 19.811 8.930 ( -1.456 1.223 0.641) 2.007 9.173 ( 9.239 2.882 -0.024) 9.678 9.840 ( -3.499 -9.850 -0.703) 10.477 10.431 ( -19.170 6.328 0.425) 20.192 10.904 ( -12.668 4.178 -0.992) 13.376 11.592 ( 23.885 -7.998 0.082) 25.188 12.606 ( -8.209 19.443 0.959) 21.127 13.234 ( -12.371 -0.690 -2.183) 12.581 14.164 ( 5.556 6.831 -0.383) 8.814 14.480 ( -4.861 -41.001 2.465) 41.361 16.576 ( -8.395 0.768 2.032) 8.671 16.997 ( -16.652 -24.968 -2.710) 30.133 17.249 ( -2.783 12.273 -0.254) 12.587 18.901 ( 5.851 -9.158 -3.117) 11.306 21.248 ( 0.604 2.394 4.257) 4.922 21.919 ( 3.509 -4.013 3.023) 6.128 23.433 ( 3.909 5.631 -2.039) 7.152 ======================= Grid point 450 (206/267) ======================= q-point: ( 0.50 0.21 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.061 ( 4.610 -5.190 -3.404) 7.731 2.533 ( 7.154 -3.221 5.171) 9.397 2.958 ( 7.901 -5.073 -4.652) 10.479 3.041 ( 4.904 -12.537 -0.505) 13.472 3.376 ( -3.571 -11.604 6.852) 13.941 3.520 ( 1.434 -4.512 1.760) 5.051 3.939 ( -5.223 -11.378 -2.981) 12.870 4.255 ( 4.545 0.567 -7.836) 9.076 4.832 ( -2.982 -1.593 5.380) 6.354 5.082 ( 1.596 -9.108 6.322) 11.201 5.163 ( -2.327 -9.867 -5.726) 11.643 5.520 ( -6.256 -11.031 -5.424) 13.793 5.895 ( 0.895 -5.126 -1.038) 5.306 6.183 ( 5.471 -7.301 2.912) 9.577 6.464 ( 1.241 1.108 1.321) 2.124 6.808 ( -11.554 -10.285 0.466) 15.475 6.999 ( 6.850 -9.927 1.424) 12.144 8.087 ( 4.447 -4.603 -1.265) 6.524 8.435 ( 10.499 -31.963 -0.029) 33.643 9.028 ( 3.318 -11.249 -0.378) 11.734 9.212 ( 7.049 -1.490 0.231) 7.208 9.828 ( -10.357 3.108 -0.376) 10.820 10.397 ( -4.321 -7.941 0.767) 9.073 10.842 ( -16.977 -12.531 -1.383) 21.146 11.892 ( 19.787 -1.987 0.157) 19.887 12.189 ( -4.678 15.669 0.774) 16.371 13.143 ( -10.546 -0.058 -1.420) 10.642 14.028 ( 4.835 10.627 -0.065) 11.676 15.201 ( -4.031 -36.819 1.043) 37.053 16.412 ( 1.475 11.589 1.046) 11.729 17.019 ( -11.098 3.391 -0.439) 11.613 17.405 ( -9.949 -24.924 -1.707) 26.890 19.084 ( 4.069 -7.374 -1.798) 8.612 21.179 ( 4.993 8.145 3.238) 10.087 22.064 ( 0.597 -8.927 0.481) 8.960 23.324 ( 1.316 7.836 -0.642) 7.972 ======================= Grid point 451 (207/267) ======================= q-point: ( 0.57 0.21 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.144 ( 0.788 -2.826 -2.544) 3.883 2.629 ( 4.486 -1.913 6.431) 8.071 3.009 ( 0.973 -1.150 -3.014) 3.370 3.220 ( 1.344 -0.903 -1.365) 2.117 3.561 ( 1.572 -8.739 6.711) 11.130 3.709 ( 4.692 -11.859 -1.452) 12.836 4.109 ( -1.828 -9.045 -0.652) 9.251 4.249 ( 4.428 1.674 -9.644) 10.743 4.840 ( -1.366 -0.559 5.222) 5.427 5.144 ( -1.798 -3.049 -3.748) 5.155 5.428 ( 1.361 -13.378 3.807) 13.976 5.645 ( -1.576 -6.493 -3.560) 7.571 5.901 ( -7.036 -0.600 -3.877) 8.056 6.389 ( 6.687 -7.036 3.646) 10.369 6.462 ( 1.290 0.069 0.517) 1.392 6.887 ( -10.826 -8.443 1.893) 13.859 7.175 ( 5.328 -2.875 1.426) 6.219 8.056 ( -5.060 4.873 -0.722) 7.062 8.972 ( 8.885 -16.736 -0.636) 18.960 9.249 ( 2.584 -9.564 0.204) 9.909 9.346 ( -0.857 -8.753 -0.505) 8.810 9.839 ( 1.333 -11.522 -0.263) 11.602 10.456 ( 2.991 0.197 0.260) 3.009 11.082 ( -16.189 -17.839 -0.427) 24.093 11.630 ( -0.789 19.033 0.550) 19.057 12.321 ( 11.825 -11.959 0.141) 16.819 13.092 ( -8.956 -2.537 -0.765) 9.340 13.861 ( 3.277 10.330 -0.035) 10.838 15.703 ( -3.289 -18.356 0.299) 18.651 16.252 ( 6.875 7.775 0.510) 10.392 16.943 ( -10.446 -4.654 -0.178) 11.438 17.763 ( -5.719 -19.963 -0.932) 20.787 19.224 ( 3.192 -5.234 -0.446) 6.147 21.043 ( 4.780 10.841 1.454) 11.937 22.231 ( -0.327 -8.546 -0.162) 8.554 23.162 ( -0.114 10.074 0.030) 10.074 ======================= Grid point 452 (208/267) ======================= q-point: ( 0.64 0.21 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.181 ( -0.239 -1.733 -1.614) 2.381 2.712 ( 3.978 -2.134 8.157) 9.323 3.009 ( 1.468 2.000 -3.302) 4.130 3.182 ( -4.570 1.042 -0.951) 4.783 3.726 ( 2.897 -5.698 4.618) 7.885 3.911 ( 2.178 -5.417 -2.092) 6.202 4.207 ( 7.033 3.168 -10.099) 12.707 4.221 ( -2.581 -2.867 0.761) 3.932 4.873 ( 1.307 -1.944 5.377) 5.865 5.180 ( -2.042 -3.343 -5.545) 6.789 5.615 ( 1.123 -1.957 0.630) 2.342 5.731 ( -0.118 -5.838 1.004) 5.925 5.862 ( -6.230 -2.949 -5.034) 8.535 6.443 ( -2.412 0.072 3.565) 4.305 6.560 ( 5.934 -3.971 0.070) 7.140 6.971 ( -4.586 -4.824 2.061) 6.968 7.195 ( 0.536 2.178 1.963) 2.981 7.878 ( -9.065 7.134 -0.427) 11.544 9.197 ( 7.314 -3.860 -0.652) 8.296 9.469 ( 2.825 -11.875 -0.364) 12.211 9.551 ( -3.117 -15.284 -0.130) 15.599 10.077 ( 2.280 -5.376 -0.357) 5.851 10.565 ( 9.420 -9.054 0.326) 13.069 10.849 ( -8.603 22.487 0.861) 24.092 11.636 ( -5.022 -12.123 -0.310) 13.125 12.586 ( 7.335 -7.604 0.346) 10.571 13.097 ( -6.994 -4.212 -0.247) 8.168 13.709 ( 1.894 7.947 -0.111) 8.170 15.839 ( -2.085 -2.078 0.001) 2.943 16.223 ( 4.373 2.170 0.972) 4.978 17.053 ( -4.931 -12.632 -0.191) 13.562 18.045 ( -2.015 -13.815 -0.784) 13.983 19.323 ( 2.703 -3.111 1.071) 4.258 20.863 ( 2.590 11.519 -0.250) 11.810 22.367 ( -0.588 -6.700 -0.298) 6.732 22.954 ( -1.159 11.811 0.488) 11.877 ======================= Grid point 453 (209/267) ======================= q-point: (-0.29 0.21 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.200 ( 0.450 -0.434 -0.805) 1.019 2.791 ( 3.602 -0.582 7.355) 8.211 2.939 ( 1.222 5.033 1.176) 5.311 3.145 ( -4.995 -1.071 -4.979) 7.134 3.830 ( 2.774 -1.604 3.177) 4.513 3.910 ( -2.394 3.832 1.579) 4.787 4.132 ( -0.817 3.774 -7.927) 8.817 4.241 ( 3.876 2.525 -2.995) 5.511 4.947 ( 3.142 -2.479 6.073) 7.273 5.204 ( -1.283 -1.851 -6.406) 6.790 5.539 ( -1.369 6.873 -3.073) 7.653 5.837 ( 1.064 -2.698 1.107) 3.104 5.903 ( -2.921 -5.278 -2.208) 6.424 6.418 ( -2.272 1.694 2.553) 3.814 6.655 ( 3.474 -3.097 0.606) 4.693 6.896 ( -0.905 11.898 1.245) 11.997 7.195 ( -2.477 -2.730 2.659) 4.545 7.736 ( -5.843 0.779 0.135) 5.897 9.258 ( 4.692 1.687 -0.929) 5.072 9.629 ( 1.689 4.790 -0.575) 5.111 9.825 ( -0.460 -19.647 0.227) 19.653 10.149 ( 4.654 5.699 -0.461) 7.372 10.202 ( -5.355 18.397 0.987) 19.186 11.093 ( 4.682 -28.781 0.461) 29.163 11.700 ( -4.038 3.577 0.046) 5.395 12.669 ( 2.759 3.478 0.301) 4.450 13.135 ( -3.597 -4.098 0.268) 5.459 13.592 ( 0.759 6.000 -0.166) 6.050 15.861 ( -0.211 -2.671 0.094) 2.681 16.204 ( 0.513 1.742 1.037) 2.092 17.278 ( -0.465 -12.665 0.078) 12.674 18.235 ( -0.453 -7.832 -1.308) 7.954 19.385 ( 2.576 -1.055 2.796) 3.945 20.662 ( -0.161 10.886 -1.790) 11.033 22.477 ( 0.774 -5.469 -0.083) 5.524 22.723 ( -2.521 11.529 0.745) 11.825 ======================= Grid point 454 (210/267) ======================= q-point: (-0.21 0.21 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.187 ( 0.990 2.825 -0.464) 3.029 2.753 ( 0.132 6.427 0.912) 6.493 2.919 ( 4.591 1.827 8.419) 9.762 3.093 ( -4.392 2.418 -6.893) 8.524 3.720 ( -2.802 10.129 3.813) 11.180 3.910 ( 1.020 -1.380 1.947) 2.595 4.030 ( -6.209 3.336 -4.008) 8.108 4.170 ( 6.162 7.354 -6.004) 11.318 5.014 ( 1.347 -0.788 6.022) 6.221 5.200 ( 1.858 0.930 -5.073) 5.482 5.373 ( -1.652 8.347 -4.420) 9.588 5.842 ( 0.288 2.399 -0.579) 2.484 5.974 ( -0.108 -3.634 -0.886) 3.742 6.337 ( -1.301 7.183 1.394) 7.431 6.610 ( 0.129 15.402 2.206) 15.560 6.752 ( 0.361 -5.010 0.116) 5.025 7.207 ( 0.330 2.119 2.414) 3.229 7.761 ( -1.207 -4.742 0.697) 4.942 9.161 ( 0.030 13.778 -0.924) 13.809 9.430 ( 0.244 10.250 -0.471) 10.264 9.575 ( 0.411 29.687 0.302) 29.692 10.232 ( -0.030 -21.833 0.166) 21.834 10.417 ( 0.111 -14.749 -0.006) 14.750 11.421 ( -0.003 24.042 0.581) 24.049 11.680 ( -0.173 -30.933 0.200) 30.934 12.488 ( 0.089 17.294 0.146) 17.295 13.195 ( -0.201 -3.727 0.574) 3.777 13.503 ( 0.133 3.359 -0.174) 3.367 15.960 ( -0.318 -8.480 0.462) 8.498 16.177 ( -0.110 1.660 0.351) 1.700 17.487 ( -0.069 -9.797 0.429) 9.806 18.314 ( -1.256 -1.485 -1.924) 2.736 19.412 ( 2.611 1.054 3.885) 4.798 20.455 ( -1.673 10.153 -2.814) 10.668 22.493 ( 2.207 10.903 1.271) 11.196 22.605 ( -1.827 -6.744 -0.183) 6.990 ======================= Grid point 455 (211/267) ======================= q-point: (-0.14 0.21 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.092 ( 0.326 8.084 -0.625) 8.115 2.603 ( -2.000 10.279 3.042) 10.905 2.846 ( 3.637 12.803 -1.831) 13.435 2.989 ( -0.620 3.581 0.571) 3.679 3.543 ( -2.620 6.901 2.025) 7.655 3.869 ( -6.929 8.095 -2.831) 11.025 3.939 ( 0.621 -0.571 2.808) 2.932 4.087 ( 5.964 4.291 -3.904) 8.320 4.979 ( -1.334 6.372 3.120) 7.220 5.191 ( 6.175 3.215 1.648) 7.154 5.227 ( -2.091 3.036 -7.157) 8.051 5.765 ( -0.722 4.947 -1.750) 5.297 6.005 ( 5.774 6.313 -0.768) 8.590 6.119 ( -0.510 11.209 0.044) 11.221 6.407 ( -0.292 7.101 3.300) 7.835 6.826 ( -11.016 -4.132 -0.363) 11.771 7.151 ( 11.386 6.429 1.774) 13.195 7.817 ( 1.631 1.599 1.202) 2.581 8.739 ( -3.565 27.046 -0.271) 27.282 9.134 ( 1.310 18.076 0.143) 18.124 9.329 ( -0.874 2.796 -1.255) 3.187 10.543 ( -11.494 -7.535 0.269) 13.746 10.678 ( 0.731 -14.535 -0.222) 14.555 10.894 ( 8.367 27.707 1.092) 28.964 12.035 ( -0.731 24.212 -0.289) 24.225 12.236 ( -2.145 -23.840 0.097) 23.936 13.275 ( 1.369 -4.421 0.288) 4.638 13.491 ( 1.372 -1.689 0.013) 2.176 16.123 ( -1.317 2.600 -0.257) 2.926 16.177 ( -1.512 -13.635 0.277) 13.721 17.623 ( -5.281 -6.226 0.149) 8.165 18.256 ( -2.101 5.886 -0.489) 6.269 19.389 ( 0.216 4.098 1.296) 4.303 20.259 ( 2.886 10.411 -1.289) 10.880 22.322 ( -1.339 7.516 0.143) 7.635 22.742 ( 5.149 -6.061 0.609) 7.976 ======================= Grid point 456 (212/267) ======================= q-point: (-0.07 0.21 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.894 ( -0.258 12.731 -0.727) 12.755 2.296 ( -5.303 21.454 8.377) 23.634 2.625 ( 6.000 10.852 -10.212) 16.065 2.895 ( 1.824 9.105 1.738) 9.447 3.419 ( -0.415 6.355 0.012) 6.368 3.640 ( -4.492 10.644 -1.104) 11.606 3.966 ( 2.184 -0.308 4.328) 4.857 4.069 ( 2.348 1.295 -1.180) 2.930 4.821 ( 1.087 9.383 0.794) 9.479 5.125 ( -2.356 4.616 0.999) 5.278 5.212 ( 4.660 1.660 -4.300) 6.555 5.658 ( -2.209 5.069 -1.312) 5.683 5.720 ( 8.516 21.342 -0.152) 22.979 6.081 ( 2.567 1.097 0.692) 2.876 6.323 ( 0.505 3.393 3.663) 5.018 6.653 ( -18.094 9.126 -2.507) 20.419 7.224 ( 16.809 -0.352 0.932) 16.839 7.642 ( 5.787 21.969 1.482) 22.766 8.170 ( -5.733 29.911 -0.501) 30.460 8.940 ( -0.614 3.824 0.682) 3.933 9.255 ( -6.227 3.168 -1.844) 7.226 10.144 ( -2.359 25.396 0.877) 25.521 10.786 ( 5.616 7.073 0.887) 9.075 10.963 ( -3.594 -15.733 -0.168) 16.139 11.572 ( -1.111 17.259 -0.277) 17.297 12.653 ( -4.995 -21.581 -0.389) 22.155 13.378 ( 0.526 -6.009 -0.825) 6.088 13.582 ( 5.717 -5.157 0.470) 7.713 15.960 ( -9.245 11.949 -4.219) 15.686 16.468 ( -2.622 -17.332 2.618) 17.724 17.594 ( -16.675 1.487 -1.991) 16.859 18.108 ( 2.041 8.973 6.108) 11.045 19.210 ( -8.339 12.830 -8.515) 17.511 20.163 ( 19.813 7.931 6.525) 22.316 22.198 ( -5.783 3.130 -2.030) 6.882 22.899 ( 11.160 -4.320 0.259) 11.970 ======================= Grid point 461 (213/267) ======================= q-point: ( 0.29 0.29 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.386 ( 16.685 -0.000 -8.969) 18.943 1.540 ( 12.727 -0.000 -4.069) 13.362 2.066 ( 17.379 -0.000 4.950) 18.070 2.396 ( 4.610 -0.000 3.912) 6.046 3.043 ( -7.551 0.000 2.427) 7.932 3.150 ( -1.180 0.000 8.740) 8.820 3.412 ( 1.624 -0.000 -10.947) 11.067 3.487 ( -5.918 0.000 -3.618) 6.937 3.930 ( 3.418 -0.000 0.953) 3.549 4.351 ( 2.358 -0.000 -0.612) 2.436 4.528 ( 2.809 -0.000 3.985) 4.875 5.154 ( -5.582 0.000 2.112) 5.968 5.383 ( -13.740 0.000 -14.096) 19.684 5.598 ( 1.587 -0.000 0.035) 1.587 5.963 ( 9.451 -0.000 13.218) 16.249 6.234 ( 8.159 -0.000 0.879) 8.206 6.607 ( -0.890 0.000 1.119) 1.430 7.155 ( 14.976 -0.000 -3.831) 15.458 7.281 ( -0.212 0.000 0.037) 0.216 9.136 ( -3.669 0.000 -0.154) 3.672 9.312 ( 11.718 -0.000 -0.799) 11.745 9.537 ( -1.376 0.000 -1.030) 1.719 10.747 ( -2.830 0.000 0.269) 2.842 11.073 ( -23.807 0.000 -0.006) 23.807 11.380 ( -4.813 0.000 -0.172) 4.816 12.253 ( 21.534 -0.000 2.500) 21.679 13.297 ( -7.263 0.000 1.347) 7.387 14.242 ( 0.483 -0.000 -0.101) 0.493 14.282 ( 7.431 -0.000 0.507) 7.449 15.399 ( -39.648 0.000 -5.969) 40.095 16.858 ( -0.152 0.000 0.046) 0.159 17.970 ( 0.042 -0.000 -0.061) 0.074 18.389 ( 13.810 -0.000 2.054) 13.962 21.153 ( -21.257 0.000 -2.415) 21.394 21.995 ( 11.342 -0.000 20.051) 23.036 23.551 ( 9.744 -0.000 -8.485) 12.921 ======================= Grid point 462 (214/267) ======================= q-point: ( 0.36 0.29 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.543 ( 20.838 -4.133 -5.378) 21.914 1.841 ( 12.155 -19.760 -2.549) 23.339 2.226 ( 13.465 -4.521 2.214) 14.375 2.481 ( 4.374 -4.024 2.926) 6.625 3.066 ( -6.926 -1.872 5.080) 8.792 3.264 ( 2.420 -10.019 -0.716) 10.332 3.423 ( -9.490 -8.056 1.821) 12.581 3.673 ( -2.815 -23.113 -8.029) 24.629 4.216 ( -0.950 -19.425 1.284) 19.491 4.377 ( 1.396 -5.207 -0.867) 5.460 4.640 ( 3.016 -10.076 5.228) 11.745 5.115 ( -6.050 0.048 2.225) 6.446 5.352 ( -8.194 -10.175 -13.313) 18.652 5.656 ( -0.235 -6.472 -0.259) 6.481 6.046 ( 5.915 0.038 12.392) 13.731 6.346 ( 13.188 -4.097 -1.433) 13.884 6.575 ( 0.593 2.567 0.469) 2.676 7.194 ( 10.113 0.671 -1.703) 10.277 7.437 ( 7.385 -9.682 -1.586) 12.280 9.058 ( -5.243 3.554 -0.098) 6.334 9.348 ( 12.818 4.702 -0.446) 13.660 9.547 ( -2.326 -3.089 -0.307) 3.879 10.778 ( -25.836 5.522 0.248) 26.420 11.030 ( 3.569 -20.964 -0.340) 21.268 11.270 ( -5.321 7.909 -0.275) 9.536 12.566 ( 10.086 -16.923 1.697) 19.774 13.171 ( -6.102 8.418 1.586) 10.517 13.955 ( -2.332 14.745 0.363) 14.933 14.417 ( 7.583 0.725 -0.030) 7.617 15.483 ( -33.561 -34.304 -4.877) 48.238 16.852 ( -0.234 0.625 0.158) 0.686 17.829 ( 0.156 13.475 0.890) 13.505 18.569 ( 9.790 -7.587 -0.460) 12.395 21.068 ( -14.775 -6.123 -1.044) 16.027 22.035 ( 4.663 4.966 13.061) 14.731 23.583 ( 8.024 2.357 -4.152) 9.337 ======================= Grid point 463 (215/267) ======================= q-point: ( 0.43 0.29 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.800 ( 17.427 -7.882 -3.843) 19.509 2.277 ( 15.121 -13.851 1.203) 20.541 2.471 ( 7.156 -13.378 -4.052) 15.703 2.631 ( 3.258 -10.453 4.445) 11.817 3.043 ( -8.391 -1.840 3.662) 9.338 3.383 ( 0.900 -4.376 -2.646) 5.192 3.592 ( -5.569 -10.590 2.742) 12.275 4.116 ( -3.568 -22.345 -3.648) 22.920 4.349 ( 1.709 -6.775 -2.406) 7.390 4.649 ( -7.849 -17.631 6.898) 20.494 4.937 ( 0.700 -15.327 -3.064) 15.646 5.082 ( -4.327 -0.772 1.439) 4.625 5.567 ( 4.861 -12.897 -6.157) 15.096 5.892 ( -6.343 -19.501 -1.144) 20.538 6.158 ( 1.732 -10.592 8.540) 13.716 6.526 ( 3.372 -0.359 -1.469) 3.696 6.579 ( 10.523 -6.930 -0.224) 12.602 7.335 ( 7.082 -11.465 -0.100) 13.476 7.715 ( 15.043 -12.213 -1.956) 19.475 8.954 ( -5.796 2.916 -0.092) 6.489 9.337 ( 11.098 5.847 -0.060) 12.545 9.632 ( -2.507 -8.379 -0.087) 8.747 10.419 ( -26.888 10.079 0.322) 28.716 11.016 ( -4.902 12.780 -0.543) 13.699 11.542 ( 18.901 -19.605 -0.443) 27.236 12.821 ( -10.570 2.130 -0.750) 10.809 12.998 ( -8.478 -3.970 1.398) 9.465 13.887 ( 2.135 -11.709 2.187) 12.102 14.390 ( 5.701 6.448 -0.042) 8.607 15.966 ( -25.195 -39.131 -3.457) 46.669 16.828 ( -0.570 1.572 0.194) 1.683 17.528 ( -0.951 17.866 0.228) 17.892 18.775 ( 6.247 -8.487 -1.567) 10.654 21.145 ( -6.697 -9.514 0.970) 11.675 21.980 ( 2.412 4.914 6.552) 8.538 23.556 ( 4.481 4.899 -1.528) 6.813 ======================= Grid point 464 (216/267) ======================= q-point: ( 0.50 0.29 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.007 ( 8.381 -4.653 -3.595) 10.238 2.544 ( 10.148 -4.106 3.219) 11.411 2.793 ( 12.515 -17.747 -5.779) 22.472 2.902 ( 0.783 -8.017 4.054) 9.018 3.094 ( -7.605 -13.441 4.172) 15.997 3.464 ( -0.180 -3.897 0.174) 3.905 3.705 ( -5.198 -7.735 -1.211) 9.398 4.260 ( 2.093 -1.333 -5.438) 5.978 4.664 ( -1.330 -18.470 1.930) 18.618 4.876 ( -1.045 -10.261 8.715) 13.503 5.049 ( -7.288 -3.574 -2.722) 8.561 5.218 ( -0.758 -13.949 -6.068) 15.230 5.804 ( 5.354 -7.785 -2.161) 9.692 6.079 ( 0.261 -8.349 2.023) 8.595 6.462 ( -7.109 -12.202 3.162) 14.472 6.521 ( -0.724 -2.599 -0.123) 2.701 6.851 ( 8.578 -12.087 -0.741) 14.840 7.816 ( 8.990 -33.258 -0.315) 34.453 8.048 ( 11.629 -10.497 -1.012) 15.698 8.909 ( -1.253 -3.194 -0.757) 3.513 9.309 ( 9.398 4.595 0.403) 10.469 9.784 ( -3.509 -5.303 -0.243) 6.363 10.105 ( -24.010 -2.984 0.418) 24.199 10.764 ( -6.247 8.841 -0.499) 10.837 11.963 ( 26.033 -7.892 -0.295) 27.204 12.508 ( -5.406 19.124 0.818) 19.890 13.005 ( -17.672 -4.577 -1.352) 18.305 14.233 ( 4.182 4.544 0.206) 6.179 14.462 ( -0.221 -34.020 1.907) 34.074 16.420 ( -11.838 -20.096 -1.239) 23.356 16.824 ( -6.180 -6.356 -0.836) 8.904 17.220 ( -1.217 11.566 -0.571) 11.644 18.966 ( 4.271 -8.280 -1.283) 9.404 21.259 ( -0.517 -3.473 2.417) 4.263 21.962 ( 0.880 -1.658 2.020) 2.757 23.467 ( 1.696 6.799 -0.447) 7.022 ======================= Grid point 465 (217/267) ======================= q-point: ( 0.57 0.29 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.097 ( 2.203 -2.489 -2.817) 4.357 2.652 ( 6.067 -1.498 4.241) 7.552 2.955 ( -3.312 -2.380 -0.333) 4.092 3.183 ( 11.188 -9.905 -4.372) 15.569 3.360 ( -2.594 -14.843 7.196) 16.698 3.543 ( 0.835 -6.945 0.994) 7.065 3.863 ( -3.045 -13.271 -2.877) 13.917 4.271 ( 2.210 0.070 -7.562) 7.878 4.824 ( -1.150 -2.072 5.745) 6.214 5.065 ( -3.827 -3.392 -4.058) 6.528 5.168 ( 2.040 -16.712 6.796) 18.156 5.443 ( -0.872 -12.357 -6.257) 13.878 5.852 ( -4.246 0.590 -3.087) 5.283 6.317 ( 10.227 -9.888 2.206) 14.396 6.483 ( 0.486 0.738 1.267) 1.545 6.625 ( -12.076 -9.610 2.144) 15.581 7.106 ( 4.936 -9.171 0.214) 10.417 8.124 ( 1.454 3.482 -0.489) 3.805 8.555 ( 5.652 -33.274 -0.492) 33.754 9.072 ( 2.617 -10.984 -0.963) 11.333 9.323 ( 7.590 1.782 0.360) 7.804 9.688 ( -8.335 -0.859 -0.313) 8.385 10.338 ( -4.055 -22.779 0.527) 23.143 10.633 ( -9.766 -3.247 -0.614) 10.310 12.061 ( 0.619 23.457 0.665) 23.475 12.258 ( 15.230 -5.019 0.136) 16.036 12.958 ( -13.120 -3.874 -1.052) 13.721 14.083 ( 2.561 10.948 0.036) 11.244 15.172 ( -0.983 -36.188 0.795) 36.210 16.459 ( 4.359 7.028 -0.264) 8.275 16.832 ( -12.471 0.498 -0.309) 12.485 17.312 ( -2.905 -21.416 -1.091) 21.639 19.133 ( 3.099 -7.011 -0.782) 7.705 21.241 ( 1.948 6.245 2.278) 6.927 22.067 ( -0.187 -8.239 0.029) 8.241 23.333 ( 0.340 8.432 -0.005) 8.439 ======================= Grid point 466 (218/267) ======================= q-point: ( 0.64 0.29 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.139 ( 0.043 -2.046 -1.966) 2.838 2.730 ( 4.919 -1.581 7.027) 8.722 2.975 ( -3.030 -2.661 -3.855) 5.579 3.224 ( -0.539 3.962 0.185) 4.003 3.620 ( 2.284 -9.281 5.592) 11.074 3.755 ( 2.630 -12.177 -3.284) 12.884 4.087 ( -1.117 -11.001 0.346) 11.063 4.255 ( 1.459 1.140 -9.038) 9.225 4.856 ( 0.372 -1.545 4.980) 5.228 5.097 ( -1.354 -3.104 -4.258) 5.441 5.475 ( 1.822 -13.130 5.551) 14.371 5.627 ( 1.234 -8.057 -3.845) 9.012 5.777 ( -6.274 1.074 -4.604) 7.856 6.445 ( -0.472 0.361 4.273) 4.314 6.537 ( 6.318 -2.897 -1.444) 7.099 6.763 ( -5.900 -12.480 2.554) 14.039 7.232 ( 1.536 -1.600 0.988) 2.428 7.990 ( -2.891 8.880 -0.077) 9.339 9.056 ( 2.743 -17.231 -0.709) 17.462 9.275 ( 0.989 -10.680 -0.059) 10.725 9.333 ( -0.541 -3.370 -0.321) 3.428 9.864 ( 1.320 -16.274 -0.275) 16.330 10.514 ( 3.479 -1.091 -0.062) 3.647 10.891 ( -8.086 -20.639 0.258) 22.168 11.619 ( -0.580 19.505 0.350) 19.517 12.478 ( 7.638 -8.572 0.101) 11.482 12.963 ( -6.613 -4.721 -0.358) 8.133 13.893 ( 1.156 10.607 -0.074) 10.670 15.669 ( -1.364 -17.028 0.235) 17.084 16.353 ( 5.087 7.400 0.131) 8.980 16.804 ( -6.616 -7.701 -0.045) 10.153 17.706 ( -1.828 -21.019 -0.620) 21.107 19.263 ( 2.023 -5.233 -0.214) 5.614 21.093 ( 1.223 10.937 1.093) 11.059 22.224 ( -0.384 -8.325 -0.288) 8.339 23.160 ( -0.090 10.497 0.238) 10.500 ======================= Grid point 467 (219/267) ======================= q-point: (-0.29 -0.71 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.173 ( 0.211 -2.061 -1.332) 2.463 2.816 ( 4.617 -1.804 8.862) 10.154 2.984 ( -2.409 -1.359 -6.139) 6.733 3.125 ( -2.226 4.617 0.585) 5.159 3.773 ( 0.987 -5.582 4.171) 7.038 3.913 ( -1.244 -3.647 -1.462) 4.121 4.152 ( -4.357 1.968 -1.954) 5.164 4.270 ( 4.020 -2.718 -6.156) 7.838 4.922 ( 1.455 -3.415 4.616) 5.923 5.138 ( 0.603 -2.764 -5.706) 6.369 5.641 ( 1.193 4.634 -1.198) 4.933 5.705 ( -2.010 -9.354 3.220) 10.095 5.803 ( 0.510 -6.231 -4.688) 7.814 6.433 ( -1.268 0.803 3.394) 3.711 6.609 ( 0.153 -3.189 -0.411) 3.219 6.946 ( 0.800 -6.551 1.597) 6.790 7.207 ( -0.182 3.826 1.515) 4.118 7.801 ( -0.668 8.461 0.378) 8.496 9.252 ( 0.142 -4.427 -0.801) 4.502 9.488 ( -0.657 -14.511 0.106) 14.526 9.524 ( 0.491 -13.484 -0.348) 13.497 10.093 ( -0.116 -4.682 -0.231) 4.689 10.661 ( -0.970 -16.740 0.219) 16.770 10.768 ( 1.304 26.948 0.556) 26.986 11.596 ( -0.011 -10.924 -0.158) 10.925 12.653 ( 0.224 -6.006 0.130) 6.011 13.030 ( -0.769 -5.174 0.343) 5.242 13.723 ( 0.135 8.083 -0.224) 8.088 15.821 ( -0.261 -2.968 0.164) 2.984 16.263 ( -0.033 4.263 0.752) 4.329 17.010 ( -0.315 -14.920 0.031) 14.923 18.027 ( -0.213 -14.405 -0.485) 14.415 19.355 ( 0.935 -3.600 0.444) 3.746 20.878 ( -0.482 12.357 -0.039) 12.367 22.360 ( -0.187 -6.807 -0.162) 6.812 22.948 ( 0.111 12.354 0.397) 12.360 ======================= Grid point 468 (220/267) ======================= q-point: (-0.21 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.205 ( 0.742 -0.856 -1.211) 1.658 2.853 ( 0.670 3.411 2.899) 4.527 2.983 ( 2.325 -0.999 2.148) 3.319 3.056 ( -2.371 0.941 -2.702) 3.716 3.852 ( -5.918 5.210 4.962) 9.316 3.872 ( -0.493 -2.625 1.174) 2.918 4.057 ( -3.607 3.823 -2.956) 6.030 4.292 ( 4.213 2.489 -6.282) 7.963 4.998 ( -0.696 -2.776 4.281) 5.149 5.182 ( 3.196 -1.941 -6.918) 7.864 5.523 ( 0.830 7.721 -1.748) 7.960 5.825 ( -1.813 -3.378 1.694) 4.191 5.910 ( 3.569 -4.914 -2.283) 6.488 6.410 ( -0.707 1.969 3.192) 3.816 6.664 ( -2.201 -3.629 -0.133) 4.246 6.897 ( 0.255 12.219 1.174) 12.278 7.211 ( 3.299 -2.828 1.300) 4.536 7.725 ( 4.124 0.968 1.036) 4.361 9.258 ( -3.978 1.657 -0.992) 4.422 9.622 ( -2.353 4.325 -0.015) 4.924 9.830 ( 1.063 -19.311 -0.191) 19.341 10.132 ( -4.402 5.959 0.867) 7.459 10.223 ( 5.394 18.096 -0.667) 18.894 11.097 ( -4.378 -29.014 0.138) 29.343 11.697 ( 3.562 3.787 0.292) 5.207 12.671 ( -2.595 3.533 0.093) 4.384 13.130 ( 2.594 -4.349 0.735) 5.117 13.594 ( -0.366 5.983 -0.313) 6.003 15.860 ( -0.045 -2.696 0.200) 2.703 16.206 ( -0.904 1.841 0.916) 2.247 17.275 ( -0.128 -12.803 0.362) 12.809 18.225 ( -0.281 -7.332 -0.481) 7.353 19.412 ( -0.223 -2.024 0.647) 2.136 20.646 ( -1.082 11.580 -0.555) 11.643 22.477 ( -0.823 -6.006 -0.064) 6.062 22.726 ( 2.549 11.818 0.514) 12.101 ======================= Grid point 469 (221/267) ======================= q-point: (-0.14 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( 0.126 2.959 -1.632) 3.381 2.749 ( -1.120 6.825 0.233) 6.920 2.994 ( -2.737 2.164 -7.016) 7.835 3.048 ( 5.776 1.580 7.801) 9.835 3.658 ( -7.903 8.369 5.017) 12.557 3.912 ( -4.326 2.761 2.844) 5.867 3.952 ( 1.215 1.399 -3.327) 3.808 4.230 ( 4.597 5.684 -4.760) 8.723 5.019 ( -3.375 -0.146 3.408) 4.799 5.219 ( 4.106 -0.442 -7.712) 8.748 5.373 ( 2.934 9.117 -0.230) 9.580 5.819 ( -1.972 1.857 -0.801) 2.825 6.022 ( 5.096 -3.652 0.130) 6.271 6.347 ( 1.662 6.619 2.608) 7.306 6.628 ( 0.922 15.264 1.246) 15.342 6.699 ( -5.951 -2.436 0.115) 6.432 7.282 ( 7.413 0.124 0.656) 7.443 7.804 ( 6.336 -3.593 1.551) 7.447 9.087 ( -8.648 13.778 -0.646) 16.280 9.423 ( -1.049 10.283 -0.458) 10.346 9.614 ( 4.202 29.220 -0.266) 29.522 10.181 ( -6.360 -18.840 0.030) 19.885 10.409 ( -1.279 -14.660 -0.014) 14.716 11.424 ( -0.688 12.680 0.267) 12.701 11.678 ( 0.538 -21.108 0.272) 21.116 12.473 ( -2.132 16.399 0.034) 16.537 13.224 ( 3.485 -3.256 0.603) 4.807 13.506 ( 0.443 2.636 -0.262) 2.686 15.954 ( -0.796 -8.240 0.655) 8.304 16.168 ( -1.373 2.266 0.403) 2.680 17.457 ( -4.147 -7.990 0.353) 9.009 18.290 ( -1.529 -0.522 0.533) 1.701 19.420 ( -2.299 0.609 -1.239) 2.682 20.455 ( 2.396 8.862 0.614) 9.201 22.451 ( -4.388 7.157 -0.923) 8.446 22.691 ( 9.129 -3.891 1.071) 9.982 ======================= Grid point 470 (222/267) ======================= q-point: (-0.07 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.081 ( -0.748 8.146 -1.919) 8.403 2.581 ( -2.612 11.281 2.341) 11.813 2.849 ( 1.195 10.375 -7.323) 12.755 3.042 ( 4.482 4.990 4.430) 8.038 3.505 ( -3.691 4.449 3.714) 6.871 3.747 ( -6.523 7.568 -1.523) 10.106 3.992 ( 4.071 -1.158 0.760) 4.300 4.152 ( 3.824 5.221 -0.210) 6.475 4.964 ( -2.762 4.617 2.836) 6.081 5.182 ( 0.239 4.124 -6.303) 7.536 5.286 ( 5.758 3.629 -0.839) 6.857 5.742 ( -0.898 4.702 -1.458) 5.004 6.097 ( -0.057 1.071 1.657) 1.974 6.174 ( 13.251 15.293 -0.114) 20.235 6.419 ( -0.976 7.133 4.150) 8.310 6.638 ( -11.411 3.053 -1.315) 11.885 7.337 ( 11.080 0.499 -0.028) 11.091 7.887 ( 6.547 2.248 1.986) 7.201 8.651 ( -7.289 25.064 -0.290) 26.104 9.167 ( 3.105 19.779 -0.225) 20.023 9.287 ( -3.640 5.435 -1.267) 6.663 10.359 ( -12.775 -3.973 0.093) 13.379 10.631 ( -5.631 -10.997 0.119) 12.355 11.075 ( 13.698 19.388 0.838) 23.753 11.993 ( -5.280 16.401 -0.994) 17.259 12.187 ( -3.965 -16.074 0.377) 16.560 13.301 ( 1.763 -3.084 -0.254) 3.562 13.534 ( 4.434 -3.925 0.154) 5.923 16.069 ( -5.551 7.019 -0.853) 8.989 16.158 ( -1.667 -14.277 1.734) 14.478 17.489 ( -11.218 -1.304 -0.432) 11.302 18.236 ( -2.959 4.660 4.001) 6.817 19.322 ( -5.578 6.686 -6.882) 11.099 20.391 ( 11.970 3.579 4.827) 13.394 22.273 ( -3.363 8.049 -1.946) 8.938 22.874 ( 10.498 -6.786 0.595) 12.514 ======================= Grid point 476 (223/267) ======================= q-point: ( 0.36 0.36 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.679 ( 25.301 -0.000 -3.905) 25.601 1.694 ( 10.077 -0.000 -2.998) 10.513 2.309 ( 13.061 -0.000 3.480) 13.516 2.478 ( 4.209 -0.000 3.394) 5.407 2.954 ( -6.049 0.000 3.042) 6.771 3.109 ( -7.683 0.000 6.352) 9.969 3.383 ( -0.544 0.000 -9.298) 9.314 3.388 ( -4.929 0.000 -4.522) 6.689 3.977 ( 2.226 -0.000 1.508) 2.689 4.377 ( 1.556 -0.000 -0.921) 1.807 4.556 ( -3.226 0.000 7.769) 8.412 5.075 ( -6.345 0.000 2.142) 6.697 5.165 ( -6.292 0.000 -13.408) 14.811 5.620 ( 1.344 -0.000 0.046) 1.345 6.113 ( 3.116 -0.000 12.331) 12.719 6.403 ( 13.526 -0.000 -3.953) 14.092 6.602 ( -0.225 0.000 0.787) 0.819 7.278 ( -0.192 0.000 0.038) 0.195 7.416 ( 23.610 -0.000 -3.716) 23.900 9.033 ( -10.604 0.000 -1.390) 10.695 9.490 ( 12.215 -0.000 -0.653) 12.232 9.507 ( -1.906 0.000 0.943) 2.126 10.667 ( -28.671 0.000 0.743) 28.680 10.710 ( -2.285 0.000 0.272) 2.301 11.340 ( -1.907 0.000 -0.350) 1.939 12.603 ( 24.591 -0.000 2.079) 24.678 13.212 ( -5.143 0.000 1.468) 5.348 14.248 ( 0.384 -0.000 -0.098) 0.396 14.331 ( -3.520 0.000 0.090) 3.521 14.854 ( -28.492 0.000 -5.053) 28.937 16.856 ( -0.128 0.000 0.040) 0.134 17.971 ( 0.038 -0.000 -0.061) 0.072 18.565 ( 9.574 -0.000 0.684) 9.598 20.893 ( -13.297 0.000 -1.005) 13.335 22.120 ( -0.747 0.000 10.190) 10.218 23.657 ( 6.933 -0.000 -1.977) 7.209 ======================= Grid point 477 (224/267) ======================= q-point: ( 0.43 0.36 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.840 ( 19.302 -2.941 -3.319) 19.805 1.994 ( 11.192 -19.142 -1.761) 22.244 2.401 ( 8.618 -1.667 2.436) 9.109 2.557 ( 4.346 -3.483 2.194) 5.986 2.990 ( -5.902 -0.135 3.209) 6.719 3.263 ( -3.105 -21.715 4.041) 22.305 3.305 ( -5.690 -2.248 -2.579) 6.640 3.597 ( -3.180 -20.993 -7.554) 22.536 4.192 ( -3.324 -16.410 2.058) 16.870 4.378 ( 0.009 -0.605 -1.513) 1.629 4.697 ( 1.082 -15.579 7.347) 17.259 5.041 ( -4.988 -0.449 2.141) 5.446 5.207 ( -3.798 -13.211 -12.223) 18.394 5.664 ( 0.873 -4.233 0.142) 4.324 6.148 ( 1.690 0.317 11.158) 11.290 6.509 ( 8.097 -2.985 -5.292) 10.123 6.595 ( 2.960 0.670 0.628) 3.100 7.277 ( 2.222 -1.061 0.058) 2.463 7.671 ( 24.870 -7.074 -2.745) 26.001 8.921 ( -13.614 1.015 -2.000) 13.797 9.489 ( 0.402 1.365 1.033) 1.759 9.553 ( 9.078 1.045 0.335) 9.144 10.389 ( -25.235 6.948 0.715) 26.183 11.058 ( 1.036 -32.963 -0.207) 32.980 11.224 ( -1.892 10.002 -0.375) 10.186 12.756 ( 14.222 2.262 0.989) 14.434 13.106 ( -3.927 7.942 1.653) 9.012 13.901 ( -5.308 10.419 0.462) 11.702 14.508 ( 4.674 0.682 0.156) 4.726 15.037 ( -23.733 -37.409 -4.134) 44.495 16.850 ( -0.151 0.700 0.110) 0.725 17.832 ( 0.023 13.732 0.140) 13.733 18.686 ( 6.719 -5.543 -0.779) 8.745 20.899 ( -8.379 -9.250 0.274) 12.483 22.088 ( -1.669 3.885 6.498) 7.753 23.666 ( 4.446 3.341 -0.669) 5.601 ======================= Grid point 478 (225/267) ======================= q-point: ( 0.50 0.36 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.008 ( 11.708 -2.424 -3.279) 12.398 2.468 ( 10.228 -21.546 -1.327) 23.887 2.546 ( 4.515 -8.087 0.294) 9.267 2.690 ( 2.289 -10.110 2.212) 10.599 2.942 ( -6.577 -0.071 2.241) 6.949 3.346 ( -3.348 -6.206 -1.788) 7.275 3.564 ( -0.720 -8.246 2.663) 8.695 4.067 ( -1.022 -26.597 -2.417) 26.726 4.365 ( 1.228 -5.886 -1.027) 6.099 4.528 ( -9.375 -20.710 2.116) 22.831 4.944 ( 0.166 -3.561 0.510) 3.601 5.066 ( 0.987 -5.762 1.727) 6.096 5.580 ( 0.205 -24.011 -7.224) 25.075 5.820 ( -2.307 -13.920 0.364) 14.115 6.214 ( 0.899 -5.926 7.941) 9.949 6.540 ( 0.253 0.724 -0.793) 1.103 6.708 ( 6.601 -8.102 -2.675) 10.788 7.407 ( 2.754 -13.683 0.436) 13.964 7.994 ( 22.076 -8.309 -1.640) 23.645 8.824 ( -11.609 -2.245 -2.146) 12.017 9.473 ( 6.622 3.393 1.100) 7.521 9.613 ( 0.619 -4.735 0.460) 4.797 10.053 ( -21.418 10.644 0.452) 23.921 10.958 ( -2.548 14.326 -0.277) 14.554 11.792 ( 13.914 -34.144 -1.150) 36.888 12.701 ( -5.099 6.163 -0.343) 8.007 12.889 ( -6.821 10.833 1.476) 12.886 13.936 ( 2.716 -14.745 2.085) 15.137 14.446 ( 2.042 6.973 0.016) 7.266 15.653 ( -14.857 -42.277 -3.061) 44.916 16.824 ( -0.170 2.077 0.162) 2.091 17.517 ( -0.521 18.780 -0.289) 18.790 18.846 ( 4.368 -7.469 -1.473) 8.777 21.077 ( -3.529 -12.943 1.486) 13.498 22.008 ( -0.807 4.217 3.494) 5.536 23.600 ( 2.226 6.055 -0.285) 6.458 ======================= Grid point 479 (226/267) ======================= q-point: ( 0.57 0.36 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.079 ( 3.098 -0.922 -2.736) 4.235 2.662 ( 4.764 -2.815 0.726) 5.581 2.899 ( -2.551 -1.667 2.518) 3.953 2.957 ( 11.388 -21.418 -3.876) 24.565 3.012 ( -6.092 -19.176 3.939) 20.502 3.447 ( -1.543 -5.818 -0.123) 6.020 3.654 ( -1.653 -5.510 -0.001) 5.752 4.260 ( 0.824 -1.217 -4.450) 4.686 4.679 ( 1.593 -17.871 3.200) 18.225 4.865 ( -4.945 -19.189 5.254) 20.501 4.955 ( -1.746 -1.990 -2.151) 3.411 5.222 ( 2.470 -9.145 -3.999) 10.282 5.820 ( -0.916 -3.437 -2.694) 4.461 6.099 ( 1.093 -17.710 0.602) 17.754 6.397 ( -2.655 -8.451 4.527) 9.948 6.525 ( 0.444 0.679 -0.558) 0.984 6.929 ( 2.595 -11.834 -1.133) 12.168 7.901 ( 2.611 -36.007 -0.001) 36.101 8.193 ( 6.836 0.089 -0.404) 6.848 8.884 ( -1.647 -10.276 -1.780) 10.558 9.469 ( 12.654 4.516 0.596) 13.449 9.702 ( -12.166 10.247 -0.032) 15.906 9.821 ( -8.552 -20.167 0.413) 21.909 10.704 ( -1.963 10.414 -0.116) 10.598 12.327 ( 21.499 -6.002 -0.346) 22.324 12.463 ( -0.199 17.825 0.253) 17.828 12.715 ( -20.070 -6.823 -0.445) 21.203 14.285 ( 2.234 7.811 0.480) 8.139 14.467 ( -0.157 -34.684 1.219) 34.706 16.271 ( -6.263 -30.386 -1.660) 31.069 16.775 ( -1.145 2.560 0.064) 2.805 17.206 ( -0.299 11.065 -0.576) 11.084 19.013 ( 2.917 -7.868 -1.533) 8.530 21.259 ( -0.995 -6.105 2.376) 6.626 21.971 ( -0.293 -1.184 1.092) 1.637 23.484 ( 0.940 7.553 -0.213) 7.614 ======================= Grid point 480 (227/267) ======================= q-point: (-0.36 -0.64 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( -0.096 -1.426 -1.914) 2.388 2.739 ( 3.061 -2.430 2.282) 4.526 2.902 ( -2.896 -1.569 0.074) 3.295 3.228 ( -4.875 -5.576 2.436) 7.797 3.412 ( 7.786 -17.871 -1.168) 19.528 3.551 ( 0.114 -8.322 -0.110) 8.324 3.822 ( -1.976 -13.994 -0.320) 14.136 4.251 ( -0.945 0.510 -5.745) 5.844 4.850 ( 1.126 -1.389 5.782) 6.052 5.004 ( -1.013 -5.830 -4.954) 7.717 5.228 ( 1.745 -16.945 7.419) 18.580 5.417 ( 0.302 -12.020 -7.423) 14.130 5.787 ( -1.703 2.898 -1.749) 3.789 6.446 ( -9.873 -11.601 3.986) 15.747 6.467 ( 5.970 -5.817 2.006) 8.574 6.533 ( 4.605 -1.908 -2.116) 5.415 7.138 ( -0.594 -9.031 0.375) 9.058 8.132 ( -0.115 6.914 0.009) 6.915 8.592 ( -0.353 -33.427 -0.270) 33.430 9.085 ( -0.602 -10.870 -0.568) 10.901 9.401 ( 0.359 9.151 0.117) 9.159 9.607 ( -0.300 -9.217 -0.185) 9.224 10.308 ( 0.840 -32.389 -0.209) 32.400 10.559 ( -0.422 4.355 0.099) 4.376 12.057 ( 0.075 24.111 0.562) 24.118 12.421 ( 0.254 -1.029 -0.158) 1.072 12.819 ( -0.470 -8.170 -0.441) 8.195 14.101 ( -0.133 11.091 0.140) 11.093 15.169 ( -0.016 -35.453 0.576) 35.457 16.500 ( -1.119 2.775 -0.327) 3.010 16.721 ( 0.528 1.153 0.023) 1.268 17.288 ( -0.220 -19.684 -0.562) 19.693 19.163 ( 1.505 -6.789 -1.441) 7.101 21.258 ( -0.950 5.492 2.277) 6.021 22.064 ( -0.134 -8.010 -0.033) 8.012 23.338 ( 0.431 8.771 -0.143) 8.782 ======================= Grid point 481 (228/267) ======================= q-point: (-0.29 -0.64 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.131 ( -0.099 -2.238 -1.285) 2.582 2.815 ( 1.676 -3.371 3.497) 5.138 2.911 ( -2.125 -1.386 -2.117) 3.304 3.204 ( -2.666 3.247 1.874) 4.600 3.667 ( 0.882 -7.783 4.331) 8.951 3.756 ( 0.315 -10.959 -5.616) 12.318 4.074 ( -1.393 -11.537 2.125) 11.814 4.205 ( -3.580 0.436 -6.042) 7.036 4.886 ( 0.982 -1.546 3.472) 3.925 5.087 ( 2.830 -3.515 -4.442) 6.332 5.512 ( -0.264 -11.488 4.744) 12.431 5.624 ( -0.163 -11.476 -6.603) 13.241 5.731 ( 3.479 3.107 0.115) 4.666 6.442 ( -3.264 0.233 4.462) 5.533 6.532 ( -4.355 -3.399 -1.018) 5.618 6.794 ( 7.841 -11.539 -0.082) 13.951 7.230 ( -2.398 -1.846 1.186) 3.251 7.985 ( 2.222 9.044 0.306) 9.318 9.049 ( -3.299 -17.429 -0.173) 17.739 9.280 ( -0.372 -11.626 -0.436) 11.640 9.327 ( -0.126 -2.437 0.211) 2.449 9.863 ( -1.420 -16.387 -0.131) 16.449 10.509 ( -3.914 -0.886 0.349) 4.028 10.899 ( 8.853 -20.969 -0.431) 22.765 11.622 ( 0.815 19.749 0.131) 19.766 12.481 ( -7.471 -8.585 -0.119) 11.381 12.954 ( 5.541 -4.704 0.401) 7.280 13.893 ( -1.146 10.539 -0.057) 10.601 15.666 ( 0.837 -16.875 0.452) 16.902 16.350 ( -5.414 6.877 0.321) 8.759 16.804 ( 6.565 -7.337 -0.045) 9.846 17.700 ( 1.188 -21.136 -0.123) 21.169 19.276 ( -0.041 -5.203 -1.215) 5.343 21.089 ( -2.323 11.023 1.360) 11.346 22.221 ( 0.126 -8.288 -0.039) 8.289 23.163 ( 0.388 10.553 -0.017) 10.560 ======================= Grid point 482 (229/267) ======================= q-point: (-0.21 -0.64 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.176 ( 0.801 -2.394 -1.172) 2.783 2.894 ( -3.958 -4.377 -6.235) 8.585 2.904 ( 0.849 0.773 4.697) 4.836 3.131 ( 1.834 3.886 3.512) 5.549 3.796 ( 0.062 -5.354 3.001) 6.138 3.850 ( -6.701 -1.711 -0.455) 6.931 4.088 ( -3.038 2.709 -1.100) 4.217 4.273 ( -0.044 -5.444 -3.850) 6.668 4.936 ( -1.184 -2.854 1.851) 3.601 5.160 ( 5.089 -2.496 -5.380) 7.815 5.621 ( -0.838 0.770 -0.795) 1.389 5.753 ( 2.196 -3.789 2.194) 4.898 5.807 ( 4.227 -7.452 -2.585) 8.948 6.428 ( -1.964 0.096 4.267) 4.698 6.573 ( -3.491 -4.113 -0.619) 5.430 6.993 ( 3.595 -3.208 0.254) 4.825 7.207 ( -0.034 0.865 0.978) 1.307 7.865 ( 8.483 7.407 0.625) 11.279 9.195 ( -7.022 -4.222 -0.479) 8.208 9.461 ( -2.750 -11.325 0.232) 11.656 9.552 ( 2.886 -15.828 -0.240) 16.091 10.073 ( -2.250 -5.014 -0.041) 5.496 10.562 ( -9.187 -9.941 0.582) 13.548 10.866 ( 8.508 22.832 -0.477) 24.370 11.634 ( 5.090 -12.003 -0.178) 13.039 12.590 ( -7.604 -7.678 0.069) 10.806 13.082 ( 6.226 -4.330 0.939) 7.641 13.711 ( -1.634 7.824 -0.276) 7.998 15.834 ( 1.726 -2.261 0.426) 2.876 16.228 ( -4.568 2.131 0.567) 5.073 17.045 ( 4.515 -12.481 0.416) 13.279 18.035 ( 1.632 -13.742 0.028) 13.838 19.350 ( -1.493 -3.757 -1.083) 4.185 20.852 ( -3.113 12.094 0.673) 12.506 22.361 ( 0.398 -6.707 0.165) 6.721 22.960 ( 1.147 11.705 0.068) 11.762 ======================= Grid point 483 (230/267) ======================= q-point: (-0.14 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.210 ( 0.698 -0.471 -1.721) 1.916 2.835 ( -3.005 3.685 -2.496) 5.370 2.943 ( -2.520 -2.382 -3.795) 5.140 3.131 ( 5.968 0.933 7.156) 9.365 3.736 ( -10.034 5.935 3.914) 12.298 3.886 ( 0.205 -3.606 2.995) 4.692 4.019 ( -0.583 3.974 -2.466) 4.713 4.305 ( 1.133 0.922 -4.199) 4.446 4.969 ( -3.538 -2.170 0.870) 4.241 5.225 ( 5.419 -1.362 -6.174) 8.327 5.545 ( 2.528 6.847 -0.352) 7.307 5.809 ( -1.322 -1.233 0.105) 1.810 5.965 ( 4.328 -6.097 -0.014) 7.477 6.424 ( 0.165 0.971 4.125) 4.241 6.616 ( -3.071 -2.798 -0.166) 4.158 6.903 ( -0.626 11.131 1.170) 11.210 7.285 ( 5.799 -4.240 -0.194) 7.186 7.858 ( 12.597 2.086 0.937) 12.803 9.146 ( -10.038 2.449 -0.750) 10.360 9.565 ( -5.177 0.872 0.335) 5.261 9.850 ( 1.539 -13.394 -0.495) 13.491 10.082 ( -2.815 2.088 0.646) 3.564 10.298 ( 5.296 20.997 -0.810) 21.670 10.986 ( -9.821 -26.560 0.014) 28.318 11.788 ( 7.857 2.388 0.210) 8.214 12.607 ( -5.515 1.441 0.153) 5.702 13.201 ( 5.846 -3.322 1.027) 6.802 13.579 ( -1.404 5.253 -0.433) 5.455 15.861 ( 0.025 -1.806 0.291) 1.830 16.189 ( -1.695 0.746 0.808) 2.021 17.276 ( -0.006 -9.674 0.710) 9.700 18.225 ( 0.312 -6.017 0.441) 6.041 19.384 ( -2.883 -1.824 -1.883) 3.896 20.630 ( -1.067 9.553 0.899) 9.655 22.462 ( -0.922 -2.908 0.121) 3.053 22.786 ( 4.658 7.372 0.114) 8.721 ======================= Grid point 484 (231/267) ======================= q-point: (-0.07 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.179 ( -0.207 3.642 -2.297) 4.311 2.719 ( -2.842 6.188 -0.830) 6.859 2.933 ( -0.786 1.228 -5.781) 5.962 3.169 ( 5.499 2.381 5.801) 8.340 3.565 ( -6.760 5.633 5.864) 10.574 3.865 ( -2.026 8.067 -0.863) 8.362 3.981 ( 2.808 -2.335 -0.584) 3.699 4.264 ( 2.179 3.706 -1.294) 4.490 4.966 ( -4.654 -0.475 1.300) 4.855 5.245 ( 3.963 1.902 -7.929) 9.066 5.430 ( 3.803 7.429 1.251) 8.439 5.792 ( -1.088 1.621 -1.145) 2.264 6.078 ( 1.396 -3.196 1.328) 3.732 6.403 ( 2.535 3.345 3.055) 5.191 6.609 ( -2.697 3.126 0.462) 4.154 6.670 ( 2.447 12.530 1.227) 12.826 7.384 ( 5.212 -1.823 -0.601) 5.554 7.949 ( 11.635 -0.782 1.216) 11.725 8.940 ( -9.565 12.271 -0.597) 15.570 9.397 ( -2.195 10.223 -0.142) 10.458 9.680 ( 4.508 28.796 -0.440) 29.150 10.068 ( -8.266 -12.787 -0.301) 15.229 10.380 ( -2.442 -12.905 0.144) 13.134 11.375 ( -6.172 -14.181 0.014) 15.466 11.719 ( 4.784 2.710 0.146) 5.500 12.430 ( -3.546 14.616 0.011) 15.040 13.285 ( 3.780 -1.279 0.497) 4.022 13.517 ( 1.431 0.030 -0.264) 1.456 15.944 ( -0.938 -7.907 0.780) 8.001 16.142 ( -2.377 3.954 0.532) 4.644 17.381 ( -5.989 -3.514 0.451) 6.958 18.269 ( -2.375 0.551 1.955) 3.125 19.352 ( -4.232 2.133 -4.628) 6.623 20.522 ( 5.151 3.506 2.676) 6.781 22.399 ( -2.047 7.021 -0.644) 7.341 22.827 ( 8.338 -5.096 0.278) 9.776 ======================= Grid point 491 (232/267) ======================= q-point: ( 0.43 0.43 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.800 ( 5.316 -0.000 -1.469) 5.516 2.033 ( 22.341 -0.000 -1.987) 22.429 2.483 ( 8.703 -0.000 4.661) 9.873 2.545 ( 3.142 -0.000 1.972) 3.709 2.896 ( -3.816 0.000 3.794) 5.381 3.007 ( -8.096 0.000 1.809) 8.296 3.300 ( -5.290 0.000 -7.748) 9.381 3.309 ( -2.786 0.000 -5.072) 5.787 4.009 ( 1.107 -0.000 1.723) 2.048 4.389 ( 0.668 -0.000 -0.977) 1.184 4.514 ( -5.734 0.000 7.492) 9.435 5.007 ( -3.027 0.000 0.603) 3.086 5.070 ( -1.554 0.000 -8.008) 8.158 5.636 ( 0.805 -0.000 0.019) 0.806 6.187 ( 0.503 -0.000 11.127) 11.139 6.519 ( 4.361 -0.000 -6.040) 7.450 6.624 ( 3.338 -0.000 -0.257) 3.348 7.276 ( -0.111 0.000 0.030) 0.115 7.814 ( 31.327 -0.000 -2.550) 31.430 8.789 ( -21.660 0.000 -3.125) 21.884 9.488 ( -0.889 0.000 2.126) 2.304 9.666 ( 10.867 -0.000 0.179) 10.869 10.296 ( -20.733 0.000 0.863) 20.751 10.684 ( -1.274 0.000 0.239) 1.296 11.315 ( -1.293 0.000 0.066) 1.294 12.984 ( 25.705 -0.000 0.813) 25.718 13.160 ( -2.831 0.000 1.476) 3.193 14.082 ( -26.244 0.000 -2.266) 26.342 14.252 ( 0.210 -0.000 -0.080) 0.224 14.625 ( -3.583 0.000 -1.064) 3.738 16.855 ( -0.078 0.000 0.037) 0.086 17.971 ( 0.028 -0.000 -0.059) 0.065 18.681 ( 6.540 -0.000 -1.312) 6.670 20.746 ( -7.001 0.000 0.820) 7.048 22.118 ( -2.932 0.000 5.272) 6.032 23.727 ( 3.476 -0.000 -0.357) 3.494 ======================= Grid point 492 (233/267) ======================= q-point: ( 0.50 0.43 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.988 ( 3.488 -12.179 -2.068) 12.837 2.177 ( 10.546 -5.883 -1.378) 12.154 2.500 ( 3.912 -0.399 3.348) 5.164 2.620 ( 2.954 -2.273 -0.255) 3.736 2.925 ( -3.782 0.928 1.520) 4.180 3.210 ( -4.978 -10.052 3.498) 11.750 3.271 ( 1.903 -20.923 -0.442) 21.014 3.510 ( -3.760 -20.609 -7.827) 22.364 4.151 ( -2.709 -11.980 2.012) 12.446 4.374 ( 0.123 0.997 -0.899) 1.348 4.742 ( 0.740 -22.944 7.644) 24.195 4.995 ( -2.425 -0.747 1.763) 3.090 5.123 ( -1.440 -10.508 -9.891) 14.503 5.676 ( 0.617 -4.088 -0.017) 4.135 6.207 ( 0.395 0.221 9.599) 9.610 6.533 ( 0.278 -0.706 -3.506) 3.588 6.655 ( 3.511 -1.545 -2.573) 4.619 7.292 ( 0.248 -2.414 0.203) 2.435 8.067 ( 26.514 -3.157 -1.601) 26.749 8.636 ( -21.725 -3.206 -3.095) 22.177 9.483 ( -0.007 0.008 1.869) 1.869 9.700 ( 7.434 3.675 0.569) 8.312 10.098 ( -12.768 7.261 0.470) 14.696 11.070 ( 0.656 -37.679 -0.249) 37.686 11.199 ( -1.106 10.715 -0.069) 10.773 12.953 ( 10.173 17.298 -0.298) 20.070 13.066 ( -2.161 8.376 1.115) 8.722 13.818 ( -5.014 -0.457 0.871) 5.109 14.553 ( 1.263 1.770 0.347) 2.202 14.775 ( -9.469 -38.292 -2.194) 39.506 16.849 ( -0.001 0.691 0.038) 0.692 17.832 ( -0.011 13.950 -0.097) 13.950 18.762 ( 4.705 -4.376 -2.610) 6.936 20.816 ( -3.786 -10.919 1.734) 11.686 22.078 ( -1.971 3.125 3.988) 5.437 23.711 ( 2.350 3.881 -0.622) 4.579 ======================= Grid point 493 (234/267) ======================= q-point: (-0.43 -0.57 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.085 ( 0.283 -0.019 -2.748) 2.762 2.512 ( -3.191 -22.106 0.676) 22.345 2.640 ( 5.212 -7.584 1.675) 9.354 2.698 ( -0.410 -10.675 -2.818) 11.048 2.899 ( 0.436 0.569 1.386) 1.560 3.304 ( -1.011 -7.186 -0.567) 7.279 3.570 ( -0.358 -6.117 2.422) 6.589 4.062 ( 1.151 -30.406 -2.183) 30.506 4.371 ( -0.241 -6.315 -0.093) 6.320 4.442 ( -2.052 -19.636 1.559) 19.804 4.948 ( 0.355 0.313 0.869) 0.990 5.100 ( 1.833 -6.944 1.069) 7.261 5.523 ( -3.341 -28.937 -4.246) 29.437 5.817 ( 1.043 -11.352 -0.101) 11.401 6.257 ( 0.975 -4.713 5.654) 7.425 6.534 ( -0.529 0.029 -0.655) 0.842 6.745 ( 0.169 -7.716 -2.662) 8.164 7.427 ( -0.235 -14.689 0.504) 14.700 8.221 ( 1.245 -1.525 -1.100) 2.255 8.658 ( -2.493 -9.963 -1.588) 10.392 9.540 ( 2.472 -6.437 0.696) 6.931 9.637 ( -1.388 5.597 0.615) 5.799 9.868 ( 0.221 11.875 0.084) 11.877 10.938 ( -0.088 14.849 -0.117) 14.849 11.891 ( -0.852 -44.032 -0.673) 44.046 12.669 ( 0.492 14.098 -0.241) 14.109 12.842 ( 1.065 15.002 0.389) 15.045 13.970 ( 0.519 -16.704 1.429) 16.773 14.455 ( -0.676 7.315 0.400) 7.358 15.518 ( -1.885 -43.344 -1.104) 43.399 16.825 ( 0.261 2.129 -0.058) 2.146 17.511 ( -0.007 19.080 -0.320) 19.083 18.890 ( 3.049 -6.879 -3.228) 8.188 21.048 ( -1.619 -14.142 2.430) 14.440 22.007 ( -0.737 3.798 2.633) 4.680 23.624 ( 1.418 6.620 -0.953) 6.837 ======================= Grid point 494 (235/267) ======================= q-point: (-0.36 -0.57 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.070 ( -2.922 -0.837 -1.938) 3.605 2.685 ( -1.492 -3.820 -1.225) 4.280 2.845 ( -8.365 -9.256 4.510) 13.266 2.951 ( -1.035 -10.523 -0.650) 10.594 3.090 ( 7.916 -22.444 -2.651) 23.946 3.435 ( -0.054 -6.493 0.812) 6.544 3.645 ( -0.043 -4.383 0.888) 4.472 4.243 ( -0.819 0.158 -3.276) 3.380 4.714 ( 0.514 -19.708 1.140) 19.747 4.845 ( 2.147 -16.653 3.902) 17.238 4.959 ( 1.832 -5.388 0.154) 5.693 5.224 ( -0.239 -7.113 -4.617) 8.483 5.789 ( -1.909 -4.406 -0.034) 4.802 6.097 ( -1.567 -16.649 1.044) 16.755 6.429 ( 4.492 -8.291 1.920) 9.623 6.525 ( -0.141 0.106 -0.769) 0.789 6.919 ( -3.466 -11.975 -0.360) 12.472 7.895 ( -3.603 -35.402 0.527) 35.588 8.200 ( -5.886 -0.067 -1.000) 5.970 8.858 ( -0.510 -10.976 0.338) 10.993 9.479 ( -12.142 4.680 -0.209) 13.014 9.700 ( 12.124 10.553 0.159) 16.074 9.832 ( 10.058 -20.289 -0.518) 22.651 10.701 ( 1.385 10.501 0.200) 10.593 12.320 ( -22.779 -7.397 0.121) 23.950 12.458 ( 1.466 17.234 0.676) 17.309 12.725 ( 20.215 -4.647 -1.244) 20.780 14.287 ( -2.265 9.375 0.308) 9.650 14.473 ( 0.442 -35.979 0.774) 35.990 16.244 ( 3.130 -30.827 0.522) 30.990 16.778 ( 1.491 2.646 -0.205) 3.044 17.206 ( 0.623 10.988 -0.570) 11.020 19.035 ( 1.383 -7.453 -3.310) 8.271 21.250 ( -1.738 -6.395 3.054) 7.297 21.972 ( -0.046 -1.062 1.015) 1.469 23.494 ( 0.696 7.860 -1.008) 7.955 ======================= Grid point 495 (236/267) ======================= q-point: (-0.29 -0.57 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.078 ( -2.206 -2.560 -1.157) 3.572 2.733 ( -3.325 -3.950 -2.797) 5.872 2.896 ( -0.751 -1.419 4.537) 4.813 3.128 ( -7.742 -8.881 1.064) 11.830 3.514 ( 6.838 -15.377 -5.145) 17.598 3.547 ( -0.717 -7.226 0.183) 7.263 3.797 ( -1.694 -13.027 2.781) 13.428 4.199 ( -3.433 1.937 -2.287) 4.557 4.902 ( 2.591 0.616 3.857) 4.687 4.997 ( 2.612 -8.901 -3.711) 9.990 5.291 ( 3.111 -15.605 6.603) 17.227 5.364 ( -2.362 -11.866 -9.489) 15.376 5.806 ( 3.821 1.084 1.377) 4.204 6.307 ( -10.088 -9.371 2.887) 14.068 6.493 ( -0.274 0.692 0.229) 0.779 6.672 ( 11.482 -9.892 -1.502) 15.229 7.095 ( -5.546 -9.625 1.086) 11.162 8.120 ( -1.648 3.504 -0.158) 3.876 8.545 ( -5.975 -32.748 0.326) 33.290 9.054 ( -3.134 -12.230 0.511) 12.635 9.331 ( -7.345 2.375 -0.275) 7.724 9.682 ( 8.298 -0.875 0.136) 8.345 10.355 ( 4.681 -22.146 -0.849) 22.651 10.622 ( 9.243 -3.634 0.253) 9.935 12.065 ( -1.149 22.742 0.307) 22.773 12.262 ( -14.723 -4.617 -0.165) 15.431 12.946 ( 12.892 -3.528 -0.037) 13.366 14.080 ( -2.884 10.839 0.278) 11.220 15.177 ( 1.170 -35.427 0.335) 35.448 16.443 ( -4.269 6.154 1.019) 7.559 16.832 ( 11.818 -0.113 -0.307) 11.823 17.298 ( 1.967 -20.795 0.004) 20.888 19.161 ( -0.517 -6.464 -3.048) 7.166 21.235 ( -3.630 5.927 2.781) 7.486 22.066 ( 0.364 -7.948 0.158) 7.958 23.342 ( 0.178 8.786 -0.726) 8.818 ======================= Grid point 496 (237/267) ======================= q-point: (-0.21 -0.57 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.124 ( -0.386 -3.398 -0.764) 3.504 2.770 ( -4.337 -4.144 -5.648) 8.239 2.918 ( -1.240 -0.463 4.681) 4.865 3.178 ( -1.516 -1.142 2.550) 3.179 3.676 ( -2.205 -7.846 2.506) 8.526 3.721 ( -0.642 -6.582 -6.953) 9.595 4.072 ( -0.291 -13.865 2.530) 14.097 4.117 ( -5.313 2.615 -0.055) 5.923 4.912 ( 1.228 0.054 0.897) 1.521 5.128 ( 4.514 -3.952 -4.057) 7.242 5.518 ( -0.142 -9.709 -0.644) 9.731 5.591 ( -0.035 -11.404 -2.649) 11.707 5.840 ( 8.672 0.823 2.211) 8.987 6.364 ( -8.926 -4.968 4.232) 11.058 6.492 ( -0.740 -1.528 -0.715) 1.842 6.921 ( 8.364 -7.910 -0.869) 11.545 7.179 ( -4.473 -3.627 1.074) 5.859 8.046 ( 5.161 5.156 0.092) 7.296 8.959 ( -8.808 -17.157 0.420) 19.291 9.255 ( -2.649 -10.030 -0.293) 10.378 9.336 ( 0.970 -8.286 0.306) 8.349 9.835 ( -1.432 -11.721 0.077) 11.808 10.453 ( -2.849 0.705 0.484) 2.975 11.088 ( 15.801 -18.797 -0.907) 24.573 11.639 ( 1.032 19.569 -0.109) 19.596 12.321 ( -12.283 -11.912 0.138) 17.111 13.073 ( 8.645 -2.526 0.735) 9.037 13.860 ( -3.308 10.109 0.019) 10.637 15.698 ( 3.169 -17.887 0.642) 18.176 16.251 ( -6.821 7.135 0.559) 9.886 16.941 ( 10.443 -4.238 -0.024) 11.271 17.743 ( 4.846 -20.513 0.647) 21.088 19.251 ( -2.190 -5.086 -2.545) 6.094 21.039 ( -5.295 11.054 1.745) 12.380 22.227 ( 0.572 -8.360 0.179) 8.382 23.166 ( -0.105 10.173 -0.304) 10.178 ======================= Grid point 497 (238/267) ======================= q-point: (-0.14 -0.57 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.182 ( 0.554 -2.667 -1.165) 2.962 2.792 ( -4.107 -2.896 -8.001) 9.448 2.913 ( -2.621 0.185 3.919) 4.718 3.197 ( 3.622 0.381 4.752) 5.987 3.736 ( -7.424 0.288 -0.443) 7.442 3.804 ( -0.234 -6.007 1.192) 6.129 4.048 ( -2.416 1.236 0.334) 2.734 4.258 ( -0.119 -5.757 -0.794) 5.813 4.921 ( -1.110 -0.774 0.074) 1.355 5.211 ( 4.496 -2.819 -5.526) 7.661 5.628 ( 1.973 -0.654 -0.662) 2.182 5.737 ( -2.032 -5.975 -2.750) 6.885 5.915 ( 7.591 -2.209 2.784) 8.382 6.401 ( -4.491 -3.386 4.646) 7.295 6.541 ( 0.065 -3.770 -0.012) 3.771 7.009 ( -2.742 1.854 1.041) 3.470 7.240 ( 4.999 -4.504 -0.655) 6.761 8.021 ( 10.962 3.860 0.119) 11.622 9.062 ( -10.262 -3.488 -0.146) 10.839 9.411 ( -3.840 -9.337 0.085) 10.096 9.604 ( 4.203 -15.403 0.055) 15.966 10.032 ( -3.481 -8.379 -0.035) 9.073 10.433 ( -7.893 -5.493 0.414) 9.625 10.992 ( 8.857 27.188 -0.529) 28.599 11.727 ( 6.997 -13.983 -0.371) 15.640 12.469 ( -8.152 -10.323 0.462) 13.162 13.185 ( 6.464 -3.450 1.122) 7.413 13.674 ( -3.186 7.189 -0.300) 7.869 15.872 ( 2.995 0.325 0.528) 3.058 16.156 ( -4.868 -1.776 0.514) 5.207 17.127 ( 5.814 -8.114 0.660) 10.003 18.077 ( 3.964 -11.755 0.613) 12.421 19.307 ( -3.137 -3.666 -2.219) 5.311 20.797 ( -4.694 10.553 1.071) 11.600 22.371 ( 0.738 -6.544 0.335) 6.594 22.974 ( 0.433 10.167 -0.074) 10.176 ======================= Grid point 498 (239/267) ======================= q-point: (-0.07 0.43 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.208 ( 0.223 0.081 -1.966) 1.980 2.763 ( -3.808 1.654 -4.209) 5.912 2.911 ( -0.847 -1.168 -0.851) 1.675 3.234 ( 3.772 0.152 5.452) 6.631 3.631 ( -5.500 4.767 2.819) 7.805 3.906 ( 1.158 -4.001 1.870) 4.566 4.003 ( -0.516 3.407 -1.863) 3.918 4.301 ( 0.306 -0.182 -1.437) 1.480 4.921 ( -3.143 -0.824 0.213) 3.256 5.268 ( 4.056 -0.953 -6.572) 7.781 5.588 ( 3.142 5.910 0.529) 6.714 5.780 ( -1.993 -1.538 -1.977) 3.201 6.022 ( 2.544 -3.851 1.986) 5.024 6.432 ( -1.603 -0.916 3.209) 3.702 6.609 ( 1.856 -1.952 1.808) 3.244 6.885 ( -2.313 7.917 1.106) 8.321 7.361 ( 4.257 -3.547 -0.762) 5.593 8.059 ( 12.646 1.863 0.026) 12.782 8.991 ( -9.305 2.503 -0.482) 9.648 9.487 ( -5.023 -0.813 0.303) 5.098 9.866 ( 0.942 -6.951 -0.484) 7.031 10.055 ( -1.323 0.117 0.445) 1.401 10.368 ( 4.445 18.515 -0.710) 19.054 10.840 ( -8.968 -20.369 0.139) 22.256 11.904 ( 6.910 1.429 -0.083) 7.057 12.528 ( -4.909 -0.163 0.421) 4.930 13.289 ( 4.924 -2.444 1.069) 5.600 13.551 ( -1.899 3.658 -0.519) 4.154 15.862 ( -0.042 -0.650 0.299) 0.717 16.169 ( -1.319 -0.119 0.791) 1.542 17.279 ( -0.050 -4.935 0.882) 5.013 18.237 ( 0.819 -3.608 0.836) 3.793 19.324 ( -3.309 -1.161 -2.842) 4.514 20.624 ( -0.393 5.502 1.296) 5.666 22.455 ( -0.100 -0.748 0.377) 0.844 22.845 ( 3.000 3.098 -0.156) 4.316 ======================= Grid point 506 (240/267) ======================= q-point: (-0.50 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.828 ( -1.138 0.000 -0.025) 1.138 2.220 ( 1.527 -0.000 -3.141) 3.492 2.583 ( 1.254 -0.000 0.219) 1.273 2.623 ( 6.624 -0.000 4.968) 8.280 2.880 ( -0.719 0.000 4.113) 4.176 2.904 ( -4.971 0.000 0.278) 4.978 3.206 ( -1.049 0.000 -6.485) 6.569 3.269 ( 0.509 -0.000 -4.794) 4.821 4.024 ( -0.055 0.000 1.484) 1.485 4.388 ( -0.185 0.000 -0.697) 0.721 4.488 ( -1.440 0.000 7.139) 7.283 4.983 ( -1.514 0.000 1.007) 1.818 5.035 ( 1.073 -0.000 -5.761) 5.860 5.643 ( 0.080 -0.000 -0.045) 0.092 6.233 ( -0.395 0.000 9.586) 9.594 6.517 ( -0.333 0.000 -4.384) 4.396 6.658 ( 1.207 -0.000 -2.569) 2.838 7.275 ( 0.012 -0.000 0.014) 0.018 8.185 ( 1.740 -0.000 -1.597) 2.362 8.463 ( -2.846 0.000 -2.299) 3.658 9.500 ( 1.354 -0.000 1.085) 1.736 9.763 ( -1.239 0.000 1.243) 1.755 10.128 ( 0.775 -0.000 0.029) 0.775 10.676 ( 0.005 -0.000 0.179) 0.179 11.307 ( 0.299 -0.000 -0.006) 0.300 13.138 ( -1.118 0.000 1.036) 1.524 13.280 ( 6.160 -0.000 -2.168) 6.530 13.767 ( -5.310 0.000 0.784) 5.368 14.253 ( -0.008 0.000 -0.055) 0.055 14.603 ( -1.038 0.000 0.481) 1.144 16.854 ( -0.012 0.000 0.036) 0.038 17.971 ( 0.014 -0.000 -0.056) 0.058 18.748 ( 4.323 -0.000 -4.410) 6.176 20.687 ( -2.190 0.000 2.570) 3.376 22.104 ( -1.304 0.000 4.147) 4.347 23.763 ( 2.147 -0.000 -1.482) 2.609 ======================= Grid point 507 (241/267) ======================= q-point: (-0.43 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.968 ( -5.248 -12.625 -0.261) 13.674 2.181 ( -8.967 -4.403 -2.045) 10.197 2.562 ( 2.464 -0.968 -0.447) 2.685 2.623 ( -1.620 0.342 -1.549) 2.268 2.916 ( 1.817 -1.023 2.485) 3.244 3.184 ( 0.521 -7.225 1.119) 7.329 3.334 ( 4.443 -27.503 4.506) 28.222 3.439 ( -0.457 -18.023 -8.057) 19.748 4.148 ( 1.319 -11.571 2.312) 11.873 4.368 ( -0.614 1.350 -0.530) 1.575 4.787 ( 1.147 -27.272 6.639) 28.092 4.981 ( -0.847 -1.218 1.498) 2.108 5.077 ( 0.562 -5.751 -7.206) 9.237 5.680 ( -0.025 -4.431 -0.326) 4.443 6.247 ( -0.020 0.019 7.402) 7.403 6.510 ( -1.543 -1.001 -2.813) 3.361 6.657 ( -1.373 -1.044 -2.772) 3.265 7.292 ( -0.427 -2.375 0.224) 2.424 8.069 ( -27.222 -3.382 -1.799) 27.490 8.602 ( 20.483 -3.076 -0.260) 20.714 9.509 ( 2.651 -0.219 -0.280) 2.675 9.690 ( -9.138 3.628 1.368) 9.926 10.105 ( 13.381 7.458 -0.106) 15.320 11.067 ( -0.980 -37.052 0.050) 37.065 11.201 ( 1.335 10.754 -0.246) 10.839 12.960 ( -7.410 16.798 -0.834) 18.379 13.089 ( 3.533 9.790 -0.824) 10.441 13.812 ( 3.849 -2.345 1.451) 4.735 14.548 ( -2.076 2.638 0.709) 3.431 14.742 ( 5.279 -38.643 0.451) 39.005 16.850 ( 0.176 0.569 -0.059) 0.599 17.832 ( 0.045 14.003 -0.075) 14.003 18.801 ( 3.070 -3.932 -5.847) 7.686 20.797 ( -0.302 -11.180 3.327) 11.668 22.079 ( -0.042 3.071 3.883) 4.951 23.733 ( 1.538 4.140 -2.379) 5.016 ======================= Grid point 508 (242/267) ======================= q-point: (-0.36 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.996 ( -10.402 -2.122 -2.269) 10.856 2.413 ( -10.669 -21.244 2.461) 23.900 2.608 ( -4.967 -2.934 -4.149) 7.106 2.731 ( 2.598 -14.694 -1.215) 14.972 2.959 ( 6.289 -0.656 1.063) 6.412 3.312 ( 1.446 -6.920 0.771) 7.111 3.573 ( -0.388 -5.778 2.176) 6.186 4.069 ( 1.372 -29.942 -2.778) 30.102 4.355 ( -1.878 -4.892 -0.162) 5.243 4.501 ( 8.060 -21.795 4.014) 23.582 4.963 ( 1.232 0.294 -0.249) 1.291 5.110 ( -0.355 -4.672 -1.865) 5.043 5.467 ( -3.315 -28.192 1.699) 28.437 5.840 ( 2.423 -13.484 -1.027) 13.739 6.292 ( 1.246 -5.061 2.152) 5.639 6.519 ( -1.454 -0.885 0.160) 1.710 6.693 ( -5.812 -7.107 -1.698) 9.336 7.404 ( -3.426 -13.525 0.674) 13.968 7.990 ( -22.776 -8.916 -1.368) 24.497 8.783 ( 12.175 -2.389 1.252) 12.471 9.494 ( -9.172 5.031 -0.512) 10.474 9.620 ( 1.899 -6.278 -0.260) 6.564 10.059 ( 21.793 10.817 -0.086) 24.330 10.954 ( 2.209 14.604 0.075) 14.770 11.770 ( -14.336 -33.748 0.629) 36.673 12.706 ( 5.046 8.006 -0.590) 9.482 12.923 ( 9.037 10.270 -1.485) 13.761 13.961 ( -1.894 -15.854 0.134) 15.967 14.432 ( -2.988 7.042 1.089) 7.727 15.589 ( 11.138 -42.680 1.971) 44.153 16.831 ( 0.644 1.928 -0.364) 2.065 17.514 ( 0.595 18.851 -0.125) 18.861 18.904 ( 1.473 -6.481 -6.236) 9.114 21.049 ( -0.097 -13.532 3.825) 14.062 22.016 ( 0.432 4.210 2.763) 5.055 23.631 ( 0.400 6.796 -2.714) 7.328 ======================= Grid point 509 (243/267) ======================= q-point: (-0.29 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.982 ( -7.650 -4.253 -1.448) 8.872 2.623 ( -4.911 -3.891 -3.318) 7.090 2.683 ( -14.850 -16.754 3.426) 22.648 2.970 ( 2.348 -5.161 -1.808) 5.951 3.174 ( 5.632 -19.848 -2.128) 20.741 3.443 ( -0.313 -6.119 1.807) 6.388 3.666 ( 2.558 -4.342 2.179) 5.490 4.207 ( -2.620 1.510 -1.443) 3.351 4.710 ( 0.234 -22.782 -1.544) 22.836 4.944 ( 4.854 -2.518 5.116) 7.488 5.017 ( 7.903 -16.919 0.662) 18.686 5.175 ( -2.713 -5.110 -5.876) 8.246 5.754 ( -4.411 -9.464 2.322) 10.696 6.092 ( 1.255 -8.467 0.916) 8.609 6.506 ( -0.706 0.393 0.987) 1.276 6.526 ( 6.035 -14.124 -1.963) 15.484 6.830 ( -8.220 -12.681 0.843) 15.136 7.801 ( -9.638 -32.111 0.889) 33.538 8.050 ( -11.603 -11.654 -1.169) 16.486 8.880 ( 2.425 -3.342 1.627) 4.438 9.319 ( -9.918 4.388 -0.369) 10.851 9.786 ( 3.667 -4.074 -0.399) 5.496 10.122 ( 24.209 -3.867 -0.973) 24.535 10.750 ( 5.403 9.126 0.614) 10.623 11.952 ( -26.017 -8.514 0.611) 27.381 12.515 ( 5.657 18.353 0.215) 19.206 13.005 ( 17.717 -2.648 -1.397) 17.968 14.232 ( -4.918 6.983 0.287) 8.546 14.488 ( 1.579 -35.585 -0.178) 35.621 16.363 ( 11.469 -24.000 3.222) 26.794 16.817 ( 4.165 -3.459 -0.198) 5.418 17.219 ( 1.531 11.349 -0.546) 11.465 19.021 ( -0.664 -7.013 -5.753) 9.095 21.236 ( -2.266 -4.664 4.263) 6.713 21.978 ( 0.251 -0.836 0.773) 1.166 23.489 ( -0.786 7.668 -2.182) 8.011 ======================= Grid point 510 (244/267) ======================= q-point: (-0.21 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.029 ( -3.904 -5.397 -0.590) 6.686 2.651 ( -4.703 -4.062 -5.140) 8.064 2.830 ( -11.587 -8.619 5.136) 15.327 3.076 ( 0.744 -6.134 -1.419) 6.340 3.507 ( -2.810 -10.106 -3.143) 10.950 3.571 ( 2.860 -9.357 -4.065) 10.595 3.826 ( 3.141 -10.961 6.932) 13.344 4.137 ( -4.413 2.655 1.179) 5.283 4.946 ( 2.723 1.201 -1.643) 3.400 5.042 ( 3.637 -9.694 1.179) 10.420 5.272 ( -3.802 -11.608 -8.561) 14.916 5.396 ( 7.495 -13.305 4.393) 15.890 5.871 ( 2.450 -4.769 1.659) 5.612 6.195 ( -5.787 -5.353 1.618) 8.047 6.476 ( -2.308 0.418 0.479) 2.394 6.815 ( 5.489 -10.441 -0.092) 11.797 7.011 ( -2.774 -10.665 0.358) 11.026 8.076 ( -4.306 -5.259 -0.441) 6.811 8.427 ( -10.069 -31.161 0.634) 32.753 9.010 ( -2.909 -11.766 1.019) 12.163 9.220 ( -7.235 -1.234 -0.409) 7.351 9.821 ( 10.206 3.130 0.196) 10.677 10.415 ( 4.070 -6.872 -0.640) 8.013 10.823 ( 16.850 -13.476 0.136) 21.576 11.888 ( -20.133 -2.715 0.483) 20.321 12.204 ( 4.781 16.276 -0.391) 16.968 13.124 ( 10.621 0.185 0.098) 10.623 14.021 ( -5.226 10.327 0.483) 11.584 15.217 ( 4.655 -35.403 -0.258) 35.709 16.412 ( -0.563 11.519 1.141) 11.589 17.014 ( 11.729 2.060 -0.023) 11.909 17.363 ( 7.560 -24.986 1.517) 26.149 19.120 ( -2.732 -6.257 -4.619) 8.243 21.179 ( -5.839 7.460 3.265) 10.020 22.072 ( 0.315 -8.039 -0.142) 8.047 23.329 ( -1.658 8.324 -1.086) 8.556 ======================= Grid point 511 (245/267) ======================= q-point: (-0.14 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.108 ( -1.476 -5.041 -0.522) 5.279 2.683 ( -3.366 -4.006 -6.526) 8.365 2.875 ( -6.480 -2.974 4.044) 8.197 3.184 ( 0.274 -4.640 1.453) 4.870 3.619 ( -5.332 -7.259 1.092) 9.073 3.697 ( 1.408 -4.446 -7.828) 9.112 4.046 ( -4.156 -1.042 6.071) 7.430 4.114 ( 2.531 -8.569 2.540) 9.289 4.930 ( 1.062 1.560 -0.704) 2.014 5.164 ( 2.349 -3.798 -4.052) 6.030 5.490 ( -1.118 -12.890 -6.424) 14.446 5.625 ( 3.832 -6.216 3.029) 7.906 5.971 ( 7.536 -0.988 1.239) 7.701 6.260 ( -6.555 -6.942 3.571) 10.193 6.481 ( -1.113 -2.697 0.909) 3.056 6.953 ( -6.968 -4.760 1.795) 8.628 7.184 ( 7.830 -6.161 -1.381) 10.058 8.109 ( 2.736 -0.234 -0.462) 2.785 8.805 ( -11.957 -17.440 0.568) 21.153 9.212 ( -2.576 -8.809 -0.190) 9.180 9.334 ( -2.064 -17.462 0.265) 17.586 9.855 ( 5.018 -1.172 0.309) 5.163 10.439 ( 0.701 3.046 0.340) 3.144 11.326 ( 16.078 -18.730 -0.693) 24.694 11.633 ( -2.135 17.728 -0.235) 17.857 12.167 ( -7.635 -11.936 0.476) 14.177 13.189 ( 6.396 -1.036 0.835) 6.533 13.798 ( -5.142 9.370 0.119) 10.689 15.764 ( 5.489 -18.755 0.428) 19.546 16.177 ( -3.320 10.316 0.506) 10.849 17.085 ( 8.931 -2.563 -0.067) 9.291 17.854 ( 9.634 -18.111 1.758) 20.589 19.193 ( -3.713 -5.310 -3.096) 7.181 20.953 ( -7.391 10.777 1.604) 13.166 22.235 ( 0.292 -8.641 -0.079) 8.646 23.150 ( -2.246 9.384 -0.117) 9.649 ======================= Grid point 512 (246/267) ======================= q-point: (-0.07 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.177 ( -0.603 -3.079 -1.276) 3.387 2.716 ( -1.806 -2.663 -5.912) 6.731 2.881 ( -3.268 -1.261 3.025) 4.628 3.252 ( 1.024 -1.755 3.412) 3.971 3.653 ( -3.063 0.175 -1.177) 3.286 3.801 ( 0.015 -7.503 -1.029) 7.574 4.022 ( -1.914 0.442 2.260) 2.994 4.267 ( 1.182 -4.024 0.837) 4.276 4.906 ( -1.012 0.913 0.103) 1.367 5.238 ( 2.621 -3.426 -5.640) 7.101 5.641 ( -0.498 -4.696 -5.054) 6.917 5.709 ( 0.640 -1.756 0.547) 1.948 6.022 ( 5.009 0.280 2.667) 5.682 6.362 ( -2.267 -5.797 3.470) 7.126 6.564 ( 1.633 -4.949 2.338) 5.712 6.925 ( -8.846 0.690 1.352) 8.975 7.330 ( 6.460 -3.619 -0.899) 7.459 8.142 ( 4.407 -0.461 -0.641) 4.477 8.915 ( -8.707 -4.421 -0.008) 9.765 9.368 ( -1.377 -8.701 -0.221) 8.812 9.674 ( 4.930 -14.674 0.273) 15.482 9.971 ( -4.181 -11.233 0.084) 11.986 10.355 ( -2.604 3.277 0.304) 4.197 11.122 ( 9.122 29.642 -0.178) 31.014 11.808 ( 3.234 -15.226 -0.686) 15.581 12.378 ( -3.939 -12.157 0.930) 12.814 13.269 ( 4.028 -3.098 1.127) 5.205 13.617 ( -4.211 6.119 -0.315) 7.435 15.917 ( 2.535 4.870 0.295) 5.498 16.106 ( -1.816 -5.423 0.617) 5.753 17.214 ( 5.588 -4.307 0.593) 7.080 18.155 ( 5.979 -8.060 0.895) 10.075 19.249 ( -3.027 -3.946 -1.821) 5.297 20.728 ( -5.069 7.745 0.629) 9.278 22.382 ( 0.497 -6.729 0.092) 6.748 22.963 ( -2.109 8.341 0.252) 8.607 ======================= Grid point 521 (247/267) ======================= q-point: (-0.43 -0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.765 ( -7.790 0.000 1.349) 7.906 2.053 ( -19.695 0.000 -4.034) 20.104 2.584 ( -0.745 0.000 -1.282) 1.482 2.618 ( -5.902 0.000 -5.806) 8.279 2.909 ( 2.318 -0.000 3.324) 4.053 2.954 ( 7.679 -0.000 7.588) 10.796 3.221 ( 4.195 -0.000 -3.097) 5.215 3.285 ( 4.044 -0.000 -3.533) 5.370 4.019 ( -1.346 0.000 0.907) 1.623 4.378 ( -0.944 0.000 -0.153) 0.956 4.546 ( 5.466 -0.000 6.738) 8.677 4.957 ( -2.392 0.000 -0.783) 2.517 5.051 ( 3.182 -0.000 -2.384) 3.976 5.638 ( -0.656 0.000 -0.131) 0.669 6.262 ( -0.829 0.000 7.462) 7.508 6.475 ( -3.180 0.000 -4.491) 5.502 6.638 ( -2.062 0.000 -1.907) 2.809 7.276 ( 0.131 -0.000 -0.006) 0.132 7.794 ( -33.135 0.000 -0.996) 33.150 8.749 ( 22.287 -0.000 0.187) 22.288 9.528 ( 2.223 -0.000 -1.152) 2.504 9.648 ( -12.256 0.000 1.609) 12.361 10.311 ( 21.046 -0.000 -0.344) 21.048 10.686 ( 1.286 -0.000 0.101) 1.290 11.321 ( 1.470 -0.000 -0.414) 1.527 13.023 ( -20.283 0.000 -2.413) 20.426 13.193 ( 0.140 -0.000 -1.207) 1.215 14.014 ( 26.208 -0.000 3.324) 26.418 14.252 ( -0.226 0.000 -0.024) 0.227 14.588 ( -1.075 0.000 1.920) 2.201 16.855 ( 0.057 -0.000 0.037) 0.068 17.971 ( -0.000 0.000 -0.053) 0.053 18.768 ( 2.212 -0.000 -8.575) 8.856 20.702 ( 2.028 -0.000 4.683) 5.103 22.124 ( 1.515 -0.000 4.626) 4.868 23.776 ( 0.970 -0.000 -4.172) 4.283 ======================= Grid point 522 (248/267) ======================= q-point: (-0.36 -0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.818 ( -16.096 -6.029 -0.815) 17.207 1.967 ( -15.797 -14.498 -0.701) 21.453 2.515 ( -5.375 -0.183 -6.859) 8.716 2.603 ( -1.100 -2.123 -1.123) 2.642 2.984 ( 4.169 -2.961 4.655) 6.915 3.226 ( 3.989 -3.834 -0.578) 5.563 3.407 ( 0.408 -22.329 9.279) 24.184 3.441 ( 6.307 -20.317 -8.402) 22.873 4.203 ( 3.935 -17.293 1.599) 17.807 4.351 ( -1.457 1.683 0.234) 2.238 4.838 ( 3.215 -21.604 0.370) 21.845 4.968 ( -2.617 -5.735 4.819) 7.935 5.085 ( 3.725 -2.005 -2.835) 5.092 5.673 ( -0.501 -5.004 -0.621) 5.068 6.272 ( -0.069 -0.193 4.008) 4.014 6.449 ( -5.918 -2.291 -3.138) 7.079 6.606 ( -3.504 0.710 -0.956) 3.700 7.272 ( -3.469 -0.746 0.474) 3.580 7.641 ( -25.494 -7.993 -0.351) 26.720 8.885 ( 15.349 0.966 0.901) 15.405 9.512 ( -10.566 4.068 0.119) 11.322 9.556 ( 0.007 -1.810 -0.764) 1.964 10.402 ( 25.145 7.173 -0.299) 26.149 11.051 ( -1.196 -32.202 0.288) 32.226 11.223 ( 1.607 10.807 -0.240) 10.928 12.808 ( -10.376 3.786 -3.178) 11.493 13.136 ( 3.985 7.273 -0.920) 8.344 13.900 ( 5.743 8.381 0.713) 10.185 14.498 ( -5.339 1.872 1.001) 5.745 14.932 ( 19.021 -38.453 4.163) 43.102 16.853 ( 0.320 0.354 -0.169) 0.506 17.834 ( 0.244 13.763 0.003) 13.766 18.797 ( 0.927 -3.987 -9.978) 10.785 20.838 ( 3.257 -10.116 5.599) 12.012 22.114 ( 2.271 3.842 4.196) 6.126 23.726 ( -0.816 4.218 -5.392) 6.894 ======================= Grid point 523 (249/267) ======================= q-point: (-0.29 -0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.783 ( -16.358 -7.300 -2.419) 18.076 2.239 ( -14.168 -19.843 3.295) 24.604 2.502 ( -6.166 -3.882 -6.052) 9.471 2.729 ( -1.287 -13.816 -3.275) 14.257 3.071 ( 7.291 -2.242 2.019) 7.890 3.325 ( -1.336 -5.956 1.446) 6.273 3.600 ( 3.473 -6.866 2.587) 8.117 4.090 ( 3.222 -25.557 -1.958) 25.834 4.316 ( -3.267 -5.813 0.400) 6.680 4.682 ( 12.746 -24.529 4.621) 28.026 4.951 ( -3.021 -2.925 -4.278) 5.999 5.105 ( 2.283 -1.316 -1.038) 2.832 5.431 ( -3.988 -21.846 5.119) 22.790 5.889 ( 5.035 -18.803 -0.361) 19.468 6.302 ( -0.386 -5.481 -2.983) 6.252 6.481 ( -5.152 -4.742 1.472) 7.156 6.577 ( -7.919 -3.843 -0.126) 8.803 7.318 ( -9.262 -11.926 1.220) 15.149 7.699 ( -13.944 -12.914 -0.563) 19.014 8.937 ( 7.671 2.657 1.229) 8.211 9.332 ( -12.338 5.163 0.412) 13.382 9.650 ( 2.269 -7.430 -1.455) 7.904 10.430 ( 27.029 10.025 -0.558) 28.834 11.002 ( 3.846 13.118 0.594) 13.684 11.523 ( -18.073 -19.808 1.006) 26.832 12.817 ( 10.222 4.192 -0.250) 11.051 13.061 ( 10.880 -1.699 -3.921) 11.689 13.931 ( -1.243 -13.996 -1.322) 14.113 14.371 ( -6.260 6.334 1.492) 9.029 15.852 ( 21.833 -40.717 5.603) 46.540 16.840 ( 0.888 1.570 -0.657) 1.919 17.528 ( 1.364 18.235 0.124) 18.286 18.873 ( -1.059 -6.317 -9.596) 11.538 21.084 ( 2.174 -11.145 6.051) 12.867 22.038 ( 0.767 5.692 1.888) 6.046 23.598 ( -3.212 6.321 -4.899) 8.618 ======================= Grid point 524 (250/267) ======================= q-point: (-0.21 -0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.844 ( -9.991 -9.558 -1.218) 13.880 2.463 ( -15.340 -16.441 0.259) 22.488 2.529 ( -6.181 -5.081 -2.268) 8.317 2.967 ( -1.188 -9.739 -4.347) 10.731 3.251 ( 5.906 -12.627 -1.150) 13.987 3.424 ( -3.520 -6.698 1.924) 7.807 3.751 ( 6.976 -5.055 4.327) 9.640 4.156 ( -4.017 2.564 0.908) 4.851 4.723 ( 2.451 -24.137 -1.428) 24.303 4.971 ( -1.772 -2.056 -2.377) 3.608 5.124 ( 0.085 -2.107 -1.971) 2.886 5.213 ( 15.175 -16.578 3.716) 22.780 5.669 ( -7.975 -12.841 1.524) 15.193 6.134 ( 3.127 -2.333 -0.864) 3.995 6.463 ( -5.075 -0.397 0.833) 5.158 6.566 ( -5.659 -14.878 1.249) 15.967 6.764 ( 4.462 -19.380 -0.727) 19.900 7.636 ( -12.196 -28.956 0.893) 31.433 7.888 ( -9.951 -17.701 -0.682) 20.317 8.926 ( 2.630 1.661 0.962) 3.256 9.173 ( -9.806 2.389 -0.092) 10.093 9.837 ( 3.319 -9.265 -0.428) 9.851 10.447 ( 18.955 5.871 -0.860) 19.862 10.878 ( 12.022 4.358 1.094) 12.834 11.586 ( -23.577 -8.103 0.609) 24.938 12.620 ( 8.412 19.053 -0.207) 20.828 13.223 ( 12.650 0.603 -1.301) 12.731 14.151 ( -6.539 7.498 0.729) 9.975 14.538 ( 7.019 -39.943 -2.284) 40.620 16.570 ( 12.444 -5.407 3.015) 13.899 16.924 ( 11.388 -20.458 2.609) 23.559 17.249 ( 3.052 12.040 -0.332) 12.426 18.961 ( -3.516 -6.914 -7.852) 11.037 21.225 ( -2.139 -0.562 5.773) 6.182 21.975 ( -1.116 -0.869 -1.086) 1.783 23.440 ( -4.619 6.496 -2.773) 8.440 ======================= Grid point 525 (251/267) ======================= q-point: (-0.14 -0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.960 ( -5.214 -8.730 -0.330) 10.174 2.563 ( -3.211 -5.096 -7.135) 9.337 2.660 ( -12.904 -13.751 4.753) 19.447 3.077 ( -0.587 -5.572 -2.608) 6.180 3.459 ( -1.748 -6.838 -0.662) 7.089 3.575 ( 0.609 -9.722 -4.991) 10.945 3.934 ( 6.126 -8.329 8.345) 13.287 4.085 ( -3.819 1.732 2.854) 5.072 4.965 ( 1.067 0.360 -3.533) 3.708 5.094 ( 1.844 -6.377 2.638) 7.143 5.187 ( -2.021 -14.119 -8.522) 16.615 5.543 ( 8.678 -8.293 4.505) 12.821 5.880 ( 0.156 -12.964 -0.221) 12.967 6.159 ( -0.653 -1.142 0.473) 1.398 6.426 ( -5.172 -0.908 1.067) 5.358 6.728 ( -13.621 -10.969 2.640) 17.686 7.135 ( 15.597 -9.323 -1.172) 18.209 7.987 ( -7.390 -14.293 -0.483) 16.097 8.266 ( -11.815 -29.273 0.315) 31.569 8.984 ( -1.372 -9.014 0.762) 9.150 9.123 ( -5.360 -3.316 -0.330) 6.311 9.971 ( 9.428 0.420 0.309) 9.442 10.480 ( 5.513 0.687 -0.253) 5.562 11.078 ( 16.402 -13.057 0.244) 20.966 11.592 ( -19.157 -11.070 0.647) 22.135 12.304 ( 8.429 20.709 -0.579) 22.366 13.250 ( 6.508 2.312 0.221) 6.910 13.932 ( -7.221 9.687 0.688) 12.102 15.324 ( 10.660 -33.700 -1.373) 35.372 16.428 ( 1.930 15.335 0.394) 15.461 17.148 ( 6.939 2.875 -0.654) 7.539 17.562 ( 17.688 -24.905 4.361) 30.857 19.041 ( -5.100 -6.809 -5.093) 9.916 21.093 ( -7.812 9.925 2.873) 12.953 22.066 ( -0.921 -8.708 -1.179) 8.835 23.277 ( -5.119 7.158 -0.561) 8.818 ======================= Grid point 526 (252/267) ======================= q-point: (-0.07 -0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.075 ( -2.507 -6.679 -0.621) 7.161 2.626 ( -0.626 -4.699 -5.289) 7.103 2.794 ( -6.053 -6.885 3.420) 9.785 3.177 ( -1.809 -6.268 -0.190) 6.526 3.560 ( -3.072 -6.430 1.857) 7.364 3.690 ( 2.462 -4.412 -7.654) 9.172 4.026 ( -2.462 0.818 5.526) 6.104 4.171 ( 2.805 -8.093 3.531) 9.264 4.936 ( 0.264 2.293 -0.505) 2.363 5.161 ( -0.049 -4.379 -4.014) 5.941 5.442 ( -1.395 -12.347 -6.089) 13.837 5.695 ( 3.254 -3.315 1.757) 4.967 6.068 ( 5.936 -2.299 -1.256) 6.488 6.226 ( -0.233 -7.278 4.904) 8.779 6.461 ( -2.678 -6.159 1.853) 6.967 6.787 ( -14.754 -6.302 1.629) 16.126 7.327 ( 9.293 -2.696 -0.342) 9.682 8.110 ( -2.154 -4.112 -1.081) 4.766 8.639 ( -9.600 -18.871 0.256) 21.174 9.192 ( 0.156 -8.377 -0.125) 8.379 9.282 ( -4.660 -22.148 0.266) 22.634 9.983 ( 11.276 5.780 0.500) 12.681 10.473 ( 3.534 4.704 0.270) 5.890 11.452 ( -4.512 -17.793 -0.667) 18.368 11.648 ( 9.990 8.322 0.335) 13.007 12.116 ( -0.066 -4.946 0.427) 4.964 13.264 ( 3.218 -0.140 0.880) 3.339 13.713 ( -6.425 8.272 0.182) 10.475 15.860 ( 7.336 -17.239 -0.138) 18.736 16.156 ( -0.058 13.586 0.223) 13.588 17.206 ( 8.082 -2.249 -0.288) 8.394 18.035 ( 13.415 -12.873 2.184) 18.720 19.123 ( -4.102 -6.701 -1.743) 8.048 20.839 ( -8.721 9.687 0.393) 13.041 22.231 ( -0.650 -9.310 -0.586) 9.351 23.095 ( -5.463 8.286 0.639) 9.946 ======================= Grid point 536 (253/267) ======================= q-point: (-0.36 -0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.619 ( -13.071 0.000 3.066) 13.425 1.678 ( -26.995 0.000 -4.508) 27.368 2.476 ( -7.968 0.000 -10.167) 12.917 2.553 ( -2.070 0.000 -2.789) 3.473 2.973 ( 4.638 -0.000 2.149) 5.111 3.092 ( 1.249 -0.000 13.761) 13.817 3.261 ( 5.026 -0.000 -4.932) 7.041 3.351 ( 6.471 -0.000 -1.989) 6.770 3.992 ( -2.754 0.000 0.318) 2.772 4.360 ( -1.616 0.000 0.415) 1.669 4.697 ( 10.441 -0.000 0.193) 10.442 4.901 ( -4.979 0.000 5.133) 7.151 5.107 ( 5.560 -0.000 -0.674) 5.601 5.623 ( -1.222 0.000 -0.216) 1.241 6.272 ( -1.724 0.000 5.004) 5.292 6.367 ( -8.190 0.000 -6.868) 10.689 6.602 ( -1.734 0.000 0.446) 1.791 7.279 ( 0.205 -0.000 -0.025) 0.206 7.354 ( -25.530 0.000 1.276) 25.562 9.009 ( 12.954 -0.000 0.353) 12.959 9.461 ( -13.718 0.000 1.853) 13.842 9.549 ( 1.712 -0.000 -2.446) 2.986 10.683 ( 28.311 -0.000 -0.554) 28.316 10.713 ( 2.297 -0.000 0.009) 2.297 11.340 ( 1.361 -0.000 -0.369) 1.410 12.691 ( -20.430 0.000 -5.124) 21.063 13.238 ( 5.200 -0.000 -0.641) 5.239 14.247 ( -0.402 0.000 0.013) 0.402 14.327 ( 7.225 -0.000 0.498) 7.242 14.697 ( 20.200 -0.000 7.599) 21.582 16.856 ( 0.111 -0.000 0.037) 0.117 17.970 ( -0.011 0.000 -0.048) 0.049 18.733 ( -0.462 0.000 -13.403) 13.411 20.792 ( 6.859 -0.000 7.826) 10.406 22.188 ( 4.187 -0.000 4.459) 6.117 23.736 ( -3.515 0.000 -8.283) 8.998 ======================= Grid point 537 (254/267) ======================= q-point: (-0.29 -0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.502 ( -23.341 -5.285 -2.417) 24.054 1.756 ( -14.653 -20.421 3.525) 25.380 2.381 ( -7.354 -0.866 -10.372) 12.745 2.562 ( -3.151 -3.270 -3.015) 5.451 3.043 ( -1.900 -5.097 8.383) 9.993 3.258 ( 1.498 -0.972 -3.241) 3.701 3.460 ( 2.914 -16.720 8.976) 19.199 3.543 ( 11.170 -23.614 -5.707) 26.738 4.236 ( -0.436 -19.425 -0.631) 19.441 4.340 ( -0.683 -4.608 2.151) 5.131 4.802 ( -6.356 -6.317 -9.416) 12.999 5.027 ( 5.924 -12.256 13.491) 19.166 5.164 ( 8.098 -2.526 0.373) 8.491 5.663 ( -0.318 -6.409 -0.637) 6.448 6.273 ( -1.498 1.305 -4.750) 5.148 6.300 ( -10.968 -4.445 0.061) 11.835 6.565 ( -2.381 2.614 1.220) 3.740 7.143 ( -14.148 0.026 2.275) 14.330 7.420 ( -4.650 -10.083 -0.042) 11.104 9.051 ( 7.010 3.362 0.289) 7.780 9.322 ( -13.473 3.935 1.642) 14.132 9.573 ( 1.568 -2.395 -2.259) 3.647 10.786 ( 25.245 5.156 -0.420) 25.770 11.019 ( -3.930 -18.569 0.507) 18.987 11.265 ( 5.453 7.338 0.135) 9.143 12.668 ( -4.928 -14.887 -6.538) 16.990 13.204 ( 5.990 7.660 -1.290) 9.809 13.964 ( 2.875 13.522 -0.289) 13.827 14.402 ( -8.247 1.606 1.218) 8.490 15.318 ( 28.984 -36.055 8.364) 47.010 16.858 ( 0.410 0.095 -0.277) 0.504 17.840 ( 0.650 13.085 -0.027) 13.101 18.735 ( -2.226 -4.310 -14.276) 15.077 20.951 ( 8.183 -7.813 9.087) 14.511 22.172 ( 3.079 5.868 2.127) 6.960 23.639 ( -7.593 3.659 -8.961) 12.302 ======================= Grid point 538 (255/267) ======================= q-point: (-0.21 -0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.525 ( -16.565 -13.100 -1.624) 21.181 2.039 ( -14.946 -18.163 4.116) 23.879 2.380 ( -6.033 -5.715 -7.656) 11.299 2.673 ( -3.789 -13.746 -5.036) 15.121 3.145 ( -2.561 -6.435 6.652) 9.603 3.302 ( 1.194 -3.341 -2.134) 4.140 3.700 ( 7.878 -7.962 3.094) 11.620 4.134 ( 2.365 -13.183 -0.648) 13.409 4.281 ( -0.976 -14.774 1.752) 14.910 4.841 ( -7.608 -6.554 -6.485) 11.954 4.880 ( 10.397 -29.838 3.628) 31.805 5.171 ( 5.935 -0.616 0.560) 5.993 5.406 ( -1.304 -10.075 5.167) 11.398 5.985 ( 7.505 -24.591 1.371) 25.747 6.211 ( -10.039 -4.527 -6.182) 12.629 6.392 ( -5.042 -12.062 -0.196) 13.075 6.491 ( -5.451 1.660 1.560) 5.908 7.171 ( -10.227 -13.130 2.326) 16.805 7.581 ( -3.054 -9.888 -0.459) 10.359 9.007 ( 0.140 3.581 0.026) 3.584 9.158 ( -9.695 4.282 1.092) 10.655 9.670 ( 1.257 -7.823 -1.165) 8.008 10.787 ( 18.758 12.910 -0.585) 22.779 11.042 ( -0.839 2.888 1.748) 3.478 11.322 ( -5.280 -4.389 0.101) 6.867 12.989 ( 12.129 10.849 0.325) 16.277 13.213 ( 13.748 -17.402 -6.649) 23.153 13.927 ( 2.415 -15.943 -3.110) 16.422 14.263 ( -9.305 5.590 1.541) 10.964 16.262 ( 29.022 -37.854 8.920) 48.526 16.850 ( 1.023 1.038 -0.842) 1.684 17.559 ( 2.842 17.109 0.289) 17.346 18.783 ( -4.820 -6.531 -12.443) 14.857 21.177 ( 6.258 -6.584 9.302) 13.001 22.030 ( -3.025 8.232 -2.996) 9.267 23.479 ( -10.073 4.163 -5.660) 12.282 ======================= Grid point 539 (256/267) ======================= q-point: (-0.14 -0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.693 ( -9.462 -14.423 -0.490) 17.256 2.250 ( -13.218 -17.356 0.386) 21.819 2.436 ( -4.612 -5.745 -3.070) 7.982 2.907 ( -3.408 -12.211 -5.962) 14.009 3.315 ( -0.324 -12.593 2.376) 12.819 3.377 ( -0.568 -4.566 -0.492) 4.628 3.890 ( 8.506 -5.437 4.440) 11.029 4.102 ( -4.445 2.738 3.047) 6.045 4.762 ( 2.747 -23.850 -0.796) 24.021 4.892 ( -5.052 -5.423 -4.589) 8.718 5.154 ( 3.681 2.521 -0.860) 4.544 5.475 ( 16.009 -11.111 5.533) 20.257 5.557 ( -5.694 -18.020 -0.027) 18.899 6.123 ( -4.566 -1.677 -5.660) 7.463 6.356 ( -9.053 -4.358 1.517) 10.161 6.450 ( -8.054 -6.310 3.352) 10.766 6.916 ( 12.897 -32.087 -0.285) 34.583 7.484 ( -7.940 -25.893 0.744) 27.093 7.743 ( -9.612 -14.579 -0.478) 17.469 8.948 ( -0.840 1.847 -0.285) 2.049 9.051 ( -5.420 0.639 0.471) 5.477 9.869 ( 0.925 -12.045 -0.094) 12.080 10.657 ( 10.342 10.097 0.197) 14.455 11.088 ( 12.478 -3.065 1.014) 12.889 11.294 ( -13.843 -2.226 0.099) 14.021 12.752 ( 9.427 19.376 -0.719) 21.560 13.364 ( 7.272 4.140 -0.926) 8.419 14.042 ( -8.996 8.214 1.171) 12.238 14.701 ( 18.063 -43.993 -5.199) 47.840 16.703 ( 5.503 9.651 -0.559) 11.124 17.164 ( 13.029 -22.263 4.201) 26.135 17.356 ( 16.220 1.754 3.443) 16.674 18.845 ( -7.444 -7.665 -8.754) 13.813 21.220 ( -2.848 7.230 5.841) 9.722 21.920 ( -4.954 -3.424 -4.453) 7.490 23.326 ( -9.523 3.912 -1.389) 10.388 ======================= Grid point 540 (257/267) ======================= q-point: (-0.07 -0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.883 ( -4.643 -11.469 0.023) 12.374 2.498 ( -1.556 -12.808 -9.593) 16.077 2.523 ( -8.057 -11.057 7.202) 15.461 3.035 ( -3.068 -6.724 -2.558) 7.821 3.453 ( 0.244 -4.241 0.798) 4.322 3.555 ( 0.037 -11.267 -4.188) 12.020 4.037 ( -1.122 0.485 6.098) 6.219 4.065 ( 3.100 -5.561 3.070) 7.068 4.935 ( -2.836 -3.463 -3.420) 5.633 5.111 ( -0.122 1.763 0.044) 1.768 5.158 ( 1.622 -17.020 -3.613) 17.475 5.633 ( 1.547 -5.985 0.726) 6.224 5.950 ( 9.058 -13.990 0.290) 16.669 6.148 ( -0.776 -4.985 0.231) 5.051 6.327 ( -8.689 -2.840 0.293) 9.146 6.535 ( -12.393 -8.386 2.184) 15.122 7.353 ( 11.032 -4.221 1.122) 11.865 7.879 ( -5.639 -19.002 -0.763) 19.836 8.099 ( -9.778 -30.793 -0.286) 32.309 8.967 ( -1.457 -6.697 0.159) 6.856 9.079 ( -0.010 -5.303 0.080) 5.304 10.080 ( 4.918 -7.370 0.266) 8.865 10.589 ( 9.496 5.854 0.291) 11.159 11.211 ( -5.325 -2.162 -0.042) 5.748 11.414 ( 1.060 -21.978 0.926) 22.023 12.434 ( 9.302 22.077 -0.672) 23.967 13.320 ( 2.964 3.520 0.407) 4.620 13.818 ( -8.629 8.718 0.736) 12.288 15.516 ( 16.294 -28.739 -2.604) 33.139 16.462 ( 2.401 17.083 -0.480) 17.258 17.240 ( 7.016 -0.114 -0.976) 7.085 17.893 ( 23.538 -17.768 4.815) 29.882 18.929 ( -7.457 -9.260 -3.172) 12.305 20.964 ( -11.292 11.982 -0.002) 16.465 22.036 ( -1.980 -10.211 -1.277) 10.479 23.175 ( -8.655 5.485 0.848) 10.282 ======================= Grid point 551 (258/267) ======================= q-point: (-0.29 -0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.270 ( -25.436 0.000 -0.914) 25.452 1.420 ( -16.281 0.000 5.573) 17.208 2.301 ( -8.516 0.000 -14.393) 16.724 2.501 ( -2.848 0.000 -4.492) 5.319 3.023 ( -18.549 0.000 18.139) 25.944 3.062 ( 6.434 -0.000 1.284) 6.561 3.389 ( 13.846 -0.000 -6.885) 15.463 3.449 ( 7.447 -0.000 -0.838) 7.494 3.941 ( -4.194 0.000 0.027) 4.194 4.334 ( -2.216 0.000 0.756) 2.341 4.657 ( -10.357 0.000 -8.327) 13.289 5.028 ( 12.607 -0.000 14.272) 19.043 5.215 ( 9.803 -0.000 0.954) 9.849 5.602 ( -1.499 0.000 -0.279) 1.525 6.173 ( -11.984 0.000 -4.236) 12.711 6.271 ( -1.071 0.000 -3.115) 3.294 6.594 ( -0.367 0.000 2.178) 2.209 7.067 ( -15.372 0.000 3.248) 15.712 7.282 ( 0.216 -0.000 -0.038) 0.220 9.138 ( 4.145 -0.000 -0.786) 4.219 9.278 ( -11.176 0.000 2.259) 11.402 9.556 ( 0.675 -0.000 -2.411) 2.504 10.751 ( 2.830 -0.000 -0.086) 2.832 11.080 ( 23.195 -0.000 -0.614) 23.203 11.373 ( 4.914 -0.000 0.394) 4.929 12.394 ( -15.772 0.000 -9.040) 18.179 13.328 ( 7.332 -0.000 -1.269) 7.441 14.240 ( -0.496 0.000 0.053) 0.499 14.289 ( -7.842 0.000 -0.046) 7.842 15.180 ( 35.096 -0.000 11.718) 37.001 16.858 ( 0.138 -0.000 0.032) 0.142 17.970 ( -0.015 0.000 -0.042) 0.045 18.633 ( -3.723 0.000 -18.332) 18.706 20.983 ( 13.571 -0.000 12.234) 18.271 22.268 ( 4.191 -0.000 -0.596) 4.233 23.571 ( -13.676 0.000 -11.946) 18.159 ======================= Grid point 552 (259/267) ======================= q-point: (-0.21 -0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.176 ( -19.284 -8.735 2.424) 21.309 1.559 ( -14.973 -21.892 6.307) 27.263 2.215 ( -7.596 -2.725 -14.567) 16.653 2.487 ( -5.177 -2.617 -3.634) 6.845 2.952 ( -16.638 -7.028 14.196) 22.972 3.296 ( 6.676 -4.142 -5.226) 9.436 3.567 ( 6.388 -14.740 6.672) 17.396 3.695 ( 12.014 -21.693 -6.237) 25.570 4.203 ( -3.077 -15.236 0.447) 15.551 4.326 ( -2.937 -14.523 1.278) 14.872 4.629 ( -10.979 -7.018 -4.990) 13.953 5.185 ( 8.534 -3.025 3.872) 9.848 5.341 ( 13.459 -4.090 7.349) 15.870 5.665 ( 1.167 -10.086 0.304) 10.158 6.085 ( -12.030 -0.794 -7.009) 13.946 6.257 ( -1.795 -1.164 -2.554) 3.332 6.532 ( -3.735 5.562 2.319) 7.090 6.965 ( -10.773 -2.139 3.848) 11.638 7.414 ( 2.404 -9.802 -0.186) 10.094 9.050 ( -8.883 5.927 -0.171) 10.680 9.199 ( -1.642 3.279 1.290) 3.888 9.578 ( 0.248 -2.865 -1.747) 3.365 10.887 ( -10.425 -6.850 1.071) 12.520 11.132 ( 17.457 7.106 -0.690) 18.860 11.409 ( 13.698 3.371 0.377) 14.112 12.615 ( 2.986 -36.319 -11.887) 38.331 13.300 ( 7.939 8.557 -1.387) 11.755 13.985 ( 0.334 13.778 -0.893) 13.811 14.272 ( -9.975 2.210 1.372) 10.309 15.832 ( 34.042 -32.998 12.215) 48.958 16.863 ( 0.503 -0.191 -0.382) 0.660 17.854 ( 1.447 11.668 -0.297) 11.761 18.604 ( -5.936 -4.582 -18.180) 19.666 21.172 ( 15.708 -4.411 13.590) 21.234 22.177 ( -3.606 9.977 -8.563) 13.633 23.412 ( -17.532 1.207 -8.091) 19.347 ======================= Grid point 553 (260/267) ======================= q-point: (-0.14 -0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 492 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.315 ( -11.234 -16.723 2.458) 20.296 1.847 ( -13.295 -17.252 3.937) 22.133 2.269 ( -3.961 -8.582 -8.491) 12.705 2.576 ( -6.290 -14.695 -5.571) 16.927 3.050 ( -12.830 -11.697 10.798) 20.446 3.359 ( 6.604 -0.934 -4.850) 8.247 3.835 ( 8.361 -8.400 1.689) 11.971 4.128 ( -3.084 1.064 2.411) 4.056 4.320 ( 4.305 -25.831 1.017) 26.207 4.697 ( -7.860 -9.544 -4.297) 13.090 4.980 ( 1.390 -35.305 0.951) 35.346 5.263 ( 6.177 -0.611 -0.450) 6.224 5.481 ( 8.591 -2.083 4.784) 10.052 5.996 ( -12.151 -1.720 -8.597) 14.984 6.116 ( 6.784 -25.882 5.320) 27.280 6.321 ( -4.524 -13.685 -3.972) 14.951 6.410 ( -6.514 0.244 2.935) 7.148 7.060 ( -6.495 -14.797 2.531) 16.357 7.584 ( 3.365 -4.637 -0.099) 5.731 8.908 ( -9.368 0.204 -0.390) 9.378 9.115 ( 0.322 5.529 0.632) 5.574 9.673 ( -0.389 -8.066 -0.503) 8.091 10.781 ( -16.009 1.529 1.532) 16.154 11.141 ( 13.914 6.525 -0.511) 15.376 11.400 ( 11.358 7.380 0.335) 13.549 13.133 ( 7.471 14.517 -1.946) 16.443 13.419 ( 16.811 -15.884 -5.758) 23.834 14.001 ( 11.584 -28.704 -6.262) 31.580 14.120 ( -10.069 2.924 0.780) 10.514 16.749 ( 29.498 -31.321 10.212) 44.220 16.864 ( 1.588 -1.407 -0.342) 2.149 17.629 ( 7.562 13.548 0.514) 15.524 18.619 ( -9.407 -6.910 -14.488) 18.605 21.358 ( 11.610 2.651 11.907) 16.840 21.861 ( -17.119 7.619 -14.161) 23.488 23.269 ( -15.033 0.144 -0.882) 15.060 ======================= Grid point 554 (261/267) ======================= q-point: (-0.07 -0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.582 ( -5.560 -16.935 1.857) 17.921 2.091 ( -8.775 -19.307 1.136) 21.238 2.372 ( -1.967 -6.893 -3.628) 8.034 2.825 ( -3.917 -13.867 -6.240) 15.703 3.249 ( -7.658 -15.799 5.721) 18.466 3.423 ( 4.750 -2.601 -2.197) 5.844 4.011 ( 4.460 -4.640 1.543) 6.618 4.061 ( -2.295 1.906 4.266) 5.206 4.737 ( -5.147 -14.046 -2.297) 15.134 4.862 ( 3.122 -15.059 -0.715) 15.396 5.193 ( 1.110 4.209 -0.401) 4.371 5.460 ( -3.825 -12.596 -1.232) 13.222 5.779 ( 17.636 -14.788 4.991) 23.551 5.958 ( -10.520 -7.955 -6.348) 14.637 6.247 ( -6.573 -0.973 -1.528) 6.818 6.365 ( -5.586 -3.687 2.964) 7.320 7.053 ( 3.206 -41.095 1.776) 41.258 7.430 ( -1.900 -27.769 0.101) 27.835 7.620 ( -4.226 -1.688 0.268) 4.558 8.912 ( -0.688 -2.976 -1.237) 3.295 9.034 ( 0.979 1.858 0.883) 2.278 9.861 ( -1.921 -12.722 0.149) 12.867 10.727 ( -3.791 -3.479 1.265) 5.299 11.095 ( -0.225 2.928 -0.293) 2.951 11.347 ( 11.094 5.364 0.417) 12.330 12.880 ( 8.393 18.614 -1.431) 20.469 13.435 ( 3.282 6.441 -0.370) 7.239 13.902 ( -10.507 7.618 1.102) 13.025 15.018 ( 28.209 -42.595 -7.819) 51.684 16.756 ( 2.962 11.151 -1.490) 11.633 17.279 ( 5.541 -2.263 0.347) 5.995 17.778 ( 32.634 -16.736 7.493) 37.433 18.662 ( -12.715 -9.841 -7.776) 17.860 21.122 ( -15.543 16.091 -3.594) 22.659 21.833 ( -1.799 -9.604 -0.437) 9.781 23.164 ( -12.044 1.228 1.826) 12.244 ======================= Grid point 566 (262/267) ======================= q-point: (-0.21 -0.21 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.977 ( -15.532 0.000 10.836) 18.938 1.204 ( -16.981 0.000 8.982) 19.210 2.104 ( -8.100 0.000 -18.969) 20.626 2.432 ( -3.195 0.000 -6.135) 6.917 2.762 ( -27.819 0.000 22.357) 35.689 3.171 ( 7.726 -0.000 0.694) 7.758 3.553 ( 12.672 -0.000 -10.180) 16.255 3.556 ( 7.295 -0.000 -0.148) 7.297 3.870 ( -5.556 0.000 0.111) 5.557 4.302 ( -2.666 0.000 0.790) 2.781 4.452 ( -12.680 0.000 -1.664) 12.789 5.232 ( 8.840 -0.000 1.554) 8.976 5.439 ( 17.341 -0.000 9.493) 19.769 5.578 ( -1.456 0.000 -0.306) 1.488 5.987 ( -9.227 0.000 -5.890) 10.946 6.236 ( -1.441 0.000 -3.640) 3.915 6.606 ( 0.400 -0.000 3.136) 3.161 6.909 ( -9.085 0.000 3.846) 9.865 7.285 ( 0.179 -0.000 -0.043) 0.184 9.063 ( -10.159 0.000 0.180) 10.160 9.234 ( 1.083 -0.000 0.280) 1.119 9.548 ( -0.614 0.000 -1.743) 1.848 10.793 ( 2.788 -0.000 -0.165) 2.793 11.245 ( 1.241 -0.000 -1.365) 1.845 11.558 ( 16.311 -0.000 0.497) 16.318 12.147 ( -10.718 0.000 -13.936) 17.581 13.436 ( 8.114 -0.000 -1.532) 8.257 14.144 ( -11.376 0.000 0.153) 11.377 14.233 ( -0.490 0.000 0.088) 0.498 15.773 ( 36.583 -0.000 14.888) 39.496 16.860 ( 0.132 -0.000 0.024) 0.135 17.970 ( -0.012 0.000 -0.037) 0.039 18.468 ( -5.943 0.000 -22.981) 23.737 21.308 ( 21.982 -0.000 16.287) 27.359 22.211 ( -11.083 0.000 -22.763) 25.318 23.257 ( -20.495 0.000 -2.443) 20.640 ======================= Grid point 567 (263/267) ======================= q-point: (-0.14 -0.21 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.005 ( -8.013 -9.280 13.720) 18.400 1.384 ( -12.770 -23.528 8.381) 28.052 2.037 ( -6.894 -5.905 -17.040) 19.307 2.373 ( -8.971 -0.820 -1.472) 9.128 2.741 ( -18.768 -12.071 15.366) 27.093 3.385 ( 8.202 -2.891 -6.756) 11.013 3.697 ( 7.742 -15.589 4.777) 18.049 3.809 ( 7.022 -21.314 -7.780) 23.752 4.167 ( -2.487 -12.526 2.249) 12.967 4.262 ( -5.324 -18.614 -0.598) 19.370 4.478 ( -7.626 -9.845 0.179) 12.454 5.294 ( 5.433 -0.918 -3.434) 6.493 5.544 ( 6.830 0.607 3.621) 7.754 5.742 ( 9.556 -15.210 3.691) 18.338 5.916 ( -5.471 0.534 -2.542) 6.056 6.210 ( -2.411 0.402 -3.955) 4.649 6.466 ( -7.191 10.359 4.140) 13.273 6.859 ( -6.291 -3.410 2.921) 7.729 7.484 ( 7.491 -12.675 0.155) 14.724 8.894 ( -9.630 6.526 -0.100) 11.633 9.205 ( 0.339 3.510 0.209) 3.532 9.566 ( -1.040 -3.244 -0.943) 3.534 10.683 ( -17.979 5.494 0.576) 18.808 11.362 ( 15.514 0.034 -0.941) 15.543 11.615 ( 12.314 5.080 0.330) 13.324 12.629 ( 6.866 -57.454 -19.628) 61.101 13.427 ( 10.033 6.515 -0.470) 11.972 13.960 ( -3.628 9.386 -1.028) 10.115 14.140 ( -7.763 5.984 1.124) 9.866 16.386 ( 31.350 -29.754 14.965) 45.739 16.871 ( 0.954 -0.747 -0.438) 1.288 17.885 ( 3.394 8.479 -0.586) 9.152 18.412 ( -7.371 -3.874 -21.761) 23.300 21.530 ( 20.359 -2.530 14.716) 25.248 21.848 ( -30.551 14.693 -31.532) 46.298 23.143 ( -14.581 -0.744 6.862) 16.132 ======================= Grid point 568 (264/267) ======================= q-point: (-0.07 -0.21 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.236 ( -2.998 -16.273 8.933) 18.804 1.696 ( -9.292 -17.300 4.266) 20.096 2.197 ( -0.459 -12.105 -9.036) 15.113 2.435 ( -9.883 -17.255 -4.488) 20.385 2.921 ( -10.572 -14.726 12.569) 22.058 3.424 ( 5.158 -0.415 -6.072) 7.978 3.938 ( 4.986 -7.615 -2.075) 9.336 4.089 ( -3.749 2.709 3.589) 5.855 4.383 ( 2.991 -23.210 1.891) 23.478 4.606 ( -1.865 -13.958 -1.687) 14.183 4.953 ( -4.228 -32.747 -0.590) 33.024 5.322 ( 1.328 -0.140 -3.225) 3.491 5.650 ( 9.742 -9.392 3.388) 13.950 5.817 ( -4.716 1.213 -7.426) 8.881 6.161 ( -6.627 -2.165 -2.673) 7.467 6.277 ( 2.055 -14.621 3.959) 15.286 6.352 ( -1.583 -17.593 4.532) 18.236 6.984 ( -5.560 -15.244 0.899) 16.251 7.670 ( 7.126 0.693 1.210) 7.261 8.830 ( 1.390 -4.301 -1.028) 4.636 9.122 ( 0.078 5.267 0.411) 5.284 9.658 ( -1.308 -7.820 0.005) 7.929 10.498 ( -22.369 -4.101 0.796) 22.756 11.345 ( 13.683 11.334 -0.111) 17.768 11.566 ( 9.593 8.678 0.300) 12.939 13.199 ( 3.981 8.615 -5.285) 10.862 13.586 ( 7.435 3.834 -2.036) 8.609 13.951 ( -10.863 6.329 1.178) 12.628 14.288 ( 30.864 -55.993 -13.737) 65.395 16.879 ( 2.024 0.821 -1.175) 2.480 17.147 ( 14.788 -21.429 8.927) 27.524 17.840 ( 21.291 -1.153 4.103) 21.713 18.387 ( -11.782 -5.477 -17.152) 21.517 21.209 ( -45.013 13.492 -25.602) 53.513 21.751 ( 19.331 -1.528 13.740) 23.765 23.073 ( -12.937 -0.671 6.287) 14.400 ======================= Grid point 581 (265/267) ======================= q-point: (-0.14 -0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 267 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.934 ( -2.383 0.000 24.608) 24.723 1.017 ( -14.323 0.000 12.543) 19.038 1.913 ( -5.665 0.000 -17.556) 18.447 2.356 ( -3.016 0.000 -7.235) 7.838 2.445 ( -27.523 0.000 23.077) 35.917 3.291 ( 8.350 -0.000 0.231) 8.353 3.653 ( 8.094 -0.000 -15.210) 17.229 3.657 ( 6.139 -0.000 0.253) 6.144 3.781 ( -6.622 0.000 0.388) 6.633 4.265 ( -2.728 0.000 0.605) 2.794 4.302 ( -8.166 0.000 5.302) 9.736 5.296 ( 0.641 -0.000 -6.741) 6.772 5.558 ( -1.134 0.000 -0.298) 1.172 5.736 ( 15.502 -0.000 3.756) 15.951 5.899 ( 0.902 -0.000 4.049) 4.149 6.211 ( 0.217 -0.000 -1.687) 1.701 6.652 ( 4.992 -0.000 5.236) 7.234 6.817 ( -5.840 0.000 2.458) 6.336 7.287 ( 0.119 -0.000 -0.039) 0.125 8.931 ( -6.914 0.000 -0.402) 6.925 9.242 ( 0.009 -0.000 -0.344) 0.344 9.525 ( -1.530 0.000 -0.882) 1.766 10.829 ( 2.195 -0.000 -0.203) 2.204 11.114 ( -20.194 0.000 -11.804) 23.391 11.710 ( 4.169 -0.000 -0.898) 4.265 12.008 ( 0.473 -0.000 -9.869) 9.880 13.547 ( 7.421 -0.000 -0.772) 7.461 13.972 ( -11.421 0.000 0.016) 11.421 14.227 ( -0.383 0.000 0.106) 0.398 16.332 ( 27.361 -0.000 16.411) 31.905 16.862 ( 0.098 -0.000 0.018) 0.100 17.969 ( -0.004 0.000 -0.033) 0.033 18.295 ( -0.188 0.000 -26.281) 26.282 21.375 ( -54.411 0.000 -32.306) 63.278 21.928 ( 24.786 -0.000 0.216) 24.787 23.106 ( -4.214 0.000 16.431) 16.962 ======================= Grid point 582 (266/267) ======================= q-point: (-0.07 -0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 490 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.041 ( -0.089 -7.152 21.158) 22.334 1.275 ( -7.032 -25.167 9.946) 27.960 1.872 ( -7.119 -7.868 -9.784) 14.433 2.223 ( -9.279 -0.565 -0.515) 9.311 2.584 ( -9.911 -16.619 10.726) 22.124 3.456 ( 5.806 0.891 -10.019) 11.614 3.796 ( 1.577 -8.913 -5.409) 10.545 3.860 ( 6.267 -32.922 1.278) 33.538 4.143 ( -2.614 -0.513 3.672) 4.536 4.204 ( -0.916 -29.472 -3.048) 29.643 4.402 ( -3.935 -10.571 3.214) 11.729 5.276 ( -4.488 -1.264 -8.116) 9.360 5.587 ( 0.334 -3.992 -0.111) 4.008 5.830 ( 6.435 -0.233 -7.658) 10.005 6.038 ( 10.976 -8.962 13.219) 19.378 6.173 ( 0.471 6.149 0.686) 6.205 6.365 ( -9.012 14.956 5.923) 18.439 6.790 ( -4.438 -3.427 -0.099) 5.608 7.644 ( 13.885 -15.617 1.038) 20.923 8.816 ( 1.020 2.719 -0.907) 3.042 9.203 ( -0.624 3.484 0.046) 3.540 9.545 ( -1.221 -3.646 -0.285) 3.856 10.341 ( -29.454 9.648 -1.236) 31.019 11.592 ( 16.036 -0.038 -1.132) 16.076 11.757 ( 7.488 1.720 -0.457) 7.697 12.588 ( -0.094 -76.615 -26.737) 81.147 13.583 ( 10.101 -1.378 -0.055) 10.194 13.877 ( -5.355 0.377 -0.600) 5.401 14.072 ( -2.343 12.521 0.088) 12.738 16.773 ( 8.868 -19.420 10.683) 23.873 16.906 ( 4.283 -7.098 2.490) 8.656 17.950 ( 3.443 1.211 1.658) 4.008 18.272 ( 7.765 -0.222 -24.126) 25.346 20.778 ( -76.776 -0.464 -35.426) 84.556 22.103 ( 35.602 7.786 11.575) 38.238 23.056 ( -6.310 5.847 14.568) 16.918 ======================= Grid point 596 (267/267) ======================= q-point: (-0.07 -0.07 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 2.86e-04 2.86e-04 5.83e-04 5.83e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.911 ( -7.637 0.000 13.946) 15.900 1.016 ( -3.573 0.000 20.898) 21.201 1.848 ( 1.855 -0.000 6.216) 6.487 2.190 ( -15.778 0.000 8.787) 18.060 2.285 ( -2.166 0.000 -7.211) 7.529 3.412 ( 7.645 -0.000 -0.145) 7.646 3.652 ( 2.544 -0.000 -19.492) 19.658 3.680 ( -6.828 0.000 1.374) 6.965 3.736 ( 3.938 -0.000 -0.309) 3.950 4.231 ( -1.952 0.000 0.376) 1.988 4.275 ( 0.069 -0.000 9.281) 9.281 5.202 ( -6.982 0.000 -8.320) 10.862 5.543 ( -0.615 0.000 -0.260) 0.667 5.842 ( 3.165 -0.000 -5.348) 6.214 6.077 ( 12.314 -0.000 11.901) 17.125 6.228 ( 0.638 -0.000 2.169) 2.261 6.737 ( -4.044 0.000 -1.199) 4.218 6.888 ( 23.135 -0.000 8.909) 24.791 7.288 ( 0.054 -0.000 -0.029) 0.062 8.880 ( 1.376 -0.000 -1.321) 1.908 9.233 ( -1.174 0.000 -0.389) 1.237 9.502 ( -1.011 0.000 -0.295) 1.053 10.436 ( -59.826 0.000 -19.721) 62.992 10.853 ( 1.181 -0.000 -0.184) 1.195 11.776 ( 6.132 -0.000 0.136) 6.134 11.999 ( -0.769 0.000 -1.478) 1.666 13.630 ( 3.140 -0.000 0.148) 3.143 13.840 ( -5.203 0.000 -0.280) 5.211 14.223 ( -0.199 0.000 0.097) 0.222 16.630 ( 4.601 -0.000 10.902) 11.833 16.863 ( 0.045 -0.000 0.017) 0.048 17.969 ( 0.007 -0.000 -0.033) 0.034 18.340 ( 22.970 -0.000 -20.872) 31.037 20.063 ( -88.379 0.000 -24.753) 91.780 22.437 ( 30.219 -0.000 3.343) 30.403 23.201 ( 6.393 -0.000 14.959) 16.268 =================== 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 3/35280 10.0 661.318 512.139 547.396 0.000 107.090 0.000 3/35280 20.0 193.066 275.747 139.085 0.000 -2.589 0.000 3/35280 30.0 78.448 121.453 48.573 0.000 -3.088 0.000 3/35280 40.0 41.646 67.109 24.347 0.000 -1.856 0.000 3/35280 50.0 26.409 44.126 15.100 0.000 -1.216 0.000 3/35280 60.0 18.804 32.419 10.639 0.000 -0.864 0.000 3/35280 70.0 14.465 25.546 8.124 0.000 -0.652 0.000 3/35280 80.0 11.732 21.078 6.542 0.000 -0.513 0.000 3/35280 90.0 9.878 17.955 5.468 0.000 -0.418 0.000 3/35280 100.0 8.548 15.656 4.695 0.000 -0.349 0.000 3/35280 110.0 7.551 13.895 4.114 0.000 -0.297 0.000 3/35280 120.0 6.777 12.505 3.663 0.000 -0.257 0.000 3/35280 130.0 6.159 11.379 3.303 0.000 -0.226 0.000 3/35280 140.0 5.654 10.449 3.011 0.000 -0.200 0.000 3/35280 150.0 5.234 9.667 2.768 0.000 -0.179 0.000 3/35280 160.0 4.879 9.001 2.565 0.000 -0.161 0.000 3/35280 170.0 4.574 8.425 2.391 0.000 -0.146 0.000 3/35280 180.0 4.309 7.923 2.242 0.000 -0.133 0.000 3/35280 190.0 4.077 7.480 2.111 0.000 -0.121 0.000 3/35280 200.0 3.871 7.087 1.997 0.000 -0.111 0.000 3/35280 210.0 3.688 6.735 1.896 0.000 -0.102 0.000 3/35280 220.0 3.523 6.418 1.805 0.000 -0.094 0.000 3/35280 230.0 3.373 6.131 1.724 0.000 -0.086 0.000 3/35280 240.0 3.237 5.869 1.650 0.000 -0.080 0.000 3/35280 250.0 3.113 5.630 1.584 0.000 -0.074 0.000 3/35280 260.0 2.998 5.410 1.522 0.000 -0.068 0.000 3/35280 270.0 2.893 5.207 1.466 0.000 -0.064 0.000 3/35280 280.0 2.795 5.019 1.415 0.000 -0.059 0.000 3/35280 290.0 2.704 4.845 1.367 0.000 -0.055 0.000 3/35280 300.0 2.619 4.683 1.322 0.000 -0.051 0.000 3/35280 310.0 2.539 4.531 1.281 0.000 -0.048 0.000 3/35280 320.0 2.464 4.389 1.242 0.000 -0.045 0.000 3/35280 330.0 2.394 4.256 1.206 0.000 -0.042 0.000 3/35280 340.0 2.328 4.131 1.172 0.000 -0.039 0.000 3/35280 350.0 2.266 4.013 1.139 0.000 -0.037 0.000 3/35280 360.0 2.206 3.902 1.109 0.000 -0.034 0.000 3/35280 370.0 2.150 3.797 1.080 0.000 -0.032 0.000 3/35280 380.0 2.097 3.698 1.053 0.000 -0.030 0.000 3/35280 390.0 2.047 3.603 1.027 0.000 -0.029 0.000 3/35280 400.0 1.998 3.514 1.003 0.000 -0.027 0.000 3/35280 410.0 1.952 3.429 0.980 0.000 -0.026 0.000 3/35280 420.0 1.909 3.347 0.957 0.000 -0.024 0.000 3/35280 430.0 1.867 3.270 0.936 0.000 -0.023 0.000 3/35280 440.0 1.827 3.196 0.916 0.000 -0.022 0.000 3/35280 450.0 1.788 3.126 0.896 0.000 -0.020 0.000 3/35280 460.0 1.751 3.058 0.878 0.000 -0.019 0.000 3/35280 470.0 1.716 2.993 0.860 0.000 -0.018 0.000 3/35280 480.0 1.682 2.932 0.843 0.000 -0.018 0.000 3/35280 490.0 1.649 2.872 0.826 0.000 -0.017 0.000 3/35280 500.0 1.618 2.815 0.810 0.000 -0.016 0.000 3/35280 510.0 1.588 2.760 0.795 0.000 -0.015 0.000 3/35280 520.0 1.559 2.708 0.781 0.000 -0.014 0.000 3/35280 530.0 1.531 2.657 0.766 0.000 -0.014 0.000 3/35280 540.0 1.503 2.608 0.753 0.000 -0.013 0.000 3/35280 550.0 1.477 2.561 0.740 0.000 -0.013 0.000 3/35280 560.0 1.452 2.515 0.727 0.000 -0.012 0.000 3/35280 570.0 1.428 2.472 0.715 0.000 -0.011 0.000 3/35280 580.0 1.404 2.429 0.703 0.000 -0.011 0.000 3/35280 590.0 1.381 2.388 0.691 0.000 -0.011 0.000 3/35280 600.0 1.359 2.349 0.680 0.000 -0.010 0.000 3/35280 610.0 1.338 2.311 0.670 0.000 -0.010 0.000 3/35280 620.0 1.317 2.274 0.659 0.000 -0.009 0.000 3/35280 630.0 1.297 2.238 0.649 0.000 -0.009 0.000 3/35280 640.0 1.277 2.203 0.639 0.000 -0.009 0.000 3/35280 650.0 1.258 2.169 0.630 0.000 -0.008 0.000 3/35280 660.0 1.240 2.137 0.620 0.000 -0.008 0.000 3/35280 670.0 1.222 2.105 0.612 0.000 -0.008 0.000 3/35280 680.0 1.205 2.074 0.603 0.000 -0.007 0.000 3/35280 690.0 1.188 2.044 0.594 0.000 -0.007 0.000 3/35280 700.0 1.171 2.015 0.586 0.000 -0.007 0.000 3/35280 710.0 1.155 1.987 0.578 0.000 -0.007 0.000 3/35280 720.0 1.140 1.960 0.570 0.000 -0.006 0.000 3/35280 730.0 1.125 1.933 0.563 0.000 -0.006 0.000 3/35280 740.0 1.110 1.907 0.555 0.000 -0.006 0.000 3/35280 750.0 1.095 1.882 0.548 0.000 -0.006 0.000 3/35280 760.0 1.081 1.857 0.541 0.000 -0.006 0.000 3/35280 770.0 1.068 1.833 0.534 0.000 -0.005 0.000 3/35280 780.0 1.054 1.810 0.528 0.000 -0.005 0.000 3/35280 790.0 1.041 1.787 0.521 0.000 -0.005 0.000 3/35280 800.0 1.029 1.765 0.515 0.000 -0.005 0.000 3/35280 810.0 1.016 1.743 0.509 0.000 -0.005 0.000 3/35280 820.0 1.004 1.722 0.502 0.000 -0.005 0.000 3/35280 830.0 0.992 1.701 0.497 0.000 -0.004 0.000 3/35280 840.0 0.981 1.681 0.491 0.000 -0.004 0.000 3/35280 850.0 0.970 1.661 0.485 0.000 -0.004 0.000 3/35280 860.0 0.959 1.642 0.480 0.000 -0.004 0.000 3/35280 870.0 0.948 1.623 0.474 0.000 -0.004 0.000 3/35280 880.0 0.937 1.605 0.469 0.000 -0.004 0.000 3/35280 890.0 0.927 1.587 0.464 0.000 -0.004 0.000 3/35280 900.0 0.917 1.570 0.459 0.000 -0.004 0.000 3/35280 910.0 0.907 1.552 0.454 0.000 -0.004 0.000 3/35280 920.0 0.897 1.536 0.449 0.000 -0.003 0.000 3/35280 930.0 0.888 1.519 0.444 0.000 -0.003 0.000 3/35280 940.0 0.879 1.503 0.440 0.000 -0.003 0.000 3/35280 950.0 0.870 1.487 0.435 0.000 -0.003 0.000 3/35280 960.0 0.861 1.472 0.431 0.000 -0.003 0.000 3/35280 970.0 0.852 1.457 0.426 0.000 -0.003 0.000 3/35280 980.0 0.843 1.442 0.422 0.000 -0.003 0.000 3/35280 990.0 0.835 1.427 0.418 0.000 -0.003 0.000 3/35280 1000.0 0.827 1.413 0.414 0.000 -0.003 0.000 3/35280 Thermal conductivity related properties were written into "kappa-m14145.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 12:29:24]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|