----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 00:11:48]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [3 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2/c (13) Number of symmetry operations in supercell: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.056236650021281 0.000000000000000 0.000000000000000 b 0.000000000000000 5.354282419999999 0.000000000000000 c -0.589079141180753 0.000000000000000 5.201402090886897 Atomic positions (fractional): *1 O 0.73670409380076 0.44018496195652 0.50961589479209 15.999 2 O 0.26329590619924 0.44018496195652 0.99038410520791 15.999 3 O 0.26329590619924 0.55981503804348 0.49038410520791 15.999 4 O 0.73670409380076 0.55981503804348 0.00961589479209 15.999 *5 O 0.24768003896245 0.92459822360454 0.09419074395331 15.999 6 O 0.75231996103755 0.92459822360454 0.40580925604669 15.999 7 O 0.75231996103755 0.07540177639546 0.90580925604669 15.999 8 O 0.24768003896245 0.07540177639546 0.59419074395331 15.999 *9 Tm 0.00000000000000 0.23474172606789 0.25000000000000 168.934 10 Tm 0.00000000000000 0.76525827393211 0.75000000000000 168.934 *11 Ta 0.50000000000000 0.30119863116531 0.75000000000000 180.948 12 Ta 0.50000000000000 0.69880136883469 0.25000000000000 180.948 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.056236650021281 0.000000000000000 0.000000000000000 b 0.000000000000000 5.354282419999999 0.000000000000000 c -0.589079141180753 0.000000000000000 5.201402090886897 Atomic positions (fractional): *1 O 0.73670409380076 0.44018496195652 0.50961589479209 15.999 > 1 2 O 0.26329590619924 0.44018496195652 0.99038410520791 15.999 > 2 3 O 0.26329590619924 0.55981503804348 0.49038410520791 15.999 > 3 4 O 0.73670409380076 0.55981503804348 0.00961589479209 15.999 > 4 *5 O 0.24768003896245 0.92459822360454 0.09419074395331 15.999 > 5 6 O 0.75231996103755 0.92459822360454 0.40580925604669 15.999 > 6 7 O 0.75231996103755 0.07540177639546 0.90580925604669 15.999 > 7 8 O 0.24768003896245 0.07540177639546 0.59419074395331 15.999 > 8 *9 Tm 0.00000000000000 0.23474172606789 0.25000000000000 168.934 > 9 10 Tm 0.00000000000000 0.76525827393211 0.75000000000000 168.934 > 10 *11 Ta 0.50000000000000 0.30119863116531 0.75000000000000 180.948 > 11 12 Ta 0.50000000000000 0.69880136883469 0.25000000000000 180.948 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 15.168709950063844 0.000000000000000 0.000000000000000 b 0.000000000000000 10.708564839999998 0.000000000000000 c -1.178158282361506 0.000000000000000 10.402804181773794 Atomic positions (fractional): *1 O 0.24556803126692 0.22009248097826 0.25480794739604 15.999 > 1 2 O 0.57890136460025 0.22009248097826 0.25480794739604 15.999 > 1 3 O 0.91223469793359 0.22009248097826 0.25480794739604 15.999 > 1 4 O 0.24556803126692 0.72009248097826 0.25480794739604 15.999 > 1 5 O 0.57890136460025 0.72009248097826 0.25480794739604 15.999 > 1 6 O 0.91223469793359 0.72009248097826 0.25480794739604 15.999 > 1 7 O 0.24556803126692 0.22009248097826 0.75480794739604 15.999 > 1 8 O 0.57890136460025 0.22009248097826 0.75480794739604 15.999 > 1 9 O 0.91223469793359 0.22009248097826 0.75480794739604 15.999 > 1 10 O 0.24556803126692 0.72009248097826 0.75480794739604 15.999 > 1 11 O 0.57890136460025 0.72009248097826 0.75480794739604 15.999 > 1 12 O 0.91223469793359 0.72009248097826 0.75480794739604 15.999 > 1 13 O 0.08776530206641 0.22009248097826 0.49519205260396 15.999 > 2 14 O 0.42109863539975 0.22009248097826 0.49519205260396 15.999 > 2 15 O 0.75443196873308 0.22009248097826 0.49519205260396 15.999 > 2 16 O 0.08776530206641 0.72009248097826 0.49519205260396 15.999 > 2 17 O 0.42109863539975 0.72009248097826 0.49519205260396 15.999 > 2 18 O 0.75443196873308 0.72009248097826 0.49519205260396 15.999 > 2 19 O 0.08776530206641 0.22009248097826 0.99519205260396 15.999 > 2 20 O 0.42109863539975 0.22009248097826 0.99519205260396 15.999 > 2 21 O 0.75443196873308 0.22009248097826 0.99519205260396 15.999 > 2 22 O 0.08776530206641 0.72009248097826 0.99519205260396 15.999 > 2 23 O 0.42109863539975 0.72009248097826 0.99519205260396 15.999 > 2 24 O 0.75443196873308 0.72009248097826 0.99519205260396 15.999 > 2 25 O 0.08776530206641 0.27990751902174 0.24519205260396 15.999 > 3 26 O 0.42109863539975 0.27990751902174 0.24519205260396 15.999 > 3 27 O 0.75443196873308 0.27990751902174 0.24519205260396 15.999 > 3 28 O 0.08776530206641 0.77990751902174 0.24519205260396 15.999 > 3 29 O 0.42109863539975 0.77990751902174 0.24519205260396 15.999 > 3 30 O 0.75443196873308 0.77990751902174 0.24519205260396 15.999 > 3 31 O 0.08776530206641 0.27990751902174 0.74519205260396 15.999 > 3 32 O 0.42109863539975 0.27990751902174 0.74519205260396 15.999 > 3 33 O 0.75443196873308 0.27990751902174 0.74519205260396 15.999 > 3 34 O 0.08776530206641 0.77990751902174 0.74519205260396 15.999 > 3 35 O 0.42109863539975 0.77990751902174 0.74519205260396 15.999 > 3 36 O 0.75443196873308 0.77990751902174 0.74519205260396 15.999 > 3 37 O 0.24556803126692 0.27990751902174 0.00480794739604 15.999 > 4 38 O 0.57890136460025 0.27990751902174 0.00480794739604 15.999 > 4 39 O 0.91223469793359 0.27990751902174 0.00480794739604 15.999 > 4 40 O 0.24556803126692 0.77990751902174 0.00480794739604 15.999 > 4 41 O 0.57890136460025 0.77990751902174 0.00480794739604 15.999 > 4 42 O 0.91223469793359 0.77990751902174 0.00480794739604 15.999 > 4 43 O 0.24556803126692 0.27990751902174 0.50480794739604 15.999 > 4 44 O 0.57890136460025 0.27990751902174 0.50480794739604 15.999 > 4 45 O 0.91223469793359 0.27990751902174 0.50480794739604 15.999 > 4 46 O 0.24556803126692 0.77990751902174 0.50480794739604 15.999 > 4 47 O 0.57890136460025 0.77990751902174 0.50480794739604 15.999 > 4 48 O 0.91223469793359 0.77990751902174 0.50480794739604 15.999 > 4 *49 O 0.08256001298748 0.46229911180227 0.04709537197665 15.999 > 5 50 O 0.41589334632082 0.46229911180227 0.04709537197665 15.999 > 5 51 O 0.74922667965415 0.46229911180227 0.04709537197665 15.999 > 5 52 O 0.08256001298748 0.96229911180227 0.04709537197665 15.999 > 5 53 O 0.41589334632082 0.96229911180227 0.04709537197665 15.999 > 5 54 O 0.74922667965415 0.96229911180227 0.04709537197665 15.999 > 5 55 O 0.08256001298748 0.46229911180227 0.54709537197666 15.999 > 5 56 O 0.41589334632082 0.46229911180227 0.54709537197666 15.999 > 5 57 O 0.74922667965415 0.46229911180227 0.54709537197666 15.999 > 5 58 O 0.08256001298748 0.96229911180227 0.54709537197666 15.999 > 5 59 O 0.41589334632082 0.96229911180227 0.54709537197666 15.999 > 5 60 O 0.74922667965415 0.96229911180227 0.54709537197666 15.999 > 5 61 O 0.25077332034585 0.46229911180227 0.20290462802334 15.999 > 6 62 O 0.58410665367918 0.46229911180227 0.20290462802334 15.999 > 6 63 O 0.91743998701252 0.46229911180227 0.20290462802334 15.999 > 6 64 O 0.25077332034585 0.96229911180227 0.20290462802334 15.999 > 6 65 O 0.58410665367918 0.96229911180227 0.20290462802334 15.999 > 6 66 O 0.91743998701252 0.96229911180227 0.20290462802334 15.999 > 6 67 O 0.25077332034585 0.46229911180227 0.70290462802334 15.999 > 6 68 O 0.58410665367918 0.46229911180227 0.70290462802334 15.999 > 6 69 O 0.91743998701252 0.46229911180227 0.70290462802334 15.999 > 6 70 O 0.25077332034585 0.96229911180227 0.70290462802334 15.999 > 6 71 O 0.58410665367918 0.96229911180227 0.70290462802334 15.999 > 6 72 O 0.91743998701252 0.96229911180227 0.70290462802334 15.999 > 6 73 O 0.25077332034585 0.03770088819773 0.45290462802335 15.999 > 7 74 O 0.58410665367918 0.03770088819773 0.45290462802335 15.999 > 7 75 O 0.91743998701252 0.03770088819773 0.45290462802335 15.999 > 7 76 O 0.25077332034585 0.53770088819773 0.45290462802335 15.999 > 7 77 O 0.58410665367918 0.53770088819773 0.45290462802335 15.999 > 7 78 O 0.91743998701252 0.53770088819773 0.45290462802335 15.999 > 7 79 O 0.25077332034585 0.03770088819773 0.95290462802335 15.999 > 7 80 O 0.58410665367918 0.03770088819773 0.95290462802335 15.999 > 7 81 O 0.91743998701252 0.03770088819773 0.95290462802335 15.999 > 7 82 O 0.25077332034585 0.53770088819773 0.95290462802335 15.999 > 7 83 O 0.58410665367918 0.53770088819773 0.95290462802335 15.999 > 7 84 O 0.91743998701252 0.53770088819773 0.95290462802335 15.999 > 7 85 O 0.08256001298748 0.03770088819773 0.29709537197665 15.999 > 8 86 O 0.41589334632082 0.03770088819773 0.29709537197665 15.999 > 8 87 O 0.74922667965415 0.03770088819773 0.29709537197665 15.999 > 8 88 O 0.08256001298748 0.53770088819773 0.29709537197665 15.999 > 8 89 O 0.41589334632082 0.53770088819773 0.29709537197665 15.999 > 8 90 O 0.74922667965415 0.53770088819773 0.29709537197665 15.999 > 8 91 O 0.08256001298748 0.03770088819773 0.79709537197665 15.999 > 8 92 O 0.41589334632082 0.03770088819773 0.79709537197665 15.999 > 8 93 O 0.74922667965415 0.03770088819773 0.79709537197665 15.999 > 8 94 O 0.08256001298748 0.53770088819773 0.79709537197665 15.999 > 8 95 O 0.41589334632082 0.53770088819773 0.79709537197665 15.999 > 8 96 O 0.74922667965415 0.53770088819773 0.79709537197665 15.999 > 8 *97 Tm 0.00000000000000 0.11737086303394 0.12500000000000 168.934 > 9 98 Tm 0.33333333333333 0.11737086303394 0.12500000000000 168.934 > 9 99 Tm 0.66666666666667 0.11737086303394 0.12500000000000 168.934 > 9 100 Tm 0.00000000000000 0.61737086303394 0.12500000000000 168.934 > 9 101 Tm 0.33333333333333 0.61737086303394 0.12500000000000 168.934 > 9 102 Tm 0.66666666666667 0.61737086303394 0.12500000000000 168.934 > 9 103 Tm 0.00000000000000 0.11737086303394 0.62500000000000 168.934 > 9 104 Tm 0.33333333333333 0.11737086303394 0.62500000000000 168.934 > 9 105 Tm 0.66666666666667 0.11737086303394 0.62500000000000 168.934 > 9 106 Tm 0.00000000000000 0.61737086303394 0.62500000000000 168.934 > 9 107 Tm 0.33333333333333 0.61737086303394 0.62500000000000 168.934 > 9 108 Tm 0.66666666666667 0.61737086303394 0.62500000000000 168.934 > 9 109 Tm 0.00000000000000 0.38262913696606 0.37500000000000 168.934 > 10 110 Tm 0.33333333333333 0.38262913696606 0.37500000000000 168.934 > 10 111 Tm 0.66666666666667 0.38262913696606 0.37500000000000 168.934 > 10 112 Tm 0.00000000000000 0.88262913696606 0.37500000000000 168.934 > 10 113 Tm 0.33333333333333 0.88262913696606 0.37500000000000 168.934 > 10 114 Tm 0.66666666666667 0.88262913696606 0.37500000000000 168.934 > 10 115 Tm 0.00000000000000 0.38262913696606 0.87500000000000 168.934 > 10 116 Tm 0.33333333333333 0.38262913696606 0.87500000000000 168.934 > 10 117 Tm 0.66666666666667 0.38262913696606 0.87500000000000 168.934 > 10 118 Tm 0.00000000000000 0.88262913696606 0.87500000000000 168.934 > 10 119 Tm 0.33333333333333 0.88262913696606 0.87500000000000 168.934 > 10 120 Tm 0.66666666666667 0.88262913696606 0.87500000000000 168.934 > 10 *121 Ta 0.16666666666667 0.15059931558265 0.37500000000000 180.948 > 11 122 Ta 0.50000000000000 0.15059931558265 0.37500000000000 180.948 > 11 123 Ta 0.83333333333333 0.15059931558265 0.37500000000000 180.948 > 11 124 Ta 0.16666666666667 0.65059931558265 0.37500000000000 180.948 > 11 125 Ta 0.50000000000000 0.65059931558265 0.37500000000000 180.948 > 11 126 Ta 0.83333333333333 0.65059931558265 0.37500000000000 180.948 > 11 127 Ta 0.16666666666667 0.15059931558265 0.87500000000000 180.948 > 11 128 Ta 0.50000000000000 0.15059931558265 0.87500000000000 180.948 > 11 129 Ta 0.83333333333333 0.15059931558265 0.87500000000000 180.948 > 11 130 Ta 0.16666666666667 0.65059931558265 0.87500000000000 180.948 > 11 131 Ta 0.50000000000000 0.65059931558265 0.87500000000000 180.948 > 11 132 Ta 0.83333333333333 0.65059931558265 0.87500000000000 180.948 > 11 133 Ta 0.16666666666667 0.34940068441735 0.12500000000000 180.948 > 12 134 Ta 0.50000000000000 0.34940068441735 0.12500000000000 180.948 > 12 135 Ta 0.83333333333333 0.34940068441735 0.12500000000000 180.948 > 12 136 Ta 0.16666666666667 0.84940068441735 0.12500000000000 180.948 > 12 137 Ta 0.50000000000000 0.84940068441735 0.12500000000000 180.948 > 12 138 Ta 0.83333333333333 0.84940068441735 0.12500000000000 180.948 > 12 139 Ta 0.16666666666667 0.34940068441735 0.62500000000000 180.948 > 12 140 Ta 0.50000000000000 0.34940068441735 0.62500000000000 180.948 > 12 141 Ta 0.83333333333333 0.34940068441735 0.62500000000000 180.948 > 12 142 Ta 0.16666666666667 0.84940068441735 0.62500000000000 180.948 > 12 143 Ta 0.50000000000000 0.84940068441735 0.62500000000000 180.948 > 12 144 Ta 0.83333333333333 0.84940068441735 0.62500000000000 180.948 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.8758941 0.0000000 0.1847075 0.0000000 4.6893879 0.0000000 0.1847073 0.0000000 4.6872126 -------------------------- Born effective charges -------------------------- 1 O -2.5127081 -0.1186788 0.5313570 -0.0290203 -2.1391699 0.5239250 0.5564248 0.4973149 -2.5550204 2 O -2.5127081 0.1186788 0.5313570 0.0290203 -2.1391699 -0.5239250 0.5564248 -0.4973149 -2.5550204 3 O -2.5127081 -0.1186788 0.5313570 -0.0290203 -2.1391699 0.5239250 0.5564248 0.4973149 -2.5550204 4 O -2.5127081 0.1186788 0.5313570 0.0290203 -2.1391699 -0.5239250 0.5564248 -0.4973149 -2.5550204 5 O -2.5630709 1.0180968 -0.7969752 1.1174278 -2.6067272 0.3065228 -0.8781608 0.2838252 -2.1695160 6 O -2.5630709 -1.0180968 -0.7969752 -1.1174278 -2.6067272 -0.3065228 -0.8781608 -0.2838252 -2.1695160 7 O -2.5630709 1.0180968 -0.7969752 1.1174278 -2.6067272 0.3065228 -0.8781608 0.2838252 -2.1695160 8 O -2.5630709 -1.0180968 -0.7969752 -1.1174278 -2.6067272 -0.3065228 -0.8781608 -0.2838252 -2.1695160 9 Tm 4.6858680 0.0000000 0.1474809 0.0000000 3.8478464 0.0000000 0.1810050 0.0000000 4.0352960 10 Tm 4.6858680 0.0000000 0.1474809 0.0000000 3.8478464 0.0000000 0.1810050 0.0000000 4.0352960 11 Ta 5.4656899 0.0000000 0.3837555 0.0000000 5.6439479 0.0000000 0.4624670 0.0000000 5.4137768 12 Ta 5.4656899 0.0000000 0.3837555 0.0000000 5.6439479 0.0000000 0.4624670 0.0000000 5.4137768 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 432/432 Permutation basis: 8352/8352 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2074 Number of blocks in projector: 2074 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 440 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 262 Use standard eigh solver. Tree of FC basis block matrices: - (2074, 2047), data: False |-- (262, 258), data: True |-- (262, 258), data: True |-- (262, 258), data: True |-- (424, 420), data: True |-- (424, 420), data: True |-- (440, 433), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.005 Solver_block: 100 / 400 - Time: 0.893 Solver_block: 200 / 400 - Time: 0.919 Solver_block: 300 / 400 - Time: 0.945 Solver_block: 400 / 400 - Time: 0.924 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 3.768 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 432/432 Permutation basis: 8352/8352 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2074 Number of blocks in projector: 2074 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 440 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 262 Use standard eigh solver. Tree of FC basis block matrices: - (2074, 2047), data: False |-- (262, 258), data: True |-- (262, 258), data: True |-- (262, 258), data: True |-- (424, 420), data: True |-- (424, 420), data: True |-- (440, 433), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 00:12:14]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 00:12:15]------------------------- 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): [3 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2/c (13) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.056236650021281 0.000000000000000 0.000000000000000 b 0.000000000000000 5.354282419999999 0.000000000000000 c -0.589079141180753 0.000000000000000 5.201402090886897 Atomic positions (fractional): 1 O 0.73670409380076 0.44018496195652 0.50961589479209 15.999 2 O 0.26329590619924 0.44018496195652 0.99038410520791 15.999 3 O 0.26329590619924 0.55981503804348 0.49038410520791 15.999 4 O 0.73670409380076 0.55981503804348 0.00961589479209 15.999 5 O 0.24768003896245 0.92459822360454 0.09419074395331 15.999 6 O 0.75231996103755 0.92459822360454 0.40580925604669 15.999 7 O 0.75231996103755 0.07540177639546 0.90580925604669 15.999 8 O 0.24768003896245 0.07540177639546 0.59419074395331 15.999 9 Tm 0.00000000000000 0.23474172606789 0.25000000000000 168.934 10 Tm 0.00000000000000 0.76525827393211 0.75000000000000 168.934 11 Ta 0.50000000000000 0.30119863116531 0.75000000000000 180.948 12 Ta 0.50000000000000 0.69880136883469 0.25000000000000 180.948 -------------------------------- supercell --------------------------------- Lattice vectors: a 15.168709950063844 0.000000000000000 0.000000000000000 b 0.000000000000000 10.708564839999998 0.000000000000000 c -1.178158282361506 0.000000000000000 10.402804181773794 Atomic positions (fractional): 1 O 0.24556803126692 0.22009248097826 0.25480794739604 15.999 > 1 2 O 0.57890136460025 0.22009248097826 0.25480794739604 15.999 > 1 3 O 0.91223469793359 0.22009248097826 0.25480794739604 15.999 > 1 4 O 0.24556803126692 0.72009248097826 0.25480794739604 15.999 > 1 5 O 0.57890136460025 0.72009248097826 0.25480794739604 15.999 > 1 6 O 0.91223469793359 0.72009248097826 0.25480794739604 15.999 > 1 7 O 0.24556803126692 0.22009248097826 0.75480794739604 15.999 > 1 8 O 0.57890136460025 0.22009248097826 0.75480794739604 15.999 > 1 9 O 0.91223469793359 0.22009248097826 0.75480794739604 15.999 > 1 10 O 0.24556803126692 0.72009248097826 0.75480794739604 15.999 > 1 11 O 0.57890136460025 0.72009248097826 0.75480794739604 15.999 > 1 12 O 0.91223469793359 0.72009248097826 0.75480794739604 15.999 > 1 13 O 0.08776530206641 0.22009248097826 0.49519205260396 15.999 > 13 14 O 0.42109863539975 0.22009248097826 0.49519205260396 15.999 > 13 15 O 0.75443196873308 0.22009248097826 0.49519205260396 15.999 > 13 16 O 0.08776530206641 0.72009248097826 0.49519205260396 15.999 > 13 17 O 0.42109863539975 0.72009248097826 0.49519205260396 15.999 > 13 18 O 0.75443196873308 0.72009248097826 0.49519205260396 15.999 > 13 19 O 0.08776530206641 0.22009248097826 0.99519205260396 15.999 > 13 20 O 0.42109863539975 0.22009248097826 0.99519205260396 15.999 > 13 21 O 0.75443196873308 0.22009248097826 0.99519205260396 15.999 > 13 22 O 0.08776530206641 0.72009248097826 0.99519205260396 15.999 > 13 23 O 0.42109863539975 0.72009248097826 0.99519205260396 15.999 > 13 24 O 0.75443196873308 0.72009248097826 0.99519205260396 15.999 > 13 25 O 0.08776530206641 0.27990751902174 0.24519205260396 15.999 > 25 26 O 0.42109863539975 0.27990751902174 0.24519205260396 15.999 > 25 27 O 0.75443196873308 0.27990751902174 0.24519205260396 15.999 > 25 28 O 0.08776530206641 0.77990751902174 0.24519205260396 15.999 > 25 29 O 0.42109863539975 0.77990751902174 0.24519205260396 15.999 > 25 30 O 0.75443196873308 0.77990751902174 0.24519205260396 15.999 > 25 31 O 0.08776530206641 0.27990751902174 0.74519205260396 15.999 > 25 32 O 0.42109863539975 0.27990751902174 0.74519205260396 15.999 > 25 33 O 0.75443196873308 0.27990751902174 0.74519205260396 15.999 > 25 34 O 0.08776530206641 0.77990751902174 0.74519205260396 15.999 > 25 35 O 0.42109863539975 0.77990751902174 0.74519205260396 15.999 > 25 36 O 0.75443196873308 0.77990751902174 0.74519205260396 15.999 > 25 37 O 0.24556803126692 0.27990751902174 0.00480794739604 15.999 > 37 38 O 0.57890136460025 0.27990751902174 0.00480794739604 15.999 > 37 39 O 0.91223469793359 0.27990751902174 0.00480794739604 15.999 > 37 40 O 0.24556803126692 0.77990751902174 0.00480794739604 15.999 > 37 41 O 0.57890136460025 0.77990751902174 0.00480794739604 15.999 > 37 42 O 0.91223469793359 0.77990751902174 0.00480794739604 15.999 > 37 43 O 0.24556803126692 0.27990751902174 0.50480794739604 15.999 > 37 44 O 0.57890136460025 0.27990751902174 0.50480794739604 15.999 > 37 45 O 0.91223469793359 0.27990751902174 0.50480794739604 15.999 > 37 46 O 0.24556803126692 0.77990751902174 0.50480794739604 15.999 > 37 47 O 0.57890136460025 0.77990751902174 0.50480794739604 15.999 > 37 48 O 0.91223469793359 0.77990751902174 0.50480794739604 15.999 > 37 49 O 0.08256001298748 0.46229911180227 0.04709537197665 15.999 > 49 50 O 0.41589334632082 0.46229911180227 0.04709537197665 15.999 > 49 51 O 0.74922667965415 0.46229911180227 0.04709537197665 15.999 > 49 52 O 0.08256001298748 0.96229911180227 0.04709537197665 15.999 > 49 53 O 0.41589334632082 0.96229911180227 0.04709537197665 15.999 > 49 54 O 0.74922667965415 0.96229911180227 0.04709537197665 15.999 > 49 55 O 0.08256001298748 0.46229911180227 0.54709537197666 15.999 > 49 56 O 0.41589334632082 0.46229911180227 0.54709537197666 15.999 > 49 57 O 0.74922667965415 0.46229911180227 0.54709537197666 15.999 > 49 58 O 0.08256001298748 0.96229911180227 0.54709537197666 15.999 > 49 59 O 0.41589334632082 0.96229911180227 0.54709537197666 15.999 > 49 60 O 0.74922667965415 0.96229911180227 0.54709537197666 15.999 > 49 61 O 0.25077332034585 0.46229911180227 0.20290462802334 15.999 > 61 62 O 0.58410665367918 0.46229911180227 0.20290462802334 15.999 > 61 63 O 0.91743998701252 0.46229911180227 0.20290462802334 15.999 > 61 64 O 0.25077332034585 0.96229911180227 0.20290462802334 15.999 > 61 65 O 0.58410665367918 0.96229911180227 0.20290462802334 15.999 > 61 66 O 0.91743998701252 0.96229911180227 0.20290462802334 15.999 > 61 67 O 0.25077332034585 0.46229911180227 0.70290462802334 15.999 > 61 68 O 0.58410665367918 0.46229911180227 0.70290462802334 15.999 > 61 69 O 0.91743998701252 0.46229911180227 0.70290462802334 15.999 > 61 70 O 0.25077332034585 0.96229911180227 0.70290462802334 15.999 > 61 71 O 0.58410665367918 0.96229911180227 0.70290462802334 15.999 > 61 72 O 0.91743998701252 0.96229911180227 0.70290462802334 15.999 > 61 73 O 0.25077332034585 0.03770088819773 0.45290462802335 15.999 > 73 74 O 0.58410665367918 0.03770088819773 0.45290462802335 15.999 > 73 75 O 0.91743998701252 0.03770088819773 0.45290462802335 15.999 > 73 76 O 0.25077332034585 0.53770088819773 0.45290462802335 15.999 > 73 77 O 0.58410665367918 0.53770088819773 0.45290462802335 15.999 > 73 78 O 0.91743998701252 0.53770088819773 0.45290462802335 15.999 > 73 79 O 0.25077332034585 0.03770088819773 0.95290462802335 15.999 > 73 80 O 0.58410665367918 0.03770088819773 0.95290462802335 15.999 > 73 81 O 0.91743998701252 0.03770088819773 0.95290462802335 15.999 > 73 82 O 0.25077332034585 0.53770088819773 0.95290462802335 15.999 > 73 83 O 0.58410665367918 0.53770088819773 0.95290462802335 15.999 > 73 84 O 0.91743998701252 0.53770088819773 0.95290462802335 15.999 > 73 85 O 0.08256001298748 0.03770088819773 0.29709537197665 15.999 > 85 86 O 0.41589334632082 0.03770088819773 0.29709537197665 15.999 > 85 87 O 0.74922667965415 0.03770088819773 0.29709537197665 15.999 > 85 88 O 0.08256001298748 0.53770088819773 0.29709537197665 15.999 > 85 89 O 0.41589334632082 0.53770088819773 0.29709537197665 15.999 > 85 90 O 0.74922667965415 0.53770088819773 0.29709537197665 15.999 > 85 91 O 0.08256001298748 0.03770088819773 0.79709537197665 15.999 > 85 92 O 0.41589334632082 0.03770088819773 0.79709537197665 15.999 > 85 93 O 0.74922667965415 0.03770088819773 0.79709537197665 15.999 > 85 94 O 0.08256001298748 0.53770088819773 0.79709537197665 15.999 > 85 95 O 0.41589334632082 0.53770088819773 0.79709537197665 15.999 > 85 96 O 0.74922667965415 0.53770088819773 0.79709537197665 15.999 > 85 97 Tm 0.00000000000000 0.11737086303394 0.12500000000000 168.934 > 97 98 Tm 0.33333333333333 0.11737086303394 0.12500000000000 168.934 > 97 99 Tm 0.66666666666667 0.11737086303394 0.12500000000000 168.934 > 97 100 Tm 0.00000000000000 0.61737086303394 0.12500000000000 168.934 > 97 101 Tm 0.33333333333333 0.61737086303394 0.12500000000000 168.934 > 97 102 Tm 0.66666666666667 0.61737086303394 0.12500000000000 168.934 > 97 103 Tm 0.00000000000000 0.11737086303394 0.62500000000000 168.934 > 97 104 Tm 0.33333333333333 0.11737086303394 0.62500000000000 168.934 > 97 105 Tm 0.66666666666667 0.11737086303394 0.62500000000000 168.934 > 97 106 Tm 0.00000000000000 0.61737086303394 0.62500000000000 168.934 > 97 107 Tm 0.33333333333333 0.61737086303394 0.62500000000000 168.934 > 97 108 Tm 0.66666666666667 0.61737086303394 0.62500000000000 168.934 > 97 109 Tm 0.00000000000000 0.38262913696606 0.37500000000000 168.934 > 109 110 Tm 0.33333333333333 0.38262913696606 0.37500000000000 168.934 > 109 111 Tm 0.66666666666667 0.38262913696606 0.37500000000000 168.934 > 109 112 Tm 0.00000000000000 0.88262913696606 0.37500000000000 168.934 > 109 113 Tm 0.33333333333333 0.88262913696606 0.37500000000000 168.934 > 109 114 Tm 0.66666666666667 0.88262913696606 0.37500000000000 168.934 > 109 115 Tm 0.00000000000000 0.38262913696606 0.87500000000000 168.934 > 109 116 Tm 0.33333333333333 0.38262913696606 0.87500000000000 168.934 > 109 117 Tm 0.66666666666667 0.38262913696606 0.87500000000000 168.934 > 109 118 Tm 0.00000000000000 0.88262913696606 0.87500000000000 168.934 > 109 119 Tm 0.33333333333333 0.88262913696606 0.87500000000000 168.934 > 109 120 Tm 0.66666666666667 0.88262913696606 0.87500000000000 168.934 > 109 121 Ta 0.16666666666667 0.15059931558265 0.37500000000000 180.948 > 121 122 Ta 0.50000000000000 0.15059931558265 0.37500000000000 180.948 > 121 123 Ta 0.83333333333333 0.15059931558265 0.37500000000000 180.948 > 121 124 Ta 0.16666666666667 0.65059931558265 0.37500000000000 180.948 > 121 125 Ta 0.50000000000000 0.65059931558265 0.37500000000000 180.948 > 121 126 Ta 0.83333333333333 0.65059931558265 0.37500000000000 180.948 > 121 127 Ta 0.16666666666667 0.15059931558265 0.87500000000000 180.948 > 121 128 Ta 0.50000000000000 0.15059931558265 0.87500000000000 180.948 > 121 129 Ta 0.83333333333333 0.15059931558265 0.87500000000000 180.948 > 121 130 Ta 0.16666666666667 0.65059931558265 0.87500000000000 180.948 > 121 131 Ta 0.50000000000000 0.65059931558265 0.87500000000000 180.948 > 121 132 Ta 0.83333333333333 0.65059931558265 0.87500000000000 180.948 > 121 133 Ta 0.16666666666667 0.34940068441735 0.12500000000000 180.948 > 133 134 Ta 0.50000000000000 0.34940068441735 0.12500000000000 180.948 > 133 135 Ta 0.83333333333333 0.34940068441735 0.12500000000000 180.948 > 133 136 Ta 0.16666666666667 0.84940068441735 0.12500000000000 180.948 > 133 137 Ta 0.50000000000000 0.84940068441735 0.12500000000000 180.948 > 133 138 Ta 0.83333333333333 0.84940068441735 0.12500000000000 180.948 > 133 139 Ta 0.16666666666667 0.34940068441735 0.62500000000000 180.948 > 133 140 Ta 0.50000000000000 0.34940068441735 0.62500000000000 180.948 > 133 141 Ta 0.83333333333333 0.34940068441735 0.62500000000000 180.948 > 133 142 Ta 0.16666666666667 0.84940068441735 0.62500000000000 180.948 > 133 143 Ta 0.50000000000000 0.84940068441735 0.62500000000000 180.948 > 133 144 Ta 0.83333333333333 0.84940068441735 0.62500000000000 180.948 > 133 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.8758941 0.0000000 0.1847075 0.0000000 4.6893879 0.0000000 0.1847073 0.0000000 4.6872126 -------------------------- Born effective charges -------------------------- 1 O -2.5127081 -0.1186788 0.5313570 -0.0290203 -2.1391699 0.5239250 0.5564248 0.4973149 -2.5550204 2 O -2.5127081 0.1186788 0.5313570 0.0290203 -2.1391699 -0.5239250 0.5564248 -0.4973149 -2.5550204 3 O -2.5127081 -0.1186788 0.5313570 -0.0290203 -2.1391699 0.5239250 0.5564248 0.4973149 -2.5550204 4 O -2.5127081 0.1186788 0.5313570 0.0290203 -2.1391699 -0.5239250 0.5564248 -0.4973149 -2.5550204 5 O -2.5630709 1.0180968 -0.7969752 1.1174278 -2.6067272 0.3065228 -0.8781608 0.2838252 -2.1695160 6 O -2.5630709 -1.0180968 -0.7969752 -1.1174278 -2.6067272 -0.3065228 -0.8781608 -0.2838252 -2.1695160 7 O -2.5630709 1.0180968 -0.7969752 1.1174278 -2.6067272 0.3065228 -0.8781608 0.2838252 -2.1695160 8 O -2.5630709 -1.0180968 -0.7969752 -1.1174278 -2.6067272 -0.3065228 -0.8781608 -0.2838252 -2.1695160 9 Tm 4.6858680 0.0000000 0.1474809 0.0000000 3.8478464 0.0000000 0.1810050 0.0000000 4.0352960 10 Tm 4.6858680 0.0000000 0.1474809 0.0000000 3.8478464 0.0000000 0.1810050 0.0000000 4.0352960 11 Ta 5.4656899 0.0000000 0.3837555 0.0000000 5.6439479 0.0000000 0.4624670 0.0000000 5.4137768 12 Ta 5.4656899 0.0000000 0.3837555 0.0000000 5.6439479 0.0000000 0.4624670 0.0000000 5.4137768 ---------------------------------------------------------------------------- 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] [-0.0011 0.0000 0.0099] [ 0.0011 0.0000 -0.0099] 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] [-0.0011 0.0000 0.0099] [ 0.0011 0.0000 -0.0099] Computing fc3[ 97, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0011 0.0000 0.0099] [ 0.0011 0.0000 -0.0099] Computing fc3[ 121, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0011 0.0000 0.0099] [ 0.0011 0.0000 -0.0099] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000005 (yyy) 0.00000005 (yyy) 0.00000005 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000002 (zx) -0.00000002 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 00:12:40]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 00:12:40]------------------------- 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): [3 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2/c (13) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.056236650021281 0.000000000000000 0.000000000000000 b 0.000000000000000 5.354282419999999 0.000000000000000 c -0.589079141180753 0.000000000000000 5.201402090886897 Atomic positions (fractional): 1 O 0.73670409380076 0.44018496195652 0.50961589479209 15.999 2 O 0.26329590619924 0.44018496195652 0.99038410520791 15.999 3 O 0.26329590619924 0.55981503804348 0.49038410520791 15.999 4 O 0.73670409380076 0.55981503804348 0.00961589479209 15.999 5 O 0.24768003896245 0.92459822360454 0.09419074395331 15.999 6 O 0.75231996103755 0.92459822360454 0.40580925604669 15.999 7 O 0.75231996103755 0.07540177639546 0.90580925604669 15.999 8 O 0.24768003896245 0.07540177639546 0.59419074395331 15.999 9 Tm 0.00000000000000 0.23474172606789 0.25000000000000 168.934 10 Tm 0.00000000000000 0.76525827393211 0.75000000000000 168.934 11 Ta 0.50000000000000 0.30119863116531 0.75000000000000 180.948 12 Ta 0.50000000000000 0.69880136883469 0.25000000000000 180.948 -------------------------------- supercell --------------------------------- Lattice vectors: a 15.168709950063844 0.000000000000000 0.000000000000000 b 0.000000000000000 10.708564839999998 0.000000000000000 c -1.178158282361506 0.000000000000000 10.402804181773794 Atomic positions (fractional): 1 O 0.24556803126692 0.22009248097826 0.25480794739604 15.999 > 1 2 O 0.57890136460025 0.22009248097826 0.25480794739604 15.999 > 1 3 O 0.91223469793359 0.22009248097826 0.25480794739604 15.999 > 1 4 O 0.24556803126692 0.72009248097826 0.25480794739604 15.999 > 1 5 O 0.57890136460025 0.72009248097826 0.25480794739604 15.999 > 1 6 O 0.91223469793359 0.72009248097826 0.25480794739604 15.999 > 1 7 O 0.24556803126692 0.22009248097826 0.75480794739604 15.999 > 1 8 O 0.57890136460025 0.22009248097826 0.75480794739604 15.999 > 1 9 O 0.91223469793359 0.22009248097826 0.75480794739604 15.999 > 1 10 O 0.24556803126692 0.72009248097826 0.75480794739604 15.999 > 1 11 O 0.57890136460025 0.72009248097826 0.75480794739604 15.999 > 1 12 O 0.91223469793359 0.72009248097826 0.75480794739604 15.999 > 1 13 O 0.08776530206641 0.22009248097826 0.49519205260396 15.999 > 13 14 O 0.42109863539975 0.22009248097826 0.49519205260396 15.999 > 13 15 O 0.75443196873308 0.22009248097826 0.49519205260396 15.999 > 13 16 O 0.08776530206641 0.72009248097826 0.49519205260396 15.999 > 13 17 O 0.42109863539975 0.72009248097826 0.49519205260396 15.999 > 13 18 O 0.75443196873308 0.72009248097826 0.49519205260396 15.999 > 13 19 O 0.08776530206641 0.22009248097826 0.99519205260396 15.999 > 13 20 O 0.42109863539975 0.22009248097826 0.99519205260396 15.999 > 13 21 O 0.75443196873308 0.22009248097826 0.99519205260396 15.999 > 13 22 O 0.08776530206641 0.72009248097826 0.99519205260396 15.999 > 13 23 O 0.42109863539975 0.72009248097826 0.99519205260396 15.999 > 13 24 O 0.75443196873308 0.72009248097826 0.99519205260396 15.999 > 13 25 O 0.08776530206641 0.27990751902174 0.24519205260396 15.999 > 25 26 O 0.42109863539975 0.27990751902174 0.24519205260396 15.999 > 25 27 O 0.75443196873308 0.27990751902174 0.24519205260396 15.999 > 25 28 O 0.08776530206641 0.77990751902174 0.24519205260396 15.999 > 25 29 O 0.42109863539975 0.77990751902174 0.24519205260396 15.999 > 25 30 O 0.75443196873308 0.77990751902174 0.24519205260396 15.999 > 25 31 O 0.08776530206641 0.27990751902174 0.74519205260396 15.999 > 25 32 O 0.42109863539975 0.27990751902174 0.74519205260396 15.999 > 25 33 O 0.75443196873308 0.27990751902174 0.74519205260396 15.999 > 25 34 O 0.08776530206641 0.77990751902174 0.74519205260396 15.999 > 25 35 O 0.42109863539975 0.77990751902174 0.74519205260396 15.999 > 25 36 O 0.75443196873308 0.77990751902174 0.74519205260396 15.999 > 25 37 O 0.24556803126692 0.27990751902174 0.00480794739604 15.999 > 37 38 O 0.57890136460025 0.27990751902174 0.00480794739604 15.999 > 37 39 O 0.91223469793359 0.27990751902174 0.00480794739604 15.999 > 37 40 O 0.24556803126692 0.77990751902174 0.00480794739604 15.999 > 37 41 O 0.57890136460025 0.77990751902174 0.00480794739604 15.999 > 37 42 O 0.91223469793359 0.77990751902174 0.00480794739604 15.999 > 37 43 O 0.24556803126692 0.27990751902174 0.50480794739604 15.999 > 37 44 O 0.57890136460025 0.27990751902174 0.50480794739604 15.999 > 37 45 O 0.91223469793359 0.27990751902174 0.50480794739604 15.999 > 37 46 O 0.24556803126692 0.77990751902174 0.50480794739604 15.999 > 37 47 O 0.57890136460025 0.77990751902174 0.50480794739604 15.999 > 37 48 O 0.91223469793359 0.77990751902174 0.50480794739604 15.999 > 37 49 O 0.08256001298748 0.46229911180227 0.04709537197665 15.999 > 49 50 O 0.41589334632082 0.46229911180227 0.04709537197665 15.999 > 49 51 O 0.74922667965415 0.46229911180227 0.04709537197665 15.999 > 49 52 O 0.08256001298748 0.96229911180227 0.04709537197665 15.999 > 49 53 O 0.41589334632082 0.96229911180227 0.04709537197665 15.999 > 49 54 O 0.74922667965415 0.96229911180227 0.04709537197665 15.999 > 49 55 O 0.08256001298748 0.46229911180227 0.54709537197666 15.999 > 49 56 O 0.41589334632082 0.46229911180227 0.54709537197666 15.999 > 49 57 O 0.74922667965415 0.46229911180227 0.54709537197666 15.999 > 49 58 O 0.08256001298748 0.96229911180227 0.54709537197666 15.999 > 49 59 O 0.41589334632082 0.96229911180227 0.54709537197666 15.999 > 49 60 O 0.74922667965415 0.96229911180227 0.54709537197666 15.999 > 49 61 O 0.25077332034585 0.46229911180227 0.20290462802334 15.999 > 61 62 O 0.58410665367918 0.46229911180227 0.20290462802334 15.999 > 61 63 O 0.91743998701252 0.46229911180227 0.20290462802334 15.999 > 61 64 O 0.25077332034585 0.96229911180227 0.20290462802334 15.999 > 61 65 O 0.58410665367918 0.96229911180227 0.20290462802334 15.999 > 61 66 O 0.91743998701252 0.96229911180227 0.20290462802334 15.999 > 61 67 O 0.25077332034585 0.46229911180227 0.70290462802334 15.999 > 61 68 O 0.58410665367918 0.46229911180227 0.70290462802334 15.999 > 61 69 O 0.91743998701252 0.46229911180227 0.70290462802334 15.999 > 61 70 O 0.25077332034585 0.96229911180227 0.70290462802334 15.999 > 61 71 O 0.58410665367918 0.96229911180227 0.70290462802334 15.999 > 61 72 O 0.91743998701252 0.96229911180227 0.70290462802334 15.999 > 61 73 O 0.25077332034585 0.03770088819773 0.45290462802335 15.999 > 73 74 O 0.58410665367918 0.03770088819773 0.45290462802335 15.999 > 73 75 O 0.91743998701252 0.03770088819773 0.45290462802335 15.999 > 73 76 O 0.25077332034585 0.53770088819773 0.45290462802335 15.999 > 73 77 O 0.58410665367918 0.53770088819773 0.45290462802335 15.999 > 73 78 O 0.91743998701252 0.53770088819773 0.45290462802335 15.999 > 73 79 O 0.25077332034585 0.03770088819773 0.95290462802335 15.999 > 73 80 O 0.58410665367918 0.03770088819773 0.95290462802335 15.999 > 73 81 O 0.91743998701252 0.03770088819773 0.95290462802335 15.999 > 73 82 O 0.25077332034585 0.53770088819773 0.95290462802335 15.999 > 73 83 O 0.58410665367918 0.53770088819773 0.95290462802335 15.999 > 73 84 O 0.91743998701252 0.53770088819773 0.95290462802335 15.999 > 73 85 O 0.08256001298748 0.03770088819773 0.29709537197665 15.999 > 85 86 O 0.41589334632082 0.03770088819773 0.29709537197665 15.999 > 85 87 O 0.74922667965415 0.03770088819773 0.29709537197665 15.999 > 85 88 O 0.08256001298748 0.53770088819773 0.29709537197665 15.999 > 85 89 O 0.41589334632082 0.53770088819773 0.29709537197665 15.999 > 85 90 O 0.74922667965415 0.53770088819773 0.29709537197665 15.999 > 85 91 O 0.08256001298748 0.03770088819773 0.79709537197665 15.999 > 85 92 O 0.41589334632082 0.03770088819773 0.79709537197665 15.999 > 85 93 O 0.74922667965415 0.03770088819773 0.79709537197665 15.999 > 85 94 O 0.08256001298748 0.53770088819773 0.79709537197665 15.999 > 85 95 O 0.41589334632082 0.53770088819773 0.79709537197665 15.999 > 85 96 O 0.74922667965415 0.53770088819773 0.79709537197665 15.999 > 85 97 Tm 0.00000000000000 0.11737086303394 0.12500000000000 168.934 > 97 98 Tm 0.33333333333333 0.11737086303394 0.12500000000000 168.934 > 97 99 Tm 0.66666666666667 0.11737086303394 0.12500000000000 168.934 > 97 100 Tm 0.00000000000000 0.61737086303394 0.12500000000000 168.934 > 97 101 Tm 0.33333333333333 0.61737086303394 0.12500000000000 168.934 > 97 102 Tm 0.66666666666667 0.61737086303394 0.12500000000000 168.934 > 97 103 Tm 0.00000000000000 0.11737086303394 0.62500000000000 168.934 > 97 104 Tm 0.33333333333333 0.11737086303394 0.62500000000000 168.934 > 97 105 Tm 0.66666666666667 0.11737086303394 0.62500000000000 168.934 > 97 106 Tm 0.00000000000000 0.61737086303394 0.62500000000000 168.934 > 97 107 Tm 0.33333333333333 0.61737086303394 0.62500000000000 168.934 > 97 108 Tm 0.66666666666667 0.61737086303394 0.62500000000000 168.934 > 97 109 Tm 0.00000000000000 0.38262913696606 0.37500000000000 168.934 > 109 110 Tm 0.33333333333333 0.38262913696606 0.37500000000000 168.934 > 109 111 Tm 0.66666666666667 0.38262913696606 0.37500000000000 168.934 > 109 112 Tm 0.00000000000000 0.88262913696606 0.37500000000000 168.934 > 109 113 Tm 0.33333333333333 0.88262913696606 0.37500000000000 168.934 > 109 114 Tm 0.66666666666667 0.88262913696606 0.37500000000000 168.934 > 109 115 Tm 0.00000000000000 0.38262913696606 0.87500000000000 168.934 > 109 116 Tm 0.33333333333333 0.38262913696606 0.87500000000000 168.934 > 109 117 Tm 0.66666666666667 0.38262913696606 0.87500000000000 168.934 > 109 118 Tm 0.00000000000000 0.88262913696606 0.87500000000000 168.934 > 109 119 Tm 0.33333333333333 0.88262913696606 0.87500000000000 168.934 > 109 120 Tm 0.66666666666667 0.88262913696606 0.87500000000000 168.934 > 109 121 Ta 0.16666666666667 0.15059931558265 0.37500000000000 180.948 > 121 122 Ta 0.50000000000000 0.15059931558265 0.37500000000000 180.948 > 121 123 Ta 0.83333333333333 0.15059931558265 0.37500000000000 180.948 > 121 124 Ta 0.16666666666667 0.65059931558265 0.37500000000000 180.948 > 121 125 Ta 0.50000000000000 0.65059931558265 0.37500000000000 180.948 > 121 126 Ta 0.83333333333333 0.65059931558265 0.37500000000000 180.948 > 121 127 Ta 0.16666666666667 0.15059931558265 0.87500000000000 180.948 > 121 128 Ta 0.50000000000000 0.15059931558265 0.87500000000000 180.948 > 121 129 Ta 0.83333333333333 0.15059931558265 0.87500000000000 180.948 > 121 130 Ta 0.16666666666667 0.65059931558265 0.87500000000000 180.948 > 121 131 Ta 0.50000000000000 0.65059931558265 0.87500000000000 180.948 > 121 132 Ta 0.83333333333333 0.65059931558265 0.87500000000000 180.948 > 121 133 Ta 0.16666666666667 0.34940068441735 0.12500000000000 180.948 > 133 134 Ta 0.50000000000000 0.34940068441735 0.12500000000000 180.948 > 133 135 Ta 0.83333333333333 0.34940068441735 0.12500000000000 180.948 > 133 136 Ta 0.16666666666667 0.84940068441735 0.12500000000000 180.948 > 133 137 Ta 0.50000000000000 0.84940068441735 0.12500000000000 180.948 > 133 138 Ta 0.83333333333333 0.84940068441735 0.12500000000000 180.948 > 133 139 Ta 0.16666666666667 0.34940068441735 0.62500000000000 180.948 > 133 140 Ta 0.50000000000000 0.34940068441735 0.62500000000000 180.948 > 133 141 Ta 0.83333333333333 0.34940068441735 0.62500000000000 180.948 > 133 142 Ta 0.16666666666667 0.84940068441735 0.62500000000000 180.948 > 133 143 Ta 0.50000000000000 0.84940068441735 0.62500000000000 180.948 > 133 144 Ta 0.83333333333333 0.84940068441735 0.62500000000000 180.948 > 133 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.8758941 0.0000000 0.1847075 0.0000000 4.6893879 0.0000000 0.1847073 0.0000000 4.6872126 -------------------------- Born effective charges -------------------------- 1 O -2.5127081 -0.1186788 0.5313570 -0.0290203 -2.1391699 0.5239250 0.5564248 0.4973149 -2.5550204 2 O -2.5127081 0.1186788 0.5313570 0.0290203 -2.1391699 -0.5239250 0.5564248 -0.4973149 -2.5550204 3 O -2.5127081 -0.1186788 0.5313570 -0.0290203 -2.1391699 0.5239250 0.5564248 0.4973149 -2.5550204 4 O -2.5127081 0.1186788 0.5313570 0.0290203 -2.1391699 -0.5239250 0.5564248 -0.4973149 -2.5550204 5 O -2.5630709 1.0180968 -0.7969752 1.1174278 -2.6067272 0.3065228 -0.8781608 0.2838252 -2.1695160 6 O -2.5630709 -1.0180968 -0.7969752 -1.1174278 -2.6067272 -0.3065228 -0.8781608 -0.2838252 -2.1695160 7 O -2.5630709 1.0180968 -0.7969752 1.1174278 -2.6067272 0.3065228 -0.8781608 0.2838252 -2.1695160 8 O -2.5630709 -1.0180968 -0.7969752 -1.1174278 -2.6067272 -0.3065228 -0.8781608 -0.2838252 -2.1695160 9 Tm 4.6858680 0.0000000 0.1474809 0.0000000 3.8478464 0.0000000 0.1810050 0.0000000 4.0352960 10 Tm 4.6858680 0.0000000 0.1474809 0.0000000 3.8478464 0.0000000 0.1810050 0.0000000 4.0352960 11 Ta 5.4656899 0.0000000 0.3837555 0.0000000 5.6439479 0.0000000 0.4624670 0.0000000 5.4137768 12 Ta 5.4656899 0.0000000 0.3837555 0.0000000 5.6439479 0.0000000 0.4624670 0.0000000 5.4137768 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000005 (yyy) 0.00000005 (yyy) 0.00000005 (yyy) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 10 9 10 ] 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: 0.80, Number of G-points: 295, Lambda: 0.18 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/260) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 3.249 ( 0.000 0.000 0.000) 0.000 3.274 ( 0.000 0.000 0.000) 0.000 3.681 ( 0.000 0.000 0.000) 0.000 4.058 ( 0.000 0.000 0.000) 0.000 4.143 ( 0.000 0.000 0.000) 0.000 4.346 ( 0.000 0.000 0.000) 0.000 4.442 ( 0.000 0.000 0.000) 0.000 5.323 ( 0.000 0.000 0.000) 0.000 5.340 ( 0.000 0.000 0.000) 0.000 5.665 ( 0.000 0.000 0.000) 0.000 6.574 ( 0.000 0.000 0.000) 0.000 7.737 ( 0.000 0.000 0.000) 0.000 7.792 ( 0.000 0.000 0.000) 0.000 8.404 ( 0.000 0.000 0.000) 0.000 8.434 ( 0.000 0.000 0.000) 0.000 9.277 ( 0.000 0.000 0.000) 0.000 9.440 ( 0.000 0.000 0.000) 0.000 10.654 ( 0.000 0.000 0.000) 0.000 11.481 ( 0.000 0.000 0.000) 0.000 12.296 ( 0.000 0.000 0.000) 0.000 12.301 ( 0.000 0.000 0.000) 0.000 12.915 ( 0.000 0.000 0.000) 0.000 14.966 ( 0.000 0.000 0.000) 0.000 15.065 ( 0.000 0.000 0.000) 0.000 16.259 ( 0.000 0.000 0.000) 0.000 16.315 ( 0.000 0.000 0.000) 0.000 18.583 ( 0.000 0.000 0.000) 0.000 19.824 ( 0.000 0.000 0.000) 0.000 19.907 ( 0.000 0.000 0.000) 0.000 20.027 ( 0.000 0.000 0.000) 0.000 21.145 ( 0.000 0.000 0.000) 0.000 23.667 ( 0.000 0.000 0.000) 0.000 24.242 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/260) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.547 ( 25.494 0.000 14.181) 29.173 0.559 ( 27.866 0.000 1.178) 27.891 1.171 ( 56.723 0.000 14.360) 58.513 3.272 ( -0.330 0.000 -1.314) 1.355 3.291 ( 3.200 0.000 7.260) 7.934 3.708 ( 2.050 0.000 2.905) 3.556 3.989 ( -6.300 0.000 0.555) 6.324 4.181 ( 0.551 0.000 1.915) 1.993 4.361 ( 2.122 0.000 -8.992) 9.239 4.609 ( 3.357 0.000 7.489) 8.207 5.314 ( -1.107 0.000 2.169) 2.435 5.340 ( -0.111 0.000 2.568) 2.570 6.567 ( -0.438 0.000 -2.443) 2.482 7.185 ( 2.493 0.000 -54.240) 54.297 7.760 ( 1.769 0.000 -0.254) 1.787 7.776 ( -2.454 0.000 -5.286) 5.828 8.336 ( -9.056 0.000 -3.003) 9.541 8.394 ( -0.721 0.000 -2.607) 2.705 9.495 ( 5.325 0.000 4.294) 6.840 10.707 ( 5.170 0.000 -3.098) 6.027 11.046 ( -19.706 0.000 180.043) 181.118 11.488 ( 0.867 0.000 -0.815) 1.190 12.214 ( -6.192 0.000 10.276) 11.997 12.502 ( 12.145 0.000 -43.871) 45.521 12.997 ( 8.050 0.000 0.951) 8.106 14.944 ( -2.228 0.000 -0.316) 2.250 15.075 ( 0.841 0.000 0.486) 0.971 16.263 ( -5.153 0.000 -0.528) 5.179 17.284 ( 18.098 0.000 -100.224) 101.845 18.613 ( 2.345 0.000 7.121) 7.497 19.838 ( -7.199 0.000 0.633) 7.227 19.971 ( -5.599 0.000 0.410) 5.614 21.001 ( -12.595 0.000 -7.620) 14.721 23.764 ( 8.791 0.000 2.132) 9.046 24.017 ( -11.384 0.000 35.187) 36.983 24.335 ( 4.750 0.000 14.279) 15.049 ======================= Grid point 2 (3/260) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.064 ( 23.612 0.000 12.775) 26.847 1.102 ( 26.714 0.000 1.133) 26.738 2.287 ( 52.146 0.000 13.845) 53.953 3.237 ( -3.019 0.000 -3.658) 4.743 3.389 ( 4.058 0.000 11.157) 11.872 3.698 ( -8.248 0.000 5.538) 9.935 3.893 ( 0.464 0.000 -0.612) 0.768 4.217 ( 3.314 0.000 -0.979) 3.456 4.384 ( 2.979 0.000 -12.919) 13.257 4.714 ( 5.729 0.000 -0.622) 5.763 5.294 ( -1.638 0.000 5.157) 5.411 5.353 ( 0.806 0.000 3.197) 3.297 6.551 ( -0.279 0.000 -3.994) 4.004 7.077 ( -4.561 0.000 -23.483) 23.922 7.682 ( -5.963 0.000 -4.370) 7.393 7.776 ( -0.813 0.000 0.233) 0.846 8.097 ( -13.464 0.000 -2.792) 13.751 8.367 ( -1.143 0.000 -4.147) 4.302 9.677 ( 12.060 0.000 3.057) 12.442 10.813 ( 5.616 0.000 -4.355) 7.107 11.065 ( -7.771 0.000 78.969) 79.350 11.517 ( 2.378 0.000 -1.117) 2.628 12.135 ( -4.663 0.000 15.783) 16.457 12.648 ( 10.533 0.000 -26.772) 28.769 13.230 ( 14.895 0.000 2.238) 15.062 14.879 ( -4.092 0.000 -0.473) 4.120 15.093 ( 0.452 0.000 0.827) 0.943 16.114 ( -9.495 0.000 -0.896) 9.537 17.474 ( 17.350 0.000 -46.838) 49.948 18.709 ( 5.116 0.000 12.883) 13.861 19.620 ( -14.970 0.000 1.438) 15.039 19.814 ( -10.229 0.000 1.191) 10.298 20.674 ( -16.475 0.000 -13.709) 21.433 23.863 ( -9.540 0.000 14.292) 17.184 23.984 ( 11.928 0.000 2.876) 12.270 24.460 ( 5.035 0.000 8.795) 10.134 ======================= Grid point 3 (4/260) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.534 ( 21.161 0.000 11.030) 23.863 1.616 ( 24.773 0.000 0.981) 24.793 3.034 ( -1.552 0.000 -0.033) 1.553 3.361 ( 37.929 0.000 6.759) 38.526 3.438 ( -16.364 0.000 0.840) 16.386 3.489 ( 3.331 0.000 10.271) 10.798 3.946 ( 1.612 0.000 5.082) 5.332 4.312 ( 6.543 0.000 -2.379) 6.963 4.444 ( 6.384 0.000 -12.753) 14.262 4.800 ( 2.774 0.000 -4.942) 5.667 5.280 ( -1.349 0.000 9.080) 9.180 5.384 ( 1.468 0.000 2.199) 2.644 6.542 ( 0.340 0.000 -3.813) 3.828 6.906 ( -8.084 0.000 -14.671) 16.751 7.526 ( -8.523 0.000 -3.270) 9.129 7.724 ( -4.091 0.000 -0.329) 4.104 7.828 ( -12.456 0.000 -0.281) 12.459 8.334 ( -1.100 0.000 -3.955) 4.105 9.956 ( 14.660 0.000 -0.172) 14.661 10.895 ( 3.636 0.000 -3.573) 5.098 11.092 ( -3.088 0.000 40.795) 40.911 11.573 ( 3.210 0.000 -0.982) 3.357 12.094 ( -3.001 0.000 13.663) 13.989 12.797 ( 9.347 0.000 -16.741) 19.173 13.584 ( 19.904 0.000 3.501) 20.209 14.786 ( -4.957 0.000 -0.450) 4.978 15.064 ( -4.750 0.000 0.065) 4.751 15.912 ( -9.598 0.000 -0.579) 9.616 17.742 ( 17.464 0.000 -26.990) 32.148 18.869 ( 7.508 0.000 15.934) 17.615 19.274 ( -19.105 0.000 1.381) 19.155 19.586 ( -12.700 0.000 2.339) 12.914 20.335 ( -13.790 0.000 -16.542) 21.537 23.713 ( -7.718 0.000 7.028) 10.438 24.217 ( 10.304 0.000 2.481) 10.599 24.568 ( 4.130 0.000 5.613) 6.969 ======================= Grid point 4 (5/260) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.941 ( 17.214 0.000 8.659) 19.269 2.076 ( 20.999 0.000 0.720) 21.011 2.838 ( -11.764 0.000 -5.438) 12.961 3.094 ( -17.482 0.000 -0.451) 17.488 3.565 ( 2.244 0.000 6.278) 6.667 3.954 ( -1.227 0.000 3.025) 3.265 4.134 ( 31.996 0.000 10.875) 33.794 4.446 ( 6.984 0.000 -3.961) 8.029 4.562 ( 6.538 0.000 -6.799) 9.433 4.785 ( -2.708 0.000 -8.753) 9.162 5.267 ( -2.781 0.000 10.793) 11.146 5.412 ( 0.935 0.000 0.944) 1.329 6.547 ( 0.666 0.000 -0.883) 1.106 6.716 ( -7.242 0.000 -11.164) 13.307 7.358 ( -7.046 0.000 -1.351) 7.175 7.606 ( -6.732 0.000 -2.275) 7.106 7.660 ( -4.372 0.000 2.521) 5.047 8.309 ( -0.649 0.000 -2.312) 2.401 10.204 ( 9.407 0.000 -1.486) 9.524 10.948 ( 2.334 0.000 -1.628) 2.846 11.121 ( -0.800 0.000 18.067) 18.085 11.627 ( 2.167 0.000 -0.578) 2.242 12.072 ( -1.660 0.000 7.369) 7.554 12.928 ( 6.188 0.000 -7.830) 9.980 14.017 ( 22.505 0.000 4.059) 22.868 14.695 ( -3.717 0.000 -0.278) 3.727 14.863 ( -15.498 0.000 -2.061) 15.635 15.775 ( -3.842 0.000 0.230) 3.849 18.010 ( 13.129 0.000 -13.973) 19.173 18.934 ( -13.435 0.000 1.288) 13.497 19.058 ( 7.022 0.000 12.819) 14.616 19.350 ( -10.637 0.000 2.783) 10.994 20.068 ( -9.224 0.000 -13.621) 16.450 23.601 ( -4.457 0.000 2.903) 5.319 24.384 ( 5.848 0.000 1.410) 6.016 24.643 ( 2.342 0.000 2.852) 3.690 ======================= Grid point 5 (6/260) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.168 ( -0.000 0.000 -0.000) 0.000 2.349 ( 0.000 0.000 -0.000) 0.000 2.667 ( 0.000 0.000 0.000) 0.000 2.855 ( 0.000 0.000 0.000) 0.000 3.596 ( 0.000 0.000 -0.000) 0.000 3.940 ( 0.000 0.000 0.000) 0.000 4.503 ( 0.000 0.000 0.000) 0.000 4.590 ( 0.000 0.000 -0.000) 0.000 4.626 ( 0.000 0.000 -0.000) 0.000 4.665 ( 0.000 0.000 -0.000) 0.000 5.234 ( 0.000 0.000 -0.000) 0.000 5.423 ( 0.000 0.000 -0.000) 0.000 6.558 ( 0.000 0.000 0.000) 0.000 6.618 ( 0.000 0.000 -0.000) 0.000 7.280 ( 0.000 0.000 -0.000) 0.000 7.532 ( 0.000 0.000 0.000) 0.000 7.620 ( 0.000 0.000 -0.000) 0.000 8.300 ( 0.000 0.000 -0.000) 0.000 10.297 ( 0.000 0.000 0.000) 0.000 10.972 ( 0.000 0.000 -0.000) 0.000 11.135 ( 0.000 0.000 0.000) 0.000 11.649 ( 0.000 0.000 0.000) 0.000 12.064 ( 0.000 0.000 -0.000) 0.000 12.985 ( 0.000 0.000 0.000) 0.000 14.443 ( 0.000 0.000 0.000) 0.000 14.503 ( -0.000 0.000 -0.000) 0.000 14.655 ( 0.000 0.000 0.000) 0.000 15.743 ( 0.000 0.000 -0.000) 0.000 18.138 ( 0.000 0.000 0.000) 0.000 18.794 ( 0.000 0.000 -0.000) 0.000 19.158 ( 0.000 0.000 -0.000) 0.000 19.235 ( 0.000 0.000 -0.000) 0.000 19.950 ( 0.000 0.000 0.000) 0.000 23.559 ( 0.000 0.000 -0.000) 0.000 24.445 ( 0.000 0.000 -0.000) 0.000 24.670 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 11 (7/260) ======================= q-point: ( 0.00 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.503 ( 0.000 24.249 0.000) 24.249 0.585 ( 0.000 27.695 0.000) 27.695 0.951 ( 0.000 45.208 0.000) 45.208 3.213 ( 0.000 -3.521 0.000) 3.521 3.330 ( 0.000 5.045 0.000) 5.045 3.649 ( 0.000 -4.091 0.000) 4.091 4.149 ( 0.000 0.798 0.000) 0.798 4.162 ( 0.000 -1.029 0.000) 1.029 4.339 ( 0.000 1.797 0.000) 1.797 4.519 ( 0.000 5.776 0.000) 5.776 5.357 ( 0.000 2.562 0.000) 2.562 5.485 ( 0.000 9.920 0.000) 9.920 5.682 ( 0.000 3.919 0.000) 3.919 6.686 ( 0.000 10.319 0.000) 10.319 7.826 ( 0.000 3.370 0.000) 3.370 8.340 ( 0.000 -5.278 0.000) 5.278 8.485 ( 0.000 4.810 0.000) 4.810 8.753 ( 0.000 -2.903 0.000) 2.903 9.331 ( 0.000 5.465 0.000) 5.465 9.552 ( 0.000 5.385 0.000) 5.385 10.637 ( 0.000 -1.742 0.000) 1.742 12.108 ( 0.000 -15.594 0.000) 15.594 12.326 ( 0.000 2.687 0.000) 2.687 13.025 ( 0.000 8.218 0.000) 8.218 14.091 ( 0.000 -4.344 0.000) 4.344 15.036 ( 0.000 -2.786 0.000) 2.786 15.053 ( 0.000 7.169 0.000) 7.169 16.238 ( 0.000 -1.931 0.000) 1.931 16.344 ( 0.000 -11.898 0.000) 11.898 19.790 ( 0.000 -2.425 0.000) 2.425 19.943 ( 0.000 2.585 0.000) 2.585 20.076 ( 0.000 4.603 0.000) 4.603 21.138 ( 0.000 -0.597 0.000) 0.597 21.379 ( 0.000 -4.983 0.000) 4.983 24.263 ( 0.000 1.965 0.000) 1.965 24.622 ( 0.000 -0.240 0.000) 0.240 ======================= Grid point 12 (8/260) ======================= q-point: ( 0.10 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.706 ( 16.134 17.679 8.981) 25.564 0.839 ( 21.076 18.418 6.157) 28.659 1.478 ( 42.288 26.318 7.294) 50.340 3.254 ( 2.605 -3.091 6.058) 7.283 3.329 ( 0.074 4.460 -0.380) 4.476 3.685 ( 3.388 -3.704 0.387) 5.035 3.982 ( -9.343 0.202 2.383) 9.645 4.218 ( 3.537 2.531 -4.574) 6.312 4.408 ( 1.273 4.498 -0.770) 4.737 4.591 ( 4.895 -0.110 2.673) 5.578 5.340 ( -1.572 2.452 0.556) 2.965 5.515 ( 0.340 14.036 3.880) 14.566 6.318 ( 36.670 -31.983 -11.068) 49.901 6.676 ( -0.642 9.994 -2.439) 10.308 7.799 ( -2.953 4.170 0.479) 5.132 8.178 ( -14.626 3.443 -7.091) 16.615 8.364 ( -10.000 5.712 1.230) 11.582 8.538 ( -0.426 10.077 -19.039) 21.545 9.552 ( 3.327 4.874 4.136) 7.206 10.005 ( 29.318 -25.750 55.594) 67.922 10.706 ( 6.657 -0.795 -2.704) 7.229 12.134 ( 0.933 -11.055 13.742) 17.662 12.272 ( -6.725 3.502 -1.382) 7.707 13.077 ( -4.041 13.186 15.174) 20.505 13.180 ( -37.448 39.452 -0.070) 54.395 14.945 ( -4.285 -0.151 -3.689) 5.656 15.086 ( 1.936 1.859 3.420) 4.348 16.194 ( -6.413 -7.155 0.184) 9.611 16.834 ( 32.452 -24.327 -49.129) 63.707 19.056 ( -23.412 21.840 -16.082) 35.829 19.830 ( -8.510 0.176 1.013) 8.572 20.037 ( -4.579 5.643 -0.315) 7.274 20.992 ( -12.664 -0.863 -7.165) 14.577 22.623 ( 51.942 -49.506 33.595) 79.230 24.208 ( -5.272 3.158 0.376) 6.157 24.560 ( -3.441 6.400 7.608) 10.520 ======================= Grid point 13 (9/260) ======================= q-point: ( 0.20 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.119 ( 22.066 8.806 7.992) 25.067 1.299 ( 23.300 13.676 3.734) 27.274 2.399 ( 45.597 10.527 11.324) 48.147 3.262 ( -2.823 1.869 -2.180) 4.026 3.377 ( 3.575 -0.932 10.105) 10.760 3.737 ( -6.379 3.161 4.151) 8.241 3.824 ( 0.135 -5.984 -0.943) 6.059 4.288 ( 4.625 5.259 -3.262) 7.726 4.412 ( 0.892 3.404 -7.597) 8.373 4.705 ( 6.079 -0.389 -1.248) 6.218 5.303 ( -2.142 2.461 1.680) 3.670 5.537 ( 0.918 13.965 5.537) 15.051 6.650 ( -1.116 8.800 -2.658) 9.260 6.738 ( 11.083 -22.664 -15.791) 29.763 7.703 ( -7.171 5.989 3.028) 9.821 7.921 ( -9.088 4.668 -4.506) 11.166 8.162 ( -10.803 6.575 -1.561) 12.743 8.503 ( -1.186 9.883 -9.563) 13.803 9.691 ( 10.435 1.124 3.131) 10.952 10.545 ( 15.190 -20.826 40.524) 48.027 10.856 ( 8.047 0.367 -0.914) 8.107 12.014 ( -16.374 15.528 4.094) 22.934 12.199 ( 0.687 0.970 24.248) 24.277 12.709 ( -3.511 15.449 -15.157) 21.926 13.293 ( 12.726 4.909 0.649) 13.656 14.848 ( -4.921 -2.655 -3.015) 6.353 15.126 ( 0.992 2.865 2.936) 4.221 16.019 ( -10.621 -9.184 -1.166) 14.089 17.284 ( 24.708 -14.174 -35.238) 45.311 18.844 ( -1.504 9.377 3.504) 10.123 19.591 ( -15.831 -1.355 2.299) 16.055 19.894 ( -9.943 6.478 0.723) 11.889 20.662 ( -16.745 -1.128 -13.367) 21.455 23.340 ( 19.425 -33.081 19.963) 43.246 24.114 ( -2.317 4.115 -0.685) 4.771 24.555 ( 0.588 4.822 6.041) 7.752 ======================= Grid point 14 (10/260) ======================= q-point: ( 0.30 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.577 ( 21.928 5.705 8.208) 24.099 1.760 ( 22.514 11.018 1.065) 25.088 3.049 ( -0.621 1.303 0.302) 1.474 3.330 ( 16.103 -2.977 5.921) 17.413 3.470 ( 5.131 1.659 5.313) 7.570 3.531 ( -1.438 4.692 6.660) 8.273 3.907 ( 2.936 -2.659 3.380) 5.208 4.391 ( 6.860 5.171 -7.140) 11.170 4.446 ( 4.693 1.362 -4.562) 6.685 4.799 ( 3.364 0.076 -4.901) 5.945 5.272 ( -1.392 2.279 3.562) 4.452 5.570 ( 0.851 13.230 5.405) 14.317 6.617 ( -1.488 6.323 -3.345) 7.306 6.784 ( -1.294 -10.260 -13.726) 17.185 7.549 ( -8.498 6.115 3.892) 11.169 7.770 ( -6.185 2.211 -2.187) 6.923 7.951 ( -9.314 11.494 -2.487) 15.001 8.444 ( -2.709 7.908 -5.111) 9.797 9.957 ( 14.877 -0.157 -0.106) 14.878 10.831 ( 7.767 -7.791 18.834) 21.812 10.996 ( 4.933 -0.778 9.333) 10.585 11.756 ( -9.498 11.180 -0.894) 14.697 12.255 ( -0.478 11.774 21.232) 24.283 12.728 ( 6.621 -3.733 -17.643) 19.211 13.599 ( 17.550 1.047 2.932) 17.824 14.737 ( -5.670 -4.348 -2.130) 7.456 15.108 ( -4.472 3.827 1.446) 6.061 15.804 ( -9.639 -10.083 -0.802) 13.972 17.687 ( 22.780 -4.584 -24.673) 33.892 18.909 ( 4.872 3.085 12.402) 13.677 19.244 ( -18.459 -1.919 2.004) 18.667 19.654 ( -14.260 5.752 2.566) 15.589 20.317 ( -14.155 -1.735 -16.274) 21.639 23.563 ( 1.362 -14.140 11.471) 18.258 24.171 ( 8.003 -2.941 -0.669) 8.552 24.582 ( 0.410 0.851 4.299) 4.402 ======================= Grid point 15 (11/260) ======================= q-point: ( 0.40 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.004 ( 18.694 6.049 8.321) 21.338 2.184 ( 19.849 8.749 -1.473) 21.742 2.863 ( -11.790 2.385 -4.006) 12.678 3.114 ( -17.082 0.427 -0.084) 17.088 3.558 ( 2.718 0.423 6.725) 7.266 3.889 ( -0.196 -5.701 1.621) 5.930 4.114 ( 26.574 -0.757 10.500) 28.583 4.513 ( 6.659 4.024 -11.553) 13.929 4.562 ( 5.836 0.807 3.075) 6.646 4.797 ( -2.188 1.088 -7.776) 8.151 5.268 ( -0.061 2.780 5.182) 5.880 5.577 ( -1.405 11.474 3.634) 12.118 6.579 ( -1.471 2.268 -2.802) 3.893 6.690 ( -4.094 -1.442 -8.485) 9.531 7.408 ( -5.827 7.612 1.923) 9.777 7.662 ( -4.169 0.891 -0.001) 4.263 7.803 ( -4.928 16.642 -1.974) 17.468 8.388 ( -1.885 5.467 -2.350) 6.242 10.224 ( 10.931 1.564 -1.379) 11.128 10.949 ( 2.338 -0.045 1.684) 2.882 11.099 ( 2.636 -1.089 15.174) 15.440 11.625 ( -3.594 2.329 -3.786) 5.716 12.277 ( -0.707 15.874 10.459) 19.023 12.833 ( 5.832 -8.607 -8.669) 13.537 13.985 ( 20.147 -3.179 3.688) 20.727 14.612 ( -7.061 -6.823 -1.381) 9.916 14.933 ( -11.980 5.666 -1.093) 13.298 15.677 ( -3.099 -8.976 0.278) 9.500 18.049 ( 17.057 3.340 -15.574) 23.338 18.939 ( -10.616 -0.228 0.677) 10.640 19.035 ( 2.422 -0.841 14.867) 15.086 19.384 ( -11.323 2.789 2.289) 11.884 20.044 ( -9.646 -2.422 -13.361) 16.656 23.550 ( -2.408 -4.544 4.424) 6.784 24.354 ( 9.005 -5.270 0.152) 10.435 24.577 ( -1.925 -3.581 2.589) 4.820 ======================= Grid point 16 (12/260) ======================= q-point: (-0.50 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.261 ( 0.000 8.810 -0.000) 8.810 2.436 ( 0.000 6.108 0.000) 6.108 2.698 ( 0.000 3.628 0.000) 3.628 2.866 ( -0.000 -0.219 0.000) 0.219 3.598 ( 0.000 1.166 -0.000) 1.166 3.869 ( 0.000 -6.167 0.000) 6.167 4.491 ( 0.000 -6.085 0.000) 6.085 4.537 ( -0.000 0.732 -0.000) 0.732 4.633 ( 0.000 0.515 -0.000) 0.515 4.723 ( 0.000 5.112 -0.000) 5.112 5.281 ( 0.000 4.699 0.000) 4.699 5.553 ( 0.000 9.660 -0.000) 9.660 6.559 ( 0.000 0.470 0.000) 0.470 6.633 ( 0.000 1.821 -0.000) 1.821 7.349 ( 0.000 8.931 0.000) 8.931 7.619 ( 0.000 0.531 -0.000) 0.531 7.751 ( 0.000 18.764 0.000) 18.764 8.366 ( 0.000 4.457 -0.000) 4.457 10.338 ( -0.000 3.487 0.000) 3.487 10.967 ( 0.000 -0.401 -0.000) 0.401 11.146 ( 0.000 1.218 0.000) 1.218 11.586 ( 0.000 -1.794 0.000) 1.794 12.280 ( 0.000 16.576 0.000) 16.576 12.886 ( 0.000 -9.244 0.000) 9.244 14.359 ( 0.000 -10.681 0.000) 10.681 14.397 ( -0.000 -4.357 -0.000) 4.357 14.778 ( 0.000 8.623 -0.000) 8.623 15.653 ( 0.000 -8.197 -0.000) 8.197 18.216 ( 0.000 7.098 0.000) 7.098 18.858 ( 0.000 5.991 0.000) 5.991 19.022 ( 0.000 -8.830 -0.000) 8.830 19.300 ( 0.000 2.196 -0.000) 2.196 19.919 ( 0.000 -2.933 -0.000) 2.933 23.528 ( 0.000 -2.461 -0.000) 2.461 24.482 ( 0.000 3.164 -0.000) 3.164 24.525 ( -0.000 -13.389 0.000) 13.389 ======================= Grid point 22 (13/260) ======================= q-point: ( 0.00 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.003 ( 0.000 23.744 0.000) 23.744 1.140 ( 0.000 25.574 0.000) 25.574 1.855 ( 0.000 41.148 0.000) 41.148 3.100 ( 0.000 -7.312 0.000) 7.312 3.462 ( 0.000 7.107 0.000) 7.107 3.478 ( 0.000 -12.144 0.000) 12.144 4.132 ( 0.000 -1.765 0.000) 1.765 4.218 ( 0.000 6.159 0.000) 6.159 4.430 ( 0.000 6.035 0.000) 6.035 4.646 ( 0.000 5.862 0.000) 5.862 5.391 ( 0.000 -0.054 0.000) 0.054 5.548 ( 0.000 -1.477 0.000) 1.477 5.937 ( 0.000 16.100 0.000) 16.100 6.962 ( 0.000 14.862 0.000) 14.862 7.935 ( 0.000 6.977 0.000) 6.977 8.233 ( 0.000 -4.160 0.000) 4.160 8.630 ( 0.000 9.309 0.000) 9.309 8.669 ( 0.000 -4.888 0.000) 4.888 9.518 ( 0.000 12.767 0.000) 12.767 9.676 ( 0.000 5.786 0.000) 5.786 10.571 ( 0.000 -5.028 0.000) 5.028 11.721 ( 0.000 -20.804 0.000) 20.804 12.430 ( 0.000 7.796 0.000) 7.796 13.191 ( 0.000 7.106 0.000) 7.106 14.003 ( 0.000 -3.565 0.000) 3.565 14.957 ( 0.000 -4.535 0.000) 4.535 15.197 ( 0.000 4.768 0.000) 4.768 16.020 ( 0.000 -17.493 0.000) 17.493 16.185 ( 0.000 -3.012 0.000) 3.012 19.740 ( 0.000 -2.174 0.000) 2.174 19.997 ( 0.000 2.448 0.000) 2.448 20.207 ( 0.000 7.674 0.000) 7.674 21.122 ( 0.000 -0.946 0.000) 0.946 21.237 ( 0.000 -8.323 0.000) 8.323 24.318 ( 0.000 3.139 0.000) 3.139 24.612 ( 0.000 -0.764 0.000) 0.764 ======================= Grid point 23 (14/260) ======================= q-point: ( 0.10 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.140 ( 10.373 22.282 6.134) 25.332 1.258 ( 12.351 21.165 4.181) 24.860 2.113 ( 23.839 32.081 1.541) 39.998 3.150 ( 3.625 -6.802 6.499) 10.082 3.452 ( -0.864 6.486 -1.328) 6.677 3.519 ( 4.550 -11.221 -2.031) 12.278 3.996 ( -9.940 0.319 3.136) 10.428 4.303 ( 6.209 6.056 -4.570) 9.803 4.517 ( 4.779 5.342 1.001) 7.238 4.636 ( -0.061 3.818 0.026) 3.819 5.381 ( -0.497 0.808 -0.190) 0.968 5.745 ( 10.014 0.591 3.095) 10.497 6.020 ( 12.408 3.819 -3.012) 13.327 6.938 ( -2.351 13.765 -0.500) 13.973 7.928 ( -0.544 7.594 -2.135) 7.907 8.162 ( -7.287 -0.723 2.550) 7.754 8.513 ( -9.116 6.601 5.451) 12.506 8.675 ( 2.526 5.172 -16.415) 17.395 9.651 ( -1.470 3.268 4.246) 5.556 9.810 ( 21.131 3.144 25.040) 32.915 10.669 ( 9.294 -3.124 -3.966) 10.577 11.790 ( 6.584 -19.862 2.481) 21.071 12.384 ( -4.560 8.271 -1.704) 9.598 13.240 ( 4.643 6.528 2.105) 8.283 13.686 ( -27.244 11.037 9.932) 31.027 14.911 ( -4.385 -3.026 -5.055) 7.345 15.162 ( -0.983 3.591 5.202) 6.397 15.942 ( -7.188 -16.078 -1.264) 17.657 16.487 ( 26.997 -9.868 -21.396) 35.834 19.321 ( -24.391 5.562 -13.559) 28.455 19.865 ( -9.238 2.971 -2.191) 9.948 20.184 ( -4.001 8.214 0.001) 9.136 20.969 ( -12.991 -1.233 -6.387) 14.529 21.905 ( 42.705 -24.052 25.543) 55.268 24.278 ( -3.670 3.761 -0.202) 5.258 24.609 ( -0.524 -0.070 2.317) 2.377 ======================= Grid point 24 (15/260) ======================= q-point: ( 0.20 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.405 ( 15.628 17.477 3.834) 23.757 1.605 ( 19.543 15.074 4.969) 25.176 2.681 ( 29.465 14.876 5.054) 33.392 3.232 ( 1.950 -5.297 6.878) 8.898 3.424 ( -1.358 5.202 1.612) 5.613 3.651 ( 7.983 -8.531 -0.590) 11.698 3.804 ( -8.491 1.753 1.142) 8.746 4.412 ( 5.470 7.262 -6.204) 11.007 4.518 ( -2.747 5.477 1.889) 6.412 4.712 ( 6.479 1.081 -3.515) 7.450 5.373 ( -0.242 3.626 0.438) 3.661 5.822 ( 0.151 10.373 4.860) 11.456 6.346 ( 16.145 -13.025 -8.533) 22.430 6.872 ( -4.030 11.293 -0.120) 11.991 7.897 ( -2.199 8.553 -3.444) 9.479 7.988 ( -10.293 6.634 6.565) 13.895 8.365 ( -6.425 11.929 1.193) 13.602 8.659 ( -1.724 5.176 -11.702) 12.911 9.704 ( 7.163 -0.290 2.644) 7.641 10.303 ( 20.444 -2.936 29.245) 35.803 10.867 ( 10.513 -0.108 -4.764) 11.543 11.981 ( 11.427 -17.185 5.093) 21.257 12.235 ( -9.895 10.765 -3.219) 14.972 13.185 ( -21.291 21.323 9.550) 31.610 13.390 ( 8.861 3.698 -0.594) 9.620 14.782 ( -6.932 -3.582 -5.700) 9.663 15.188 ( 1.448 1.822 5.519) 5.989 15.750 ( -11.212 -15.011 -2.379) 18.886 17.020 ( 30.887 -9.931 -22.988) 39.763 18.984 ( -7.931 3.126 -3.490) 9.212 19.609 ( -16.352 3.456 1.183) 16.755 20.049 ( -9.923 7.952 1.199) 12.773 20.628 ( -17.739 -2.052 -12.590) 21.850 22.689 ( 29.743 -27.975 21.237) 46.024 24.193 ( -4.044 3.980 -1.629) 5.904 24.603 ( -0.683 0.111 2.920) 3.000 ======================= Grid point 25 (16/260) ======================= q-point: ( 0.30 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.763 ( 19.325 11.415 2.882) 22.629 2.008 ( 19.833 12.184 2.564) 23.417 3.077 ( 1.814 0.990 1.100) 2.342 3.235 ( -2.573 -5.693 3.878) 7.353 3.494 ( 8.432 -0.832 5.846) 10.294 3.630 ( -0.270 3.695 4.761) 6.032 3.894 ( 10.411 2.741 2.446) 11.040 4.428 ( 0.656 1.089 -8.322) 8.419 4.560 ( 5.150 6.640 3.419) 9.072 4.809 ( 3.720 0.937 -7.253) 8.205 5.375 ( 0.330 6.761 0.865) 6.824 5.818 ( -1.726 8.385 4.697) 9.765 6.549 ( 6.887 -9.141 -12.677) 17.079 6.790 ( -4.046 8.367 1.899) 9.486 7.809 ( -7.689 3.880 2.972) 9.110 7.829 ( -5.015 18.013 2.926) 18.926 8.271 ( -2.949 18.047 -1.607) 18.357 8.560 ( -5.468 2.670 -6.778) 9.108 9.938 ( 15.113 -1.874 -0.445) 15.235 10.710 ( 14.330 -2.329 23.707) 27.799 11.029 ( 6.143 2.202 -2.140) 6.868 11.997 ( -11.897 12.949 -6.521) 18.755 12.241 ( 12.248 -12.570 9.319) 19.871 12.886 ( -10.444 16.636 0.369) 19.646 13.608 ( 12.524 -0.420 2.310) 12.742 14.619 ( -8.459 -7.019 -3.734) 11.609 15.204 ( -2.331 4.561 3.758) 6.353 15.527 ( -9.075 -14.763 -2.301) 17.481 17.587 ( 30.940 -4.405 -20.978) 37.640 18.941 ( 1.895 -1.260 5.573) 6.020 19.254 ( -18.629 4.052 2.561) 19.236 19.795 ( -16.161 7.299 4.070) 18.194 20.262 ( -15.399 -3.609 -15.455) 22.114 23.181 ( 16.280 -20.794 15.385) 30.563 24.131 ( -1.267 -0.808 -3.548) 3.853 24.591 ( -1.203 -0.002 2.601) 2.866 ======================= Grid point 26 (17/260) ======================= q-point: ( 0.40 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.160 ( 19.541 7.556 3.290) 21.208 2.382 ( 17.093 9.871 -0.765) 19.753 2.925 ( -12.283 2.441 1.131) 12.574 3.070 ( -12.504 -3.131 -1.151) 12.941 3.582 ( 3.580 -1.066 5.821) 6.916 3.763 ( 0.996 -3.942 0.682) 4.123 4.141 ( 14.369 3.337 9.407) 17.495 4.499 ( 6.463 -2.297 -6.593) 9.514 4.663 ( 3.984 5.766 2.548) 7.457 4.812 ( -1.192 0.093 -8.717) 8.798 5.397 ( 1.879 8.808 1.227) 9.090 5.765 ( -4.448 4.932 3.186) 7.366 6.595 ( 1.873 0.205 -11.054) 11.213 6.730 ( -2.703 5.021 3.035) 6.459 7.693 ( -4.565 5.319 5.345) 8.815 7.747 ( -3.333 21.609 -0.619) 21.874 8.235 ( -0.564 23.269 -1.537) 23.327 8.445 ( -4.251 -0.829 -3.296) 5.442 10.243 ( 14.187 -0.466 -1.370) 14.261 10.943 ( 4.185 -0.619 7.132) 8.292 11.118 ( 3.775 3.243 8.638) 9.969 11.772 ( -8.434 11.909 -7.599) 16.453 12.479 ( 8.843 -7.551 11.401) 16.284 12.737 ( -4.836 9.731 -6.499) 12.662 13.880 ( 13.837 -6.907 2.287) 15.634 14.432 ( -9.800 -10.367 -1.306) 14.326 15.084 ( -8.193 8.777 -0.654) 12.025 15.435 ( -0.974 -13.319 0.275) 13.358 18.122 ( 26.276 3.081 -18.306) 32.172 18.926 ( -10.556 -0.184 2.974) 10.968 19.045 ( 1.445 1.108 13.012) 13.139 19.460 ( -16.557 4.600 2.747) 17.403 19.967 ( -10.762 -4.981 -12.415) 17.169 23.420 ( 5.917 -8.125 8.339) 13.060 24.132 ( 1.756 -13.191 -3.050) 13.653 24.568 ( -1.451 1.437 1.648) 2.624 ======================= Grid point 27 (18/260) ======================= q-point: (-0.50 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.503 ( 0.000 0.102 0.000) 0.102 2.518 ( 0.000 15.328 0.000) 15.328 2.797 ( 0.000 -6.480 0.000) 6.480 2.835 ( -0.000 8.434 -0.000) 8.434 3.676 ( -0.000 5.896 -0.000) 5.896 3.702 ( 0.000 -9.665 0.000) 9.665 4.354 ( 0.000 -6.674 0.000) 6.674 4.542 ( 0.000 2.197 0.000) 2.197 4.714 ( 0.000 4.981 -0.000) 4.981 4.775 ( 0.000 -0.986 -0.000) 0.986 5.433 ( 0.000 9.505 0.000) 9.505 5.703 ( 0.000 3.312 -0.000) 3.312 6.604 ( 0.000 4.431 0.000) 4.431 6.700 ( 0.000 4.153 0.000) 4.153 7.655 ( 0.000 2.781 0.000) 2.781 7.710 ( 0.000 26.177 -0.000) 26.177 8.230 ( 0.000 25.623 0.000) 25.623 8.397 ( 0.000 -2.857 -0.000) 2.857 10.405 ( -0.000 1.716 0.000) 1.716 10.958 ( 0.000 -0.488 -0.000) 0.488 11.191 ( 0.000 3.219 0.000) 3.219 11.669 ( -0.000 10.380 0.000) 10.380 12.627 ( 0.000 -14.630 -0.000) 14.630 12.639 ( 0.000 16.360 0.000) 16.360 14.090 ( 0.000 -15.038 -0.000) 15.038 14.270 ( 0.000 -7.565 0.000) 7.565 14.985 ( 0.000 11.229 -0.000) 11.229 15.432 ( 0.000 -12.209 -0.000) 12.209 18.412 ( 0.000 11.380 0.000) 11.380 18.839 ( -0.000 -8.201 0.000) 8.201 19.025 ( 0.000 9.415 -0.000) 9.415 19.297 ( 0.000 -2.435 -0.000) 2.435 19.829 ( 0.000 -5.616 -0.000) 5.616 23.483 ( 0.000 -1.441 -0.000) 1.441 24.154 ( 0.000 -21.083 0.000) 21.083 24.553 ( 0.000 3.183 0.000) 3.183 ======================= Grid point 33 (19/260) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.477 ( 0.000 21.571 0.000) 21.571 1.632 ( 0.000 21.266 0.000) 21.266 2.616 ( 0.000 30.922 0.000) 30.922 2.917 ( 0.000 -9.931 0.000) 9.931 3.179 ( 0.000 -15.824 0.000) 15.824 3.612 ( 0.000 7.347 0.000) 7.347 4.089 ( 0.000 -2.371 0.000) 2.371 4.376 ( 0.000 8.114 0.000) 8.114 4.554 ( 0.000 5.281 0.000) 5.281 4.744 ( 0.000 3.263 0.000) 3.263 5.339 ( 0.000 -4.782 0.000) 4.782 5.501 ( 0.000 -2.538 0.000) 2.538 6.214 ( 0.000 9.670 0.000) 9.670 7.252 ( 0.000 12.503 0.000) 12.503 8.086 ( 0.000 6.487 0.000) 6.487 8.156 ( 0.000 -4.571 0.000) 4.571 8.586 ( 0.000 -1.899 0.000) 1.899 8.890 ( 0.000 16.001 0.000) 16.001 9.774 ( 0.000 3.504 0.000) 3.504 9.845 ( 0.000 17.577 0.000) 17.577 10.418 ( 0.000 -9.366 0.000) 9.366 11.272 ( 0.000 -21.888 0.000) 21.888 12.655 ( 0.000 13.418 0.000) 13.418 13.310 ( 0.000 4.278 0.000) 4.278 13.953 ( 0.000 -1.247 0.000) 1.247 14.861 ( 0.000 -4.299 0.000) 4.299 15.131 ( 0.000 -13.010 0.000) 13.010 15.755 ( 0.000 -5.099 0.000) 5.099 16.123 ( 0.000 -2.703 0.000) 2.703 19.703 ( 0.000 -1.421 0.000) 1.421 20.040 ( 0.000 1.695 0.000) 1.695 20.382 ( 0.000 8.967 0.000) 8.967 21.048 ( 0.000 -9.558 0.000) 9.558 21.102 ( 0.000 -0.866 0.000) 0.866 24.387 ( 0.000 3.338 0.000) 3.338 24.589 ( 0.000 -1.484 0.000) 1.484 ======================= Grid point 34 (20/260) ======================= q-point: ( 0.10 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.591 ( 10.024 20.550 3.949) 23.203 1.687 ( 5.449 19.400 1.654) 20.218 2.712 ( 9.118 22.649 0.539) 24.422 2.987 ( 5.462 -7.675 5.388) 10.852 3.225 ( 5.158 -14.650 -2.802) 15.783 3.618 ( 0.927 7.773 -0.891) 7.879 3.990 ( -8.476 -0.218 2.011) 8.714 4.450 ( 6.247 7.114 -2.253) 9.733 4.618 ( 5.827 4.013 -2.465) 7.492 4.708 ( -3.881 2.495 2.306) 5.158 5.364 ( 2.839 -2.190 -1.004) 3.724 5.638 ( 11.381 -6.220 2.255) 13.164 6.212 ( 0.311 8.487 -0.981) 8.549 7.204 ( -4.718 11.503 1.982) 12.590 8.044 ( -2.517 2.714 -7.987) 8.803 8.179 ( 0.469 -0.055 7.963) 7.976 8.598 ( 0.112 4.128 6.992) 8.121 8.887 ( -0.009 15.347 -6.710) 16.750 9.693 ( -5.315 0.767 2.810) 6.061 9.999 ( 12.840 12.321 12.582) 21.794 10.570 ( 13.405 -5.875 -5.408) 15.603 11.356 ( 8.248 -21.222 0.987) 22.790 12.620 ( -3.370 13.880 -2.000) 14.423 13.346 ( 3.488 3.451 0.106) 4.909 13.812 ( -13.764 3.461 7.143) 15.889 14.837 ( -3.235 -3.884 -3.674) 6.249 15.089 ( -2.949 -12.971 3.829) 13.842 15.688 ( -5.421 -4.763 -0.790) 7.259 16.356 ( 22.369 -3.892 -12.344) 25.843 19.367 ( -23.029 0.224 -7.794) 24.313 19.932 ( -7.369 3.062 -6.657) 10.392 20.363 ( -4.653 8.596 1.461) 9.883 20.945 ( -13.495 -1.000 -6.189) 14.881 21.511 ( 33.065 -15.025 19.514) 41.229 24.361 ( -2.598 4.167 -0.068) 4.911 24.584 ( -0.520 -2.081 0.783) 2.284 ======================= Grid point 35 (21/260) ======================= q-point: ( 0.20 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.794 ( 9.670 18.857 -0.437) 21.197 1.908 ( 15.456 13.788 6.528) 21.717 2.932 ( 11.058 6.794 1.772) 13.098 3.095 ( 3.235 -6.896 5.506) 9.399 3.351 ( 5.988 -9.290 -1.689) 11.181 3.659 ( 2.152 3.822 1.962) 4.805 3.848 ( -2.188 6.388 1.199) 6.858 4.572 ( 5.592 5.009 -0.195) 7.510 4.600 ( -6.388 3.872 1.186) 7.564 4.745 ( 7.052 2.117 -6.854) 10.059 5.437 ( 4.241 2.395 -0.217) 4.875 5.845 ( 6.098 -6.660 2.496) 9.368 6.260 ( 6.430 2.607 -4.006) 8.012 7.091 ( -6.837 9.548 2.974) 12.114 7.964 ( -4.090 2.119 -4.128) 6.185 8.197 ( -0.776 4.248 10.439) 11.297 8.611 ( -0.286 12.829 4.468) 13.588 8.833 ( -3.963 14.179 -8.594) 17.047 9.676 ( 4.506 -2.558 0.813) 5.245 10.346 ( 16.768 4.240 18.971) 25.672 10.843 ( 14.321 -1.277 -5.811) 15.507 11.590 ( 14.493 -19.153 2.254) 24.124 12.512 ( -6.766 15.528 -4.130) 17.434 13.413 ( -1.583 -0.757 -3.127) 3.585 13.535 ( -9.887 12.630 12.349) 20.243 14.683 ( -10.804 -7.071 -4.772) 13.766 15.083 ( 1.038 -12.506 4.887) 13.467 15.559 ( -6.986 -0.901 -2.068) 7.341 16.876 ( 32.340 -4.387 -17.140) 36.863 18.991 ( -12.114 -1.392 -3.499) 12.686 19.715 ( -13.584 5.816 -3.556) 15.199 20.207 ( -11.308 6.909 2.904) 13.566 20.581 ( -19.677 -2.332 -11.488) 22.904 22.203 ( 30.283 -18.652 19.069) 40.356 24.280 ( -5.510 4.263 -1.720) 7.175 24.577 ( -0.279 -2.274 1.608) 2.799 ======================= Grid point 36 (22/260) ======================= q-point: ( 0.30 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.016 ( 12.992 12.214 -1.627) 17.906 2.247 ( 16.405 10.140 5.708) 20.112 3.047 ( -1.861 -4.403 2.572) 5.428 3.150 ( 1.251 -1.833 -2.078) 3.040 3.418 ( 1.574 -4.518 6.831) 8.340 3.648 ( 0.819 -2.594 1.394) 3.057 4.031 ( 14.570 9.344 4.110) 17.790 4.460 ( -6.625 1.294 4.093) 7.894 4.684 ( 5.278 5.234 -3.062) 8.039 4.836 ( 3.337 1.582 -10.994) 11.598 5.516 ( 3.611 6.209 0.097) 7.183 5.867 ( -3.052 -3.031 2.818) 5.142 6.439 ( 11.324 -1.555 -7.513) 13.678 6.962 ( -6.612 7.885 3.410) 10.841 7.866 ( -5.251 3.212 0.047) 6.155 8.201 ( -1.090 6.674 11.948) 13.729 8.587 ( -3.714 16.096 -1.764) 16.612 8.732 ( -2.382 17.416 -6.103) 18.608 9.870 ( 14.060 -5.222 -1.131) 15.041 10.687 ( 12.831 -2.511 15.107) 19.979 11.083 ( 10.309 4.419 -0.636) 11.234 11.902 ( 15.336 -16.264 1.249) 22.389 12.339 ( -9.291 17.940 -4.583) 20.716 13.177 ( -13.342 8.199 3.743) 16.101 13.603 ( 6.296 1.738 3.342) 7.337 14.426 ( -13.368 -12.254 -2.141) 18.261 15.126 ( 2.006 -11.811 3.445) 12.466 15.412 ( -7.113 4.715 -2.601) 8.922 17.519 ( 35.735 -2.086 -18.630) 40.354 18.871 ( -0.795 -4.385 2.933) 5.335 19.397 ( -16.903 8.680 -1.658) 19.073 19.934 ( -17.275 5.380 5.927) 19.040 20.171 ( -17.930 -4.701 -12.908) 22.588 22.771 ( 23.437 -17.291 15.193) 32.850 24.131 ( -8.913 0.619 -4.104) 9.832 24.583 ( 0.423 -0.718 1.719) 1.910 ======================= Grid point 37 (23/260) ======================= q-point: ( 0.40 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.284 ( 13.846 4.677 -2.434) 14.816 2.548 ( 11.524 3.173 5.611) 13.204 2.930 ( -7.828 2.089 -0.884) 8.150 3.090 ( -5.789 3.439 -1.582) 6.917 3.466 ( 1.954 -6.720 4.774) 8.472 3.735 ( 4.601 -2.393 1.458) 5.387 4.233 ( 1.787 5.081 7.874) 9.540 4.464 ( 8.344 -1.118 3.701) 9.196 4.754 ( 1.625 2.488 -2.997) 4.221 4.819 ( -1.580 1.392 -12.201) 12.381 5.581 ( 3.105 7.710 -0.068) 8.312 5.780 ( -5.540 -2.223 2.370) 6.423 6.631 ( 9.282 2.841 -7.992) 12.574 6.855 ( -5.056 6.624 3.957) 9.225 7.768 ( -4.335 3.822 1.611) 5.999 8.216 ( 0.212 1.491 10.399) 10.507 8.465 ( -5.907 22.634 -6.481) 24.274 8.727 ( 1.364 21.485 -1.943) 21.616 10.169 ( 14.539 -7.881 -1.083) 16.573 10.895 ( 5.779 -4.424 3.645) 8.140 11.237 ( 4.323 8.244 8.039) 12.299 12.077 ( -2.358 10.681 -13.623) 17.471 12.236 ( 4.737 -4.857 9.165) 11.403 12.975 ( -7.489 7.711 1.987) 10.931 13.718 ( 4.188 -7.558 -0.141) 8.642 14.191 ( -9.108 -12.441 1.181) 15.464 15.167 ( 1.362 -11.343 1.289) 11.497 15.281 ( -5.112 9.295 -1.660) 10.737 18.168 ( 33.018 1.497 -18.509) 37.881 18.913 ( -0.091 -2.260 4.822) 5.326 19.106 ( -9.098 6.057 5.496) 12.234 19.564 ( -20.599 4.355 5.352) 21.724 19.843 ( -12.003 -6.362 -9.892) 16.805 23.209 ( 17.985 -11.573 11.318) 24.197 23.914 ( -11.652 -6.820 -6.110) 14.819 24.597 ( 0.537 1.016 1.024) 1.539 ======================= Grid point 38 (24/260) ======================= q-point: (-0.50 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.478 ( 0.000 -1.737 -0.000) 1.737 2.635 ( 0.000 -7.834 0.000) 7.834 2.867 ( 0.000 17.364 0.000) 17.364 2.987 ( 0.000 5.262 0.000) 5.262 3.498 ( 0.000 -8.784 0.000) 8.784 3.775 ( 0.000 1.366 -0.000) 1.366 4.253 ( 0.000 -1.486 0.000) 1.486 4.637 ( -0.000 6.079 -0.000) 6.079 4.685 ( 0.000 -7.030 0.000) 7.030 4.802 ( 0.000 3.162 -0.000) 3.162 5.632 ( -0.000 8.531 0.000) 8.531 5.701 ( 0.000 -2.332 -0.000) 2.332 6.750 ( 0.000 9.231 -0.000) 9.231 6.777 ( -0.000 2.911 0.000) 2.911 7.723 ( 0.000 3.578 -0.000) 3.578 8.242 ( 0.000 -11.196 -0.000) 11.196 8.383 ( 0.000 36.041 -0.000) 36.041 8.742 ( 0.000 22.497 0.000) 22.497 10.337 ( 0.000 -10.154 0.000) 10.154 10.946 ( 0.000 -0.608 -0.000) 0.608 11.290 ( 0.000 6.523 0.000) 6.523 12.000 ( -0.000 20.445 0.000) 20.445 12.330 ( 0.000 -12.903 -0.000) 12.903 12.900 ( 0.000 7.248 0.000) 7.248 13.756 ( 0.000 -16.092 -0.000) 16.092 14.102 ( 0.000 -7.943 0.000) 7.943 15.183 ( 0.000 -10.962 -0.000) 10.962 15.224 ( 0.000 10.973 0.000) 10.973 18.672 ( -0.000 13.296 0.000) 13.296 18.703 ( 0.000 -4.603 -0.000) 4.603 19.206 ( -0.000 6.562 -0.000) 6.562 19.211 ( 0.000 -5.233 0.000) 5.233 19.699 ( 0.000 -6.188 -0.000) 6.188 23.474 ( -0.000 0.423 -0.000) 0.423 23.716 ( 0.000 -19.464 0.000) 19.464 24.604 ( 0.000 1.677 0.000) 1.677 ======================= Grid point 44 (25/260) ======================= q-point: ( 0.00 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.863 ( 0.000 13.798 0.000) 13.798 1.968 ( 0.000 8.543 0.000) 8.543 2.743 ( 0.000 -4.054 0.000) 4.054 2.865 ( 0.000 -12.691 0.000) 12.691 3.071 ( 0.000 11.437 0.000) 11.437 3.761 ( 0.000 5.942 0.000) 5.942 4.033 ( 0.000 -2.674 0.000) 2.674 4.513 ( 0.000 4.068 0.000) 4.068 4.632 ( 0.000 1.964 0.000) 1.964 4.782 ( 0.000 0.637 0.000) 0.637 5.231 ( 0.000 -3.979 0.000) 3.979 5.458 ( 0.000 -1.273 0.000) 1.273 6.338 ( 0.000 2.670 0.000) 2.670 7.467 ( 0.000 7.152 0.000) 7.152 8.030 ( 0.000 -5.732 0.000) 5.732 8.175 ( 0.000 2.015 0.000) 2.015 8.591 ( 0.000 1.085 0.000) 1.085 9.242 ( 0.000 14.193 0.000) 14.193 9.820 ( 0.000 1.057 0.000) 1.057 10.045 ( 0.000 -4.832 0.000) 4.832 10.369 ( 0.000 12.161 0.000) 12.161 10.838 ( 0.000 -18.775 0.000) 18.775 12.918 ( 0.000 8.932 0.000) 8.932 13.368 ( 0.000 1.400 0.000) 1.400 13.946 ( 0.000 0.317 0.000) 0.317 14.795 ( 0.000 -1.791 0.000) 1.791 14.810 ( 0.000 -11.897 0.000) 11.897 15.739 ( 0.000 0.759 0.000) 0.759 16.082 ( 0.000 -1.081 0.000) 1.081 19.683 ( 0.000 -0.490 0.000) 0.490 20.065 ( 0.000 0.607 0.000) 0.607 20.561 ( 0.000 7.228 0.000) 7.228 20.860 ( 0.000 -7.459 0.000) 7.459 21.089 ( 0.000 -0.352 0.000) 0.352 24.447 ( 0.000 2.099 0.000) 2.099 24.555 ( 0.000 -1.421 0.000) 1.421 ======================= Grid point 45 (26/260) ======================= q-point: ( 0.10 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.946 ( 7.292 11.412 3.790) 14.063 2.016 ( 4.782 10.211 -1.428) 11.366 2.792 ( 4.066 -3.916 5.892) 8.160 2.877 ( 1.235 -10.412 4.054) 11.241 3.151 ( 8.011 7.144 -8.672) 13.799 3.730 ( -3.332 2.145 0.069) 3.963 4.023 ( -0.556 2.973 4.100) 5.095 4.557 ( 3.109 2.490 -2.038) 4.474 4.663 ( 3.012 0.388 -2.772) 4.112 4.741 ( -2.138 0.980 0.961) 2.541 5.317 ( 7.347 -1.525 0.454) 7.517 5.536 ( 7.175 -2.954 1.296) 7.866 6.322 ( -1.161 2.404 -1.102) 2.888 7.399 ( -6.607 6.151 2.665) 9.413 8.047 ( 0.791 -2.278 2.348) 3.366 8.138 ( -1.736 -1.209 -4.665) 5.122 8.694 ( 6.743 3.216 12.193) 14.300 9.253 ( 0.673 16.673 -1.754) 16.779 9.648 ( -10.163 -5.571 1.584) 11.698 10.170 ( 8.570 0.834 -0.535) 8.627 10.559 ( 16.150 8.853 0.531) 18.425 10.939 ( 10.086 -17.864 0.967) 20.537 12.891 ( -2.340 9.372 -2.453) 9.966 13.380 ( 0.853 0.093 -1.430) 1.668 13.877 ( -6.892 2.725 6.355) 9.763 14.709 ( -8.744 -9.619 -1.989) 13.151 14.828 ( 1.887 -4.485 2.133) 5.313 15.678 ( -4.324 0.918 0.581) 4.459 16.305 ( 21.295 -1.181 -10.025) 23.566 19.362 ( -23.166 -0.277 -5.070) 23.716 19.978 ( -5.395 1.191 -8.845) 10.428 20.512 ( -6.722 4.586 3.107) 8.711 20.932 ( -14.067 -0.229 -7.460) 15.924 21.279 ( 30.452 -6.614 17.355) 35.669 24.445 ( -0.897 3.717 0.409) 3.846 24.529 ( -2.044 -3.016 -0.103) 3.645 ======================= Grid point 46 (27/260) ======================= q-point: ( 0.20 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.104 ( 6.487 8.072 3.264) 10.858 2.167 ( 10.940 10.261 -0.599) 15.011 2.911 ( 4.963 -3.870 6.722) 9.209 2.942 ( 5.057 -7.722 4.885) 10.443 3.295 ( 7.612 2.409 -9.649) 12.524 3.633 ( -5.957 -2.841 1.805) 6.842 4.069 ( 4.403 9.456 6.699) 12.397 4.546 ( -4.555 -3.404 5.311) 7.781 4.707 ( 3.524 2.861 -5.069) 6.805 4.794 ( 6.177 2.024 -8.315) 10.554 5.479 ( 8.106 1.617 0.728) 8.298 5.700 ( 7.327 -5.089 1.214) 9.003 6.313 ( 1.888 1.454 -2.251) 3.278 7.249 ( -8.557 4.692 3.374) 10.326 8.021 ( -3.175 3.513 -1.180) 4.880 8.138 ( 0.392 -5.927 6.894) 9.100 8.838 ( 4.648 6.131 9.202) 11.995 9.223 ( -2.778 20.614 -3.383) 21.073 9.562 ( 1.931 -9.904 -0.133) 10.092 10.361 ( 10.319 -2.550 2.317) 10.879 10.915 ( 18.261 9.201 2.209) 20.567 11.224 ( 17.340 -15.458 2.738) 23.391 12.816 ( -4.391 10.774 -4.849) 12.604 13.353 ( -4.575 -3.653 -3.267) 6.704 13.764 ( -4.576 8.605 10.400) 14.253 14.455 ( -15.923 -11.694 -1.357) 19.803 14.884 ( 3.012 -4.226 1.793) 5.490 15.595 ( -4.112 1.803 -0.641) 4.535 16.821 ( 32.811 -1.186 -15.096) 36.136 18.961 ( -14.564 -0.986 -2.511) 14.812 19.812 ( -9.701 2.826 -7.404) 12.527 20.314 ( -13.981 2.863 3.797) 14.768 20.543 ( -21.545 -1.091 -9.480) 23.563 21.931 ( 29.824 -6.950 16.870) 34.963 24.359 ( -7.767 2.790 -2.051) 8.504 24.525 ( 1.466 -2.173 1.509) 3.025 ======================= Grid point 47 (28/260) ======================= q-point: ( 0.30 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.242 ( 7.226 8.537 0.590) 11.200 2.377 ( 8.889 1.223 1.719) 9.136 2.988 ( 2.847 0.699 2.300) 3.726 3.074 ( 5.229 -5.644 0.873) 7.744 3.400 ( 3.869 2.947 0.347) 4.876 3.546 ( -1.690 -5.834 2.288) 6.490 4.214 ( 7.725 6.462 7.084) 12.313 4.455 ( -5.408 -1.517 9.514) 11.049 4.766 ( 3.175 2.189 -7.592) 8.516 4.869 ( 3.121 1.261 -13.604) 14.015 5.621 ( 5.760 3.739 0.572) 6.891 5.768 ( -0.933 -4.600 1.377) 4.892 6.437 ( 11.207 0.332 -3.685) 11.802 7.095 ( -7.325 4.018 2.940) 8.857 7.947 ( -4.129 4.554 1.319) 6.287 8.121 ( -4.286 -7.307 8.478) 11.985 8.917 ( 1.943 8.218 4.847) 9.736 9.196 ( 1.625 25.797 -4.072) 26.167 9.675 ( 8.413 -14.811 -0.685) 17.048 10.578 ( 11.064 -5.287 1.526) 12.357 11.248 ( 13.242 9.962 6.580) 17.830 11.594 ( 18.550 -12.443 2.763) 22.507 12.700 ( -5.962 13.808 -6.611) 16.429 13.177 ( -11.256 -5.356 -1.446) 12.549 13.751 ( -0.799 11.332 6.877) 13.279 14.116 ( -16.079 -15.662 0.659) 22.456 14.947 ( 2.830 -4.340 1.463) 5.384 15.510 ( -4.189 3.036 -1.259) 5.324 17.495 ( 37.877 -0.420 -17.682) 41.803 18.796 ( -2.383 -2.156 2.557) 4.106 19.565 ( -13.329 5.901 -7.166) 16.243 19.972 ( -20.184 -1.687 -2.023) 20.355 20.113 ( -19.776 -0.184 0.250) 19.778 22.512 ( 25.449 -6.769 13.829) 29.744 24.146 ( -12.901 0.520 -4.147) 13.561 24.568 ( 2.227 -0.477 1.458) 2.705 ======================= Grid point 48 (29/260) ======================= q-point: ( 0.40 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.380 ( 6.174 5.036 -1.106) 8.044 2.495 ( 2.382 -5.565 3.453) 6.969 3.037 ( 1.430 4.024 -1.528) 4.536 3.143 ( 3.484 1.458 -4.612) 5.961 3.409 ( -2.866 2.025 8.415) 9.118 3.623 ( 6.417 -6.835 1.016) 9.430 4.336 ( 0.025 4.311 6.741) 8.002 4.431 ( 3.374 -2.334 9.693) 10.526 4.783 ( 0.032 0.798 -8.338) 8.376 4.858 ( -0.427 1.350 -12.584) 12.664 5.679 ( -1.351 1.055 0.503) 1.786 5.740 ( 0.534 -0.206 1.293) 1.413 6.679 ( 12.117 1.290 -3.863) 12.783 6.983 ( -4.448 4.385 1.921) 6.535 7.863 ( -4.712 5.875 2.767) 8.024 8.034 ( -4.553 -10.456 4.406) 12.226 8.946 ( 0.404 10.332 2.074) 10.546 9.246 ( 2.986 31.900 -2.030) 32.104 9.853 ( 8.338 -23.369 -0.704) 24.822 10.801 ( 10.931 -3.033 -0.856) 11.377 11.427 ( 2.748 7.876 8.429) 11.859 11.940 ( 15.153 -7.976 0.705) 17.138 12.558 ( -6.652 18.811 -4.902) 20.546 12.960 ( -9.101 -8.973 -0.719) 12.801 13.635 ( -10.510 -0.101 -0.120) 10.512 13.961 ( -0.629 -7.776 4.442) 8.977 14.996 ( 1.700 -4.440 0.826) 4.826 15.432 ( -3.111 4.196 -1.082) 5.335 18.191 ( 35.075 0.720 -17.711) 39.300 18.853 ( 6.112 -2.243 6.293) 9.055 19.274 ( -14.015 8.195 -4.828) 16.938 19.559 ( -21.389 -5.053 3.663) 22.281 19.768 ( -13.958 -0.166 -0.402) 13.965 23.009 ( 22.278 -5.852 10.962) 25.510 23.837 ( -16.945 -1.359 -6.324) 18.137 24.609 ( 1.443 0.229 0.804) 1.667 ======================= Grid point 49 (30/260) ======================= q-point: (-0.50 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.450 ( 0.000 -0.721 -0.000) 0.721 2.512 ( -0.000 -3.311 0.000) 3.311 3.041 ( 0.000 0.531 0.000) 0.531 3.189 ( 0.000 11.501 0.000) 11.501 3.378 ( 0.000 -2.539 0.000) 2.539 3.700 ( 0.000 -6.146 -0.000) 6.146 4.327 ( 0.000 7.505 0.000) 7.505 4.510 ( 0.000 -9.277 -0.000) 9.277 4.752 ( 0.000 4.038 0.000) 4.038 4.837 ( 0.000 0.182 -0.000) 0.182 5.650 ( 0.000 -1.764 -0.000) 1.764 5.757 ( 0.000 3.170 0.000) 3.170 6.817 ( 0.000 0.926 -0.000) 0.926 6.933 ( 0.000 6.292 0.000) 6.292 7.807 ( 0.000 4.955 0.000) 4.955 7.993 ( 0.000 -10.861 -0.000) 10.861 8.951 ( 0.000 11.410 -0.000) 11.410 9.276 ( 0.000 33.506 0.000) 33.506 9.944 ( 0.000 -27.187 0.000) 27.187 10.936 ( 0.000 -0.303 0.000) 0.303 11.439 ( 0.000 5.918 0.000) 5.918 12.124 ( 0.000 -6.117 -0.000) 6.117 12.460 ( -0.000 22.305 0.000) 22.305 12.861 ( 0.000 -12.072 -0.000) 12.072 13.510 ( 0.000 -5.673 0.000) 5.673 13.974 ( 0.000 -3.559 0.000) 3.559 15.014 ( 0.000 -4.510 0.000) 4.510 15.397 ( 0.000 4.737 0.000) 4.737 18.648 ( -0.000 -0.950 0.000) 0.950 18.936 ( 0.000 10.660 0.000) 10.660 19.114 ( -0.000 -3.062 -0.000) 3.062 19.231 ( 0.000 -4.026 -0.000) 4.026 19.621 ( 0.000 -0.985 0.000) 0.985 23.415 ( 0.000 -8.049 0.000) 8.049 23.487 ( 0.000 0.532 0.000) 0.532 24.625 ( 0.000 0.425 0.000) 0.425 ======================= Grid point 99 (31/260) ======================= q-point: ( 0.00 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.472 ( -1.604 0.000 24.387) 24.440 0.575 ( 12.247 0.000 29.384) 31.835 1.123 ( 6.967 0.000 57.166) 57.589 3.254 ( -0.459 0.000 -2.021) 2.072 3.308 ( 6.247 0.000 5.283) 8.181 3.638 ( 3.693 0.000 -4.837) 6.086 3.927 ( -0.686 0.000 -7.478) 7.509 4.229 ( -0.488 0.000 -5.016) 5.040 4.507 ( -8.163 0.000 11.867) 14.404 4.780 ( 24.906 0.000 2.991) 25.085 5.396 ( 2.043 0.000 5.424) 5.796 5.401 ( 2.910 0.000 7.784) 8.310 5.726 ( -24.776 0.000 4.071) 25.109 6.673 ( -2.717 0.000 9.445) 9.829 7.659 ( 0.501 0.000 -7.880) 7.896 7.781 ( -0.897 0.000 -0.288) 0.942 8.433 ( -3.678 0.000 -0.396) 3.700 8.555 ( 0.111 0.000 14.546) 14.546 9.389 ( 5.759 0.000 -5.112) 7.701 10.583 ( 79.217 0.000 0.210) 79.217 10.690 ( -3.255 0.000 3.348) 4.670 11.387 ( -0.013 0.000 -9.362) 9.362 12.215 ( 5.026 0.000 -8.311) 9.713 12.863 ( 1.519 0.000 -5.442) 5.650 14.001 ( 43.458 0.000 3.722) 43.617 14.996 ( -0.137 0.000 3.031) 3.034 15.070 ( 0.331 0.000 0.359) 0.488 16.205 ( 0.871 0.000 -11.013) 11.047 18.237 (-208.283 0.000 -0.103) 208.283 18.586 ( 6.984 0.000 0.277) 6.989 19.912 ( 0.464 0.000 0.468) 0.660 20.028 ( -0.552 0.000 0.127) 0.567 21.194 ( -8.267 0.000 4.943) 9.632 22.282 ( 147.590 0.000 -2.001) 147.603 23.678 ( 2.301 0.000 1.107) 2.554 24.225 ( -0.976 0.000 -1.778) 2.028 ======================= Grid point 100 (32/260) ======================= q-point: ( 0.10 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.754 ( 20.308 0.000 16.482) 26.155 1.050 ( 20.846 0.000 26.739) 33.904 1.724 ( 38.683 0.000 40.762) 56.195 3.245 ( -0.704 0.000 -1.627) 1.773 3.458 ( 6.348 0.000 7.380) 9.734 3.733 ( 6.597 0.000 0.818) 6.648 3.875 ( -2.677 0.000 -8.795) 9.193 4.178 ( -2.217 0.000 -3.077) 3.792 4.358 ( -8.576 0.000 6.483) 10.751 4.746 ( -5.476 0.000 5.132) 7.505 5.424 ( 0.005 0.000 8.805) 8.805 5.438 ( 0.652 0.000 7.036) 7.066 6.267 ( 29.030 0.000 -26.127) 39.055 6.650 ( -0.810 0.000 6.148) 6.201 7.674 ( 2.501 0.000 -8.202) 8.575 7.739 ( -3.169 0.000 -0.719) 3.249 8.284 ( -10.025 0.000 -2.703) 10.383 8.554 ( -3.342 0.000 17.184) 17.505 9.536 ( 8.819 0.000 -0.362) 8.826 10.680 ( 1.809 0.000 0.469) 1.869 11.373 ( 1.097 0.000 -10.891) 10.946 11.623 ( 31.700 0.000 -27.189) 41.763 12.184 ( -5.898 0.000 -4.768) 7.584 12.965 ( 9.757 0.000 -4.305) 10.664 13.808 ( -61.923 0.000 62.375) 87.893 14.939 ( -3.061 0.000 0.448) 3.093 15.085 ( 0.993 0.000 0.290) 1.034 16.150 ( -3.882 0.000 -10.602) 11.290 16.336 ( 6.883 0.000 0.939) 6.947 18.754 ( 8.947 0.000 7.273) 11.530 19.850 ( -6.864 0.000 0.602) 6.891 19.977 ( -5.060 0.000 0.197) 5.064 20.906 ( -19.893 0.000 -2.382) 20.035 23.812 ( 9.846 0.000 2.830) 10.244 23.973 ( 30.379 0.000 -28.265) 41.495 24.182 ( 2.188 0.000 -7.549) 7.860 ======================= Grid point 101 (33/260) ======================= q-point: ( 0.20 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.232 ( 23.778 0.000 11.480) 26.404 1.491 ( 18.299 0.000 25.786) 31.619 2.648 ( 44.577 0.000 23.806) 50.535 3.194 ( -4.693 0.000 -0.667) 4.740 3.560 ( 2.728 0.000 3.418) 4.374 3.710 ( -9.345 0.000 -4.414) 10.336 3.961 ( 10.293 0.000 9.811) 14.220 4.158 ( 1.576 0.000 -4.914) 5.161 4.219 ( -4.643 0.000 -3.137) 5.603 4.724 ( 1.012 0.000 1.097) 1.493 5.452 ( 0.678 0.000 10.298) 10.320 5.455 ( -0.298 0.000 6.996) 7.002 6.494 ( 3.047 0.000 -8.200) 8.748 6.683 ( 2.406 0.000 -7.209) 7.600 7.656 ( -5.108 0.000 0.543) 5.137 7.693 ( 0.560 0.000 -7.800) 7.820 8.057 ( -11.644 0.000 -1.941) 11.805 8.516 ( -4.135 0.000 18.531) 18.987 9.729 ( 10.693 0.000 1.904) 10.861 10.749 ( 4.790 0.000 -1.995) 5.189 11.389 ( 3.184 0.000 -12.029) 12.443 11.851 ( -8.712 0.000 6.301) 10.752 12.111 ( 7.782 0.000 -20.857) 22.262 13.040 ( -27.221 0.000 59.948) 65.839 13.220 ( 16.577 0.000 -3.344) 16.911 14.879 ( -3.627 0.000 0.075) 3.628 15.095 ( -0.521 0.000 -1.186) 1.295 16.013 ( -7.280 0.000 -8.635) 11.294 16.767 ( 28.509 0.000 -24.078) 37.317 18.967 ( 10.036 0.000 13.804) 17.066 19.641 ( -14.403 0.000 0.565) 14.414 19.834 ( -9.222 0.000 0.877) 9.263 20.459 ( -22.278 0.000 -8.656) 23.900 23.953 ( -9.105 0.000 -0.780) 9.138 24.040 ( 11.699 0.000 2.910) 12.055 24.403 ( 10.992 0.000 -14.097) 17.876 ======================= Grid point 102 (34/260) ======================= q-point: ( 0.30 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.722 ( 23.050 0.000 9.506) 24.933 1.893 ( 16.699 0.000 22.579) 28.083 3.039 ( -10.331 0.000 1.294) 10.412 3.450 ( -15.344 0.000 0.135) 15.344 3.537 ( 39.591 0.000 11.381) 41.194 3.597 ( 0.244 0.000 -0.106) 0.266 4.024 ( -4.670 0.000 -0.112) 4.672 4.221 ( 5.688 0.000 -6.517) 8.650 4.321 ( 13.294 0.000 4.251) 13.958 4.742 ( -0.034 0.000 -1.533) 1.533 5.461 ( -0.483 0.000 5.561) 5.582 5.495 ( 0.735 0.000 11.966) 11.989 6.496 ( -0.722 0.000 -4.984) 5.036 6.665 ( -1.581 0.000 -4.199) 4.487 7.545 ( -6.410 0.000 4.151) 7.637 7.647 ( -3.467 0.000 -5.880) 6.826 7.839 ( -9.757 0.000 -0.165) 9.758 8.484 ( -3.237 0.000 18.970) 19.244 9.964 ( 12.241 0.000 0.727) 12.263 10.846 ( 5.217 0.000 -1.439) 5.412 11.441 ( 4.537 0.000 -12.552) 13.347 11.594 ( -15.347 0.000 10.565) 18.632 12.186 ( 0.672 0.000 -10.774) 10.795 12.892 ( -1.156 0.000 31.513) 31.534 13.589 ( 21.037 0.000 -3.127) 21.268 14.798 ( -4.473 0.000 1.445) 4.701 15.018 ( -7.647 0.000 -5.511) 9.426 15.856 ( -6.184 0.000 -4.235) 7.495 17.269 ( 26.972 0.000 -20.869) 34.102 19.189 ( 6.848 0.000 16.912) 18.246 19.301 ( -18.218 0.000 1.715) 18.298 19.629 ( -11.451 0.000 1.960) 11.618 20.054 ( -14.709 0.000 -12.813) 19.507 23.765 ( -9.068 0.000 -0.511) 9.083 24.260 ( 9.368 0.000 1.969) 9.573 24.532 ( 5.338 0.000 -9.203) 10.640 ======================= Grid point 103 (35/260) ======================= q-point: ( 0.40 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.174 ( 19.958 0.000 8.923) 21.862 2.234 ( 11.606 0.000 19.172) 22.411 2.812 ( -11.234 0.000 2.221) 11.452 3.121 ( -17.444 0.000 3.216) 17.738 3.572 ( -2.268 0.000 -5.820) 6.246 3.928 ( -3.479 0.000 -4.918) 6.024 4.204 ( 21.443 0.000 -3.815) 21.779 4.354 ( 12.021 0.000 -3.871) 12.629 4.587 ( 10.652 0.000 9.033) 13.966 4.701 ( -3.349 0.000 -0.227) 3.357 5.460 ( -0.737 0.000 3.775) 3.846 5.492 ( -5.155 0.000 11.463) 12.568 6.442 ( -1.716 0.000 -8.159) 8.337 6.684 ( 3.811 0.000 7.399) 8.323 7.436 ( -5.478 0.000 8.529) 10.137 7.557 ( -3.724 0.000 -2.812) 4.667 7.683 ( -5.880 0.000 -0.068) 5.881 8.478 ( -1.699 0.000 19.431) 19.505 10.185 ( 9.257 0.000 -0.628) 9.278 10.942 ( 4.255 0.000 0.970) 4.364 11.320 ( -13.985 0.000 2.127) 14.146 11.500 ( 3.938 0.000 -12.389) 13.000 12.117 ( -4.767 0.000 -3.289) 5.792 13.016 ( 5.844 0.000 17.096) 18.067 14.019 ( 22.644 0.000 -4.131) 23.017 14.721 ( -3.373 0.000 2.837) 4.407 14.752 ( -16.888 0.000 -9.326) 19.292 15.768 ( -2.483 0.000 -0.665) 2.571 17.729 ( 23.049 0.000 -14.396) 27.176 18.944 ( -14.211 0.000 0.170) 14.212 19.272 ( -5.483 0.000 6.902) 8.815 19.410 ( -10.556 0.000 3.048) 10.987 19.905 ( 3.078 0.000 -1.451) 3.403 23.609 ( -6.195 0.000 -1.809) 6.454 24.403 ( 4.571 0.000 0.549) 4.604 24.582 ( 1.825 0.000 -8.857) 9.043 ======================= Grid point 104 (36/260) ======================= q-point: (-0.50 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.273 ( -12.742 0.000 9.830) 16.093 2.446 ( -2.076 0.000 9.769) 9.987 2.777 ( 8.154 0.000 9.910) 12.834 2.885 ( 0.442 0.000 2.872) 2.905 3.484 ( -4.352 0.000 -10.879) 11.718 3.876 ( -0.738 0.000 -5.130) 5.182 4.260 ( -7.750 0.000 -15.837) 17.631 4.531 ( -1.380 0.000 -6.741) 6.881 4.750 ( 3.151 0.000 10.950) 11.394 4.792 ( 12.722 0.000 6.381) 14.233 5.327 ( -12.119 0.000 9.230) 15.234 5.449 ( -1.052 0.000 2.646) 2.848 6.457 ( 4.622 0.000 -3.554) 5.830 6.822 ( 6.663 0.000 14.173) 15.661 7.395 ( -0.114 0.000 11.229) 11.229 7.520 ( 0.945 0.000 -1.694) 1.940 7.611 ( -1.144 0.000 -0.338) 1.193 8.502 ( -0.385 0.000 20.432) 20.436 10.301 ( 1.929 0.000 0.131) 1.933 11.001 ( 0.970 0.000 2.776) 2.941 11.036 ( -14.211 0.000 -9.580) 17.139 11.533 ( 2.038 0.000 -11.576) 11.754 12.012 ( -4.707 0.000 -4.088) 6.235 13.144 ( 2.907 0.000 14.695) 14.979 14.295 ( -14.389 0.000 -13.662) 19.841 14.499 ( 14.565 0.000 -1.978) 14.699 14.693 ( -0.032 0.000 3.827) 3.827 15.737 ( -0.671 0.000 -0.615) 0.910 18.084 ( 14.056 0.000 -5.081) 14.946 18.784 ( -1.353 0.000 -1.337) 1.902 19.070 ( -11.864 0.000 -7.564) 14.070 19.264 ( -3.612 0.000 2.586) 4.442 20.098 ( 12.140 0.000 14.102) 18.607 23.516 ( -2.509 0.000 -4.607) 5.246 24.436 ( -1.313 0.000 -0.973) 1.634 24.567 ( -1.211 0.000 -10.074) 10.146 ======================= Grid point 105 (37/260) ======================= q-point: (-0.40 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.941 ( -20.388 0.000 7.442) 21.704 2.154 ( -22.388 0.000 8.628) 23.994 3.003 ( 9.446 0.000 10.551) 14.161 3.126 ( 15.791 0.000 2.266) 15.952 3.368 ( -4.397 0.000 -12.821) 13.554 3.865 ( -27.325 0.000 -14.881) 31.114 3.866 ( 0.696 0.000 -4.759) 4.809 4.433 ( -6.843 0.000 -5.865) 9.013 4.768 ( -3.249 0.000 12.674) 13.084 4.972 ( 2.713 0.000 6.574) 7.112 5.171 ( -3.192 0.000 5.127) 6.039 5.427 ( -1.955 0.000 2.309) 3.026 6.568 ( 5.596 0.000 1.662) 5.838 6.982 ( 6.124 0.000 16.021) 17.152 7.496 ( 7.145 0.000 11.900) 13.880 7.573 ( 4.040 0.000 -5.635) 6.933 7.658 ( 6.584 0.000 2.321) 6.981 8.550 ( 0.289 0.000 21.677) 21.679 10.238 ( -8.882 0.000 1.663) 9.037 10.703 ( -16.114 0.000 -22.655) 27.801 11.000 ( -1.321 0.000 3.420) 3.667 11.527 ( -0.156 0.000 -10.383) 10.384 11.922 ( -2.896 0.000 -7.255) 7.812 13.194 ( -1.210 0.000 17.094) 17.137 13.868 ( -20.851 0.000 -11.458) 23.791 14.736 ( 3.275 0.000 4.058) 5.215 14.840 ( 15.181 0.000 -4.024) 15.705 15.749 ( 2.941 0.000 -2.495) 3.857 18.234 ( 1.249 0.000 8.780) 8.868 18.759 ( -7.268 0.000 -14.657) 16.360 18.954 ( 8.916 0.000 0.029) 8.916 19.317 ( 8.545 0.000 -0.493) 8.559 20.390 ( 13.032 0.000 19.405) 23.375 23.478 ( -0.129 0.000 -10.628) 10.629 24.349 ( -6.892 0.000 -2.251) 7.251 24.494 ( -3.594 0.000 -11.219) 11.780 ======================= Grid point 106 (38/260) ======================= q-point: (-0.30 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( -22.411 0.000 8.987) 24.146 1.695 ( -25.467 0.000 9.031) 27.021 2.990 ( -27.841 0.000 -3.843) 28.105 3.264 ( -3.095 0.000 -11.661) 12.065 3.326 ( -8.618 0.000 3.400) 9.265 3.403 ( 11.288 0.000 -3.587) 11.844 3.882 ( 1.698 0.000 -1.235) 2.100 4.275 ( -6.343 0.000 -6.739) 9.254 4.713 ( -4.570 0.000 14.429) 15.135 4.942 ( -6.472 0.000 9.142) 11.201 5.201 ( 3.456 0.000 2.179) 4.086 5.382 ( -2.793 0.000 1.981) 3.425 6.657 ( 2.217 0.000 6.897) 7.244 7.154 ( 8.124 0.000 12.726) 15.098 7.639 ( 4.052 0.000 -7.705) 8.705 7.685 ( 8.176 0.000 10.927) 13.647 7.868 ( 13.193 0.000 2.497) 13.427 8.603 ( -0.134 0.000 22.063) 22.064 9.972 ( -17.173 0.000 1.162) 17.213 10.283 ( -20.175 0.000 -36.222) 41.462 10.971 ( -2.681 0.000 3.768) 4.625 11.486 ( -1.417 0.000 -9.234) 9.342 11.877 ( 0.667 0.000 -9.812) 9.835 13.191 ( -2.948 0.000 21.720) 21.919 13.458 ( -17.753 0.000 -9.620) 20.192 14.824 ( 4.346 0.000 3.733) 5.729 15.034 ( 5.302 0.000 -2.843) 6.016 15.861 ( 8.914 0.000 -5.842) 10.658 18.248 ( -1.100 0.000 24.273) 24.298 18.572 ( -6.109 0.000 -15.143) 16.328 19.252 ( 18.043 0.000 -0.704) 18.057 19.546 ( 13.315 0.000 -1.588) 13.409 20.692 ( 12.911 0.000 20.595) 24.307 23.431 ( -2.054 0.000 -23.853) 23.942 24.164 ( -10.800 0.000 -2.969) 11.201 24.384 ( -4.730 0.000 -10.423) 11.446 ======================= Grid point 107 (39/260) ======================= q-point: (-0.20 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.110 ( -22.308 0.000 13.009) 25.824 1.201 ( -26.392 0.000 10.874) 28.544 2.154 ( -47.071 0.000 2.552) 47.140 3.202 ( -0.688 0.000 -7.441) 7.473 3.318 ( -0.723 0.000 4.363) 4.423 3.544 ( 5.004 0.000 -9.939) 11.127 3.921 ( 1.659 0.000 2.128) 2.698 4.182 ( -1.695 0.000 -5.141) 5.413 4.667 ( -3.708 0.000 15.560) 15.995 4.783 ( -10.874 0.000 7.293) 13.093 5.279 ( 3.454 0.000 3.909) 5.217 5.340 ( -1.411 0.000 1.803) 2.290 6.692 ( -0.352 0.000 9.557) 9.564 7.341 ( 7.218 0.000 5.669) 9.178 7.685 ( 2.114 0.000 -8.443) 8.703 7.835 ( 4.329 0.000 4.841) 6.494 8.155 ( 14.227 0.000 2.399) 14.428 8.622 ( -3.461 0.000 16.521) 16.880 9.626 ( -16.032 0.000 -2.138) 16.174 9.736 ( -25.368 0.000 -38.322) 45.958 10.898 ( -5.569 0.000 3.897) 6.797 11.441 ( -0.990 0.000 -8.281) 8.340 11.917 ( 5.902 0.000 -10.393) 11.952 13.134 ( -12.778 0.000 -7.802) 14.972 13.196 ( -1.358 0.000 27.852) 27.885 14.912 ( 3.476 0.000 3.262) 4.767 15.075 ( 0.331 0.000 -1.008) 1.061 16.036 ( 9.362 0.000 -8.853) 12.885 18.406 ( 12.664 0.000 45.321) 47.057 18.472 ( -0.835 0.000 -11.876) 11.905 19.593 ( 15.405 0.000 -1.177) 15.450 19.793 ( 11.155 0.000 -0.810) 11.184 20.984 ( 11.686 0.000 18.399) 21.797 23.198 ( -16.909 0.000 -52.568) 55.220 23.930 ( -11.551 0.000 -2.823) 11.891 24.279 ( -3.417 0.000 -5.761) 6.698 ======================= Grid point 108 (40/260) ======================= q-point: (-0.10 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.725 ( -23.480 0.000 16.176) 28.513 0.726 ( -20.155 0.000 16.888) 26.295 1.307 ( -36.384 0.000 31.087) 47.856 3.212 ( 2.768 0.000 -1.003) 2.945 3.289 ( -2.242 0.000 0.113) 2.245 3.592 ( 2.909 0.000 -9.203) 9.652 3.942 ( 0.247 0.000 -1.670) 1.688 4.174 ( 1.750 0.000 -1.108) 2.071 4.578 ( -9.400 0.000 6.942) 11.685 4.614 ( -5.552 0.000 14.811) 15.817 5.347 ( 1.579 0.000 3.515) 3.853 5.347 ( 2.059 0.000 5.000) 5.408 6.688 ( -2.461 0.000 8.601) 8.946 7.143 ( -46.239 0.000 -44.842) 64.412 7.681 ( -0.341 0.000 -8.112) 8.119 7.808 ( -3.908 0.000 -6.912) 7.941 8.392 ( 7.775 0.000 2.281) 8.103 8.516 ( -3.849 0.000 8.946) 9.739 9.390 ( -5.615 0.000 -6.190) 8.357 9.443 ( 12.668 0.000 28.249) 30.959 10.783 ( -6.402 0.000 4.097) 7.601 11.411 ( -0.334 0.000 -8.233) 8.240 12.061 ( 10.259 0.000 -9.725) 14.136 12.927 ( -6.373 0.000 -6.481) 9.089 13.333 ( 11.940 0.000 34.527) 36.533 14.971 ( 1.777 0.000 2.970) 3.461 15.070 ( -0.322 0.000 -0.003) 0.322 16.165 ( 5.596 0.000 -10.489) 11.888 18.484 ( 3.857 0.000 -6.401) 7.473 19.185 ( 60.844 0.000 67.440) 90.830 19.827 ( 8.147 0.000 -0.381) 8.155 19.971 ( 7.253 0.000 1.809) 7.476 21.199 ( 5.110 0.000 12.713) 13.701 22.207 ( -79.814 0.000 -95.231) 124.255 23.730 ( -7.109 0.000 -1.406) 7.247 24.234 ( -0.549 0.000 -1.478) 1.577 ======================= Grid point 109 (41/260) ======================= q-point: ( 0.00 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.821 ( 4.368 20.203 20.683) 29.241 0.871 ( 5.450 23.168 19.102) 30.518 1.355 ( 2.309 23.885 41.792) 48.191 3.267 ( 4.212 -2.407 3.223) 5.824 3.315 ( 0.810 3.826 0.008) 3.911 3.636 ( 1.036 -1.700 -1.915) 2.762 3.937 ( 1.426 -0.021 -10.755) 10.849 4.178 ( -2.067 0.301 -0.641) 2.185 4.593 ( -4.734 4.619 10.122) 12.092 4.612 ( 8.998 -5.883 11.156) 15.493 5.391 ( 0.092 1.279 3.844) 4.052 5.558 ( 2.971 9.378 6.915) 12.025 5.724 ( -8.652 2.979 4.140) 10.044 6.779 ( -2.962 10.025 9.023) 13.809 7.806 ( -0.653 3.515 -0.967) 3.703 8.038 ( -2.958 15.949 -26.386) 30.974 8.506 ( 0.373 -4.047 13.907) 14.488 8.560 ( -8.221 10.528 -1.484) 13.439 9.468 ( 6.489 6.727 -3.879) 10.120 10.012 ( 35.028 -20.804 26.812) 48.772 10.674 ( -3.409 -2.309 3.462) 5.379 11.851 ( 7.883 5.225 -18.244) 20.550 12.303 ( 2.941 8.247 -8.409) 12.140 12.868 ( 3.644 4.746 -9.963) 11.622 13.956 ( 24.718 -3.066 -2.158) 25.001 14.976 ( -2.903 -2.157 -2.065) 4.165 15.118 ( 3.672 4.403 3.509) 6.722 16.131 ( 0.519 -7.072 -10.872) 12.980 17.013 ( -61.696 -42.290 39.926) 84.787 19.344 ( -46.423 17.787 -29.667) 57.893 19.871 ( 3.497 -3.230 -0.320) 4.771 20.103 ( -2.006 5.999 -0.460) 6.342 21.190 ( -6.766 -0.300 5.467) 8.704 21.759 ( 67.645 -20.392 20.353) 73.525 24.223 ( 4.213 6.843 -7.708) 11.135 24.314 ( 4.994 16.724 -14.277) 22.549 ======================= Grid point 110 (42/260) ======================= q-point: ( 0.10 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.972 ( 11.238 17.914 14.708) 25.759 1.198 ( 16.307 12.444 24.598) 32.028 1.876 ( 35.647 14.705 33.168) 50.863 3.271 ( -1.020 2.416 -2.448) 3.587 3.447 ( 7.224 -1.395 9.204) 11.784 3.676 ( 3.995 -5.683 -1.075) 7.029 3.896 ( -3.945 1.881 -8.593) 9.640 4.157 ( 0.895 1.059 -0.834) 1.618 4.476 ( -7.629 8.216 5.380) 12.436 4.691 ( -0.420 -3.776 5.768) 6.906 5.390 ( -0.888 0.599 4.744) 4.863 5.640 ( 1.432 13.330 8.113) 15.670 6.067 ( 27.167 -12.349 -10.553) 31.653 6.738 ( -2.945 9.878 7.871) 12.969 7.767 ( -2.436 3.524 -3.409) 5.475 7.937 ( -2.907 15.764 -13.369) 20.873 8.360 ( -10.466 7.048 -1.062) 12.662 8.539 ( -0.950 -0.889 14.715) 14.772 9.598 ( 6.597 5.206 0.386) 8.413 10.638 ( 12.364 -12.588 8.512) 19.591 10.704 ( 14.271 -18.515 4.927) 23.891 12.006 ( 11.377 0.282 -17.771) 21.103 12.246 ( -6.473 6.869 -5.356) 10.852 12.970 ( 8.056 4.617 -7.234) 11.770 13.831 ( -38.547 1.484 30.502) 49.178 14.887 ( -4.473 -3.774 -2.138) 6.231 15.155 ( 0.292 5.416 3.307) 6.352 16.086 ( -4.704 -7.952 -12.483) 15.530 16.321 ( 4.759 -1.443 2.714) 5.666 18.883 ( -2.884 9.159 -3.713) 10.296 19.840 ( -6.199 -0.825 0.052) 6.254 20.032 ( -5.346 4.979 -0.401) 7.316 20.911 ( -19.722 0.442 -1.320) 19.771 22.980 ( 42.490 -40.801 6.688) 59.286 24.184 ( -4.859 2.854 -2.530) 6.177 24.443 ( 7.791 12.201 -14.204) 20.281 ======================= Grid point 111 (43/260) ======================= q-point: ( 0.20 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.319 ( 19.609 8.358 10.919) 23.950 1.584 ( 17.056 8.426 22.748) 29.654 2.719 ( 40.406 6.246 21.592) 46.238 3.222 ( -3.645 3.104 -1.473) 5.009 3.559 ( 1.965 -1.001 5.605) 6.024 3.730 ( -7.871 1.483 -4.807) 9.341 3.838 ( 8.589 -8.531 3.346) 12.560 4.178 ( -0.656 3.186 -3.095) 4.490 4.375 ( -0.646 10.581 0.684) 10.623 4.715 ( 1.826 -0.790 1.580) 2.541 5.379 ( -1.243 -0.094 5.998) 6.126 5.679 ( 0.845 13.014 8.191) 15.400 6.414 ( 10.423 -10.508 -13.902) 20.305 6.707 ( -1.638 8.205 6.553) 10.627 7.704 ( -3.313 4.310 -2.369) 5.930 7.839 ( -5.248 11.442 -4.751) 13.455 8.145 ( -10.636 8.382 -0.994) 13.578 8.547 ( -1.720 2.461 14.887) 15.187 9.745 ( 8.650 1.078 2.131) 8.973 10.757 ( 6.195 0.419 -2.237) 6.600 11.050 ( 13.094 -18.335 6.362) 23.411 12.003 ( -13.669 3.484 -4.196) 14.717 12.232 ( 11.796 5.117 -17.468) 21.690 13.008 ( -14.685 4.667 27.533) 31.551 13.351 ( 0.364 8.142 12.997) 15.341 14.802 ( -4.144 -5.803 -1.957) 7.394 15.167 ( -0.542 5.465 0.692) 5.535 15.918 ( -8.333 -9.338 -8.399) 15.072 16.718 ( 28.159 -3.987 -20.236) 34.904 18.961 ( 7.560 -0.786 7.653) 10.786 19.627 ( -15.220 -0.721 1.308) 15.293 19.898 ( -8.050 5.244 -0.582) 9.625 20.469 ( -22.519 0.917 -6.623) 23.491 23.565 ( 17.819 -27.802 5.101) 33.414 24.072 ( -3.827 2.533 -3.716) 5.905 24.534 ( 4.083 6.088 -7.232) 10.297 ======================= Grid point 112 (44/260) ======================= q-point: ( 0.30 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.758 ( 21.888 3.375 8.569) 23.746 1.962 ( 16.160 6.675 18.885) 25.736 3.062 ( -8.823 2.079 1.508) 9.189 3.453 ( -9.236 -1.561 3.245) 9.913 3.543 ( 21.453 1.191 5.549) 22.191 3.644 ( 9.290 3.431 3.613) 10.542 3.975 ( -0.387 -3.755 3.588) 5.208 4.155 ( 5.214 -0.676 -11.617) 12.752 4.481 ( 8.859 10.039 4.417) 14.098 4.744 ( 0.350 -0.154 -1.024) 1.093 5.376 ( -0.430 -0.868 6.859) 6.927 5.707 ( -0.163 11.983 7.683) 14.235 6.469 ( -0.295 -5.019 -11.021) 12.114 6.704 ( -0.044 6.673 5.760) 8.816 7.615 ( -5.949 6.448 2.570) 9.142 7.720 ( -5.196 7.092 -2.671) 9.188 7.954 ( -8.200 11.301 1.361) 14.029 8.535 ( -2.771 3.820 15.557) 16.257 9.958 ( 12.235 -0.837 0.154) 12.265 10.872 ( 5.470 1.856 -2.130) 6.156 11.267 ( 8.014 -8.796 4.515) 12.727 11.689 ( -15.586 4.892 -4.398) 16.917 12.369 ( 3.346 11.342 -15.762) 19.704 12.834 ( -4.321 -2.181 32.983) 33.337 13.609 ( 18.097 1.391 -1.839) 18.243 14.707 ( -5.217 -7.084 -1.324) 8.897 15.092 ( -7.582 5.559 -3.638) 10.081 15.755 ( -5.865 -9.504 -3.280) 11.640 17.241 ( 28.591 -2.319 -20.067) 35.007 19.155 ( 8.294 -3.917 12.354) 15.387 19.278 ( -18.818 -0.575 1.566) 18.892 19.709 ( -11.573 6.524 3.237) 13.674 20.051 ( -16.077 -0.207 -11.302) 19.653 23.695 ( -3.735 -8.121 3.264) 9.516 24.128 ( 9.831 -8.506 -4.414) 13.730 24.574 ( 1.236 2.180 -4.553) 5.197 ======================= Grid point 113 (45/260) ======================= q-point: ( 0.40 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.204 ( 20.929 1.814 7.274) 22.231 2.282 ( 10.825 5.295 14.620) 18.946 2.855 ( -10.760 4.299 2.745) 11.908 3.158 ( -16.564 1.737 4.374) 17.220 3.588 ( -2.330 2.056 -4.036) 5.094 3.861 ( -2.960 -6.322 -4.095) 8.093 4.242 ( 24.673 0.065 2.154) 24.767 4.270 ( 5.694 -1.859 -10.653) 12.221 4.669 ( 5.457 4.016 1.562) 6.953 4.728 ( 0.847 3.510 6.144) 7.126 5.383 ( -1.026 -0.495 6.291) 6.393 5.683 ( -4.380 10.333 6.409) 12.923 6.426 ( -0.022 -1.249 -7.730) 7.831 6.739 ( 2.151 5.127 9.264) 10.804 7.493 ( -6.473 7.263 6.245) 11.561 7.632 ( -3.213 5.085 -2.429) 6.487 7.842 ( -3.619 15.991 4.423) 16.981 8.520 ( -2.089 2.895 16.654) 17.032 10.193 ( 10.526 0.393 -1.901) 10.704 10.955 ( 3.016 0.895 0.191) 3.152 11.322 ( -10.520 0.130 4.839) 11.580 11.465 ( 1.716 -0.084 -11.176) 11.308 12.307 ( -4.914 14.608 -7.345) 17.074 12.935 ( 5.431 -6.914 18.733) 20.694 13.992 ( 20.420 -2.849 -3.183) 20.862 14.568 ( -9.717 -8.993 -4.204) 13.891 14.880 ( -10.120 6.781 -3.333) 12.630 15.680 ( -1.999 -8.064 0.218) 8.311 17.740 ( 25.283 0.998 -15.568) 29.709 18.951 ( -12.548 0.583 0.413) 12.568 19.263 ( -2.611 -1.155 5.693) 6.369 19.444 ( -14.901 3.565 4.909) 16.089 19.879 ( 2.068 -2.446 -2.030) 3.792 23.586 ( -5.854 -2.040 -0.496) 6.219 24.315 ( 8.691 -9.993 -4.865) 14.109 24.557 ( -2.113 -0.539 -3.817) 4.396 ======================= Grid point 114 (46/260) ======================= q-point: (-0.50 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.305 ( -11.843 4.409 5.747) 13.882 2.558 ( 3.651 7.404 10.115) 13.056 2.742 ( 1.293 -1.055 3.592) 3.960 2.950 ( 1.688 3.522 8.667) 9.506 3.490 ( -5.208 1.411 -10.383) 11.702 3.824 ( 0.134 -4.891 -4.614) 6.725 4.242 ( -8.270 -2.256 -13.294) 15.818 4.479 ( 0.817 -3.203 -9.798) 10.341 4.787 ( 10.339 0.468 9.936) 14.347 4.828 ( 1.855 5.416 9.018) 10.682 5.327 ( -6.299 2.806 4.850) 8.431 5.596 ( -3.635 9.528 4.111) 10.995 6.473 ( 5.704 1.873 -2.780) 6.616 6.830 ( 4.158 1.026 14.213) 14.844 7.419 ( -2.119 5.772 6.574) 9.002 7.590 ( -0.105 4.754 -2.360) 5.309 7.832 ( 1.274 19.542 7.066) 20.819 8.535 ( -0.280 2.004 17.590) 17.706 10.322 ( 1.954 1.710 -1.798) 3.158 10.973 ( -4.817 -1.444 -2.055) 5.432 11.057 ( -9.329 1.111 -6.380) 11.356 11.537 ( 4.452 2.590 -4.635) 6.929 12.183 ( -5.527 13.565 -7.867) 16.627 13.058 ( 2.448 -7.701 15.143) 17.164 14.248 ( -16.435 -4.703 -11.976) 20.873 14.382 ( 15.482 -8.920 -0.919) 17.892 14.790 ( 1.539 7.385 1.445) 7.681 15.654 ( -0.819 -7.591 0.017) 7.635 18.141 ( 16.765 5.142 -6.806) 18.810 18.816 ( -1.308 1.941 -3.774) 4.440 19.042 ( -15.163 -0.774 -0.231) 15.185 19.277 ( -2.625 0.457 -0.439) 2.701 20.061 ( 12.215 -3.536 13.615) 18.630 23.484 ( -3.827 -2.650 -4.778) 6.671 24.427 ( 3.153 -10.723 -8.386) 13.973 24.476 ( -4.437 1.310 -1.815) 4.970 ======================= Grid point 115 (47/260) ======================= q-point: (-0.40 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.980 ( -19.892 5.128 5.473) 21.259 2.275 ( -21.981 8.752 7.223) 24.737 2.981 ( 11.561 -1.686 6.476) 13.358 3.167 ( 12.839 1.518 5.573) 14.079 3.366 ( -3.834 1.463 -11.959) 12.644 3.788 ( -10.411 -4.920 -9.160) 14.714 3.905 ( -13.853 1.944 -8.730) 16.489 4.431 ( -3.189 -0.685 -7.691) 8.354 4.787 ( -6.673 1.801 12.077) 13.915 4.958 ( 2.692 -0.242 8.489) 8.908 5.233 ( -1.985 6.134 3.050) 7.133 5.564 ( -1.393 10.381 2.184) 10.699 6.601 ( 6.305 3.119 1.731) 7.244 6.957 ( 4.879 -2.866 16.284) 17.239 7.435 ( 2.096 1.686 4.148) 4.943 7.634 ( 5.193 5.159 -2.244) 7.656 7.917 ( 5.355 18.826 8.606) 21.381 8.588 ( 1.540 2.502 17.942) 18.180 10.239 ( -10.010 -0.032 -0.207) 10.013 10.668 ( -16.919 -1.991 -20.402) 26.579 11.025 ( -0.194 2.123 2.372) 3.189 11.609 ( 4.176 7.901 -4.751) 10.121 12.057 ( -5.098 11.310 -10.879) 16.500 13.096 ( -1.851 -8.504 15.914) 18.138 13.852 ( -18.527 -1.738 -10.038) 21.143 14.640 ( 9.281 -7.483 1.421) 12.007 14.919 ( 9.554 5.755 -1.854) 11.306 15.660 ( 2.342 -8.183 -1.655) 8.671 18.298 ( -3.602 5.564 9.447) 11.540 18.745 ( -4.207 -1.074 -14.974) 15.591 18.933 ( 7.485 -1.517 0.225) 7.641 19.351 ( 10.303 2.887 -0.851) 10.734 20.360 ( 13.593 -2.942 19.169) 23.683 23.396 ( -4.040 -7.467 -12.369) 15.003 24.318 ( -7.807 -5.254 -3.695) 10.109 24.470 ( 0.523 0.239 -7.092) 7.116 ======================= Grid point 116 (48/260) ======================= q-point: (-0.30 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.581 ( -21.494 6.453 8.260) 23.914 1.825 ( -24.691 9.264 6.261) 27.105 3.024 ( -21.259 2.834 -1.348) 21.489 3.234 ( -2.312 -2.596 -8.123) 8.836 3.340 ( -8.541 1.457 -2.365) 8.981 3.465 ( 9.891 5.267 -1.203) 11.270 3.847 ( -0.250 -2.685 -2.523) 3.693 4.330 ( -4.537 4.202 -7.362) 9.615 4.690 ( -4.919 -1.663 13.876) 14.815 4.938 ( -5.953 0.610 9.341) 11.094 5.253 ( 2.347 4.872 1.888) 5.728 5.532 ( -2.155 12.034 1.652) 12.337 6.705 ( 3.164 4.196 5.588) 7.671 7.065 ( 1.114 -10.323 14.514) 17.845 7.513 ( 5.519 1.306 0.781) 5.725 7.770 ( 8.405 4.146 -2.268) 9.643 8.074 ( 8.140 13.844 8.953) 18.387 8.671 ( 2.814 4.849 16.820) 17.730 9.958 ( -16.966 -1.240 -0.497) 17.018 10.244 ( -20.503 -1.785 -28.389) 35.064 11.004 ( -2.977 2.791 2.564) 4.820 11.695 ( 6.083 16.614 -6.916) 18.997 11.942 ( -3.224 6.269 -12.702) 14.527 13.066 ( -4.633 -9.070 15.405) 18.467 13.511 ( -13.367 2.998 -4.886) 14.544 14.796 ( 6.507 -3.041 4.052) 8.247 15.057 ( 3.836 2.346 -3.464) 5.676 15.765 ( 8.915 -8.823 -4.816) 13.436 18.106 ( -14.621 -9.708 15.823) 23.630 18.710 ( 3.262 9.240 -6.613) 11.821 19.205 ( 17.576 -3.114 -1.843) 17.944 19.615 ( 14.834 5.471 -1.197) 15.856 20.673 ( 13.431 -1.845 20.653) 24.705 23.217 ( -11.542 -17.955 -24.983) 32.860 24.166 ( -6.096 0.117 -0.951) 6.171 24.439 ( -1.642 3.935 -8.881) 9.851 ======================= Grid point 117 (49/260) ======================= q-point: (-0.20 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.190 ( -19.728 9.380 13.883) 25.883 1.336 ( -25.642 10.192 5.536) 28.143 2.323 ( -39.870 15.105 4.970) 42.924 3.176 ( -0.932 -2.608 -7.012) 7.539 3.348 ( 1.088 2.847 3.160) 4.390 3.605 ( 4.525 5.294 -8.778) 11.205 3.846 ( 0.640 -6.692 1.438) 6.874 4.250 ( -1.770 5.673 -5.493) 8.092 4.653 ( -2.970 -0.795 14.683) 15.001 4.790 ( -10.189 0.924 7.731) 12.824 5.309 ( 2.585 2.938 2.071) 4.428 5.502 ( -0.807 13.269 2.377) 13.505 6.740 ( -1.962 1.305 5.993) 6.439 6.994 ( -12.231 -20.875 9.563) 26.016 7.658 ( 8.081 5.374 0.625) 9.725 7.939 ( 9.570 3.988 -5.838) 11.899 8.260 ( 8.017 5.704 8.778) 13.186 8.763 ( 2.662 8.819 11.025) 14.367 9.625 ( -14.760 0.074 -5.244) 15.664 9.748 ( -21.848 2.419 -23.111) 31.896 10.913 ( -6.635 1.187 3.223) 7.471 11.777 ( 2.475 21.651 -15.303) 26.628 11.941 ( 8.081 4.735 -8.837) 12.877 12.978 ( -6.382 -6.464 5.199) 10.466 13.342 ( -3.385 6.729 9.867) 12.413 14.922 ( 5.223 0.294 4.723) 7.048 15.070 ( -0.893 0.094 -2.619) 2.768 15.951 ( 10.051 -8.171 -8.161) 15.310 17.872 ( -12.604 -26.010 20.383) 35.368 18.887 ( 16.210 15.429 9.444) 24.290 19.542 ( 15.701 -2.279 -2.769) 16.106 19.885 ( 11.840 6.736 0.284) 13.625 20.972 ( 11.775 -1.078 18.514) 21.968 22.751 ( -30.393 -30.106 -40.143) 58.665 24.095 ( -0.714 7.169 -2.826) 7.739 24.377 ( -2.267 7.798 -8.997) 12.120 ======================= Grid point 118 (50/260) ======================= q-point: (-0.10 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.887 ( -18.316 16.032 10.029) 26.326 0.910 ( -11.289 14.516 22.150) 28.789 1.619 ( -31.286 26.011 22.300) 46.397 3.181 ( 2.498 -3.064 -0.813) 4.036 3.343 ( -1.626 4.964 0.343) 5.234 3.631 ( 0.831 2.355 -6.472) 6.937 3.888 ( 3.849 -5.075 -4.062) 7.555 4.218 ( -1.292 4.442 -3.065) 5.549 4.562 ( -8.403 0.356 11.366) 14.139 4.660 ( -3.990 2.663 10.180) 11.253 5.359 ( 1.899 2.123 2.481) 3.777 5.517 ( 1.365 13.015 4.158) 13.731 6.377 ( -39.091 -28.221 -2.952) 48.304 6.817 ( -3.753 7.532 10.325) 13.320 7.782 ( 3.547 4.586 0.809) 5.854 8.092 ( 6.125 8.185 -21.852) 24.125 8.411 ( 5.304 -1.960 10.672) 12.077 8.742 ( -7.225 13.358 -7.354) 16.874 9.408 ( -1.996 2.774 1.420) 3.701 9.505 ( 3.596 5.371 10.906) 12.678 10.777 ( -7.208 -0.778 4.229) 8.394 11.781 ( 3.344 10.988 -17.752) 21.144 12.156 ( 12.980 13.659 -11.396) 22.021 12.877 ( -2.701 0.221 -5.719) 6.329 13.460 ( 14.043 8.650 17.894) 24.336 15.015 ( 1.434 3.787 1.345) 4.267 15.042 ( 0.653 -2.398 1.227) 2.772 16.093 ( 5.919 -7.126 -10.318) 13.866 17.663 ( -17.298 -46.120 28.290) 56.803 19.470 ( 37.044 8.302 20.560) 43.173 19.782 ( 8.378 -0.732 -5.347) 9.965 20.075 ( 7.246 6.759 4.583) 10.918 21.173 ( 2.682 -2.119 10.255) 10.810 21.768 ( -54.717 -21.382 -43.551) 73.129 24.121 ( 4.879 13.287 -9.978) 17.318 24.322 ( -1.205 10.074 -7.567) 12.657 ======================= Grid point 119 (51/260) ======================= q-point: ( 0.00 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.266 ( 4.466 19.823 17.761) 26.988 1.304 ( 2.308 21.791 18.295) 28.546 2.012 ( -1.329 34.612 17.542) 38.826 3.162 ( 5.447 -7.197 5.413) 10.524 3.434 ( -1.638 5.827 -2.192) 6.437 3.510 ( -2.265 -9.174 3.137) 9.957 3.974 ( 4.994 3.518 -9.691) 11.456 4.249 ( -3.537 5.162 -1.109) 6.355 4.547 ( 0.777 0.766 9.133) 9.198 4.720 ( -1.399 5.423 7.129) 9.066 5.393 ( -0.931 -1.920 1.031) 2.370 5.622 ( 0.815 -0.759 6.707) 6.799 5.952 ( -0.539 14.338 1.326) 14.409 7.050 ( -1.319 14.736 8.729) 17.178 7.910 ( -2.576 6.378 -0.498) 6.897 8.271 ( 2.288 9.556 -18.458) 20.911 8.412 ( 1.424 -4.730 12.929) 13.841 8.771 ( -8.542 9.049 2.041) 12.611 9.628 ( 7.087 7.895 -2.323) 10.860 9.827 ( 16.475 0.949 21.289) 26.936 10.593 ( -4.647 -5.812 1.976) 7.699 11.671 ( 2.889 -16.631 -5.052) 17.620 12.445 ( -1.330 7.266 0.289) 7.392 13.056 ( 4.084 9.948 -13.792) 17.489 13.904 ( 10.993 -1.718 -5.895) 12.591 14.911 ( -3.385 -3.889 -3.644) 6.314 15.210 ( 4.521 2.648 1.426) 5.430 15.905 ( -0.212 -14.205 -10.524) 17.680 16.461 ( -24.968 -15.684 22.636) 37.172 19.540 ( -28.966 4.892 -25.742) 39.059 19.801 ( 7.540 -3.171 -2.754) 8.631 20.239 ( -1.270 6.739 -1.835) 7.099 21.182 ( -3.789 -0.554 6.897) 7.889 21.467 ( 30.429 -10.424 16.434) 36.120 24.299 ( 0.583 3.436 -2.063) 4.050 24.524 ( 2.880 4.320 -7.551) 9.164 ======================= Grid point 120 (52/260) ======================= q-point: ( 0.10 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.388 ( 4.446 20.815 13.351) 25.126 1.496 ( 11.844 15.502 20.790) 28.510 2.296 ( 23.508 23.653 17.934) 37.865 3.285 ( 3.707 -4.199 4.502) 7.186 3.447 ( 4.453 4.370 2.452) 6.704 3.497 ( 0.920 -11.004 0.357) 11.049 3.941 ( -6.212 2.159 -6.436) 9.201 4.250 ( 3.700 6.968 -1.436) 8.019 4.588 ( -0.347 0.823 4.802) 4.884 4.693 ( -1.696 5.540 5.282) 7.840 5.396 ( 0.524 -0.923 2.044) 2.303 5.827 ( 13.146 -3.390 4.559) 14.321 5.977 ( 4.157 9.868 -0.907) 10.746 7.022 ( -3.375 15.842 9.029) 18.544 7.853 ( -2.296 4.451 -3.726) 6.242 8.248 ( -2.507 16.021 -6.160) 17.346 8.455 ( 0.335 -1.660 6.451) 6.670 8.614 ( -6.663 10.573 4.601) 13.317 9.704 ( 1.269 3.829 1.514) 4.309 10.317 ( 24.596 -6.010 22.187) 33.665 10.597 ( 5.058 -5.326 -2.949) 7.915 11.781 ( 8.761 -17.466 -3.434) 19.839 12.373 ( -5.830 7.166 -0.604) 9.257 13.139 ( 6.971 8.550 -10.970) 15.557 13.859 ( -15.836 1.268 6.100) 17.018 14.809 ( -5.843 -3.586 -4.990) 8.479 15.259 ( 0.496 2.909 3.976) 4.951 15.819 ( -5.997 -15.757 -10.815) 20.030 16.276 ( 6.919 -2.761 1.364) 7.574 19.039 ( -13.188 5.310 -14.179) 20.079 19.822 ( -4.393 -0.819 -1.921) 4.864 20.163 ( -5.717 7.069 -2.660) 9.472 20.924 ( -19.204 0.744 1.437) 19.272 22.299 ( 39.630 -25.611 14.395) 49.332 24.256 ( -4.194 4.072 -1.907) 6.149 24.570 ( 2.769 1.985 -5.541) 6.505 ======================= Grid point 121 (53/260) ======================= q-point: ( 0.20 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.565 ( 11.214 14.598 10.278) 21.083 1.813 ( 15.283 12.986 16.635) 26.056 2.862 ( 25.666 6.430 12.701) 29.349 3.312 ( 0.364 2.462 2.313) 3.398 3.500 ( 0.583 -4.481 3.602) 5.778 3.667 ( 13.268 -3.828 2.879) 14.106 3.766 ( -8.778 0.996 -3.349) 9.448 4.300 ( -0.249 8.016 -4.376) 9.136 4.572 ( 0.562 6.798 2.364) 7.219 4.706 ( 1.459 0.567 2.617) 3.050 5.410 ( 0.270 2.135 3.368) 3.997 5.928 ( -0.158 8.722 5.083) 10.096 6.187 ( 12.084 -8.399 -6.817) 16.218 6.966 ( -4.175 14.417 9.602) 17.817 7.804 ( -2.073 4.854 -3.664) 6.425 8.146 ( -6.901 18.851 2.943) 20.289 8.387 ( -6.128 13.378 0.869) 14.740 8.590 ( 0.076 1.787 9.322) 9.492 9.747 ( 4.398 -1.433 1.748) 4.945 10.739 ( 9.158 -2.804 -7.000) 11.863 10.813 ( 19.788 -4.184 19.978) 28.429 11.946 ( 4.946 -11.546 -7.344) 14.550 12.249 ( -3.291 4.288 1.827) 5.706 13.222 ( -2.377 10.151 -4.581) 11.388 13.522 ( -10.121 8.819 13.049) 18.721 14.679 ( -6.015 -5.568 -4.891) 9.545 15.281 ( 0.285 4.291 3.232) 5.379 15.637 ( -9.283 -16.345 -8.553) 20.652 16.636 ( 27.050 -3.473 -14.566) 30.919 18.929 ( 2.015 -2.212 -2.180) 3.702 19.627 ( -14.634 0.777 0.543) 14.665 20.018 ( -7.720 5.732 -4.615) 10.666 20.500 ( -22.468 2.180 -0.764) 22.586 22.981 ( 26.467 -26.652 9.360) 38.710 24.142 ( -6.165 4.039 -3.740) 8.265 24.598 ( 1.054 0.603 -3.068) 3.300 ======================= Grid point 122 (54/260) ======================= q-point: ( 0.30 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.867 ( 16.836 7.342 6.813) 19.590 2.154 ( 15.433 11.195 12.557) 22.830 3.104 ( -2.676 1.264 1.489) 3.313 3.344 ( -6.516 -8.605 6.822) 12.769 3.559 ( 5.953 -0.426 0.844) 6.027 3.678 ( 4.609 -1.473 -0.757) 4.897 3.970 ( 15.558 5.415 6.620) 17.753 4.226 ( -2.341 6.835 -10.614) 12.839 4.650 ( 4.741 3.758 0.521) 6.072 4.738 ( 1.616 0.956 3.511) 3.981 5.427 ( 0.665 5.020 4.459) 6.747 5.915 ( -2.375 6.570 4.549) 8.337 6.339 ( 5.706 -5.027 -8.173) 11.164 6.909 ( -3.671 11.082 10.340) 15.595 7.744 ( -3.493 5.367 -2.061) 6.727 8.009 ( -7.512 21.256 5.296) 23.158 8.295 ( -2.963 20.434 3.515) 20.945 8.579 ( -3.437 -0.633 11.692) 12.203 9.917 ( 12.449 -3.209 -1.606) 12.956 10.885 ( 6.525 -1.254 -5.836) 8.843 11.179 ( 12.864 0.123 16.840) 21.191 11.801 ( -12.719 5.835 -12.196) 18.562 12.375 ( 10.733 -7.619 1.241) 13.221 13.001 ( -13.278 14.949 12.340) 23.496 13.626 ( 11.859 0.022 -0.189) 11.861 14.542 ( -7.025 -8.423 -4.385) 11.812 15.218 ( -7.899 6.287 -3.712) 10.757 15.485 ( -3.273 -15.497 -0.557) 15.849 17.191 ( 31.561 -2.160 -18.423) 36.608 19.036 ( 6.367 -6.815 3.801) 10.071 19.299 ( -16.377 2.301 1.900) 16.647 19.843 ( -9.252 4.703 -1.284) 10.458 20.064 ( -20.563 2.544 -2.812) 20.910 23.396 ( 13.435 -19.109 7.444) 24.516 24.025 ( -3.338 -1.508 -7.702) 8.529 24.598 ( -0.535 0.207 -1.707) 1.801 ======================= Grid point 123 (55/260) ======================= q-point: ( 0.40 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( 18.316 1.537 4.049) 18.821 2.452 ( 10.942 10.492 7.838) 17.065 2.978 ( -8.005 6.697 3.407) 10.979 3.114 ( -14.729 -6.363 5.684) 17.022 3.631 ( 3.170 -2.217 -0.914) 3.975 3.715 ( -4.681 -3.633 -5.136) 7.842 4.174 ( 4.951 -1.492 -10.386) 11.602 4.372 ( 14.255 7.285 0.867) 16.032 4.662 ( -0.154 -3.274 -4.709) 5.737 4.844 ( 5.544 4.970 11.736) 13.898 5.454 ( 0.856 6.836 4.426) 8.189 5.841 ( -6.065 3.842 4.050) 8.243 6.426 ( 5.720 2.260 -5.554) 8.286 6.873 ( -2.300 6.979 11.316) 13.492 7.663 ( -4.013 6.157 -0.811) 7.394 7.884 ( -5.978 21.994 5.218) 23.381 8.286 ( 0.453 25.004 6.433) 25.822 8.534 ( -3.269 -2.571 13.749) 14.365 10.184 ( 13.535 -1.542 -4.461) 14.334 10.959 ( 1.957 -0.963 -2.362) 3.215 11.334 ( -5.773 1.262 7.380) 9.454 11.577 ( -0.484 10.888 -8.814) 14.017 12.517 ( 1.877 -0.733 -7.150) 7.428 12.861 ( -3.206 5.719 17.804) 18.973 13.886 ( 13.888 -7.638 -1.464) 15.917 14.366 ( -10.128 -10.236 -6.114) 15.644 15.030 ( -7.358 7.550 -4.240) 11.363 15.464 ( -0.616 -11.702 2.319) 11.946 17.767 ( 30.072 1.610 -17.330) 34.746 18.967 ( -10.450 1.086 1.408) 10.600 19.211 ( 2.702 -3.860 1.672) 4.999 19.566 ( -21.500 7.910 9.067) 24.638 19.807 ( -0.670 -4.331 -3.066) 5.348 23.528 ( -0.974 -3.849 3.150) 5.068 24.016 ( 4.249 -16.534 -9.143) 19.366 24.572 ( -1.637 1.280 -1.201) 2.400 ======================= Grid point 124 (56/260) ======================= q-point: (-0.50 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.446 ( -8.015 6.810 0.653) 10.537 2.635 ( 15.118 2.507 4.053) 15.851 2.786 ( -16.490 2.176 2.721) 16.855 2.982 ( 5.240 1.040 11.467) 12.650 3.552 ( -7.341 2.008 -9.814) 12.419 3.700 ( 3.154 -4.623 -3.049) 6.373 4.165 ( -4.998 -4.694 -11.434) 13.332 4.437 ( -2.213 -0.910 -12.794) 13.016 4.811 ( 10.689 1.817 10.057) 14.788 4.932 ( -0.664 3.894 11.332) 12.001 5.459 ( -1.944 9.097 2.801) 9.715 5.740 ( -3.060 3.492 3.532) 5.833 6.553 ( 7.522 6.074 -1.198) 9.742 6.869 ( -0.993 2.539 13.196) 13.474 7.596 ( -2.214 7.336 -0.631) 7.689 7.808 ( -2.444 19.333 3.487) 19.797 8.323 ( 1.111 25.801 9.417) 27.488 8.532 ( 0.231 -2.468 14.129) 14.345 10.349 ( 2.153 0.150 -5.595) 5.997 10.960 ( -4.101 0.007 -1.288) 4.299 11.087 ( -9.754 2.300 -8.565) 13.182 11.690 ( 7.543 12.203 2.738) 14.605 12.436 ( -6.107 6.521 -9.545) 13.074 12.897 ( 0.612 -4.090 15.309) 15.858 14.072 ( -9.118 -12.932 -3.445) 16.194 14.190 ( 8.725 -8.576 -6.562) 13.882 14.969 ( 1.954 9.512 -1.300) 9.797 15.450 ( -1.098 -11.097 1.499) 11.251 18.277 ( 23.952 7.275 -10.980) 27.334 18.811 ( -7.070 -1.651 -3.479) 8.051 19.115 ( -18.870 7.293 6.206) 21.161 19.262 ( 0.966 -1.817 -2.208) 3.018 19.954 ( 12.008 -6.706 12.370) 18.499 23.426 ( -7.976 -2.774 -6.342) 10.561 24.097 ( 4.339 -18.554 -5.189) 19.748 24.536 ( -1.463 2.886 -1.825) 3.715 ======================= Grid point 125 (57/260) ======================= q-point: (-0.40 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.159 ( -17.907 11.095 3.626) 21.376 2.425 ( -20.269 4.667 2.418) 20.939 2.940 ( 13.063 -1.928 1.875) 13.337 3.146 ( 5.656 -1.872 5.476) 8.092 3.431 ( -1.273 1.470 -8.319) 8.544 3.684 ( -6.719 -3.651 -6.608) 10.106 3.970 ( -8.530 4.461 -7.491) 12.198 4.381 ( -0.385 -4.262 -10.557) 11.391 4.847 ( -9.095 3.999 11.854) 15.467 4.984 ( 3.261 2.533 9.898) 10.725 5.410 ( -2.401 10.048 2.442) 10.616 5.746 ( 1.593 5.496 1.485) 5.912 6.699 ( 6.764 6.441 2.383) 9.640 6.875 ( -2.391 -4.025 14.562) 15.297 7.590 ( 2.318 9.209 -1.353) 9.592 7.807 ( 1.668 13.544 1.190) 13.698 8.363 ( 0.530 22.484 11.565) 25.290 8.608 ( 4.178 -0.088 12.762) 13.428 10.226 ( -12.187 -1.666 -3.389) 12.759 10.668 ( -17.117 2.227 -16.486) 23.869 11.079 ( 2.101 3.014 1.208) 3.867 11.849 ( 8.159 14.918 1.584) 17.077 12.271 ( -8.027 5.375 -10.228) 14.069 12.924 ( -0.671 -4.751 11.511) 12.471 13.787 ( -13.635 -4.495 -7.469) 16.184 14.437 ( 13.084 -12.208 -0.386) 17.899 15.059 ( 5.774 7.271 -2.490) 9.613 15.444 ( 1.094 -11.355 0.575) 11.422 18.412 ( -20.879 3.679 10.019) 23.449 18.767 ( 13.791 5.215 -12.355) 19.236 18.894 ( -0.148 -2.561 -2.080) 3.302 19.423 ( 13.895 3.856 -1.010) 14.456 20.266 ( 15.132 -6.108 18.495) 24.665 23.191 ( -13.613 -11.787 -15.938) 24.047 24.148 ( 1.657 -9.017 -0.812) 9.204 24.512 ( -0.255 2.519 -4.039) 4.767 ======================= Grid point 126 (58/260) ======================= q-point: (-0.30 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.806 ( -18.371 14.278 7.151) 24.341 2.005 ( -22.199 7.785 1.037) 23.548 3.065 ( -5.344 -0.494 -0.635) 5.404 3.179 ( -2.948 -1.164 -2.397) 3.974 3.374 ( -5.103 -0.410 -5.250) 7.333 3.565 ( 5.269 3.479 -0.369) 6.324 3.836 ( -5.983 3.525 -3.861) 7.945 4.381 ( 1.935 -0.728 -7.840) 8.108 4.693 ( -7.304 3.198 11.423) 13.931 4.981 ( -5.592 3.166 10.194) 12.050 5.386 ( -0.707 7.369 1.742) 7.605 5.773 ( 0.729 8.980 0.621) 9.031 6.756 ( -7.616 -6.700 6.583) 12.092 6.864 ( 2.925 0.962 10.675) 11.110 7.693 ( 8.145 11.508 -1.116) 14.143 7.872 ( 4.731 7.141 -0.916) 8.615 8.393 ( -0.234 16.235 11.453) 19.870 8.743 ( 6.412 2.469 10.420) 12.482 9.924 ( -16.030 -2.030 -2.295) 16.320 10.268 ( -19.080 4.324 -18.295) 26.786 11.069 ( -4.049 2.990 1.557) 5.269 11.975 ( -0.421 4.613 -7.493) 8.809 12.132 ( 1.438 12.843 -3.032) 13.274 12.942 ( 1.122 0.299 4.943) 5.078 13.542 ( -9.208 -0.141 -3.897) 10.000 14.684 ( 11.325 -8.100 2.850) 14.212 15.119 ( 0.533 2.354 -4.430) 5.044 15.534 ( 8.179 -11.360 -1.831) 14.117 17.926 ( -27.370 -6.993 12.683) 30.966 18.843 ( 4.895 1.474 -4.002) 6.492 19.204 ( 20.660 5.115 -2.702) 21.455 19.734 ( 16.348 5.414 -1.616) 17.297 20.615 ( 15.300 -3.834 20.851) 26.145 22.796 ( -22.253 -20.641 -24.395) 38.940 24.172 ( 1.048 0.487 0.917) 1.476 24.504 ( 0.478 1.961 -6.047) 6.375 ======================= Grid point 127 (59/260) ======================= q-point: (-0.20 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.487 ( -15.471 18.033 11.018) 26.190 1.581 ( -19.708 13.141 2.292) 23.798 2.692 ( -25.923 17.878 6.537) 32.161 3.095 ( -1.824 -4.939 -5.954) 7.948 3.431 ( 4.581 4.115 1.231) 6.280 3.674 ( -1.607 -8.152 1.741) 8.489 3.724 ( 1.969 5.073 -6.109) 8.182 4.378 ( -0.932 5.792 -6.581) 8.816 4.649 ( -0.304 0.822 11.636) 11.669 4.832 ( -10.643 3.114 8.538) 13.995 5.383 ( 0.080 3.682 1.222) 3.880 5.780 ( -0.182 10.542 0.962) 10.587 6.482 ( -20.075 -14.643 5.480) 25.445 6.962 ( 3.597 7.354 8.371) 11.709 7.861 ( 6.744 12.693 1.080) 14.414 7.999 ( 9.427 2.048 -3.021) 10.108 8.399 ( -1.498 7.949 7.132) 10.784 8.881 ( 4.434 3.500 7.916) 9.725 9.638 ( -10.837 1.093 -4.193) 11.671 9.864 ( -16.845 8.739 -10.768) 21.819 10.934 ( -9.322 0.529 2.354) 9.629 11.825 ( -7.601 -8.036 -9.875) 14.828 12.288 ( 9.160 16.298 -0.280) 18.698 12.992 ( 3.849 8.942 -8.891) 13.184 13.440 ( 0.209 2.611 4.244) 4.988 14.886 ( 7.799 -4.070 4.649) 9.950 15.089 ( -1.519 0.325 -4.415) 4.681 15.717 ( 9.957 -12.721 -5.736) 17.142 17.425 ( -26.452 -16.377 17.356) 35.625 19.050 ( 16.786 0.815 2.693) 17.020 19.580 ( 17.160 6.368 -2.126) 18.426 20.022 ( 12.320 5.858 -0.405) 13.648 20.944 ( 12.621 -1.480 19.215) 23.037 22.185 ( -33.392 -23.163 -29.728) 50.352 24.203 ( 2.240 4.407 -0.783) 5.005 24.501 ( 0.640 3.262 -6.735) 7.511 ======================= Grid point 128 (60/260) ======================= q-point: (-0.10 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.260 ( -8.612 18.808 13.351) 24.621 1.315 ( -7.758 22.745 11.904) 26.818 2.227 ( -21.162 29.868 13.457) 39.000 3.084 ( 1.595 -6.190 -0.186) 6.395 3.471 ( -0.773 5.999 0.561) 6.074 3.574 ( -4.994 -8.288 3.555) 10.309 3.848 ( 8.614 2.547 -9.988) 13.433 4.327 ( -3.020 5.619 -3.277) 7.172 4.612 ( -8.633 4.206 9.874) 13.773 4.711 ( -0.173 2.087 7.620) 7.903 5.394 ( 0.569 0.494 1.187) 1.407 5.741 ( -6.323 2.755 2.955) 7.503 6.076 ( -16.543 0.165 2.746) 16.770 7.031 ( 1.322 11.350 8.479) 14.229 7.932 ( 0.643 9.902 2.061) 10.134 8.203 ( 9.751 3.389 -8.397) 13.307 8.373 ( -1.202 -1.079 3.269) 3.646 8.903 ( -4.175 4.714 4.128) 7.530 9.520 ( 0.516 7.069 -3.357) 7.843 9.655 ( -1.686 9.506 6.309) 11.533 10.742 ( -9.967 -2.894 3.395) 10.920 11.691 ( -3.361 -13.295 -7.525) 15.642 12.421 ( 3.872 9.948 0.378) 10.682 13.028 ( 2.794 11.321 -16.776) 20.431 13.606 ( 14.845 5.004 1.777) 15.767 14.965 ( -0.995 -4.373 -0.391) 4.502 15.105 ( 4.647 2.658 0.332) 5.364 15.867 ( 6.192 -13.809 -8.803) 17.508 16.948 ( -27.044 -23.138 23.252) 42.514 19.488 ( 23.309 -3.311 2.734) 23.701 19.837 ( 6.808 4.553 -6.623) 10.533 20.205 ( 5.759 5.596 1.342) 8.142 21.126 ( -0.803 -2.123 6.518) 6.902 21.462 ( -24.098 -10.154 -13.050) 29.225 24.257 ( 3.355 4.324 -2.706) 6.106 24.501 ( 1.146 4.887 -7.090) 8.687 ======================= Grid point 129 (61/260) ======================= q-point: ( 0.00 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.650 ( 3.469 17.699 14.684) 23.257 1.761 ( -0.657 20.767 13.242) 24.638 2.656 ( -0.685 24.527 4.978) 25.036 2.984 ( 3.986 -8.957 6.328) 11.669 3.240 ( -2.784 -13.417 5.784) 14.874 3.604 ( -1.259 8.178 -0.052) 8.275 4.034 ( 3.294 1.715 -4.161) 5.577 4.377 ( -2.083 6.838 -1.477) 7.299 4.608 ( -2.408 4.184 4.979) 6.935 4.805 ( 1.004 2.527 5.913) 6.508 5.314 ( -0.617 -5.120 -1.250) 5.306 5.578 ( 1.097 -3.329 6.889) 7.729 6.198 ( -0.439 8.602 -1.797) 8.799 7.342 ( 1.232 12.863 9.203) 15.864 8.049 ( -6.890 6.110 -0.041) 9.209 8.275 ( 2.002 -7.389 2.826) 8.161 8.499 ( 9.897 10.122 0.108) 14.157 8.974 ( -5.331 12.242 5.482) 14.434 9.753 ( 4.741 3.850 -1.932) 6.406 10.003 ( 9.668 14.024 14.574) 22.417 10.425 ( -6.948 -10.074 0.469) 12.247 11.274 ( 1.032 -20.276 0.042) 20.303 12.654 ( -1.953 12.562 -0.145) 12.714 13.220 ( 2.043 5.740 -9.345) 11.156 13.889 ( 6.821 0.342 -5.334) 8.665 14.826 ( -2.661 -4.116 -3.467) 6.004 15.110 ( 3.403 -14.031 -1.855) 14.556 15.673 ( 0.425 -4.639 -8.051) 9.301 16.250 ( -13.713 -6.244 11.965) 19.241 19.608 ( -24.468 2.110 -23.629) 34.080 19.746 ( 10.722 -2.102 -6.202) 12.563 20.372 ( 0.755 5.801 -5.214) 7.836 21.162 ( 4.333 -1.669 10.443) 11.429 21.292 ( 9.526 -6.260 14.941) 18.793 24.371 ( 0.801 3.380 -1.591) 3.821 24.561 ( 0.731 0.096 -2.582) 2.685 ======================= Grid point 130 (62/260) ======================= q-point: ( 0.10 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.804 ( 1.727 18.628 13.380) 23.000 1.825 ( 10.063 15.690 14.256) 23.466 2.755 ( 9.066 18.332 4.388) 20.917 3.122 ( 7.713 -9.935 6.850) 14.322 3.231 ( 0.389 -13.537 3.744) 14.051 3.617 ( 3.230 9.462 2.015) 10.199 3.991 ( -6.233 3.640 -1.397) 7.352 4.401 ( 4.408 6.542 -2.924) 8.413 4.612 ( 1.143 2.025 1.394) 2.711 4.792 ( -3.534 2.356 5.519) 6.965 5.353 ( 4.172 -2.486 0.421) 4.875 5.713 ( 9.749 -6.057 5.047) 12.538 6.184 ( -0.475 7.588 -2.017) 7.866 7.335 ( -4.246 13.418 11.394) 18.107 7.944 ( -2.833 4.215 -2.921) 5.859 8.360 ( 4.366 -6.793 7.187) 10.811 8.638 ( 3.329 20.091 2.544) 20.523 8.875 ( -5.401 14.117 4.235) 15.697 9.738 ( -4.833 -0.319 1.877) 5.195 10.346 ( 18.019 2.941 20.762) 27.648 10.451 ( 10.558 -4.962 -6.510) 13.360 11.382 ( 9.494 -19.590 1.554) 21.825 12.581 ( -5.142 12.525 -2.076) 13.698 13.268 ( 4.343 3.703 -7.740) 9.617 13.891 ( -6.039 2.112 0.614) 6.427 14.737 ( -5.795 -3.726 -6.397) 9.401 15.140 ( 0.459 -15.521 1.226) 15.576 15.608 ( -4.888 -1.801 -7.662) 9.265 16.218 ( 9.650 -2.566 -0.562) 10.001 19.112 ( -17.530 2.114 -17.595) 24.927 19.809 ( -2.358 -0.421 -4.673) 5.251 20.307 ( -5.959 6.424 -6.704) 11.033 20.942 ( -18.245 1.053 4.949) 18.934 21.873 ( 32.200 -16.041 16.128) 39.424 24.347 ( -3.306 4.492 -1.309) 5.729 24.569 ( 0.715 -1.569 -2.200) 2.795 ======================= Grid point 131 (63/260) ======================= q-point: ( 0.20 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.892 ( 5.183 16.197 9.299) 19.383 2.092 ( 13.406 13.007 12.227) 22.325 2.970 ( 9.959 4.116 2.349) 11.029 3.210 ( -1.601 -9.551 6.277) 11.541 3.322 ( 8.536 -11.064 -1.643) 14.070 3.730 ( 1.367 0.286 5.091) 5.279 3.885 ( 2.809 15.651 3.186) 16.217 4.471 ( 1.510 7.541 -6.227) 9.896 4.637 ( 1.431 0.904 -3.147) 3.573 4.728 ( -2.477 -0.434 6.484) 6.955 5.452 ( 5.029 2.094 1.858) 5.756 5.904 ( 6.277 -7.616 3.316) 10.411 6.193 ( 3.220 5.343 -2.724) 6.807 7.242 ( -7.335 11.352 12.228) 18.226 7.903 ( -1.589 4.756 -1.697) 5.294 8.452 ( 2.300 -3.720 12.556) 13.296 8.640 ( -3.108 25.060 -1.210) 25.281 8.793 ( -3.866 15.891 6.747) 17.692 9.684 ( 1.422 -4.452 0.022) 4.674 10.614 ( 10.645 -10.089 -3.285) 15.030 10.844 ( 21.188 6.530 16.877) 27.864 11.628 ( 13.655 -16.247 0.814) 21.239 12.449 ( -7.206 13.290 -2.430) 15.311 13.325 ( 1.340 0.221 -6.041) 6.191 13.713 ( -9.748 9.130 6.066) 14.669 14.567 ( -9.397 -6.262 -7.087) 13.332 15.156 ( 0.632 -16.119 2.127) 16.271 15.477 ( -6.174 2.704 -6.179) 9.144 16.580 ( 26.670 -1.908 -11.813) 29.231 18.878 ( -3.653 -2.458 -7.831) 8.984 19.653 ( -11.973 1.559 -2.684) 12.369 20.114 ( -11.123 3.198 -9.731) 15.121 20.563 ( -20.269 3.757 6.403) 21.586 22.500 ( 27.154 -19.120 11.465) 35.134 24.231 ( -7.807 4.296 -3.421) 9.545 24.580 ( 0.720 -1.969 -1.170) 2.401 ======================= Grid point 132 (64/260) ======================= q-point: ( 0.30 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.060 ( 9.871 10.932 5.702) 15.794 2.391 ( 14.037 10.354 8.991) 19.624 3.100 ( 2.382 -1.515 -0.019) 2.823 3.135 ( -7.246 -10.041 3.987) 13.008 3.484 ( 6.824 -7.203 -1.240) 9.999 3.647 ( -3.218 0.057 -0.321) 3.235 4.168 ( 16.695 11.746 9.188) 22.385 4.391 ( -5.608 7.992 -8.795) 13.141 4.635 ( -1.300 -2.381 -9.055) 9.453 4.772 ( 4.535 -0.160 9.560) 10.582 5.548 ( 3.909 5.873 2.999) 7.666 5.935 ( -2.936 -3.923 3.695) 6.137 6.325 ( 9.796 3.016 -3.845) 10.948 7.118 ( -7.517 8.733 12.309) 16.861 7.854 ( -3.312 5.320 -0.149) 6.268 8.464 ( -5.701 -6.287 3.772) 9.287 8.561 ( -2.416 28.752 9.724) 30.448 8.763 ( -0.590 20.598 8.090) 22.137 9.824 ( 12.517 -6.039 -3.323) 14.290 10.788 ( 7.638 -8.855 -4.834) 12.654 11.243 ( 13.912 5.763 16.932) 22.659 11.833 ( 5.083 -5.119 -8.348) 11.033 12.346 ( -0.952 8.556 4.277) 9.613 13.228 ( -9.501 3.553 1.807) 10.303 13.642 ( 1.187 3.685 0.892) 3.973 14.354 ( -10.261 -10.409 -5.563) 15.639 15.158 ( -0.907 -13.362 -1.314) 13.457 15.358 ( -4.409 5.862 -2.043) 7.615 17.160 ( 33.966 -0.737 -16.947) 37.966 18.895 ( 5.111 -6.232 -0.529) 8.077 19.364 ( -15.243 3.661 -1.881) 15.789 19.863 ( -11.009 -1.921 -8.669) 14.144 20.177 ( -20.918 7.078 8.581) 23.692 22.996 ( 21.100 -17.605 8.262) 28.695 24.026 ( -11.610 0.924 -6.877) 13.525 24.590 ( 0.531 -0.725 -0.779) 1.190 ======================= Grid point 133 (65/260) ======================= q-point: ( 0.40 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.289 ( 11.592 4.099 2.897) 12.632 2.672 ( 12.134 7.890 6.148) 15.725 2.944 ( -12.322 -6.811 2.804) 14.355 3.083 ( -3.243 2.275 1.312) 4.173 3.517 ( -1.262 -4.027 -0.134) 4.222 3.683 ( 3.911 -3.365 -5.681) 7.674 4.204 ( -5.916 3.931 -11.433) 13.460 4.538 ( -0.711 3.115 -10.115) 10.608 4.571 ( 12.093 -0.053 6.728) 13.838 4.899 ( 4.877 0.340 12.281) 13.218 5.616 ( 2.299 7.463 3.420) 8.525 5.849 ( -5.944 -2.100 4.269) 7.613 6.525 ( 10.681 6.358 -2.797) 12.741 7.012 ( -5.868 6.419 12.108) 14.908 7.778 ( -4.121 5.284 0.566) 6.725 8.302 ( -8.401 -1.379 -3.583) 9.237 8.567 ( -1.088 23.799 17.486) 29.552 8.800 ( 1.712 22.546 8.590) 24.188 10.105 ( 14.714 -7.169 -5.149) 17.159 10.895 ( 4.331 -5.460 -2.498) 7.403 11.379 ( -4.951 3.308 2.335) 6.396 11.856 ( 4.590 12.885 -5.293) 14.667 12.413 ( 2.728 -2.072 7.416) 8.169 13.051 ( -7.973 6.371 6.220) 11.952 13.689 ( 3.017 -9.759 -2.368) 10.486 14.155 ( -8.238 -9.829 -5.303) 13.878 15.122 ( -1.107 -3.414 -4.660) 5.882 15.299 ( -1.970 1.044 2.330) 3.225 17.805 ( 34.265 1.981 -17.645) 38.592 18.989 ( -1.958 -0.049 3.004) 3.586 19.129 ( -2.631 -2.484 -3.559) 5.075 19.694 ( -4.928 -3.788 3.327) 7.050 19.756 ( -22.294 6.935 5.340) 23.951 23.380 ( 15.710 -10.962 6.855) 20.346 23.750 ( -13.541 -6.924 -11.108) 18.833 24.594 ( -0.002 0.741 -1.236) 1.442 ======================= Grid point 134 (66/260) ======================= q-point: (-0.50 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.485 ( 5.423 -0.857 1.464) 5.682 2.683 ( -13.566 -5.215 3.102) 14.862 2.863 ( 4.588 12.412 0.394) 13.239 3.041 ( 1.142 2.949 5.176) 6.066 3.461 ( -4.290 -6.333 -4.469) 8.859 3.707 ( 0.143 -0.417 -5.894) 5.911 4.090 ( -2.448 -0.716 -12.122) 12.388 4.409 ( -5.063 -2.644 -15.283) 16.315 4.866 ( 10.860 3.498 12.696) 17.069 4.986 ( 0.303 1.466 12.619) 12.708 5.652 ( 0.096 8.192 2.295) 8.508 5.754 ( -3.114 -1.109 4.845) 5.865 6.715 ( 8.368 8.411 0.187) 11.866 6.934 ( -5.263 4.222 12.142) 13.891 7.711 ( -2.128 4.436 -0.059) 4.921 8.150 ( -5.530 0.016 -5.289) 7.652 8.602 ( 0.870 21.038 16.756) 26.909 8.843 ( 0.320 22.179 9.577) 24.161 10.278 ( 1.598 -8.664 -5.766) 10.529 10.959 ( 0.005 -0.157 0.901) 0.915 11.159 ( -9.484 4.444 -11.928) 15.874 12.011 ( 9.102 16.406 2.981) 18.997 12.394 ( -6.047 -4.506 3.841) 8.463 12.961 ( -2.701 5.627 6.029) 8.678 13.747 ( 2.001 -17.013 -0.710) 17.144 14.023 ( -1.903 -7.452 -7.956) 11.066 15.115 ( 1.062 -0.849 -4.154) 4.371 15.280 ( -0.240 0.189 2.928) 2.944 18.409 ( 29.840 4.767 -14.278) 33.422 18.811 ( -11.760 2.300 -1.248) 12.047 19.191 ( -7.382 -2.173 2.477) 8.084 19.302 ( -9.360 7.226 4.262) 12.570 19.793 ( 10.544 -8.292 10.576) 17.082 23.356 ( -17.155 -4.810 -11.399) 21.151 23.742 ( 13.317 -13.292 2.111) 18.933 24.582 ( -0.836 1.540 -2.270) 2.868 ======================= Grid point 135 (67/260) ======================= q-point: (-0.40 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.370 ( -14.026 6.812 5.867) 16.660 2.472 ( -11.308 1.127 -2.498) 11.635 2.944 ( 5.445 3.467 -0.333) 6.463 3.138 ( 4.992 1.483 2.657) 5.846 3.352 ( -4.685 -6.994 -6.225) 10.470 3.649 ( -4.027 -2.383 -5.156) 6.963 4.077 ( 2.061 5.045 -7.392) 9.184 4.282 ( -3.611 -4.106 -12.503) 13.647 4.936 ( -6.550 3.995 11.945) 14.197 5.047 ( 3.244 3.217 11.279) 12.170 5.611 ( -3.734 8.437 2.446) 9.545 5.782 ( 3.557 -1.121 3.084) 4.839 6.799 ( -6.630 -1.412 6.696) 9.528 6.882 ( 3.050 8.942 8.837) 12.937 7.718 ( 3.407 4.038 -2.009) 5.652 8.068 ( -1.502 2.479 -5.822) 6.503 8.669 ( 1.729 16.465 14.187) 21.803 8.857 ( -0.607 20.077 10.022) 22.447 10.142 ( -12.296 -7.519 -3.876) 14.925 10.734 ( -15.349 2.990 -11.613) 19.478 11.150 ( 2.485 3.994 -1.190) 4.852 12.103 ( -6.328 -2.395 -4.462) 8.105 12.311 ( 3.290 12.925 9.904) 16.612 12.966 ( 2.711 5.730 1.006) 6.419 13.677 ( -7.185 -5.530 -4.744) 10.233 14.137 ( 13.240 -16.218 -3.441) 21.217 15.110 ( -1.271 -6.076 -3.494) 7.123 15.324 ( 4.249 3.787 1.684) 5.936 18.441 ( -27.745 0.443 7.687) 28.794 18.814 ( -2.930 -4.830 -4.673) 7.331 18.981 ( 18.508 13.693 -6.134) 23.827 19.499 ( 15.415 2.965 -1.256) 15.747 20.108 ( 16.994 -8.815 17.466) 25.914 22.935 ( -21.732 -11.853 -17.291) 30.195 23.997 ( 11.247 -5.028 3.027) 12.686 24.553 ( -1.358 1.297 -3.617) 4.075 ======================= Grid point 136 (68/260) ======================= q-point: (-0.30 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.108 ( -13.187 10.922 6.228) 18.220 2.176 ( -16.579 11.661 -1.065) 20.297 2.993 ( -1.162 -4.812 -3.631) 6.139 3.196 ( -6.631 -1.974 2.445) 7.339 3.282 ( 5.732 -3.229 -5.672) 8.686 3.612 ( 1.722 -0.022 -0.552) 1.809 3.980 ( -9.869 8.578 -2.728) 13.357 4.319 ( 8.174 -3.786 -8.663) 12.498 4.805 ( -7.714 6.258 7.922) 12.706 5.051 ( -5.375 3.239 11.060) 12.716 5.534 ( -4.447 6.256 1.419) 7.806 5.856 ( 2.301 -0.728 2.213) 3.275 6.588 ( -14.166 -5.726 7.477) 17.011 6.999 ( 5.724 8.389 7.156) 12.424 7.830 ( 7.984 3.139 -2.303) 8.883 8.060 ( 1.562 4.309 -4.557) 6.463 8.685 ( -3.660 13.411 9.768) 16.990 8.903 ( 3.496 14.599 9.446) 17.736 9.861 ( -13.569 -4.809 -2.170) 14.558 10.399 ( -15.491 7.108 -11.634) 20.636 11.116 ( -6.229 1.719 1.313) 6.593 11.845 ( -15.060 -13.014 -3.612) 20.229 12.473 ( 7.472 18.639 7.915) 21.584 13.083 ( 9.626 9.892 -5.802) 14.973 13.516 ( -6.847 -1.453 -5.325) 8.795 14.440 ( 16.427 -15.721 -0.530) 22.743 15.056 ( -3.045 -8.000 -3.486) 9.242 15.434 ( 6.142 2.206 -0.543) 6.549 17.824 ( -34.431 -2.934 12.323) 36.687 18.790 ( 4.997 -4.643 -5.303) 8.640 19.405 ( 20.652 12.396 -1.975) 24.167 19.822 ( 16.640 2.594 -3.202) 17.142 20.513 ( 18.919 -5.784 21.084) 28.912 22.417 ( -26.441 -14.970 -21.254) 37.081 24.189 ( 7.322 1.097 2.006) 7.670 24.521 ( -0.565 -0.080 -4.668) 4.703 ======================= Grid point 137 (69/260) ======================= q-point: (-0.20 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.848 ( -13.958 13.384 0.442) 19.343 1.909 ( -9.866 20.246 10.101) 24.683 2.908 ( -6.834 -1.937 -0.612) 7.129 3.027 ( -7.318 -0.193 -0.333) 7.328 3.389 ( 1.278 -4.431 2.105) 5.069 3.655 ( 0.391 3.044 1.601) 3.462 3.820 ( -1.585 6.314 -2.164) 6.860 4.450 ( 4.977 0.494 -7.420) 8.948 4.707 ( -2.748 4.723 6.938) 8.831 4.905 ( -10.787 3.513 9.295) 14.666 5.445 ( -4.489 2.034 0.262) 4.936 5.840 ( -5.670 -4.266 2.698) 7.592 6.334 ( -10.719 -0.458 3.416) 11.260 7.132 ( 5.992 8.741 6.987) 12.694 8.009 ( 9.875 0.954 0.767) 9.950 8.097 ( 2.860 4.406 -2.195) 5.693 8.574 ( -8.657 9.493 2.778) 13.145 9.005 ( 3.602 10.192 7.875) 13.374 9.649 ( -6.245 -0.778 -2.060) 6.621 10.094 ( -12.410 12.642 -5.207) 18.464 10.925 ( -12.845 -1.370 2.437) 13.146 11.550 ( -13.247 -16.681 -2.315) 21.426 12.602 ( 4.063 15.555 5.093) 16.864 13.255 ( 5.403 13.749 -16.047) 21.811 13.452 ( 5.054 -1.196 1.119) 5.313 14.741 ( 12.895 -11.335 0.958) 17.195 14.988 ( -2.462 -9.318 -4.471) 10.624 15.550 ( 5.773 -1.669 -3.067) 6.747 17.185 ( -32.363 -7.363 14.270) 36.128 19.000 ( 17.077 -3.779 -2.654) 17.691 19.756 ( 14.621 9.243 -0.740) 17.313 20.112 ( 12.983 2.550 -4.117) 13.857 20.913 ( 15.365 -1.498 20.601) 25.743 21.799 ( -30.283 -14.019 -21.562) 39.731 24.294 ( 3.422 4.431 -0.483) 5.619 24.520 ( 1.385 -1.027 -4.032) 4.385 ======================= Grid point 138 (70/260) ======================= q-point: (-0.10 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.648 ( -6.252 17.837 8.248) 20.623 1.788 ( -4.993 21.978 11.655) 25.373 2.744 ( -8.385 14.741 4.695) 17.597 2.947 ( -1.144 -4.686 1.447) 5.036 3.321 ( -6.312 -10.446 6.322) 13.745 3.638 ( -1.744 6.791 1.443) 7.159 3.914 ( 8.335 3.061 -5.136) 10.258 4.447 ( -2.968 5.682 -3.462) 7.285 4.711 ( -9.194 4.513 7.095) 12.459 4.742 ( 3.188 1.150 5.623) 6.565 5.365 ( -3.477 -3.125 -0.928) 4.766 5.663 ( -10.092 -5.706 5.288) 12.743 6.220 ( -2.188 7.633 -0.328) 7.947 7.259 ( 4.882 10.542 7.403) 13.776 8.119 ( 0.612 3.036 2.117) 3.751 8.238 ( 8.423 1.865 9.611) 12.915 8.388 ( -6.203 3.345 -11.125) 13.169 9.040 ( -2.067 10.069 7.144) 12.517 9.633 ( 4.863 2.888 -3.290) 6.543 9.927 ( -3.618 16.089 5.211) 17.295 10.652 ( -14.335 -5.474 3.013) 15.638 11.339 ( -7.200 -19.136 -1.187) 20.480 12.660 ( 1.042 13.498 2.254) 13.724 13.233 ( -0.671 7.512 -12.031) 14.199 13.682 ( 13.832 3.000 -4.654) 14.899 14.872 ( -0.871 -4.207 -0.032) 4.296 15.008 ( 6.614 -13.907 -4.143) 15.947 15.640 ( 4.076 -4.905 -5.729) 8.573 16.632 ( -26.337 -9.097 15.272) 31.775 19.409 ( 22.442 -3.588 -3.546) 23.001 19.928 ( 0.270 3.834 -8.320) 9.165 20.303 ( 7.230 3.772 -4.887) 9.507 21.090 ( -6.250 -1.304 3.925) 7.495 21.299 ( -7.150 -5.954 4.157) 10.191 24.342 ( 2.183 3.917 -2.286) 5.034 24.545 ( 1.549 0.047 -2.767) 3.171 ======================= Grid point 139 (71/260) ======================= q-point: ( 0.00 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.966 ( 3.134 10.719 9.060) 14.381 2.107 ( -3.037 10.214 13.779) 17.418 2.787 ( 4.879 -3.245 3.157) 6.656 2.887 ( 2.877 -8.667 4.890) 10.359 3.117 ( -8.066 4.820 3.760) 10.121 3.761 ( -0.050 5.425 0.590) 5.457 4.049 ( 3.603 0.054 2.207) 4.225 4.498 ( -2.358 3.720 -2.314) 4.976 4.693 ( -2.936 3.331 5.125) 6.781 4.819 ( 0.730 -0.893 3.734) 3.908 5.214 ( 1.106 -3.364 -1.379) 3.800 5.508 ( 0.440 -2.384 5.435) 5.951 6.309 ( -0.672 2.450 -2.913) 3.865 7.568 ( 1.986 7.738 10.331) 13.060 8.081 ( 2.478 -4.992 5.392) 7.754 8.169 ( -9.692 0.606 -1.520) 9.829 8.647 ( 15.682 3.601 5.969) 17.161 9.272 ( -2.055 12.772 2.836) 13.244 9.799 ( 6.012 0.718 -1.562) 6.253 10.122 ( -9.216 -7.935 5.950) 13.539 10.408 ( 3.515 14.409 4.765) 15.578 10.868 ( 0.339 -17.640 3.056) 17.906 12.901 ( -2.162 8.392 -1.613) 8.815 13.296 ( 0.335 1.723 -7.173) 7.385 13.915 ( 5.640 1.680 -2.979) 6.596 14.708 ( -1.144 -8.593 -7.543) 11.491 14.826 ( 1.937 -5.691 0.385) 6.024 15.657 ( 1.759 0.579 -7.695) 7.915 16.169 ( -10.850 -1.878 8.214) 13.738 19.636 ( -23.485 0.630 -21.259) 31.684 19.716 ( 12.586 -0.711 -9.854) 16.001 20.464 ( 2.742 2.597 -9.619) 10.334 21.111 ( 14.994 -2.168 18.593) 23.983 21.220 ( -7.041 -1.145 10.999) 13.110 24.429 ( 1.466 1.854 -1.750) 2.941 24.549 ( -0.540 -0.793 -0.633) 1.149 ======================= Grid point 140 (72/260) ======================= q-point: ( 0.10 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.100 ( 7.487 8.992 10.624) 15.804 2.123 ( 1.493 10.015 12.061) 15.748 2.922 ( 7.051 -7.352 3.297) 10.707 2.970 ( 3.659 -4.909 6.283) 8.772 3.025 ( -0.797 2.948 -0.701) 3.133 3.745 ( -1.721 2.211 2.206) 3.566 4.130 ( 3.770 7.636 6.842) 10.924 4.486 ( 2.209 1.330 -4.801) 5.449 4.657 ( -1.506 1.725 1.552) 2.766 4.779 ( -4.508 -2.347 1.844) 5.407 5.326 ( 8.532 -0.047 0.799) 8.569 5.599 ( 6.753 -3.914 5.099) 9.323 6.283 ( -1.087 2.227 -2.869) 3.791 7.552 ( -6.261 6.468 12.951) 15.772 8.020 ( -2.489 2.862 -2.589) 4.592 8.208 ( 5.835 -6.209 8.242) 11.855 8.930 ( 9.330 6.392 11.982) 16.476 9.241 ( -1.724 18.689 0.528) 18.776 9.679 ( -12.096 -6.224 1.326) 13.668 10.164 ( 9.745 -9.344 -0.962) 13.535 10.645 ( 16.540 14.628 9.077) 23.874 10.997 ( 11.697 -17.222 4.824) 21.370 12.830 ( -4.308 8.689 -3.701) 10.381 13.298 ( 0.846 -0.226 -6.530) 6.588 13.954 ( -1.185 3.385 1.110) 3.754 14.607 ( -7.686 -8.377 -8.302) 14.078 14.863 ( 1.976 -6.026 1.134) 6.443 15.626 ( -3.037 1.206 -6.523) 7.296 16.179 ( 11.113 -1.035 -1.650) 11.283 19.138 ( -19.467 0.545 -18.196) 26.653 19.803 ( -1.024 -0.107 -6.673) 6.752 20.408 ( -6.593 2.774 -10.711) 12.879 20.964 ( -17.133 0.810 7.665) 18.787 21.636 ( 28.012 -6.253 17.378) 33.552 24.438 ( -2.027 4.189 -0.974) 4.754 24.517 ( -1.002 -3.281 -1.171) 3.625 ======================= Grid point 141 (73/260) ======================= q-point: ( 0.20 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.198 ( 3.693 11.846 8.722) 15.167 2.293 ( 9.092 4.051 10.137) 14.207 3.013 ( 2.537 -3.000 1.537) 4.219 3.034 ( 0.934 -2.749 4.745) 5.563 3.123 ( 9.497 -5.788 -5.285) 12.314 3.707 ( -2.877 -1.078 6.142) 6.868 4.241 ( 5.866 15.222 9.684) 18.971 4.557 ( 5.529 -2.503 -5.263) 8.033 4.630 ( -1.630 -1.040 -3.694) 4.169 4.681 ( -4.636 -1.072 -0.848) 4.833 5.504 ( 8.503 2.498 1.943) 9.073 5.756 ( 6.736 -5.216 4.395) 9.586 6.275 ( 1.743 2.045 -1.648) 3.152 7.415 ( -9.580 4.739 13.328) 17.084 7.993 ( -0.992 3.294 -0.721) 3.515 8.328 ( 2.416 -5.252 11.266) 12.662 9.056 ( 1.594 7.911 12.370) 14.770 9.181 ( -3.486 23.355 -0.747) 23.626 9.546 ( -0.103 -10.103 -1.829) 10.268 10.369 ( 10.503 -9.966 -1.514) 14.558 11.043 ( 19.808 11.706 11.208) 25.593 11.315 ( 17.720 -13.817 5.964) 23.249 12.720 ( -5.586 9.889 -4.651) 12.273 13.272 ( -2.943 -3.652 -4.983) 6.843 13.903 ( -3.726 8.501 3.595) 9.954 14.371 ( -13.708 -10.914 -7.226) 18.954 14.914 ( 2.773 -5.189 1.097) 5.985 15.540 ( -3.857 1.990 -5.258) 6.818 16.555 ( 27.091 -0.601 -10.990) 29.241 18.839 ( -7.205 -1.050 -9.882) 12.275 19.681 ( -9.343 0.810 -5.717) 10.983 20.152 ( -15.732 0.713 -11.775) 19.663 20.634 ( -17.531 2.323 9.927) 20.279 22.217 ( 26.400 -7.361 12.238) 30.015 24.306 ( -9.918 2.380 -3.587) 10.812 24.536 ( 2.034 -1.662 -0.136) 2.630 ======================= Grid point 142 (74/260) ======================= q-point: ( 0.30 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.303 ( 5.054 11.762 6.249) 14.245 2.489 ( 7.998 -3.235 8.535) 12.136 3.014 ( -2.152 0.197 0.763) 2.291 3.061 ( 1.403 -2.046 -1.205) 2.758 3.318 ( 10.915 -6.663 -7.084) 14.618 3.659 ( -3.657 0.528 7.778) 8.611 4.385 ( 4.158 7.145 6.312) 10.401 4.528 ( -5.568 4.565 -6.820) 9.917 4.601 ( 1.377 0.016 -10.234) 10.326 4.712 ( 6.294 -4.914 6.748) 10.454 5.654 ( 5.870 3.979 2.677) 7.580 5.831 ( -0.572 -4.436 4.696) 6.485 6.390 ( 10.368 2.032 -0.964) 10.609 7.257 ( -9.019 3.965 13.200) 16.471 7.957 ( -2.735 3.997 0.650) 4.886 8.293 ( -8.051 -6.785 8.207) 13.349 9.095 ( 0.017 9.339 12.131) 15.310 9.174 ( 2.876 27.011 2.017) 27.238 9.630 ( 8.467 -14.004 -3.832) 16.807 10.568 ( 10.230 -8.686 -1.737) 13.532 11.400 ( 11.687 8.013 7.619) 16.088 11.671 ( 16.367 -8.042 4.991) 18.906 12.611 ( -3.809 12.027 -1.543) 12.709 13.149 ( -8.220 -7.186 -1.346) 11.001 13.814 ( -7.609 11.761 -0.538) 14.018 14.093 ( -10.418 -14.134 -3.148) 17.838 14.969 ( 2.385 -4.371 0.610) 5.017 15.455 ( -3.545 2.764 -4.469) 6.339 17.155 ( 35.491 0.010 -16.085) 38.966 18.798 ( 3.836 -2.621 -2.428) 5.242 19.433 ( -13.670 2.293 -6.273) 15.215 19.812 ( -14.482 -1.954 -7.248) 16.312 20.297 ( -19.712 3.457 11.067) 22.869 22.726 ( 22.966 -7.177 8.472) 25.510 24.045 ( -15.121 0.619 -6.406) 16.433 24.576 ( 1.912 -0.452 -0.455) 2.017 ======================= Grid point 143 (75/260) ======================= q-point: ( 0.40 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.413 ( 4.483 7.890 4.260) 10.025 2.606 ( 0.751 -9.687 7.669) 12.378 3.001 ( 2.214 6.737 -2.206) 7.426 3.076 ( 0.914 -1.652 -1.815) 2.618 3.473 ( 4.169 -1.709 -7.014) 8.337 3.604 ( -2.258 -2.240 3.708) 4.885 4.305 ( -7.463 5.352 -11.863) 15.003 4.424 ( -4.142 -6.154 -12.580) 14.604 4.730 ( 10.073 7.134 7.592) 14.491 4.864 ( 6.293 -3.417 12.035) 14.004 5.734 ( 0.598 3.750 4.239) 5.691 5.795 ( -2.265 -2.482 4.520) 5.632 6.634 ( 12.874 3.057 -0.624) 13.246 7.130 ( -6.508 4.018 12.847) 14.952 7.889 ( -4.319 5.535 0.693) 7.055 8.107 ( -10.137 -9.934 2.885) 14.483 9.103 ( -1.854 11.404 12.660) 17.140 9.258 ( 3.654 29.127 2.068) 29.428 9.827 ( 10.194 -20.522 -1.057) 22.939 10.776 ( 11.159 -4.038 -1.212) 11.928 11.459 ( -5.709 3.221 -6.636) 9.328 11.979 ( 13.059 0.299 5.251) 14.079 12.580 ( -0.841 15.228 6.387) 16.534 12.986 ( -6.814 -11.752 3.520) 14.033 13.586 ( -11.442 -0.017 -4.755) 12.391 13.981 ( -2.822 -5.696 -2.577) 6.860 15.005 ( 1.100 -3.857 0.043) 4.011 15.390 ( -1.804 3.466 -3.169) 5.031 17.841 ( 36.544 1.122 -17.115) 40.369 18.947 ( 10.087 -2.225 3.099) 10.784 19.140 ( -13.555 1.770 -8.023) 15.851 19.602 ( -5.371 -3.126 1.995) 6.527 19.886 ( -24.191 3.741 9.923) 26.413 23.170 ( 20.210 -6.449 5.660) 21.956 23.689 ( -18.738 -0.729 -8.945) 20.777 24.603 ( 0.863 0.159 -1.348) 1.608 ======================= Grid point 144 (76/260) ======================= q-point: (-0.50 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.485 ( 1.641 1.377 2.240) 3.099 2.558 ( -5.749 -5.149 5.404) 9.422 3.062 ( 1.511 -0.119 1.867) 2.404 3.124 ( 5.679 8.632 -5.278) 11.603 3.410 ( -7.551 2.856 -0.455) 8.086 3.587 ( -1.394 -9.378 -7.426) 12.043 4.155 ( -3.189 5.052 -15.426) 16.543 4.323 ( -2.713 -4.825 -12.553) 13.719 4.943 ( 7.653 3.459 13.163) 15.614 4.992 ( 3.469 -1.030 12.879) 13.378 5.712 ( -1.471 -0.926 6.008) 6.255 5.785 ( -1.191 2.903 2.742) 4.167 6.830 ( 4.915 2.220 1.761) 5.673 7.059 ( -3.462 5.908 12.354) 14.125 7.798 ( -3.841 4.599 -0.423) 6.007 7.965 ( -3.662 -10.634 -2.475) 11.515 9.084 ( -2.861 11.706 12.277) 17.203 9.307 ( 0.959 27.303 1.560) 27.364 9.951 ( 0.959 -21.862 1.885) 21.964 10.955 ( 2.203 -0.155 1.737) 2.810 11.251 ( -6.704 3.323 -16.786) 18.378 12.139 ( -1.008 -1.679 2.560) 3.223 12.579 ( 1.516 19.784 9.298) 21.913 12.942 ( 0.185 -10.477 8.064) 13.222 13.460 ( 1.588 -7.478 -4.809) 9.032 13.904 ( -4.136 -3.272 -7.148) 8.883 15.009 ( -0.661 -3.947 -0.483) 4.031 15.380 ( 1.383 3.891 -1.806) 4.507 18.470 ( 27.626 1.404 -12.837) 30.495 18.867 ( -10.938 1.530 -7.790) 13.515 19.181 ( 8.622 1.590 5.780) 10.501 19.396 ( -20.420 0.859 10.458) 22.958 19.653 ( 7.326 -3.750 6.171) 10.287 23.232 ( -20.667 -4.839 -13.542) 25.178 23.593 ( 17.197 -2.303 5.666) 18.253 24.601 ( -0.627 0.392 -2.445) 2.554 ======================= Grid point 145 (77/260) ======================= q-point: (-0.40 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.405 ( -8.197 -0.599 0.297) 8.225 2.514 ( -1.477 1.535 5.545) 5.940 3.036 ( -4.327 2.756 -2.773) 5.832 3.226 ( -10.001 -3.483 -2.529) 10.887 3.244 ( 6.619 8.361 -2.141) 10.877 3.524 ( -1.463 -8.718 -5.869) 10.611 4.139 ( 4.725 0.786 -13.733) 14.545 4.248 ( -3.392 0.437 -7.568) 8.305 4.996 ( -3.708 1.524 12.301) 12.938 5.102 ( 2.741 1.600 11.473) 11.904 5.731 ( -2.144 2.060 4.486) 5.382 5.748 ( 0.702 -0.429 3.370) 3.469 6.772 ( -10.875 -0.692 5.625) 12.263 7.070 ( 1.777 6.684 10.888) 12.899 7.790 ( 3.552 3.522 -3.697) 6.220 7.941 ( 1.762 -8.628 -5.374) 10.316 9.040 ( -4.438 9.754 10.750) 15.179 9.308 ( -1.134 25.213 2.446) 25.357 9.869 ( -8.709 -18.657 2.153) 20.702 10.765 ( -13.823 0.291 -5.816) 15.000 11.244 ( 1.703 3.924 -7.301) 8.461 11.943 ( -16.174 -6.174 1.174) 17.352 12.714 ( 6.981 19.454 9.692) 22.829 13.004 ( 5.820 -4.893 3.190) 8.245 13.596 ( 7.884 -1.327 -3.881) 8.887 13.824 ( 1.874 -11.112 -9.109) 14.491 14.978 ( -2.294 -3.985 -0.963) 4.698 15.429 ( 3.620 3.462 -1.427) 5.208 18.461 ( -28.257 1.239 9.280) 29.768 18.715 ( -4.733 -3.558 -7.611) 9.643 19.272 ( 19.533 12.332 -6.405) 23.972 19.510 ( 14.691 -2.827 1.630) 15.049 19.938 ( 18.012 -5.807 15.954) 24.752 22.748 ( -24.252 -5.118 -16.232) 29.629 23.936 ( 15.429 -1.259 4.170) 16.032 24.568 ( -1.997 0.279 -3.593) 4.120 ======================= Grid point 146 (78/260) ======================= q-point: (-0.30 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.233 ( -8.893 3.058 -0.114) 9.405 2.451 ( -6.593 10.200 7.376) 14.210 2.916 ( -5.250 -1.445 -4.941) 7.353 3.015 ( -10.032 -9.260 -4.367) 14.334 3.373 ( 6.465 7.237 -0.050) 9.705 3.539 ( 2.918 -6.360 0.566) 7.021 4.134 ( -6.865 5.296 -3.029) 9.184 4.253 ( 8.807 -2.505 -10.547) 13.967 4.908 ( -6.457 2.876 7.120) 10.033 5.104 ( -5.136 1.546 10.824) 12.080 5.627 ( -7.061 2.452 0.881) 7.527 5.802 ( 0.322 -2.553 5.208) 5.809 6.521 ( -13.150 -1.340 4.844) 14.078 7.160 ( 4.872 5.516 9.775) 12.236 7.886 ( 6.364 3.067 -3.810) 8.026 7.994 ( 4.230 -6.568 -5.506) 9.558 8.943 ( -7.790 7.319 7.149) 12.860 9.287 ( -1.204 20.954 3.752) 21.321 9.681 ( -8.937 -13.487 0.746) 16.196 10.507 ( -10.743 2.515 -4.528) 11.926 11.165 ( -8.680 3.069 -2.090) 9.441 11.583 ( -19.365 -9.350 1.263) 21.541 12.833 ( 3.446 13.023 6.768) 15.076 13.202 ( 12.394 -0.325 1.019) 12.440 13.567 ( -4.259 7.502 -11.746) 14.573 14.072 ( 18.855 -16.464 -3.636) 25.294 14.920 ( -3.147 -3.636 -1.226) 4.963 15.503 ( 3.914 2.430 -2.123) 5.072 17.792 ( -37.877 -0.519 12.755) 39.970 18.707 ( 6.169 -2.441 -6.506) 9.292 19.660 ( 17.210 10.961 -1.508) 20.460 19.819 ( 16.753 -3.480 -5.411) 17.946 20.400 ( 23.241 -3.856 21.464) 31.870 22.202 ( -27.077 -5.343 -18.020) 32.961 24.210 ( 11.329 0.700 2.671) 11.661 24.513 ( -2.387 -0.425 -4.506) 5.116 ======================= Grid point 147 (79/260) ======================= q-point: (-0.20 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.065 ( -7.749 6.410 0.433) 10.066 2.311 ( -8.683 16.030 11.323) 21.460 2.808 ( -5.624 -4.031 -3.089) 7.577 2.865 ( -2.977 -11.914 -1.939) 12.432 3.441 ( -2.576 5.836 5.104) 8.170 3.626 ( 5.886 -4.166 0.795) 7.255 4.000 ( -4.593 7.477 -0.933) 8.824 4.415 ( 8.968 -2.668 -7.643) 12.081 4.802 ( -4.988 3.071 4.500) 7.386 4.963 ( -10.461 1.670 8.900) 13.836 5.467 ( -8.807 0.318 -0.629) 8.835 5.731 ( -8.355 -3.793 4.880) 10.393 6.353 ( -4.094 0.875 1.738) 4.533 7.300 ( 6.874 5.848 8.750) 12.570 7.994 ( 3.496 -2.288 -1.107) 4.322 8.090 ( 7.946 -1.371 -2.154) 8.346 8.751 ( -12.615 5.177 1.218) 13.690 9.292 ( 0.810 15.440 3.193) 15.787 9.566 ( -2.018 -8.100 0.392) 8.356 10.323 ( -7.243 7.079 0.056) 10.128 10.913 ( -15.849 1.500 0.820) 15.941 11.220 ( -16.816 -12.441 1.914) 21.005 12.896 ( 1.926 10.018 3.434) 10.763 13.382 ( 0.343 -2.459 -1.826) 3.083 13.537 ( 9.259 9.682 -10.822) 17.221 14.423 ( 16.270 -14.044 -4.436) 21.946 14.855 ( -2.991 -2.879 -1.082) 4.290 15.568 ( 3.324 1.321 -3.456) 4.974 17.093 ( -34.528 -1.985 12.755) 36.862 18.937 ( 18.061 -1.795 -4.903) 18.801 19.920 ( 9.052 5.424 2.132) 10.766 20.126 ( 15.339 -0.689 -10.590) 18.652 20.886 ( 19.169 -0.862 21.658) 28.935 21.604 ( -28.684 -4.696 -15.935) 33.147 24.383 ( 4.989 3.892 0.048) 6.328 24.474 ( 0.590 -2.920 -3.408) 4.526 ======================= Grid point 148 (80/260) ======================= q-point: (-0.10 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.953 ( -3.380 9.609 4.318) 11.064 2.180 ( -7.144 13.344 13.909) 20.557 2.737 ( -0.543 -3.073 0.558) 3.170 2.846 ( 0.477 -10.537 1.748) 10.692 3.301 ( -10.667 4.936 6.212) 13.294 3.731 ( 3.392 1.775 0.450) 3.855 3.982 ( 2.259 3.008 0.073) 3.762 4.533 ( 2.461 1.926 -4.368) 5.370 4.748 ( -2.247 0.640 5.133) 5.640 4.795 ( -4.981 2.025 6.250) 8.244 5.295 ( -7.492 -2.470 -1.803) 8.093 5.568 ( -7.322 -2.783 5.150) 9.375 6.322 ( -0.371 2.301 -1.182) 2.614 7.456 ( 6.457 7.045 8.561) 12.830 8.030 ( 1.348 -5.872 2.029) 6.357 8.299 ( 9.602 1.680 8.828) 13.152 8.477 ( -11.064 3.184 -8.563) 14.348 9.301 ( -1.128 11.983 2.979) 12.399 9.626 ( 7.821 -3.291 -0.795) 8.522 10.227 ( -3.449 8.859 6.094) 11.292 10.578 ( -16.953 1.372 1.460) 17.071 10.958 ( -9.642 -15.393 2.590) 18.347 12.922 ( 0.097 8.859 0.792) 8.895 13.328 ( -1.928 1.802 -7.248) 7.714 13.753 ( 11.167 3.443 -5.331) 12.844 14.663 ( 8.465 -13.307 -6.466) 17.045 14.807 ( -1.168 -1.769 -0.079) 2.121 15.620 ( 2.939 0.541 -5.366) 6.142 16.519 ( -25.569 -2.457 11.695) 28.224 19.355 ( 23.293 -1.399 -6.109) 24.122 19.985 ( -4.592 1.484 -9.184) 10.375 20.357 ( 10.050 1.346 -10.500) 14.597 21.073 ( -14.485 -0.322 1.778) 14.597 21.213 ( 4.653 -2.222 15.178) 16.029 24.412 ( 0.729 2.371 -3.238) 4.079 24.527 ( 2.774 -1.208 -0.121) 3.029 ======================= Grid point 189 (81/260) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.934 ( -1.971 0.000 23.480) 23.562 1.120 ( 9.257 0.000 27.022) 28.563 2.159 ( 9.328 0.000 48.585) 49.472 3.213 ( -1.730 0.000 -0.770) 1.894 3.334 ( 5.625 0.000 -6.900) 8.902 3.571 ( 10.742 0.000 1.836) 10.898 3.877 ( -3.957 0.000 2.731) 4.808 4.109 ( 1.085 0.000 -6.985) 7.069 4.737 ( -10.737 0.000 11.653) 15.845 4.842 ( 4.154 0.000 2.804) 5.012 5.524 ( 3.293 0.000 7.196) 7.914 5.594 ( 4.253 0.000 10.994) 11.788 5.841 ( -15.737 0.000 7.753) 17.543 6.895 ( -4.009 0.000 12.877) 13.487 7.452 ( 1.353 0.000 -13.174) 13.244 7.837 ( -3.510 0.000 6.819) 7.669 8.402 ( -6.218 0.000 -3.230) 7.007 8.920 ( 2.995 0.000 22.555) 22.753 9.254 ( 8.767 0.000 -8.633) 12.304 10.589 ( 34.173 0.000 0.318) 34.175 10.755 ( -3.186 0.000 2.405) 3.992 11.153 ( -2.295 0.000 -13.768) 13.958 12.019 ( 7.302 0.000 -10.932) 13.146 12.706 ( 3.472 0.000 -10.757) 11.303 14.090 ( 14.871 0.000 5.325) 15.796 15.070 ( -0.022 0.000 -0.692) 0.692 15.076 ( -1.149 0.000 5.068) 5.197 15.922 ( 2.289 0.000 -17.220) 17.371 18.240 (-100.698 0.000 0.669) 100.700 18.587 ( 13.469 0.000 -0.358) 13.474 19.923 ( 0.820 0.000 0.705) 1.081 20.029 ( -0.875 0.000 -0.100) 0.880 21.325 ( -16.243 0.000 8.331) 18.255 22.225 ( 76.608 0.000 -3.913) 76.708 23.709 ( 4.536 0.000 2.043) 4.975 24.175 ( -2.359 0.000 -3.387) 4.128 ======================= Grid point 190 (82/260) ======================= q-point: ( 0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.116 ( 13.892 0.000 20.189) 24.506 1.495 ( 19.771 0.000 20.197) 28.263 2.585 ( 22.325 0.000 44.742) 50.003 3.209 ( 0.759 0.000 -1.423) 1.613 3.415 ( 4.361 0.000 -10.676) 11.532 3.708 ( -0.673 0.000 -3.617) 3.679 3.922 ( 10.357 0.000 13.095) 16.695 4.083 ( -1.874 0.000 -5.845) 6.138 4.524 ( -13.084 0.000 10.071) 16.512 4.802 ( -5.002 0.000 0.985) 5.098 5.586 ( 1.050 0.000 7.684) 7.755 5.617 ( -0.719 0.000 10.003) 10.029 6.021 ( 18.843 0.000 -2.756) 19.044 6.839 ( -4.408 0.000 12.694) 13.437 7.472 ( 3.434 0.000 -12.178) 12.653 7.774 ( -3.863 0.000 4.915) 6.251 8.215 ( -10.380 0.000 -4.768) 11.423 8.994 ( -1.076 0.000 27.595) 27.616 9.478 ( 13.694 0.000 -5.474) 14.747 10.716 ( -1.190 0.000 2.654) 2.908 11.088 ( -0.175 0.000 -18.126) 18.127 11.222 ( 29.657 0.000 -15.645) 33.530 12.048 ( -2.399 0.000 -8.791) 9.113 12.832 ( 11.326 0.000 -9.388) 14.711 14.274 ( -3.107 0.000 5.347) 6.184 14.998 ( -8.318 0.000 4.629) 9.519 15.065 ( -0.431 0.000 -3.181) 3.210 15.898 ( -1.023 0.000 -14.117) 14.154 16.732 ( -43.061 0.000 26.895) 50.770 18.884 ( 15.707 0.000 6.052) 16.833 19.861 ( -7.249 0.000 0.599) 7.273 19.977 ( -4.734 0.000 -0.203) 4.739 20.901 ( -26.517 0.000 1.514) 26.560 23.436 ( 45.570 0.000 -23.638) 51.336 23.871 ( 10.284 0.000 3.250) 10.785 24.085 ( -5.788 0.000 -5.154) 7.751 ======================= Grid point 191 (83/260) ======================= q-point: ( 0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.506 ( 20.144 0.000 16.192) 25.845 1.913 ( 17.728 0.000 16.835) 24.448 3.183 ( 13.665 0.000 19.551) 23.854 3.212 ( 12.799 0.000 12.715) 18.041 3.446 ( 0.973 0.000 -12.257) 12.296 3.636 ( -4.332 0.000 -3.572) 5.614 4.041 ( -0.021 0.000 -6.495) 6.495 4.206 ( 8.481 0.000 9.127) 12.459 4.286 ( -7.936 0.000 13.509) 15.667 4.741 ( -1.357 0.000 0.318) 1.394 5.600 ( -1.163 0.000 7.456) 7.547 5.646 ( 1.323 0.000 8.899) 8.997 6.293 ( 8.779 0.000 -7.034) 11.250 6.790 ( -3.021 0.000 12.704) 13.059 7.515 ( 2.919 0.000 -10.002) 10.419 7.715 ( -3.173 0.000 6.004) 6.790 7.999 ( -10.034 0.000 -4.267) 10.903 9.011 ( -3.572 0.000 31.381) 31.584 9.736 ( 12.787 0.000 -1.368) 12.860 10.731 ( 2.727 0.000 -0.909) 2.875 11.076 ( 3.208 0.000 -19.341) 19.605 11.676 ( 19.743 0.000 -17.331) 26.270 11.897 ( -10.452 0.000 -4.942) 11.561 13.099 ( 17.288 0.000 -9.368) 19.663 13.947 ( -27.094 0.000 32.086) 41.995 14.882 ( -3.124 0.000 0.719) 3.206 15.014 ( -4.261 0.000 -8.129) 9.178 15.835 ( -2.282 0.000 -8.439) 8.743 16.572 ( 12.906 0.000 2.569) 13.160 19.229 ( 16.772 0.000 12.806) 21.102 19.643 ( -14.693 0.000 0.001) 14.693 19.844 ( -8.484 0.000 0.037) 8.484 20.337 ( -28.650 0.000 -4.133) 28.946 23.897 ( -5.143 0.000 -4.337) 6.728 24.034 ( 16.812 0.000 -21.816) 27.543 24.094 ( 10.890 0.000 2.642) 11.206 ======================= Grid point 192 (84/260) ======================= q-point: ( 0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.953 ( 21.172 0.000 13.862) 25.307 2.274 ( 15.329 0.000 14.847) 21.340 3.084 ( -9.163 0.000 3.092) 9.671 3.386 ( -4.848 0.000 -9.228) 10.424 3.524 ( -6.384 0.000 -4.355) 7.728 3.814 ( 25.833 0.000 16.997) 30.924 4.012 ( -11.436 0.000 1.983) 11.607 4.073 ( 4.884 0.000 -8.312) 9.641 4.551 ( 13.772 0.000 15.696) 20.881 4.727 ( -0.425 0.000 -0.221) 0.479 5.580 ( -2.267 0.000 6.269) 6.666 5.695 ( 0.979 0.000 8.029) 8.088 6.357 ( 0.303 0.000 -5.071) 5.080 6.798 ( 1.352 0.000 14.437) 14.501 7.527 ( 0.003 0.000 -6.359) 6.359 7.676 ( -2.593 0.000 9.483) 9.831 7.809 ( -8.214 0.000 -2.646) 8.630 9.006 ( -4.026 0.000 33.619) 33.859 9.972 ( 11.094 0.000 -0.261) 11.097 10.821 ( 6.556 0.000 -3.427) 7.398 11.122 ( 5.409 0.000 -18.185) 18.972 11.599 ( -15.724 0.000 -8.254) 17.758 11.959 ( 9.634 0.000 -8.831) 13.069 13.456 ( 20.668 0.000 -10.962) 23.396 13.572 ( -16.382 0.000 33.049) 36.886 14.835 ( -2.433 0.000 2.383) 3.405 14.837 ( -11.345 0.000 -12.999) 17.254 15.784 ( -1.474 0.000 -2.805) 3.169 16.979 ( 25.772 0.000 -8.666) 27.190 19.297 ( -19.280 0.000 -0.375) 19.283 19.556 ( 5.578 0.000 18.880) 19.687 19.654 ( -10.381 0.000 0.493) 10.393 19.840 ( -12.525 0.000 -9.062) 15.459 23.715 ( -9.309 0.000 -4.665) 10.412 24.258 ( 9.141 0.000 -17.601) 19.833 24.290 ( 8.029 0.000 1.155) 8.111 ======================= Grid point 193 (85/260) ======================= q-point: ( 0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.391 ( 19.621 0.000 12.849) 23.454 2.571 ( 9.299 0.000 13.568) 16.449 2.881 ( -9.410 0.000 3.717) 10.117 3.196 ( -13.816 0.000 2.797) 14.096 3.370 ( -6.516 0.000 -12.732) 14.303 3.847 ( -5.136 0.000 -2.246) 5.605 4.107 ( 1.887 0.000 -4.552) 4.927 4.267 ( 12.825 0.000 -5.071) 13.791 4.749 ( 3.953 0.000 4.897) 6.293 4.824 ( 9.921 0.000 13.835) 17.024 5.545 ( -2.391 0.000 4.619) 5.201 5.677 ( -5.456 0.000 7.221) 9.050 6.356 ( 1.953 0.000 0.163) 1.959 6.918 ( 7.103 0.000 16.223) 17.710 7.495 ( -1.762 0.000 -3.797) 4.186 7.656 ( -1.909 0.000 13.939) 14.070 7.673 ( -4.881 0.000 -0.394) 4.897 9.012 ( -3.006 0.000 34.493) 34.624 10.166 ( 8.478 0.000 -1.877) 8.683 10.948 ( 6.314 0.000 -4.384) 7.686 11.198 ( 5.858 0.000 -14.539) 15.675 11.234 ( -18.956 0.000 -9.493) 21.200 12.030 ( -0.719 0.000 -4.213) 4.274 13.446 ( -3.923 0.000 24.122) 24.439 13.837 ( 19.269 0.000 -15.515) 24.739 14.534 ( -14.662 0.000 -12.040) 18.972 14.799 ( -1.799 0.000 5.149) 5.454 15.754 ( -1.528 0.000 -0.948) 1.798 17.489 ( 26.988 0.000 -9.816) 28.717 18.939 ( -15.179 0.000 -0.991) 15.211 19.273 ( -19.550 0.000 -5.034) 20.188 19.454 ( -9.532 0.000 1.167) 9.603 20.059 ( 17.542 0.000 15.980) 23.729 23.530 ( -7.973 0.000 -6.817) 10.490 24.339 ( 3.154 0.000 -14.923) 15.253 24.403 ( 3.112 0.000 -0.590) 3.167 ======================= Grid point 194 (86/260) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.474 ( -16.697 0.000 9.025) 18.980 2.702 ( -1.586 0.000 16.037) 16.115 2.946 ( -1.560 0.000 2.883) 3.278 2.966 ( 11.725 0.000 7.661) 14.006 3.225 ( -4.877 0.000 -14.754) 15.539 3.784 ( -0.784 0.000 -3.801) 3.881 3.997 ( -11.571 0.000 -10.295) 15.488 4.361 ( 0.047 0.000 -9.766) 9.766 4.910 ( 8.464 0.000 6.872) 10.903 4.984 ( 3.069 0.000 12.568) 12.937 5.513 ( -1.660 0.000 3.567) 3.934 5.532 ( -9.478 0.000 10.281) 13.984 6.457 ( 7.257 0.000 4.006) 8.290 7.126 ( 9.130 0.000 16.890) 19.199 7.454 ( -1.017 0.000 -4.940) 5.043 7.629 ( 0.488 0.000 2.287) 2.339 7.674 ( 0.617 0.000 17.079) 17.090 9.043 ( -1.733 0.000 34.247) 34.291 10.281 ( 3.036 0.000 -3.013) 4.278 10.811 ( -21.284 0.000 -12.435) 24.650 11.022 ( 2.143 0.000 -6.085) 6.452 11.276 ( 4.225 0.000 -8.996) 9.938 11.943 ( -6.310 0.000 -2.770) 6.891 13.472 ( 0.623 0.000 17.836) 17.847 13.933 ( -10.292 0.000 -23.766) 25.899 14.431 ( 11.576 0.000 -4.596) 12.455 14.799 ( 0.572 0.000 7.124) 7.147 15.715 ( -1.975 0.000 -1.904) 2.743 17.972 ( 22.891 0.000 -5.789) 23.612 18.705 ( -9.511 0.000 -8.115) 12.502 18.949 ( -9.142 0.000 -2.982) 9.616 19.311 ( -4.312 0.000 1.771) 4.662 20.444 ( 16.664 0.000 21.037) 26.837 23.363 ( -7.249 0.000 -12.194) 14.186 24.333 ( -0.289 0.000 -12.411) 12.414 24.406 ( -2.572 0.000 -2.185) 3.375 ======================= Grid point 195 (87/260) ======================= q-point: (-0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.121 ( -20.185 0.000 8.340) 21.840 2.386 ( -23.200 0.000 14.623) 27.424 3.116 ( -2.156 0.000 -11.995) 12.187 3.155 ( 10.467 0.000 -0.193) 10.469 3.195 ( 7.417 0.000 8.240) 11.087 3.634 ( -21.075 0.000 -8.113) 22.583 3.802 ( 3.461 0.000 -1.250) 3.680 4.257 ( -7.575 0.000 -10.334) 12.813 5.013 ( -2.199 0.000 12.568) 12.759 5.059 ( 4.935 0.000 5.515) 7.400 5.403 ( -5.888 0.000 13.694) 14.906 5.488 ( -2.012 0.000 3.523) 4.057 6.628 ( 8.229 0.000 5.454) 9.872 7.317 ( 5.891 0.000 17.481) 18.447 7.441 ( 1.146 0.000 -7.864) 7.947 7.707 ( 6.832 0.000 2.854) 7.404 7.763 ( 4.169 0.000 15.412) 15.965 9.085 ( -2.008 0.000 31.907) 31.970 10.238 ( -7.450 0.000 -2.832) 7.970 10.342 ( -22.839 0.000 -12.943) 26.251 11.021 ( -0.380 0.000 -5.601) 5.614 11.311 ( 1.008 0.000 -6.541) 6.618 11.801 ( -6.314 0.000 -5.181) 8.168 13.527 ( 0.862 0.000 16.607) 16.630 13.573 ( -17.370 0.000 -19.376) 26.022 14.726 ( 15.622 0.000 -7.327) 17.255 14.852 ( 2.889 0.000 7.986) 8.492 15.680 ( -0.260 0.000 -4.651) 4.659 18.344 ( 15.061 0.000 3.144) 15.385 18.464 ( -10.342 0.000 -15.798) 18.882 18.974 ( 9.654 0.000 2.036) 9.866 19.327 ( 6.049 0.000 1.067) 6.142 20.804 ( 14.585 0.000 23.394) 27.568 23.162 ( -9.993 0.000 -22.493) 24.613 24.287 ( -1.611 0.000 -8.584) 8.733 24.296 ( -7.660 0.000 -3.293) 8.338 ======================= Grid point 196 (88/260) ======================= q-point: (-0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.730 ( -20.926 0.000 8.605) 22.626 1.939 ( -25.017 0.000 15.375) 29.364 2.995 ( -28.676 0.000 5.585) 29.215 3.074 ( 0.675 0.000 -7.610) 7.640 3.293 ( 4.410 0.000 -7.387) 8.603 3.433 ( 0.758 0.000 6.372) 6.417 3.903 ( 5.334 0.000 3.159) 6.199 4.080 ( -5.742 0.000 -11.841) 13.160 4.986 ( -2.947 0.000 13.890) 14.199 5.101 ( -3.375 0.000 7.231) 7.980 5.367 ( -0.262 0.000 12.797) 12.799 5.444 ( -3.004 0.000 3.813) 4.855 6.782 ( 5.467 0.000 6.797) 8.722 7.438 ( 2.397 0.000 14.626) 14.821 7.458 ( 2.397 0.000 -10.794) 11.057 7.859 ( 1.410 0.000 8.243) 8.363 7.903 ( 12.109 0.000 1.081) 12.157 9.062 ( -8.223 0.000 21.342) 22.871 9.901 ( -17.469 0.000 -0.121) 17.469 9.974 ( -17.775 0.000 -2.156) 17.906 10.989 ( -1.925 0.000 -4.812) 5.182 11.297 ( -0.610 0.000 -6.233) 6.262 11.700 ( -1.708 0.000 -8.384) 8.556 13.210 ( -14.812 0.000 -16.442) 22.130 13.583 ( 1.127 0.000 18.238) 18.273 14.936 ( 3.455 0.000 7.974) 8.690 14.958 ( 8.726 0.000 -4.981) 10.047 15.702 ( 4.285 0.000 -10.125) 10.994 18.282 ( -3.997 0.000 -15.207) 15.724 18.633 ( 14.443 0.000 15.189) 20.960 19.254 ( 16.673 0.000 1.091) 16.709 19.532 ( 13.141 0.000 0.174) 13.142 21.121 ( 12.018 0.000 23.838) 26.696 22.820 ( -19.336 0.000 -37.030) 41.775 24.101 ( -10.838 0.000 -3.642) 11.433 24.242 ( -1.327 0.000 -4.256) 4.458 ======================= Grid point 197 (89/260) ======================= q-point: (-0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.354 ( -18.605 0.000 11.903) 22.087 1.483 ( -24.188 0.000 17.329) 29.755 2.424 ( -28.820 0.000 21.962) 36.234 3.113 ( 4.351 0.000 -1.982) 4.782 3.337 ( 3.097 0.000 -10.885) 11.317 3.405 ( -5.277 0.000 5.471) 7.601 3.978 ( 0.773 0.000 3.897) 3.973 4.023 ( 2.159 0.000 -10.555) 10.773 4.961 ( -3.418 0.000 14.698) 15.091 4.966 ( -10.834 0.000 10.019) 14.757 5.407 ( -0.983 0.000 4.492) 4.598 5.430 ( 2.851 0.000 10.639) 11.015 6.861 ( 0.382 0.000 7.366) 7.376 7.355 ( -18.162 0.000 -6.645) 19.339 7.475 ( 1.799 0.000 -12.949) 13.073 7.850 ( -1.622 0.000 8.077) 8.238 8.168 ( 13.908 0.000 -1.165) 13.957 8.858 ( -11.615 0.000 12.475) 17.045 9.582 ( -19.507 0.000 -3.262) 19.778 9.761 ( 0.689 0.000 24.165) 24.175 10.919 ( -3.995 0.000 -3.610) 5.385 11.267 ( -0.980 0.000 -6.797) 6.868 11.714 ( 5.363 0.000 -10.130) 11.462 12.924 ( -10.417 0.000 -14.321) 17.709 13.664 ( 3.060 0.000 20.035) 20.267 15.014 ( 2.448 0.000 7.394) 7.789 15.055 ( 2.365 0.000 -1.086) 2.603 15.791 ( 7.016 0.000 -15.866) 17.348 18.248 ( 3.609 0.000 -11.599) 12.147 19.081 ( 28.060 0.000 23.208) 36.414 19.582 ( 15.214 0.000 0.209) 15.216 19.801 ( 13.413 0.000 2.468) 13.638 21.372 ( 7.552 0.000 21.653) 22.932 22.158 ( -39.780 0.000 -49.600) 63.581 23.875 ( -10.538 0.000 -2.951) 10.943 24.217 ( -0.571 0.000 -1.724) 1.816 ======================= Grid point 198 (90/260) ======================= q-point: (-0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.090 ( -10.444 0.000 22.158) 24.496 1.095 ( -17.973 0.000 20.950) 27.603 2.066 ( -11.852 0.000 40.023) 41.741 3.223 ( 6.290 0.000 -0.306) 6.298 3.292 ( -5.858 0.000 1.737) 6.110 3.401 ( 6.399 0.000 -7.820) 10.104 3.953 ( -3.542 0.000 2.897) 4.576 4.073 ( 3.848 0.000 -8.050) 8.922 4.794 ( -5.950 0.000 11.630) 13.063 4.889 ( -7.297 0.000 13.360) 15.223 5.441 ( 2.942 0.000 6.067) 6.743 5.506 ( 2.487 0.000 10.247) 10.544 6.534 ( -42.454 0.000 -12.108) 44.146 6.947 ( -5.716 0.000 10.958) 12.360 7.467 ( 0.566 0.000 -13.648) 13.660 7.864 ( -0.861 0.000 10.615) 10.649 8.398 ( 7.813 0.000 -2.089) 8.087 8.805 ( 2.004 0.000 18.209) 18.319 9.265 ( -9.093 0.000 -6.938) 11.438 10.007 ( 18.987 0.000 23.433) 30.160 10.828 ( -4.288 0.000 -0.736) 4.351 11.222 ( -1.862 0.000 -9.206) 9.392 11.854 ( 10.241 0.000 -10.758) 14.853 12.744 ( -4.393 0.000 -12.586) 13.331 13.816 ( 8.746 0.000 17.613) 19.665 15.063 ( 0.916 0.000 6.415) 6.480 15.072 ( 0.046 0.000 0.135) 0.143 15.883 ( 5.611 0.000 -18.019) 18.872 18.363 ( 9.668 0.000 -6.357) 11.571 19.603 ( -0.523 0.000 -8.574) 8.590 19.826 ( 8.847 0.000 0.290) 8.852 20.098 ( 5.391 0.000 3.449) 6.400 21.202 ( -16.392 0.000 -14.958) 22.191 21.479 ( -2.196 0.000 16.067) 16.217 23.709 ( -4.748 0.000 -0.798) 4.815 24.205 ( -0.520 0.000 -1.760) 1.836 ======================= Grid point 199 (91/260) ======================= q-point: ( 0.00 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.215 ( -2.328 21.630 18.722) 28.702 1.275 ( 8.609 13.965 24.106) 29.159 2.231 ( 6.891 7.685 43.466) 44.674 3.242 ( -2.023 2.712 -1.771) 3.819 3.371 ( 6.560 1.791 -0.112) 6.801 3.570 ( 6.079 0.872 -2.553) 6.651 3.863 ( -1.225 -1.664 3.835) 4.356 4.109 ( 0.416 1.154 -5.645) 5.777 4.780 ( 1.984 -3.790 6.333) 7.642 4.788 ( -8.580 3.515 9.754) 13.458 5.498 ( 1.162 -1.193 6.585) 6.792 5.715 ( 4.436 7.924 8.195) 12.232 5.836 ( -10.684 0.921 7.477) 13.073 6.998 ( -3.646 9.905 13.098) 16.822 7.609 ( 0.584 11.547 -17.101) 20.643 7.889 ( -2.338 5.255 6.453) 8.644 8.527 ( -8.279 10.794 -2.498) 13.831 8.833 ( 3.183 -6.118 17.794) 19.084 9.374 ( 9.139 9.185 -4.129) 13.599 10.325 ( 22.598 -12.492 8.954) 27.329 10.746 ( -5.124 -3.490 3.206) 6.979 11.499 ( 5.753 16.832 -18.193) 25.444 12.057 ( 6.512 6.939 -13.873) 16.823 12.697 ( 3.377 -0.042 -9.360) 9.950 14.012 ( 11.665 -6.459 5.800) 14.541 14.962 ( -3.155 -5.367 0.395) 6.238 15.176 ( 1.699 4.418 2.149) 5.199 15.850 ( 1.901 -7.124 -17.276) 18.784 17.575 ( -47.850 -38.312 20.591) 64.664 18.910 ( -22.260 11.535 -16.521) 30.025 19.875 ( 1.797 -3.830 0.545) 4.266 20.080 ( -0.260 3.960 -1.646) 4.297 21.330 ( -14.869 0.582 8.641) 17.208 21.988 ( 56.087 -15.317 5.016) 58.356 24.015 ( 8.264 18.601 -7.316) 21.629 24.218 ( -2.466 4.657 -3.195) 6.162 ======================= Grid point 200 (92/260) ======================= q-point: ( 0.10 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.293 ( 7.432 15.154 18.123) 24.765 1.619 ( 17.389 10.869 19.373) 28.211 2.620 ( 21.603 3.643 38.916) 44.659 3.218 ( -0.080 2.188 -1.654) 2.745 3.490 ( 5.151 5.083 -6.573) 9.776 3.645 ( 1.659 -6.116 -2.284) 6.736 3.864 ( -0.250 -1.864 6.558) 6.822 4.147 ( 5.365 3.310 1.138) 6.406 4.595 ( -12.440 5.845 6.382) 15.154 4.777 ( -2.477 -1.651 3.195) 4.367 5.511 ( -0.519 -2.349 7.190) 7.582 5.783 ( 1.095 9.721 5.839) 11.393 5.978 ( 15.895 -3.200 0.907) 16.239 6.950 ( -4.039 10.948 13.836) 18.100 7.596 ( 1.414 9.038 -12.929) 15.838 7.855 ( -2.066 8.499 3.756) 9.519 8.317 ( -10.845 9.320 -3.291) 14.673 8.930 ( 1.387 -4.631 23.203) 23.701 9.573 ( 10.477 7.415 -1.963) 12.985 10.666 ( -0.857 -8.789 -2.623) 9.212 10.764 ( 17.165 -8.191 1.343) 19.067 11.627 ( 11.703 15.863 -20.745) 28.617 12.070 ( -2.730 4.249 -10.892) 12.006 12.824 ( 11.207 0.127 -8.648) 14.156 14.148 ( -3.573 -10.174 7.537) 13.156 14.871 ( -6.237 -7.152 0.117) 9.490 15.183 ( -1.401 6.280 -1.110) 6.529 15.819 ( -1.219 -7.918 -14.072) 16.193 16.653 ( -31.803 -6.876 23.943) 40.398 18.858 ( 9.423 -2.298 0.198) 9.701 19.834 ( -5.780 -2.074 -0.586) 6.168 20.020 ( -5.727 3.396 -0.843) 6.711 20.928 ( -25.273 2.462 2.622) 25.528 22.977 ( 40.154 -27.598 -5.289) 49.010 24.118 ( -5.019 3.624 -4.160) 7.458 24.209 ( 9.888 16.417 -8.452) 20.945 ======================= Grid point 201 (93/260) ======================= q-point: ( 0.20 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( 15.891 6.639 14.935) 22.796 1.992 ( 15.749 6.725 17.797) 24.698 3.149 ( 11.427 -4.425 7.896) 14.578 3.248 ( 13.471 6.410 16.276) 22.079 3.517 ( -0.806 4.696 -7.753) 9.100 3.635 ( -1.176 -1.652 -4.223) 4.684 3.900 ( 3.813 -5.861 2.092) 7.298 4.259 ( -6.068 -1.896 10.871) 12.594 4.409 ( 2.430 12.343 3.143) 12.966 4.747 ( -0.812 0.481 1.376) 1.669 5.516 ( -0.633 -2.325 7.596) 7.969 5.812 ( 0.606 9.205 5.048) 10.515 6.235 ( 8.999 -5.004 -4.541) 11.254 6.911 ( -2.849 11.516 14.577) 18.795 7.601 ( 1.277 6.595 -8.324) 10.696 7.815 ( -3.185 10.180 3.563) 11.246 8.113 ( -8.712 10.636 -2.107) 13.909 8.987 ( -1.484 -1.930 28.058) 28.164 9.765 ( 9.301 1.895 0.008) 9.492 10.680 ( 4.120 -5.790 -7.076) 10.029 11.035 ( 10.576 0.699 -4.119) 11.371 11.819 ( 4.981 3.879 -17.013) 18.147 11.941 ( -1.655 9.013 -9.192) 12.980 13.080 ( 15.723 -1.048 -7.109) 17.288 13.884 ( -21.918 -5.069 26.513) 34.771 14.762 ( -4.182 -8.065 -2.527) 9.430 15.121 ( -4.312 6.674 -6.009) 9.962 15.752 ( -2.445 -8.153 -7.386) 11.269 16.556 ( 12.732 -1.438 2.737) 13.102 19.115 ( 13.823 -9.542 7.852) 18.541 19.637 ( -14.144 -0.579 -0.347) 14.161 19.872 ( -7.986 2.090 -1.811) 8.451 20.403 ( -26.655 5.797 -0.568) 27.284 23.568 ( 21.958 -24.111 -4.704) 32.949 23.968 ( -7.470 2.896 -6.849) 10.540 24.373 ( 7.444 10.674 -7.270) 14.907 ======================= Grid point 202 (94/260) ======================= q-point: ( 0.30 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.955 ( 19.352 1.036 11.916) 22.750 2.320 ( 13.524 3.967 16.035) 21.348 3.093 ( -7.399 1.252 0.937) 7.562 3.401 ( -6.068 0.883 -7.312) 9.543 3.559 ( -2.269 1.663 -4.598) 5.390 3.816 ( 21.205 -2.473 10.973) 24.003 3.983 ( -4.600 -0.057 -2.529) 5.250 4.052 ( -0.509 -0.254 3.920) 3.961 4.605 ( 8.205 3.677 7.171) 11.501 4.764 ( 3.530 3.718 3.910) 6.448 5.518 ( -0.939 -1.811 7.385) 7.661 5.828 ( -0.433 8.144 4.398) 9.266 6.321 ( 1.786 -3.113 -3.527) 5.032 6.915 ( 0.120 10.417 15.497) 18.673 7.599 ( -0.295 5.478 -4.717) 7.235 7.737 ( -5.497 8.586 5.082) 11.391 7.981 ( -4.288 14.875 2.262) 15.645 9.000 ( -3.545 -0.676 30.391) 30.605 9.954 ( 10.005 -2.124 -0.900) 10.267 10.787 ( 7.808 -3.336 -8.454) 11.981 11.188 ( 6.463 7.849 -7.582) 12.683 11.599 ( -14.834 -0.258 -6.648) 16.258 12.086 ( 8.731 10.086 -12.334) 18.169 13.351 ( 7.067 -6.787 6.858) 11.961 13.622 ( -2.924 2.366 14.011) 14.507 14.653 ( -7.132 -9.847 -5.716) 13.435 14.981 ( -7.503 6.148 -6.051) 11.432 15.707 ( -1.170 -7.283 -1.588) 7.545 16.962 ( 26.060 -1.406 -8.273) 27.378 19.283 ( -15.659 -3.111 0.352) 15.969 19.359 ( 0.202 -9.273 5.804) 10.942 19.777 ( 2.616 1.836 2.423) 4.011 19.911 ( -22.536 9.039 -0.582) 24.288 23.714 ( -7.561 -1.531 -1.232) 7.812 23.971 ( 12.076 -15.158 -12.091) 22.842 24.464 ( 3.214 6.092 -5.376) 8.738 ======================= Grid point 203 (95/260) ======================= q-point: ( 0.40 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.367 ( 19.346 -1.884 9.737) 21.740 2.568 ( 5.789 0.532 13.094) 14.327 2.927 ( -7.531 4.340 3.457) 9.354 3.234 ( -9.642 1.866 0.389) 9.828 3.430 ( -8.563 5.429 -9.795) 14.097 3.787 ( -6.115 -5.480 -1.670) 8.380 4.101 ( 5.132 -5.656 -7.695) 10.842 4.225 ( 7.896 1.774 -2.555) 8.486 4.722 ( 6.613 -0.743 6.069) 9.006 4.930 ( 8.187 7.250 11.897) 16.160 5.504 ( -2.268 -0.679 6.134) 6.575 5.789 ( -4.859 7.049 3.968) 9.436 6.358 ( 3.810 0.533 1.225) 4.037 6.991 ( 3.961 6.355 16.207) 17.853 7.562 ( -2.315 4.565 -3.253) 6.065 7.642 ( -4.909 7.499 7.006) 11.376 7.952 ( -0.040 19.449 7.859) 20.976 8.997 ( -3.431 -1.735 30.751) 30.990 10.143 ( 8.915 -2.279 -3.620) 9.888 10.924 ( 7.049 -2.003 -6.128) 9.552 11.157 ( -12.797 0.549 -12.234) 17.713 11.384 ( -0.012 10.067 -2.942) 10.488 12.143 ( -0.812 9.568 -7.477) 12.170 13.360 ( -2.931 -7.056 21.649) 22.957 13.847 ( 16.844 0.284 -11.938) 20.647 14.427 ( -12.845 -9.026 -9.596) 18.399 14.858 ( -3.565 4.540 1.577) 5.984 15.683 ( -1.437 -6.585 -0.206) 6.743 17.486 ( 28.099 -0.083 -10.061) 29.846 18.948 ( -14.585 0.777 -1.177) 14.653 19.237 ( -10.966 -3.130 -5.401) 12.618 19.520 ( -16.482 5.660 1.260) 17.472 20.024 ( 16.161 -3.104 15.895) 22.880 23.527 ( -9.231 -0.257 -6.316) 11.188 24.152 ( 7.865 -13.514 -11.068) 19.157 24.480 ( -0.490 3.232 -3.596) 4.860 ======================= Grid point 204 (96/260) ======================= q-point: (-0.50 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.464 ( -14.451 0.554 8.963) 17.014 2.756 ( 11.824 0.806 9.098) 14.941 2.816 ( -8.620 -2.497 4.805) 10.180 3.140 ( 4.507 7.505 8.187) 11.986 3.243 ( -6.443 2.600 -14.016) 15.644 3.716 ( -1.461 -5.740 -5.212) 7.890 4.028 ( -10.438 1.553 -8.191) 13.359 4.286 ( 1.868 -6.087 -10.097) 11.937 4.910 ( 7.894 1.573 7.187) 10.791 5.069 ( 2.850 5.867 12.473) 14.076 5.447 ( -5.017 0.298 6.710) 8.383 5.689 ( -4.628 7.894 4.727) 10.299 6.489 ( 8.077 3.109 4.691) 9.845 7.131 ( 5.884 0.592 16.178) 17.225 7.511 ( -1.735 4.174 -2.292) 5.069 7.594 ( -1.211 6.279 7.563) 9.904 8.003 ( 2.724 22.166 10.873) 24.839 9.009 ( -2.236 -3.460 29.656) 29.940 10.258 ( 2.814 -2.048 -5.163) 6.226 10.780 ( -19.851 -0.971 -12.441) 23.448 11.020 ( 3.494 -0.189 -3.153) 4.710 11.439 ( 3.782 13.620 -3.932) 14.672 12.044 ( -6.813 8.889 -5.648) 12.543 13.375 ( -0.706 -8.334 15.797) 17.875 13.924 ( -10.452 -1.250 -20.549) 23.088 14.348 ( 11.919 -7.644 -2.856) 14.445 14.845 ( 1.281 4.105 4.584) 6.285 15.645 ( -2.056 -6.418 -1.215) 6.848 18.000 ( 25.136 2.635 -6.832) 26.181 18.704 ( -10.650 -0.199 -8.456) 13.601 19.005 ( -9.065 5.253 -1.767) 10.625 19.303 ( -4.805 -0.796 1.882) 5.222 20.400 ( 16.912 -4.163 20.824) 27.148 23.321 ( -9.808 -3.786 -13.046) 16.755 24.232 ( 2.749 -8.965 -9.968) 13.685 24.434 ( -3.217 2.184 -2.818) 4.802 ======================= Grid point 205 (97/260) ======================= q-point: (-0.40 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.143 ( -18.749 3.149 8.766) 20.936 2.435 ( -22.911 3.025 9.252) 24.893 3.054 ( 8.074 -5.108 -0.608) 9.573 3.129 ( 0.173 0.603 -8.835) 8.857 3.320 ( 7.447 7.371 7.004) 12.604 3.611 ( -13.364 -2.658 -7.243) 15.432 3.800 ( -3.547 0.810 -2.141) 4.222 4.250 ( -3.249 -1.342 -10.144) 10.736 4.985 ( -1.926 0.231 9.549) 9.744 5.132 ( 1.402 3.607 9.533) 10.289 5.367 ( -3.879 1.747 8.810) 9.783 5.641 ( -2.044 9.327 4.882) 10.724 6.671 ( 8.415 4.003 6.194) 11.189 7.264 ( 3.292 -4.689 13.040) 14.244 7.499 ( 1.227 4.760 0.610) 4.954 7.635 ( 3.598 3.339 5.252) 7.189 8.100 ( 4.587 21.749 10.214) 24.462 9.032 ( -2.199 -4.903 25.873) 26.425 10.197 ( -8.719 -3.460 -4.655) 10.472 10.351 ( -19.936 1.718 -10.208) 22.463 11.050 ( 0.283 2.196 -2.146) 3.084 11.496 ( 2.956 16.280 -4.438) 17.131 11.879 ( -7.752 7.072 -7.210) 12.732 13.351 ( -6.325 -11.247 4.609) 13.702 13.640 ( -9.730 1.341 -6.893) 11.999 14.633 ( 14.519 -7.611 -3.236) 16.709 14.915 ( 4.390 4.624 3.063) 7.074 15.610 ( -0.470 -6.480 -3.622) 7.439 18.400 ( 4.260 4.143 0.474) 5.961 18.464 ( 0.685 1.157 -13.075) 13.144 18.953 ( 4.514 -2.009 1.849) 5.276 19.356 ( 9.229 2.670 1.112) 9.672 20.771 ( 15.364 -3.189 23.357) 28.138 23.054 ( -13.904 -9.650 -23.112) 28.646 24.224 ( -1.803 -4.197 -4.862) 6.671 24.352 ( -3.608 3.351 -5.210) 7.169 ======================= Grid point 206 (98/260) ======================= q-point: (-0.30 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.786 ( -19.055 5.771 9.303) 21.976 1.980 ( -24.594 3.303 11.187) 27.220 3.046 ( -4.706 -0.429 -2.941) 5.566 3.087 ( -17.359 5.344 1.804) 18.252 3.288 ( 2.705 0.445 -4.892) 5.608 3.496 ( 1.985 5.191 3.386) 6.508 3.834 ( 3.293 -4.849 1.835) 6.142 4.147 ( -3.259 4.522 -10.364) 11.768 4.950 ( -3.012 -2.682 13.032) 13.641 5.123 ( -5.265 1.570 8.825) 10.395 5.347 ( 0.061 2.360 7.389) 7.757 5.612 ( -1.924 10.955 5.641) 12.471 6.824 ( 4.904 3.663 7.247) 9.486 7.284 ( -4.024 -10.779 5.620) 12.805 7.573 ( 5.273 6.751 1.952) 8.785 7.731 ( 4.452 0.132 3.136) 5.447 8.227 ( 6.461 19.031 6.360) 21.080 9.006 ( -6.134 -4.596 15.518) 17.308 9.903 ( -16.219 -1.044 -0.890) 16.277 9.991 ( -16.605 3.126 -0.363) 16.901 11.024 ( -2.413 2.480 -1.870) 3.933 11.535 ( 1.812 21.328 -7.378) 22.640 11.739 ( -3.286 3.398 -8.534) 9.755 13.129 ( -12.389 -6.925 -10.648) 17.743 13.573 ( -0.135 -1.354 12.197) 12.273 14.871 ( 9.626 -5.090 1.537) 10.997 15.003 ( 3.305 2.856 0.176) 4.372 15.630 ( 4.143 -6.627 -8.798) 11.768 18.178 ( -9.901 -7.393 -7.060) 14.231 18.732 ( 14.589 6.787 7.177) 17.618 19.177 ( 15.858 -5.144 -0.954) 16.698 19.616 ( 15.235 6.198 1.274) 16.497 21.104 ( 12.660 -1.674 23.896) 27.094 22.631 ( -23.379 -15.826 -34.182) 44.333 24.136 ( -5.859 2.082 -2.318) 6.636 24.291 ( -1.218 4.392 -5.820) 7.392 ======================= Grid point 207 (99/260) ======================= q-point: (-0.20 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.440 ( -18.001 7.935 10.180) 22.150 1.563 ( -19.085 7.527 18.470) 27.605 2.585 ( -26.254 13.875 19.010) 35.258 3.092 ( 4.093 -2.096 -1.731) 4.914 3.352 ( 3.837 2.413 -6.393) 7.837 3.481 ( -3.844 5.841 0.830) 7.042 3.880 ( 0.909 -6.329 1.740) 6.626 4.110 ( 0.926 5.317 -7.850) 9.527 4.932 ( -2.284 -2.606 13.527) 13.963 4.973 ( -11.135 1.020 10.190) 15.129 5.383 ( 1.715 1.305 5.544) 5.949 5.604 ( -0.056 11.470 6.816) 13.342 6.836 ( -9.796 -6.742 3.480) 12.390 7.120 ( -10.911 -7.613 5.006) 14.215 7.654 ( 3.061 8.819 -14.637) 17.360 7.828 ( 4.163 2.841 10.193) 11.371 8.386 ( 8.389 13.991 2.515) 16.506 8.865 ( -8.247 0.788 7.146) 10.941 9.585 ( -16.914 0.105 -2.469) 17.093 9.785 ( -2.839 3.295 19.120) 19.608 10.949 ( -4.713 1.151 -0.193) 4.856 11.507 ( -1.489 17.182 -12.103) 21.070 11.761 ( 6.777 7.948 -8.971) 13.769 12.884 ( -9.227 -3.296 -11.626) 15.204 13.637 ( 3.212 -2.530 16.430) 16.931 15.025 ( 4.724 -2.344 1.629) 5.519 15.035 ( 0.680 1.124 3.234) 3.490 15.722 ( 7.105 -6.594 -14.987) 17.849 18.027 ( -4.376 -17.484 -1.068) 18.055 19.142 ( 25.521 2.090 13.090) 28.758 19.481 ( 13.496 -4.198 -3.732) 14.619 19.922 ( 14.572 7.411 3.543) 16.728 21.354 ( 6.038 -1.608 20.018) 20.970 21.949 ( -36.544 -15.709 -38.422) 55.304 24.011 ( -5.153 9.022 -5.233) 11.633 24.267 ( -0.438 4.912 -2.953) 5.748 ======================= Grid point 208 (100/260) ======================= q-point: (-0.10 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.187 ( -8.150 12.953 19.773) 25.003 1.330 ( -10.082 15.007 21.132) 27.810 2.215 ( -14.540 14.016 33.804) 39.377 3.201 ( 6.257 -2.306 1.348) 6.803 3.355 ( -4.623 5.558 2.157) 7.545 3.457 ( 5.421 5.203 -9.058) 11.769 3.883 ( -1.043 -6.184 2.896) 6.908 4.114 ( 0.811 3.761 -6.979) 7.969 4.788 ( -7.475 -0.114 11.011) 13.309 4.896 ( -4.840 0.316 12.437) 13.349 5.439 ( 2.596 0.691 5.584) 6.197 5.641 ( 2.011 10.180 7.406) 12.748 6.327 ( -33.941 -13.363 -0.296) 36.478 7.032 ( -2.797 7.818 11.686) 14.336 7.643 ( 0.592 11.684 -20.126) 23.279 7.901 ( -0.028 4.402 10.466) 11.354 8.548 ( 6.411 9.655 0.103) 11.590 8.791 ( -2.350 0.532 13.137) 13.356 9.324 ( -5.525 5.122 -5.397) 9.267 9.928 ( 12.069 -3.812 21.018) 24.535 10.848 ( -5.602 -0.852 2.420) 6.162 11.469 ( 1.218 14.699 -14.693) 20.819 11.912 ( 9.931 9.818 -12.409) 18.682 12.727 ( -3.827 -1.039 -10.540) 11.261 13.781 ( 8.095 -3.154 14.593) 16.983 15.010 ( -1.924 -3.102 0.358) 3.668 15.120 ( 3.082 2.398 4.623) 6.052 15.815 ( 5.518 -6.573 -17.823) 19.781 17.968 ( -4.836 -31.690 7.293) 32.876 19.571 ( -10.593 -7.308 -16.136) 20.639 19.692 ( 19.906 -3.353 4.709) 20.728 20.127 ( -1.439 1.506 -1.862) 2.794 21.170 ( -2.232 -1.418 -4.810) 5.489 21.525 ( -3.198 2.146 12.534) 13.112 23.942 ( 0.418 15.539 -6.912) 17.012 24.252 ( -0.720 4.855 -2.123) 5.348 ======================= Grid point 209 (101/260) ======================= q-point: ( 0.00 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.618 ( 0.681 17.978 19.750) 26.716 1.669 ( 5.137 20.013 17.264) 26.925 2.493 ( 1.096 16.627 27.667) 32.298 3.248 ( 5.012 -4.418 2.424) 7.108 3.420 ( -1.287 4.667 2.663) 5.525 3.592 ( -1.728 -0.693 3.632) 4.081 3.849 ( 5.362 2.545 -0.586) 5.964 4.176 ( -0.439 4.933 -5.945) 7.738 4.707 ( -2.382 -1.942 6.583) 7.265 4.879 ( -3.497 3.982 8.422) 9.951 5.446 ( -0.435 -4.445 4.283) 6.188 5.784 ( -0.702 -0.044 9.875) 9.900 5.971 ( -1.082 9.516 0.320) 9.583 7.275 ( -0.937 15.460 14.056) 20.915 7.828 ( -2.854 8.881 -13.389) 16.318 8.072 ( 2.170 12.186 4.260) 13.090 8.711 ( 0.700 -4.042 14.394) 14.967 8.792 ( -5.729 12.497 1.170) 13.797 9.571 ( 9.221 8.869 -2.066) 12.960 10.193 ( 16.078 -0.022 15.171) 22.106 10.628 ( -6.571 -7.689 1.144) 10.179 11.539 ( 5.144 -9.145 -8.157) 13.290 12.356 ( 0.186 16.281 -11.292) 19.814 12.762 ( 5.384 7.488 -13.018) 15.954 13.876 ( 7.512 -5.667 2.772) 9.810 14.853 ( -4.801 -5.102 -1.928) 7.266 15.237 ( 3.953 0.174 0.931) 4.065 15.632 ( 0.322 -12.718 -17.207) 21.400 16.910 ( -27.370 -24.746 22.543) 43.239 19.033 ( -19.173 1.968 -24.366) 31.068 19.792 ( 3.377 -3.680 0.461) 5.016 20.165 ( 0.691 3.780 -4.939) 6.258 21.348 ( -11.943 1.032 9.454) 15.267 21.722 ( 33.932 -10.155 9.193) 36.592 24.238 ( 3.246 5.395 -3.921) 7.417 24.389 ( 1.010 8.650 -5.612) 10.361 ======================= Grid point 210 (102/260) ======================= q-point: ( 0.10 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( 1.603 18.887 15.117) 24.244 1.888 ( 11.005 13.835 18.619) 25.674 2.739 ( 15.637 7.225 22.889) 28.646 3.305 ( 1.782 3.079 1.395) 3.821 3.470 ( 3.564 -5.645 0.940) 6.742 3.598 ( 2.296 2.914 4.299) 5.678 3.858 ( -3.756 1.131 1.405) 4.166 4.224 ( 5.367 4.792 -0.627) 7.223 4.658 ( -4.612 -0.819 1.822) 5.026 4.815 ( -3.762 5.594 6.625) 9.452 5.462 ( 1.077 -3.039 4.755) 5.745 5.914 ( 10.146 -3.127 5.259) 11.848 5.978 ( 0.769 8.698 -0.022) 8.732 7.263 ( -3.396 17.663 15.161) 23.524 7.760 ( -1.075 6.688 -7.402) 10.034 8.134 ( 2.505 17.167 0.074) 17.349 8.557 ( -9.613 12.086 1.106) 15.483 8.862 ( 3.081 -0.408 18.287) 18.549 9.718 ( 4.610 5.307 0.659) 7.060 10.453 ( 3.893 -8.080 -5.124) 10.329 10.711 ( 18.004 -0.611 12.409) 21.874 11.667 ( 8.777 -8.894 -8.095) 14.889 12.281 ( -4.889 12.370 -10.375) 16.869 12.897 ( 10.625 7.421 -11.969) 17.641 13.949 ( -2.621 -7.390 4.604) 9.093 14.731 ( -6.886 -6.257 -3.160) 9.826 15.293 ( 1.136 3.581 -1.187) 3.940 15.566 ( -2.859 -15.621 -13.955) 21.140 16.488 ( -14.211 -8.096 17.876) 24.229 18.802 ( -0.369 -2.784 -10.388) 10.761 19.788 ( -3.900 -2.190 -1.659) 4.771 20.096 ( -6.670 3.581 -3.827) 8.483 20.993 ( -22.375 3.598 4.966) 23.200 22.466 ( 35.018 -21.097 3.665) 41.046 24.208 ( -5.194 4.981 -2.996) 7.795 24.444 ( 4.980 6.572 -6.443) 10.465 ======================= Grid point 211 (103/260) ======================= q-point: ( 0.20 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.784 ( 7.990 13.465 12.744) 20.188 2.159 ( 11.952 8.957 17.352) 22.895 3.066 ( 9.627 -3.217 4.922) 11.281 3.403 ( 9.089 4.132 7.209) 12.315 3.507 ( 0.331 -7.928 -0.538) 7.953 3.616 ( -3.791 5.470 -6.755) 9.483 3.873 ( 8.069 2.387 12.800) 15.318 4.254 ( -5.821 2.326 0.140) 6.270 4.600 ( 0.903 3.675 0.587) 3.829 4.785 ( 0.198 4.357 4.789) 6.477 5.498 ( 1.263 -0.033 5.637) 5.777 5.986 ( -0.019 6.969 0.818) 7.017 6.122 ( 8.768 -4.953 0.355) 10.077 7.218 ( -4.395 16.296 15.582) 22.971 7.743 ( -0.024 6.897 -3.726) 7.839 8.137 ( -2.653 19.794 0.531) 19.978 8.413 ( -4.618 17.227 2.024) 17.949 8.950 ( 0.592 -1.175 23.162) 23.199 9.769 ( 2.238 -2.265 0.496) 3.223 10.548 ( 8.712 -5.265 -11.327) 15.229 11.123 ( 17.786 5.991 12.067) 22.312 11.772 ( 0.131 -6.093 -10.147) 11.837 12.179 ( 0.229 10.392 -9.642) 14.178 13.104 ( 11.668 3.978 -6.998) 14.175 13.791 ( -13.010 -2.877 13.785) 19.172 14.588 ( -6.468 -8.429 -5.044) 11.762 15.246 ( -5.215 4.917 -8.292) 10.961 15.501 ( -0.760 -15.217 -3.248) 15.579 16.519 ( 13.412 -1.959 2.625) 13.806 18.896 ( 9.191 -10.401 -1.358) 13.947 19.621 ( -12.755 -0.840 -1.364) 12.855 19.914 ( -9.258 1.830 -4.980) 10.671 20.550 ( -22.584 7.772 4.629) 24.328 23.068 ( 25.379 -23.005 0.206) 34.255 24.051 ( -9.217 4.711 -5.525) 11.733 24.515 ( 3.094 3.543 -4.762) 6.693 ======================= Grid point 212 (104/260) ======================= q-point: ( 0.30 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.028 ( 13.555 6.232 9.965) 17.941 2.426 ( 11.068 6.211 14.094) 18.966 3.117 ( -2.467 -0.146 -0.706) 2.570 3.416 ( -8.880 -0.553 -1.685) 9.055 3.542 ( 0.955 -1.721 -3.487) 4.005 3.652 ( 8.748 -11.182 0.539) 14.207 4.033 ( -11.363 3.264 -6.569) 13.524 4.162 ( 14.196 10.708 10.801) 20.805 4.617 ( -0.199 -2.986 -0.696) 3.073 4.890 ( 8.159 7.002 9.156) 14.122 5.534 ( 0.880 2.957 6.244) 6.964 5.974 ( -1.881 5.117 1.472) 5.647 6.260 ( 6.011 -1.525 0.203) 6.205 7.168 ( -3.961 12.534 15.735) 20.503 7.722 ( -1.703 6.583 -1.357) 6.933 8.051 ( -5.612 19.929 2.220) 20.823 8.385 ( 0.527 23.001 5.977) 23.771 8.967 ( -4.084 -2.582 24.495) 24.967 9.876 ( 9.232 -5.014 -2.687) 10.844 10.718 ( 10.107 -2.789 -10.185) 14.618 11.432 ( 10.336 13.811 6.939) 18.593 11.581 ( -13.643 -1.508 -8.230) 16.004 12.273 ( 7.972 6.528 -9.939) 14.316 13.258 ( 1.111 -1.131 8.536) 8.682 13.649 ( 0.523 0.421 5.585) 5.626 14.432 ( -8.595 -11.219 -7.784) 16.135 15.085 ( -7.630 3.479 -7.804) 11.455 15.505 ( 0.416 -11.045 1.405) 11.142 16.934 ( 26.991 -0.993 -7.367) 27.996 19.077 ( 6.528 -11.847 0.400) 13.532 19.311 ( -16.462 0.062 -1.076) 16.497 19.772 ( -2.617 -1.130 -3.267) 4.336 20.135 ( -20.620 11.174 7.405) 24.595 23.480 ( 16.006 -18.933 1.111) 24.817 23.837 ( -9.798 0.812 -11.141) 14.858 24.543 ( 0.676 1.923 -3.566) 4.108 ======================= Grid point 213 (105/260) ======================= q-point: ( 0.40 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.341 ( 15.444 -0.006 7.165) 17.025 2.620 ( 4.127 4.715 8.546) 10.598 3.025 ( -5.928 3.184 1.021) 6.805 3.237 ( -7.919 -1.061 3.901) 8.891 3.537 ( -2.683 3.060 -8.621) 9.534 3.623 ( -8.184 -9.628 -1.819) 12.766 3.949 ( 5.178 -5.342 -11.043) 13.315 4.310 ( -2.564 3.486 -6.668) 7.949 4.723 ( 11.647 1.214 9.748) 15.236 5.077 ( 7.059 6.089 11.903) 15.119 5.555 ( -0.341 5.381 5.665) 7.821 5.905 ( -5.287 3.524 2.323) 6.765 6.399 ( 8.233 4.055 2.943) 9.638 7.142 ( -2.126 7.442 15.680) 17.486 7.673 ( -2.860 6.460 0.551) 7.087 7.941 ( -5.777 18.768 3.333) 19.918 8.444 ( 3.077 26.572 9.493) 28.384 8.926 ( -4.678 -4.679 23.291) 24.213 10.082 ( 10.786 -3.187 -5.582) 12.556 10.883 ( 8.169 -1.854 -5.342) 9.936 11.205 ( -18.291 2.931 -12.406) 22.295 11.643 ( 6.942 14.764 8.186) 18.253 12.344 ( 0.359 7.922 -9.714) 12.540 13.226 ( -4.394 -4.034 17.909) 18.876 13.817 ( 13.012 -3.938 -6.159) 14.925 14.199 ( -12.501 -12.051 -10.207) 20.141 14.961 ( -3.151 4.989 -2.098) 6.263 15.503 ( -1.061 -9.876 1.265) 10.013 17.495 ( 30.753 1.135 -10.235) 32.431 18.969 ( -14.113 1.264 -1.890) 14.295 19.150 ( -0.190 -5.178 -5.217) 7.352 19.652 ( -18.048 5.701 -0.712) 18.941 19.958 ( 8.085 -2.019 16.990) 18.923 23.523 ( -11.992 -0.022 -5.920) 13.373 23.815 ( 11.045 -18.143 -8.852) 23.011 24.529 ( -1.271 1.646 -3.130) 3.758 ======================= Grid point 214 (106/260) ======================= q-point: (-0.50 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.521 ( -8.308 3.928 5.902) 10.922 2.681 ( 8.882 -2.564 2.024) 9.464 2.856 ( -11.106 1.086 3.145) 11.594 3.189 ( -0.234 -0.519 2.830) 2.886 3.360 ( -4.578 4.460 -3.763) 7.417 3.588 ( 0.888 -4.443 -7.656) 8.896 3.998 ( -1.424 -5.364 -5.756) 7.996 4.181 ( -3.783 -2.730 -12.907) 13.724 4.979 ( 9.486 4.711 8.982) 13.887 5.181 ( -0.018 4.395 12.899) 13.627 5.538 ( -2.658 7.756 5.103) 9.657 5.815 ( -3.138 4.007 3.625) 6.249 6.592 ( 9.808 6.987 5.468) 13.226 7.152 ( -0.677 1.555 15.191) 15.286 7.624 ( -2.025 6.282 1.655) 6.804 7.853 ( -3.667 16.217 3.714) 17.036 8.528 ( 2.800 26.833 10.769) 29.048 8.903 ( -2.663 -5.505 21.372) 22.229 10.210 ( 2.290 -2.369 -7.924) 8.582 10.807 ( -18.718 3.186 -10.430) 21.664 11.018 ( 5.966 0.054 -0.969) 6.045 11.776 ( 5.337 17.972 5.613) 19.569 12.251 ( -6.791 9.258 -9.384) 14.828 13.188 ( -3.658 -7.900 13.562) 16.115 13.866 ( -11.713 -4.523 -15.831) 20.205 14.128 ( 13.293 -13.216 -1.074) 18.776 14.954 ( 2.219 5.921 0.217) 6.327 15.472 ( -2.022 -9.446 0.289) 9.664 18.076 ( 29.651 4.509 -8.756) 31.244 18.700 ( -12.014 -0.072 -8.066) 14.470 19.148 ( -5.595 7.636 -1.547) 9.592 19.284 ( -9.359 -0.477 3.184) 9.898 20.277 ( 16.840 -7.476 20.449) 27.525 23.214 ( -16.182 -6.451 -16.113) 23.729 24.001 ( 8.426 -11.968 -3.627) 15.079 24.482 ( -2.564 2.155 -3.768) 5.041 ======================= Grid point 215 (107/260) ======================= q-point: (-0.40 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.271 ( -15.534 8.911 6.294) 18.982 2.466 ( -20.417 -0.132 2.761) 20.603 2.958 ( 8.186 -3.970 -1.048) 9.158 3.129 ( -0.351 -0.701 -7.088) 7.131 3.415 ( 2.382 -1.787 6.605) 7.246 3.564 ( -1.020 1.578 -5.180) 5.510 3.862 ( -7.143 4.799 -3.098) 9.146 4.170 ( 3.031 -6.509 -11.039) 13.169 5.040 ( -6.251 4.632 9.321) 12.141 5.195 ( 0.549 3.068 10.901) 11.338 5.489 ( -3.049 8.574 5.686) 10.730 5.805 ( 0.465 5.837 3.672) 6.912 6.790 ( 8.138 7.287 7.370) 13.177 7.152 ( -3.487 -5.016 13.194) 14.540 7.620 ( 1.759 5.747 1.129) 6.115 7.822 ( -0.206 12.794 4.000) 13.406 8.598 ( 1.856 24.789 10.483) 26.978 8.909 ( -1.465 -5.419 16.966) 17.870 10.115 ( -9.625 -4.122 -7.545) 12.906 10.435 ( -16.784 6.098 -5.282) 18.622 11.100 ( 1.813 2.519 -0.273) 3.115 11.885 ( 4.019 17.748 3.174) 18.472 12.071 ( -7.637 11.761 -10.297) 17.398 13.118 ( -6.001 -9.710 5.858) 12.830 13.618 ( -8.600 -3.051 -7.858) 12.042 14.421 ( 15.467 -13.020 -1.598) 20.281 15.019 ( 3.442 4.717 -0.925) 5.912 15.440 ( -0.539 -8.711 -1.239) 8.815 18.420 ( -15.088 -0.337 -9.061) 17.603 18.607 ( 22.519 10.525 -3.808) 25.147 18.891 ( -6.755 -3.913 1.388) 7.929 19.430 ( 13.734 4.188 1.644) 14.452 20.670 ( 17.445 -6.496 23.309) 29.830 22.806 ( -20.915 -13.227 -23.785) 34.323 24.127 ( 4.657 -4.714 -0.837) 6.679 24.418 ( -2.451 2.684 -5.645) 6.714 ======================= Grid point 216 (108/260) ======================= q-point: (-0.30 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.964 ( -16.864 10.497 5.404) 20.586 2.068 ( -19.233 5.885 8.871) 21.982 2.995 ( 0.303 -3.465 -5.314) 6.351 3.198 ( -3.247 3.679 2.690) 5.596 3.308 ( -3.114 -0.668 -1.097) 3.369 3.614 ( 2.609 4.994 2.256) 6.069 3.773 ( -1.979 1.200 0.157) 2.319 4.206 ( 2.656 0.100 -9.788) 10.142 4.913 ( -6.463 0.199 11.055) 12.807 5.176 ( -5.708 3.438 9.371) 11.499 5.448 ( -2.190 6.239 5.181) 8.400 5.824 ( 0.436 8.351 3.468) 9.053 6.878 ( -5.612 -2.484 7.219) 9.475 7.089 ( -1.817 -2.621 11.494) 11.929 7.698 ( 6.045 4.647 -5.803) 9.582 7.870 ( 3.917 11.376 7.935) 14.412 8.646 ( 0.012 20.269 11.715) 23.411 8.908 ( -1.343 -3.681 7.006) 8.028 9.853 ( -13.825 -3.057 -4.115) 14.744 10.121 ( -14.472 8.853 3.632) 17.349 11.076 ( -3.927 2.383 -1.386) 4.798 11.807 ( -8.993 2.029 -9.343) 13.126 12.067 ( 6.811 27.281 -2.557) 28.234 12.979 ( -7.552 -5.686 -4.008) 10.268 13.518 ( -1.207 -3.849 3.170) 5.130 14.714 ( 13.892 -10.581 -0.379) 17.467 15.055 ( 0.216 1.090 -1.571) 1.925 15.463 ( 3.649 -7.744 -5.268) 10.052 18.042 ( -20.230 -4.985 -0.409) 20.839 18.800 ( 7.586 -2.407 -0.598) 7.982 19.146 ( 21.565 4.247 -3.246) 22.217 19.741 ( 16.263 5.378 2.083) 17.255 21.051 ( 15.085 -3.414 24.272) 28.780 22.270 ( -27.277 -17.043 -29.249) 43.474 24.172 ( 0.129 1.641 -0.890) 1.871 24.379 ( 0.195 3.150 -6.370) 7.109 ======================= Grid point 217 (109/260) ======================= q-point: (-0.20 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( -13.143 12.668 8.856) 20.290 1.788 ( -12.291 13.918 16.342) 24.735 2.902 ( -18.456 13.853 13.017) 26.495 3.029 ( 2.637 -3.338 -0.748) 4.319 3.430 ( 8.328 3.593 -2.576) 9.428 3.602 ( -2.671 5.133 -4.090) 7.085 3.752 ( -2.051 -4.359 6.478) 8.073 4.225 ( 1.298 5.335 -9.053) 10.588 4.868 ( -0.934 -2.895 10.050) 10.500 5.018 ( -11.588 3.059 10.089) 15.666 5.430 ( -0.664 2.342 4.135) 4.798 5.836 ( 0.000 9.266 3.503) 9.906 6.575 ( -22.514 -12.950 4.928) 26.436 7.158 ( 3.330 6.987 11.826) 14.134 7.802 ( 6.384 6.108 -15.095) 17.491 8.000 ( 5.609 11.426 12.228) 17.651 8.616 ( -5.484 6.638 12.828) 15.449 8.919 ( 2.270 5.932 -0.930) 6.419 9.589 ( -11.591 0.466 -1.887) 11.753 9.920 ( -6.609 9.611 13.652) 17.956 10.955 ( -7.641 -0.449 -0.592) 7.677 11.620 ( -6.648 -2.421 -10.867) 12.967 12.209 ( 7.729 27.128 -6.524) 28.953 12.832 ( -5.296 -0.159 -9.016) 10.458 13.564 ( 4.063 -4.277 8.480) 10.330 14.938 ( 6.862 -5.977 0.105) 9.101 15.042 ( 0.645 -2.348 0.098) 2.437 15.545 ( 5.922 -8.720 -11.483) 15.587 17.663 ( -18.531 -15.576 7.585) 25.368 19.063 ( 18.218 -8.111 -1.655) 20.011 19.519 ( 16.019 6.378 -3.965) 17.692 20.040 ( 12.192 3.487 1.395) 12.757 21.318 ( 2.320 -1.454 15.573) 15.811 21.648 ( -23.548 -11.981 -20.413) 33.388 24.154 ( -0.336 5.083 -4.484) 6.786 24.387 ( 1.236 5.094 -4.298) 6.779 ======================= Grid point 218 (110/260) ======================= q-point: (-0.10 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.544 ( -1.581 18.927 17.617) 25.906 1.652 ( -5.317 16.507 18.778) 25.561 2.589 ( -14.852 19.676 21.202) 32.515 3.123 ( 5.843 -5.016 3.323) 8.387 3.488 ( -4.275 5.228 2.201) 7.103 3.597 ( 3.491 7.487 -5.115) 9.716 3.737 ( 1.922 -5.684 3.983) 7.201 4.213 ( -0.660 5.503 -7.847) 9.607 4.802 ( -9.451 1.352 8.452) 12.751 4.896 ( -0.708 -0.247 10.575) 10.601 5.438 ( 0.353 -1.665 3.685) 4.059 5.833 ( -2.009 5.324 5.084) 7.631 6.138 ( -18.789 -2.799 4.453) 19.511 7.237 ( 1.651 11.102 12.672) 16.928 7.869 ( 3.526 10.131 -19.116) 21.920 8.065 ( -2.072 10.930 11.182) 15.773 8.596 ( 2.681 -3.543 12.586) 13.347 8.931 ( -3.648 10.495 1.451) 11.206 9.451 ( 0.560 6.595 -3.466) 7.471 9.939 ( 4.955 5.498 18.250) 19.694 10.788 ( -8.862 -4.407 0.999) 9.948 11.518 ( -1.041 -6.706 -9.806) 11.926 12.323 ( 5.355 22.744 -10.862) 25.767 12.746 ( -0.797 4.271 -11.190) 12.003 13.703 ( 7.743 -3.904 7.309) 11.341 14.936 ( -3.206 -4.015 -1.215) 5.280 15.140 ( 5.639 -2.215 1.944) 6.363 15.621 ( 4.403 -10.775 -16.103) 19.870 17.327 ( -19.362 -26.271 16.144) 36.410 19.361 ( 4.980 -10.093 -16.999) 20.387 19.710 ( 3.432 2.306 -2.964) 5.087 20.149 ( 0.164 0.561 -6.476) 6.502 21.160 ( 4.663 0.315 2.458) 5.281 21.544 ( -1.907 0.021 13.505) 13.639 24.169 ( 3.278 6.623 -5.928) 9.473 24.394 ( 0.307 7.113 -3.671) 8.010 ======================= Grid point 219 (111/260) ======================= q-point: ( 0.00 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.946 ( 2.982 13.327 15.680) 20.794 2.078 ( 1.073 19.396 17.417) 26.090 2.819 ( -2.160 11.691 10.522) 15.876 3.115 ( 4.109 -6.346 6.050) 9.683 3.369 ( -2.405 -9.592 7.014) 12.124 3.682 ( -0.898 9.025 10.606) 13.955 3.966 ( 4.392 7.696 -2.639) 9.246 4.297 ( -0.325 6.361 -6.485) 9.090 4.705 ( -4.800 1.638 4.033) 6.480 4.932 ( 0.047 0.740 6.274) 6.318 5.321 ( 0.420 -6.902 2.113) 7.231 5.750 ( -0.887 -3.162 10.954) 11.436 6.143 ( -0.828 6.519 -3.674) 7.529 7.590 ( 2.741 14.105 15.904) 21.434 7.988 ( -6.900 6.753 -9.690) 13.679 8.292 ( 4.121 4.685 7.380) 9.664 8.679 ( 9.104 3.228 11.874) 15.307 9.062 ( -5.681 13.513 3.797) 15.142 9.716 ( 7.741 4.793 -1.347) 9.204 10.310 ( 8.759 9.877 13.272) 18.719 10.432 ( -6.732 -10.551 2.057) 12.684 11.267 ( 2.900 -15.341 -0.822) 15.634 12.642 ( -4.233 12.433 -1.555) 13.226 12.971 ( 5.261 10.126 -15.227) 19.028 13.803 ( 6.705 -0.957 -2.694) 7.289 14.742 ( -5.203 -6.501 -4.993) 9.709 15.063 ( 5.143 -16.284 -3.290) 17.391 15.468 ( -0.370 -1.565 -12.423) 12.527 16.536 ( -17.810 -12.141 16.907) 27.394 19.039 ( -14.423 -0.726 -29.854) 33.164 19.732 ( 3.306 -2.086 0.596) 3.954 20.230 ( 1.976 2.423 -8.242) 8.815 21.371 ( -8.328 1.250 10.464) 13.432 21.555 ( 19.147 -6.203 11.046) 22.959 24.331 ( 2.740 3.764 -2.306) 5.196 24.504 ( -0.030 2.870 -3.058) 4.194 ======================= Grid point 220 (112/260) ======================= q-point: ( 0.10 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.035 ( 1.992 16.131 12.026) 20.219 2.171 ( 4.933 13.550 18.208) 23.226 2.882 ( 5.746 5.838 7.463) 11.081 3.198 ( 3.492 -9.147 1.884) 9.971 3.360 ( -0.891 -8.416 8.242) 11.814 3.765 ( 6.757 9.278 14.482) 18.479 3.944 ( -4.946 9.944 -3.631) 11.684 4.334 ( 4.052 4.988 -3.676) 7.403 4.641 ( -2.793 0.072 0.847) 2.919 4.897 ( -4.150 0.552 4.902) 6.446 5.387 ( 5.038 -3.395 3.116) 6.828 5.833 ( 6.237 -4.751 7.577) 10.903 6.134 ( 0.494 6.062 -2.931) 6.751 7.619 ( -4.159 15.544 16.927) 23.354 7.883 ( -1.090 5.096 -4.607) 6.956 8.425 ( 6.980 5.093 3.869) 9.467 8.790 ( -1.378 14.728 8.294) 16.959 9.000 ( -0.891 12.596 9.043) 15.532 9.767 ( -3.761 -0.628 1.250) 4.013 10.305 ( 3.989 -7.758 -7.721) 11.650 10.743 ( 22.197 4.226 18.625) 29.283 11.399 ( 9.785 -14.835 -0.209) 17.773 12.529 ( -6.302 12.247 -3.871) 14.307 13.068 ( 7.395 7.038 -12.018) 15.768 13.866 ( -0.348 -0.553 -1.749) 1.868 14.602 ( -7.657 -7.000 -7.600) 12.860 15.131 ( 2.379 -17.724 -2.464) 18.052 15.413 ( -2.219 1.585 -11.253) 11.579 16.342 ( -3.549 -5.673 12.524) 14.200 18.752 ( -6.503 -1.937 -18.676) 19.870 19.748 ( -2.692 -1.547 -2.078) 3.737 20.161 ( -7.083 2.611 -7.567) 10.688 21.068 ( -19.181 3.354 6.956) 20.677 22.104 ( 28.383 -13.707 8.006) 32.521 24.314 ( -4.664 5.052 -1.988) 7.158 24.512 ( 1.843 0.580 -3.344) 3.862 ======================= Grid point 221 (113/260) ======================= q-point: ( 0.20 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.095 ( 2.587 15.556 10.925) 19.184 2.353 ( 9.090 9.489 14.298) 19.419 3.020 ( 5.527 -1.246 2.384) 6.147 3.276 ( 4.432 -10.688 -2.303) 11.797 3.351 ( -1.748 -9.266 7.750) 12.205 3.780 ( -7.955 5.962 -1.751) 10.094 4.032 ( 13.687 13.703 12.505) 23.054 4.343 ( -3.338 5.383 -6.123) 8.809 4.594 ( -2.716 -2.137 -1.706) 3.854 4.859 ( 1.220 0.120 6.811) 6.921 5.507 ( 5.809 1.168 3.784) 7.030 5.973 ( 4.741 -5.675 3.720) 8.278 6.162 ( 3.761 6.082 -0.057) 7.151 7.528 ( -7.795 12.750 16.002) 21.895 7.882 ( 0.229 6.324 -1.120) 6.426 8.524 ( 0.252 10.824 0.898) 10.864 8.761 ( -0.028 17.051 8.685) 19.135 9.017 ( -1.505 10.811 14.738) 18.340 9.675 ( -1.850 -6.241 -1.021) 6.589 10.455 ( 10.868 -4.861 -8.802) 14.806 11.233 ( 21.008 4.003 19.214) 28.750 11.593 ( 8.169 -9.763 -4.597) 13.535 12.403 ( -4.276 12.300 -3.489) 13.481 13.190 ( 6.495 2.266 -7.352) 10.069 13.785 ( -7.038 2.479 2.425) 7.846 14.413 ( -9.237 -8.997 -9.207) 15.845 15.136 ( -1.295 -14.966 -4.731) 15.749 15.355 ( -1.070 2.560 -5.137) 5.838 16.481 ( 15.589 -1.526 2.161) 15.812 18.710 ( 4.673 -7.173 -9.116) 12.506 19.605 ( -11.209 -0.696 -2.639) 11.536 19.946 ( -11.481 1.216 -6.975) 13.489 20.706 ( -18.697 6.798 7.437) 21.239 22.646 ( 24.528 -16.948 4.088) 30.092 24.149 ( -10.839 4.403 -5.017) 12.729 24.544 ( 1.610 -0.247 -2.258) 2.784 ======================= Grid point 222 (114/260) ======================= q-point: ( 0.30 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.208 ( 6.630 10.787 9.136) 15.613 2.572 ( 9.861 7.441 9.444) 15.550 3.074 ( -0.520 -3.183 -1.344) 3.494 3.270 ( -4.997 -11.252 7.215) 14.270 3.407 ( 5.573 -11.463 -4.147) 13.404 3.629 ( -5.773 7.837 -2.582) 10.071 4.116 ( -8.322 4.104 -14.382) 17.116 4.413 ( 9.017 11.534 6.473) 16.008 4.511 ( -0.037 -5.624 1.140) 5.738 4.983 ( 7.592 1.186 11.413) 13.759 5.620 ( 4.449 4.821 4.235) 7.808 5.998 ( -2.107 -2.384 2.659) 4.147 6.306 ( 9.766 5.374 2.293) 11.381 7.404 ( -8.080 9.940 16.246) 20.689 7.864 ( -2.026 6.640 0.491) 6.960 8.431 ( -7.985 10.511 -0.295) 13.204 8.834 ( 2.869 15.838 11.666) 19.879 8.998 ( -2.596 13.245 13.898) 19.373 9.761 ( 10.476 -6.171 -2.149) 12.347 10.653 ( 10.529 -4.240 -6.910) 13.288 11.497 ( -3.817 -4.619 -1.292) 6.130 11.723 ( 11.139 10.772 7.100) 17.045 12.399 ( 3.979 8.283 -1.001) 9.244 13.261 ( 0.476 -1.504 1.757) 2.362 13.658 ( -4.583 1.474 1.704) 5.107 14.202 ( -9.809 -10.769 -10.555) 17.988 15.076 ( -2.634 -5.201 -5.728) 8.173 15.343 ( -0.209 -2.473 -0.374) 2.510 16.927 ( 28.591 0.280 -6.281) 29.274 18.851 ( 9.765 -9.378 -3.852) 14.076 19.318 ( -16.033 0.530 -2.978) 16.315 19.744 ( -6.320 -1.344 -3.388) 7.296 20.351 ( -19.505 9.171 8.908) 23.322 23.093 ( 20.212 -16.685 1.842) 26.274 23.873 ( -15.369 1.886 -8.612) 17.718 24.560 ( 0.494 0.062 -2.227) 2.282 ======================= Grid point 223 (115/260) ======================= q-point: ( 0.40 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.384 ( 8.746 4.294 6.625) 11.782 2.757 ( 6.133 7.806 3.063) 10.389 2.985 ( -8.098 -6.501 0.121) 10.385 3.185 ( -4.114 -5.195 8.637) 10.886 3.436 ( -2.596 -7.300 -7.290) 10.638 3.582 ( 1.501 3.021 -4.340) 5.497 3.914 ( -5.833 1.087 -17.401) 18.385 4.306 ( -7.731 -4.024 -10.180) 13.401 4.800 ( 15.146 5.990 13.357) 21.065 5.157 ( 6.163 1.561 13.551) 14.968 5.695 ( 1.997 7.003 4.316) 8.466 5.932 ( -4.754 -0.488 4.063) 6.273 6.530 ( 11.730 7.666 3.412) 14.423 7.294 ( -6.549 7.419 16.140) 18.932 7.810 ( -3.582 6.108 2.276) 7.437 8.252 ( -9.376 4.795 -0.217) 10.534 8.868 ( -1.264 10.032 10.141) 14.321 9.029 ( 1.956 22.368 14.127) 26.528 10.007 ( 12.560 -4.642 -3.469) 13.833 10.837 ( 9.342 -2.890 -2.763) 10.162 11.240 ( -16.198 0.082 -12.380) 20.387 11.967 ( 9.274 14.800 12.856) 21.687 12.462 ( 0.671 5.813 -2.892) 6.527 13.216 ( -5.656 1.318 10.361) 11.878 13.648 ( 3.569 -12.093 -1.422) 12.689 13.981 ( -9.692 -7.995 -12.531) 17.745 15.034 ( -0.184 0.773 -3.860) 3.941 15.332 ( -0.969 -4.703 0.692) 4.851 17.534 ( 33.590 2.473 -9.769) 35.069 18.989 ( -14.550 -0.840 -7.189) 16.251 19.040 ( 8.588 -3.528 -0.231) 9.287 19.690 ( -3.012 -1.813 -0.554) 3.559 19.998 ( -14.286 5.404 15.413) 21.699 23.442 ( 7.104 -15.975 -9.805) 20.045 23.530 ( -8.939 0.061 -1.938) 9.147 24.552 ( -0.723 0.679 -3.088) 3.243 ======================= Grid point 224 (116/260) ======================= q-point: (-0.50 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.539 ( 3.448 -1.278 3.684) 5.205 2.727 ( -11.092 2.485 2.115) 11.562 2.856 ( -1.191 2.721 -1.844) 3.496 3.162 ( -1.377 -2.374 3.945) 4.805 3.323 ( -4.112 -4.360 -6.963) 9.187 3.607 ( 1.397 2.245 -3.786) 4.618 3.854 ( 2.676 -6.053 -12.178) 13.860 4.144 ( -5.583 -1.784 -11.243) 12.679 5.084 ( 10.088 4.818 10.729) 15.495 5.249 ( -0.787 2.283 13.551) 13.765 5.715 ( -1.013 8.065 3.952) 9.038 5.862 ( -2.373 0.844 5.673) 6.207 6.766 ( 10.523 8.695 5.140) 14.586 7.211 ( -5.883 4.828 15.532) 17.296 7.744 ( -3.172 4.895 2.852) 6.493 8.084 ( -6.927 0.582 -0.249) 6.956 8.873 ( 0.064 10.046 7.539) 12.560 9.088 ( 0.064 22.229 15.431) 27.060 10.148 ( 1.204 -4.129 -6.644) 7.915 10.877 ( -16.257 2.699 -9.097) 18.823 11.020 ( 8.652 0.032 0.012) 8.652 12.129 ( 3.437 12.519 8.321) 15.421 12.407 ( -3.417 9.177 -2.700) 10.158 13.108 ( -6.801 0.240 8.381) 10.796 13.715 ( -5.283 -12.538 -5.467) 14.662 13.841 ( 6.785 -11.215 -7.216) 14.963 15.045 ( 1.445 0.871 -2.872) 3.331 15.315 ( -0.468 -3.392 0.526) 3.464 18.175 ( 32.388 4.643 -9.592) 34.096 18.700 ( -11.657 -0.088 -8.624) 14.501 19.242 ( 11.394 1.297 1.696) 11.593 19.350 ( -25.489 6.565 1.015) 26.340 20.104 ( 14.456 -8.622 20.640) 26.633 23.058 ( -21.873 -8.164 -19.260) 30.265 23.789 ( 14.243 -7.572 2.928) 16.394 24.516 ( -1.992 1.130 -4.571) 5.113 ======================= Grid point 225 (117/260) ======================= q-point: (-0.40 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.435 ( -13.477 -0.151 -1.411) 13.551 2.489 ( -11.592 8.594 6.011) 15.633 2.904 ( 4.053 -0.744 -3.421) 5.356 3.106 ( -0.219 -1.327 -6.111) 6.257 3.309 ( 0.029 -5.073 2.075) 5.481 3.611 ( 0.276 -0.549 1.488) 1.610 3.945 ( 6.813 -0.521 -6.571) 9.480 4.038 ( -1.933 -1.625 -12.084) 12.345 5.147 ( -8.156 4.970 10.038) 13.856 5.259 ( 1.732 2.821 10.580) 11.085 5.670 ( -4.216 7.916 3.923) 9.789 5.879 ( 2.096 1.624 5.701) 6.287 6.916 ( -0.269 1.782 7.224) 7.445 7.132 ( -2.977 6.320 14.497) 16.093 7.717 ( 0.544 3.586 0.185) 3.632 8.001 ( -1.155 -0.070 1.259) 1.710 8.902 ( 1.041 9.007 5.555) 10.634 9.091 ( -3.129 20.006 14.847) 25.109 10.025 ( -10.293 -4.803 -7.989) 13.887 10.572 ( -13.333 6.163 -1.532) 14.768 11.149 ( 2.987 2.042 -0.181) 3.623 12.044 ( -11.381 -1.175 -2.648) 11.743 12.450 ( 6.841 22.664 5.149) 24.227 13.009 ( -4.011 -0.365 2.806) 4.909 13.535 ( -7.553 -4.343 -9.095) 12.594 14.090 ( 15.680 -18.728 -1.252) 24.457 15.049 ( -0.868 -3.116 -2.555) 4.122 15.331 ( 2.326 0.015 -0.997) 2.531 18.430 ( -12.476 1.577 -7.083) 14.433 18.752 ( 8.894 -3.588 -2.918) 10.025 18.888 ( -2.216 9.976 -3.358) 10.757 19.518 ( 15.124 4.026 2.758) 15.892 20.506 ( 19.937 -8.910 23.609) 32.160 22.547 ( -24.922 -10.755 -22.741) 35.411 24.045 ( 10.842 -2.895 2.304) 11.456 24.457 ( -2.539 1.061 -6.335) 6.907 ======================= Grid point 226 (118/260) ======================= q-point: (-0.30 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.142 ( -14.153 6.579 0.859) 15.631 2.283 ( -10.535 13.941 8.473) 19.420 2.915 ( -0.483 -4.067 -3.628) 5.471 3.186 ( 3.444 -9.009 -1.289) 9.731 3.282 ( 0.571 4.101 3.207) 5.237 3.656 ( 2.734 -0.958 4.263) 5.154 3.898 ( -5.706 8.065 -5.373) 11.246 4.150 ( 10.157 -4.404 -8.735) 14.102 4.969 ( -10.110 4.413 8.777) 14.097 5.246 ( -5.780 2.876 8.883) 10.982 5.575 ( -6.000 5.416 3.416) 8.775 5.933 ( 1.426 2.079 4.451) 5.115 6.727 ( -16.631 -7.525 7.382) 19.691 7.212 ( 4.863 10.555 14.122) 18.290 7.775 ( 5.885 2.795 -6.098) 8.923 8.044 ( 4.132 1.413 6.048) 7.460 8.896 ( -5.237 6.992 7.484) 11.503 9.062 ( -0.713 16.485 8.560) 18.589 9.785 ( -11.056 -3.764 -5.160) 12.769 10.331 ( -11.410 10.563 5.871) 16.620 11.117 ( -5.794 1.416 -1.670) 6.194 11.766 ( -14.534 -6.201 -4.746) 16.499 12.607 ( 6.357 23.672 5.437) 25.106 12.964 ( -0.497 5.185 -6.617) 8.421 13.421 ( -1.658 -5.192 -3.607) 6.536 14.413 ( 16.701 -18.467 -2.192) 24.995 15.002 ( -3.148 -5.489 -1.986) 6.632 15.390 ( 3.714 0.796 -3.871) 5.424 17.982 ( -29.049 -0.930 4.089) 29.350 18.677 ( 4.838 -7.344 -5.999) 10.645 19.310 ( 23.009 9.452 -6.953) 25.828 19.825 ( 14.490 2.526 2.339) 14.893 20.961 ( 19.494 -5.092 25.119) 32.201 21.976 ( -27.075 -10.589 -23.832) 37.592 24.211 ( 4.944 2.129 0.160) 5.386 24.410 ( 0.232 -0.029 -6.434) 6.438 ======================= Grid point 227 (119/260) ======================= q-point: (-0.20 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.928 ( -7.754 12.095 7.940) 16.416 2.127 ( -7.221 18.319 11.752) 22.931 2.916 ( 0.861 -5.258 1.960) 5.677 3.102 ( -7.651 0.058 7.170) 10.486 3.424 ( 6.505 -0.765 1.280) 6.674 3.689 ( 0.634 1.282 -1.811) 2.307 3.794 ( -3.270 8.889 3.324) 10.037 4.299 ( 5.915 1.001 -8.279) 10.224 4.841 ( -3.542 0.824 6.470) 7.422 5.084 ( -11.740 2.895 8.801) 14.956 5.460 ( -5.927 0.496 2.089) 6.304 5.930 ( -3.421 -0.564 5.143) 6.203 6.401 ( -15.445 -3.457 4.305) 16.402 7.344 ( 5.047 10.567 14.511) 18.647 7.914 ( 9.623 4.382 -11.425) 15.568 8.164 ( 5.592 0.820 10.833) 12.218 8.714 ( -13.541 6.311 9.080) 17.483 9.112 ( 3.142 11.155 3.826) 12.204 9.600 ( -6.046 0.074 -2.638) 6.597 10.168 ( -6.458 13.558 11.838) 19.122 10.934 ( -11.567 -1.386 -1.621) 11.762 11.486 ( -11.987 -9.942 -4.344) 16.167 12.697 ( 1.596 17.906 4.170) 18.454 12.943 ( 0.757 11.952 -15.731) 19.771 13.471 ( 6.472 -4.227 1.285) 7.836 14.714 ( 13.872 -17.485 -3.655) 22.616 14.926 ( -3.900 -5.953 -1.781) 7.336 15.448 ( 3.176 -0.559 -7.190) 7.880 17.417 ( -28.462 -8.152 9.890) 31.214 18.888 ( 16.486 -7.683 -9.079) 20.328 19.675 ( 14.487 8.006 -6.331) 17.722 20.060 ( 8.049 -1.511 -2.808) 8.657 21.304 ( 0.816 0.099 12.613) 12.639 21.459 ( -10.398 -6.548 -5.841) 13.606 24.246 ( 0.799 3.969 -4.928) 6.378 24.449 ( 3.472 0.959 -2.555) 4.416 ======================= Grid point 228 (120/260) ======================= q-point: (-0.10 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.878 ( -0.397 13.242 15.131) 20.111 2.056 ( -2.838 21.350 14.573) 26.005 2.898 ( -6.064 4.267 10.036) 12.479 3.031 ( 1.468 -0.586 6.397) 6.590 3.429 ( -4.193 -7.694 4.069) 9.661 3.712 ( -2.466 4.232 7.258) 8.756 3.825 ( 8.075 10.659 -2.893) 13.681 4.333 ( -0.159 5.626 -7.833) 9.646 4.824 ( -5.021 0.185 3.851) 6.330 4.901 ( -3.065 1.256 9.410) 9.976 5.361 ( -4.198 -5.210 1.307) 6.818 5.821 ( -7.683 -3.942 10.078) 13.272 6.200 ( -5.284 5.312 -1.168) 7.582 7.475 ( 4.838 11.764 14.695) 19.436 8.056 ( 5.711 7.244 -15.407) 17.957 8.271 ( -0.714 4.555 11.760) 12.631 8.519 ( -2.221 -0.620 12.242) 12.458 9.144 ( -2.099 10.358 4.042) 11.315 9.573 ( 4.538 4.346 -2.669) 6.827 10.148 ( 1.626 13.549 15.792) 20.871 10.676 ( -13.678 -6.042 -0.890) 14.980 11.299 ( -5.582 -13.180 -2.842) 14.593 12.700 ( -1.635 13.853 1.509) 14.030 12.933 ( 2.351 12.199 -17.212) 21.227 13.640 ( 9.356 -1.418 -0.188) 9.465 14.841 ( -4.144 -6.833 -2.981) 8.529 14.934 ( 9.023 -15.703 -3.798) 18.504 15.479 ( 1.813 -1.992 -10.443) 10.784 16.922 ( -24.186 -13.228 14.662) 31.224 19.179 ( 11.171 -7.141 -20.803) 24.668 19.759 ( -5.283 2.187 -5.645) 8.035 20.152 ( 5.858 -0.172 -9.401) 11.079 21.176 ( 4.044 0.979 6.349) 7.591 21.537 ( -0.685 -0.498 15.141) 15.165 24.271 ( 3.116 3.749 -4.841) 6.870 24.497 ( 1.626 2.802 -1.923) 3.767 ======================= Grid point 229 (121/260) ======================= q-point: ( 0.00 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.164 ( 4.244 6.582 10.933) 13.449 2.424 ( -3.284 11.502 17.186) 20.939 2.883 ( 2.195 -2.015 7.964) 8.503 3.050 ( 3.485 -3.741 9.288) 10.602 3.189 ( -7.656 -3.445 4.143) 9.363 3.815 ( 0.738 2.932 5.747) 6.494 4.135 ( 6.042 6.314 6.733) 11.032 4.410 ( -2.065 3.477 -6.671) 7.801 4.771 ( -4.374 4.628 1.957) 6.661 4.895 ( -2.119 -4.354 3.180) 5.793 5.200 ( 3.344 -3.568 0.405) 4.907 5.680 ( -1.314 -2.518 12.322) 12.645 6.233 ( -1.044 2.166 -4.433) 5.043 7.834 ( 3.835 8.143 14.939) 17.441 8.104 ( -8.361 4.657 -3.909) 10.339 8.237 ( 2.375 -6.625 10.876) 12.955 8.795 ( 18.254 4.329 7.945) 20.374 9.341 ( -2.488 10.821 4.106) 11.838 9.774 ( 7.604 1.055 -0.997) 7.741 10.187 ( -15.629 -9.173 -0.084) 18.122 10.583 ( 8.915 13.208 12.872) 20.485 10.949 ( 1.366 -14.096 5.240) 15.100 12.863 ( -4.096 6.991 -2.032) 8.353 13.120 ( 2.046 3.724 -10.206) 11.055 13.843 ( 6.713 3.896 -4.303) 8.875 14.513 ( -1.354 -12.599 -12.373) 17.710 14.828 ( 1.885 -4.006 -0.099) 4.428 15.469 ( 0.507 0.391 -11.324) 11.342 16.377 ( -14.513 -3.620 13.200) 19.949 19.023 ( -11.229 -0.528 -32.988) 34.851 19.704 ( 2.574 -0.610 0.745) 2.749 20.263 ( 2.927 0.821 -10.378) 10.814 21.402 ( -5.149 1.781 11.087) 12.353 21.457 ( 10.484 -3.382 12.324) 16.530 24.389 ( 3.750 1.633 -2.050) 4.575 24.532 ( -1.668 0.308 -1.155) 2.052 ======================= Grid point 230 (122/260) ======================= q-point: ( 0.10 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.287 ( 5.268 7.149 8.728) 12.451 2.429 ( 0.135 9.103 17.358) 19.600 2.948 ( 2.969 -0.461 3.655) 4.732 3.048 ( -2.245 -2.929 3.508) 5.092 3.169 ( 0.905 -7.449 9.249) 11.910 3.843 ( 0.585 0.849 8.062) 8.128 4.258 ( 3.033 14.454 3.613) 15.205 4.398 ( 4.456 0.204 -1.725) 4.783 4.671 ( -5.513 3.248 -0.993) 6.475 4.807 ( -6.338 -8.208 1.491) 10.477 5.351 ( 9.640 -0.289 1.621) 9.779 5.741 ( 4.514 -3.030 9.761) 11.173 6.220 ( 0.673 2.154 -3.102) 3.837 7.874 ( -7.681 7.805 19.199) 22.102 7.962 ( 0.371 2.256 -3.752) 4.394 8.386 ( 8.336 -4.129 9.833) 13.536 9.116 ( 10.522 9.989 5.351) 15.463 9.288 ( -3.837 14.260 5.400) 15.724 9.692 ( -13.316 -6.606 -0.137) 14.865 10.131 ( 8.887 -6.654 -2.036) 11.287 10.883 ( 18.021 8.766 14.204) 24.563 11.109 ( 12.673 -12.392 6.304) 18.813 12.761 ( -5.362 7.861 -3.090) 10.005 13.151 ( 2.737 1.209 -8.087) 8.623 13.919 ( 1.826 4.590 -4.357) 6.586 14.399 ( -7.140 -10.715 -13.013) 18.307 14.871 ( 2.380 -5.440 -0.231) 5.942 15.442 ( -0.684 0.765 -11.448) 11.494 16.261 ( 0.811 -2.005 9.770) 10.006 18.724 ( -9.152 -0.658 -22.947) 24.713 19.726 ( -2.199 -0.547 -2.162) 3.132 20.199 ( -7.163 0.971 -10.165) 12.473 21.122 ( -16.987 1.546 7.775) 18.746 21.906 ( 23.945 -5.069 10.488) 26.628 24.411 ( -4.667 3.989 -1.910) 6.430 24.489 ( 0.821 -2.315 -1.414) 2.834 ======================= Grid point 231 (123/260) ======================= q-point: ( 0.20 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.382 ( 2.527 10.130 8.136) 13.236 2.520 ( 5.368 5.107 13.663) 15.542 3.009 ( 2.536 -0.052 1.404) 2.899 3.068 ( 3.173 -7.464 1.108) 8.186 3.161 ( -3.034 -6.722 4.734) 8.764 3.849 ( -2.450 1.430 6.654) 7.233 4.298 ( 1.359 7.080 -7.666) 10.524 4.493 ( 1.093 10.486 2.844) 10.919 4.557 ( -5.244 -0.371 -3.560) 6.349 4.752 ( 3.890 -9.959 8.380) 13.584 5.546 ( 9.191 1.855 2.154) 9.621 5.867 ( 5.157 -3.475 6.845) 9.248 6.257 ( 4.022 2.544 0.337) 4.771 7.723 ( -9.976 5.294 16.708) 20.167 7.990 ( 0.708 3.380 0.392) 3.475 8.533 ( 1.209 -3.301 9.572) 10.197 9.180 ( -1.571 19.414 -0.097) 19.478 9.280 ( 1.479 9.474 9.267) 13.335 9.507 ( -2.847 -10.773 -0.627) 11.161 10.334 ( 10.818 -5.177 -1.155) 12.049 11.276 ( 14.733 0.350 8.724) 17.126 11.444 ( 19.530 -3.476 9.296) 21.907 12.658 ( -3.751 9.539 -1.498) 10.359 13.171 ( 0.249 -2.917 -5.171) 5.942 13.896 ( -3.224 7.812 -3.838) 9.282 14.188 ( -10.612 -11.757 -11.584) 19.622 14.920 ( 2.575 -4.842 -0.511) 5.508 15.395 ( -1.558 0.972 -9.241) 9.422 16.459 ( 17.594 -0.532 1.907) 17.705 18.608 ( 1.576 -2.535 -13.276) 13.608 19.594 ( -10.202 -0.264 -3.535) 10.801 19.963 ( -13.056 0.430 -7.776) 15.202 20.812 ( -16.255 2.925 8.197) 18.438 22.395 ( 23.048 -6.524 6.414) 24.798 24.220 ( -12.608 2.011 -5.327) 13.834 24.527 ( 2.030 -0.771 -0.560) 2.243 ======================= Grid point 232 (124/260) ======================= q-point: ( 0.30 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.448 ( 2.606 10.883 7.541) 13.495 2.673 ( 6.646 -0.471 10.083) 12.086 3.023 ( -3.596 -0.192 0.380) 3.621 3.076 ( -1.144 -4.897 3.524) 6.141 3.189 ( 6.255 -8.664 -5.582) 12.056 3.780 ( -5.097 5.028 3.277) 7.874 4.185 ( -8.388 2.262 -19.411) 21.266 4.363 ( -8.646 -5.015 -8.003) 12.804 4.661 ( 10.802 8.686 9.790) 16.970 4.943 ( 9.830 -3.856 14.750) 18.140 5.710 ( 6.590 3.085 2.796) 7.795 5.933 ( -0.141 -2.609 5.474) 6.065 6.407 ( 10.706 3.024 3.085) 11.545 7.567 ( -9.422 4.924 17.896) 20.815 7.977 ( -2.159 3.588 0.900) 4.283 8.417 ( -12.512 -4.933 4.952) 14.332 9.192 ( 0.863 16.599 -3.788) 17.047 9.337 ( 2.690 12.213 11.854) 17.231 9.596 ( 11.052 -10.116 3.231) 15.327 10.545 ( 10.731 -4.588 0.063) 11.671 11.411 ( -1.362 -2.521 -6.959) 7.526 11.861 ( 17.630 2.883 14.825) 23.214 12.643 ( 2.279 12.246 3.503) 12.939 13.131 ( -3.191 -9.019 -0.309) 9.572 13.746 ( -11.513 6.370 -5.519) 14.268 13.986 ( -6.378 -9.439 -8.365) 14.133 14.966 ( 2.131 -3.218 -0.893) 3.961 15.346 ( -1.459 0.818 -6.506) 6.717 16.937 ( 30.110 0.460 -5.397) 30.594 18.710 ( 10.148 -3.717 -6.307) 12.513 19.328 ( -15.008 0.327 -4.699) 15.730 19.722 ( -8.621 -0.636 -2.460) 8.987 20.491 ( -18.778 3.789 9.040) 21.182 22.839 ( 20.742 -6.715 3.324) 22.054 23.902 ( -17.649 0.773 -8.220) 19.485 24.556 ( 1.060 -0.180 -1.492) 1.839 ======================= Grid point 233 (125/260) ======================= q-point: ( 0.40 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.512 ( 1.978 7.166 5.298) 9.129 2.772 ( -1.605 -8.415 8.817) 12.294 2.956 ( 1.110 6.291 -2.081) 6.719 3.081 ( 0.208 -3.069 2.008) 3.674 3.282 ( 3.668 -6.648 -9.647) 12.277 3.675 ( -6.098 3.726 0.703) 7.181 3.958 ( -8.179 2.573 -20.559) 22.275 4.190 ( -5.964 -5.288 -10.721) 13.359 4.921 ( 12.058 4.202 11.381) 17.105 5.156 ( 7.486 -0.933 15.985) 17.676 5.812 ( 2.795 3.756 3.563) 5.883 5.905 ( -3.226 -1.585 6.287) 7.242 6.662 ( 13.145 3.789 3.666) 14.163 7.442 ( -7.088 5.599 18.354) 20.456 7.912 ( -4.515 3.511 1.718) 5.972 8.151 ( -13.879 -7.858 2.228) 16.104 9.184 ( 0.500 13.986 -9.275) 16.789 9.408 ( 0.789 10.997 15.815) 19.279 9.875 ( 12.969 -6.939 5.826) 15.821 10.769 ( 12.095 -2.684 0.971) 12.428 11.226 ( -13.158 -0.688 -14.292) 19.438 12.163 ( 9.004 3.720 12.227) 15.633 12.709 ( 1.341 17.845 4.920) 18.559 13.099 ( 0.895 -15.521 7.875) 17.428 13.473 ( -12.610 -1.692 -5.988) 14.062 13.861 ( -5.422 -3.465 -9.561) 11.525 14.996 ( 0.981 -2.279 -0.964) 2.662 15.317 ( -0.036 1.067 -4.297) 4.428 17.581 ( 35.474 1.508 -9.119) 36.659 18.915 ( 3.605 -2.874 -7.198) 8.548 19.043 ( -4.673 0.843 -0.890) 4.831 19.642 ( -0.055 -1.670 1.948) 2.567 20.102 ( -22.015 3.191 12.296) 25.417 23.193 ( 9.892 -6.693 -5.416) 13.114 23.536 ( -12.300 0.223 -4.463) 13.086 24.560 ( -0.273 0.151 -3.070) 3.086 ======================= Grid point 234 (126/260) ======================= q-point: (-0.50 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.526 ( -2.320 0.071 2.151) 3.165 2.685 ( -5.601 -2.769 6.327) 8.892 3.009 ( 0.601 7.192 -6.199) 9.514 3.097 ( 1.544 -2.761 0.385) 3.187 3.281 ( -0.591 0.109 -7.456) 7.480 3.537 ( -6.362 -6.100 -2.831) 9.257 3.838 ( 0.419 2.216 -13.656) 13.841 4.101 ( -0.676 -1.854 -10.702) 10.883 5.160 ( 8.895 2.109 10.778) 14.133 5.278 ( 0.450 0.592 14.553) 14.572 5.837 ( -0.720 3.334 4.600) 5.726 5.866 ( -1.788 -0.239 6.879) 7.111 6.894 ( 7.688 2.984 5.126) 9.710 7.369 ( -4.528 8.651 18.149) 20.609 7.817 ( -5.145 2.107 2.886) 6.264 7.919 ( -8.401 -10.602 -1.373) 13.597 9.178 ( 0.937 12.762 -9.340) 15.842 9.433 ( -1.959 9.379 16.504) 19.084 10.032 ( 0.346 -5.744 3.641) 6.810 10.905 ( -14.445 0.309 -10.360) 17.778 11.019 ( 11.886 -0.079 0.318) 11.890 12.214 ( -6.711 -0.063 4.221) 7.928 12.755 ( 4.464 19.976 8.526) 22.173 13.123 ( -5.343 -2.198 8.479) 10.260 13.361 ( 6.651 -15.859 -3.474) 17.544 13.713 ( -6.756 -2.807 -12.080) 14.122 14.996 ( -0.792 -2.698 -0.818) 2.928 15.329 ( 2.095 1.866 -3.485) 4.474 18.251 ( 32.778 2.231 -9.216) 34.122 18.691 ( -11.177 -0.547 -9.877) 14.925 19.274 ( 14.676 1.544 3.705) 15.215 19.459 ( -23.744 3.004 -1.512) 23.981 19.954 ( 9.087 -4.621 21.992) 24.240 22.917 ( -22.813 -4.158 -19.169) 30.086 23.693 ( 16.016 -2.038 4.999) 16.901 24.530 ( -1.826 0.281 -4.942) 5.277 ======================= Grid point 235 (127/260) ======================= q-point: (-0.40 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.416 ( -8.067 -0.623 0.881) 8.138 2.626 ( -2.526 3.064 4.505) 6.005 2.924 ( -5.369 1.502 -6.918) 8.884 3.078 ( -3.802 -1.158 -6.806) 7.881 3.298 ( 3.400 5.383 2.195) 6.735 3.487 ( 1.922 -10.154 1.123) 10.395 3.893 ( 7.170 -1.106 -10.428) 12.704 4.086 ( 0.535 2.116 -9.547) 9.794 5.224 ( -7.886 2.036 11.024) 13.707 5.301 ( 2.212 1.014 9.620) 9.923 5.789 ( -5.134 3.115 3.222) 6.815 5.891 ( 2.095 0.020 8.385) 8.643 6.897 ( -9.896 -1.219 7.603) 12.539 7.365 ( 0.702 11.977 17.606) 21.305 7.764 ( 0.054 0.473 1.208) 1.299 7.841 ( 1.100 -10.265 -3.239) 10.820 9.169 ( -0.754 10.790 -5.593) 12.177 9.405 ( -4.233 9.234 14.332) 17.567 9.908 ( -11.134 -5.551 -2.120) 12.620 10.659 ( -9.375 1.989 0.837) 9.620 11.182 ( 3.477 1.033 -0.961) 3.752 11.970 ( -16.641 -3.275 0.958) 16.987 12.909 ( 5.824 18.201 10.419) 21.766 13.046 ( 0.762 2.051 0.481) 2.240 13.474 ( -3.815 0.015 -9.741) 10.462 13.676 ( 12.483 -19.099 -3.913) 23.150 14.962 ( -2.429 -3.051 -0.616) 3.948 15.376 ( 3.222 2.007 -4.153) 5.626 18.488 ( -7.366 3.636 -7.536) 11.148 18.635 ( -10.405 -5.448 1.358) 11.823 19.089 ( 8.522 6.355 -10.755) 15.122 19.584 ( 14.453 1.980 4.381) 15.232 20.340 ( 21.949 -5.458 24.945) 33.672 22.389 ( -25.400 -4.061 -20.914) 33.152 24.008 ( 14.163 -0.822 3.587) 14.633 24.468 ( -3.017 0.150 -6.844) 7.481 ======================= Grid point 236 (128/260) ======================= q-point: (-0.30 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.251 ( -8.268 3.198 1.942) 9.075 2.574 ( -3.601 12.551 4.657) 13.863 2.836 ( -1.945 -3.555 -2.236) 4.628 2.969 ( -5.322 -9.538 0.520) 10.935 3.405 ( 6.475 7.311 2.683) 10.128 3.571 ( 4.585 -6.749 2.743) 8.608 4.023 ( 2.852 2.891 -8.521) 9.440 4.082 ( 5.768 -1.187 -7.554) 9.579 5.051 ( -10.586 2.489 7.791) 13.378 5.286 ( -5.798 0.929 8.222) 10.104 5.656 ( -8.803 2.120 2.263) 9.333 5.937 ( -0.426 -0.613 7.406) 7.444 6.624 ( -16.097 -2.358 6.253) 17.429 7.450 ( 3.168 10.189 18.993) 21.785 7.815 ( 5.844 1.220 -5.831) 8.345 7.927 ( 6.183 -8.705 1.989) 10.861 9.089 ( -7.963 7.225 2.614) 11.066 9.353 ( -2.630 10.881 7.136) 13.275 9.680 ( -9.478 -6.078 -2.805) 11.604 10.511 ( -7.012 5.331 7.744) 11.729 11.138 ( -7.253 0.736 -1.855) 7.522 11.613 ( -18.682 -5.844 1.127) 19.608 12.947 ( -0.472 7.525 4.642) 8.854 13.212 ( 11.281 14.112 -0.286) 18.069 13.331 ( -5.202 -1.061 -11.250) 12.440 13.994 ( 17.551 -18.489 -4.001) 25.805 14.904 ( -3.125 -2.774 -0.341) 4.193 15.427 ( 2.926 1.463 -5.667) 6.543 17.986 ( -35.673 0.662 7.693) 36.499 18.551 ( 6.879 -3.767 -9.660) 12.443 19.477 ( 22.585 5.221 -11.992) 26.099 19.847 ( 10.653 -0.022 3.014) 11.071 20.867 ( 23.746 -3.009 26.346) 35.596 21.836 ( -25.244 -3.143 -19.493) 32.048 24.254 ( 9.553 1.535 1.846) 9.850 24.393 ( -2.129 -1.009 -7.741) 8.092 ======================= Grid point 237 (129/260) ======================= q-point: (-0.20 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.123 ( -4.951 5.621 5.536) 9.315 2.520 ( -3.428 18.647 9.645) 21.272 2.818 ( -0.824 -3.209 4.050) 5.232 2.906 ( -1.006 -15.207 6.254) 16.474 3.501 ( -0.763 5.336 1.401) 5.569 3.658 ( 4.981 -3.217 2.550) 6.455 3.996 ( -0.512 7.779 -0.535) 7.814 4.263 ( 10.670 -3.390 -8.123) 13.832 4.883 ( -6.701 1.939 4.198) 8.142 5.125 ( -11.329 0.932 7.761) 13.764 5.462 ( -10.669 0.014 0.468) 10.679 5.876 ( -7.420 -2.509 9.102) 12.009 6.383 ( -8.266 0.236 1.851) 8.474 7.571 ( 4.659 9.418 18.429) 21.214 7.976 ( 11.671 1.557 -8.961) 14.796 8.048 ( 4.899 -7.954 6.880) 11.602 8.859 ( -15.587 4.795 7.590) 17.988 9.346 ( 0.561 10.264 3.134) 10.746 9.560 ( -1.852 -4.321 -1.617) 4.971 10.420 ( -3.943 8.306 10.697) 14.105 10.912 ( -14.547 -0.329 -1.691) 14.648 11.269 ( -15.818 -8.317 2.484) 18.043 12.947 ( -0.490 7.046 1.584) 7.238 13.198 ( -3.399 5.192 -12.896) 14.311 13.465 ( 11.840 6.451 -0.083) 13.484 14.302 ( 14.074 -17.132 -7.631) 23.448 14.844 ( -2.664 -2.002 0.013) 3.332 15.462 ( 2.032 0.807 -7.527) 7.838 17.312 ( -33.222 -2.311 10.248) 34.843 18.772 ( 16.841 -3.028 -12.373) 21.115 19.834 ( 13.915 6.762 -9.250) 18.026 19.989 ( 4.074 -4.672 -4.899) 7.902 21.316 ( 8.073 0.830 17.210) 19.028 21.365 ( -10.484 -2.566 -3.346) 11.300 24.315 ( -0.105 2.279 -7.107) 7.464 24.443 ( 5.817 -0.878 0.365) 5.894 ======================= Grid point 238 (130/260) ======================= q-point: (-0.10 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.092 ( 0.169 6.348 9.697) 11.591 2.470 ( -4.502 16.393 14.768) 22.519 2.830 ( 0.903 -3.774 8.919) 9.727 2.952 ( 3.290 -10.041 8.730) 13.707 3.372 ( -9.922 1.429 1.075) 10.082 3.767 ( 3.731 1.132 3.736) 5.400 4.029 ( 3.216 6.687 4.421) 8.638 4.413 ( 4.947 1.566 -7.684) 9.271 4.823 ( -1.075 0.163 2.148) 2.408 4.935 ( -7.241 1.260 7.440) 10.458 5.264 ( -8.250 -3.044 -0.910) 8.840 5.740 ( -7.213 -2.764 12.190) 14.431 6.281 ( -3.009 2.020 -2.680) 4.507 7.708 ( 5.041 9.141 16.498) 19.523 8.109 ( 3.225 -3.565 1.961) 5.192 8.243 ( 9.775 -0.761 -3.746) 10.496 8.587 ( -8.623 3.059 12.356) 15.375 9.363 ( -0.388 8.906 3.387) 9.536 9.607 ( 6.829 -0.989 -1.443) 7.049 10.409 ( -0.869 7.295 12.065) 14.126 10.589 ( -15.818 0.496 -0.394) 15.830 11.023 ( -9.156 -11.160 3.898) 14.952 12.926 ( -1.955 6.904 -0.319) 7.182 13.129 ( -0.653 4.642 -11.783) 12.681 13.682 ( 10.130 5.009 -2.667) 11.611 14.491 ( 6.642 -15.941 -10.794) 20.365 14.810 ( -0.480 -1.667 0.311) 1.762 15.475 ( 1.242 0.373 -9.522) 9.610 16.750 ( -25.582 -3.851 12.462) 28.715 19.076 ( 13.864 -2.602 -23.136) 27.097 19.793 ( -10.518 0.914 -6.820) 12.569 20.147 ( 10.590 -0.200 -10.704) 15.058 21.193 ( 2.479 0.505 8.120) 8.505 21.529 ( 0.044 -0.250 16.122) 16.124 24.326 ( 2.829 1.482 -5.204) 6.106 24.526 ( 2.324 0.417 0.037) 2.362 ======================= Grid point 279 (131/260) ======================= q-point: ( 0.00 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.369 ( -2.103 0.000 21.646) 21.748 1.600 ( 4.681 0.000 22.548) 23.029 2.756 ( 12.483 0.000 7.232) 14.427 3.128 ( 3.494 0.000 -11.978) 12.477 3.428 ( -3.773 0.000 27.956) 28.209 3.619 ( 7.270 0.000 1.447) 7.412 3.986 ( 3.394 0.000 -4.503) 5.639 4.030 ( 1.070 0.000 12.020) 12.068 4.872 ( -3.720 0.000 0.193) 3.725 4.942 ( -10.906 0.000 9.174) 14.251 5.644 ( 3.699 0.000 4.631) 5.927 5.766 ( 3.425 0.000 5.681) 6.633 6.021 ( -12.461 0.000 10.910) 16.562 7.169 ( 2.907 0.000 -15.863) 16.127 7.171 ( -2.804 0.000 16.341) 16.580 8.032 ( -8.106 0.000 12.463) 14.867 8.300 ( -6.968 0.000 -7.401) 10.165 9.061 ( 9.870 0.000 -11.502) 15.156 9.394 ( 8.635 0.000 26.063) 27.456 10.593 ( 16.081 0.000 0.059) 16.081 10.719 ( 1.290 0.000 -7.657) 7.765 10.931 ( -9.962 0.000 -7.544) 12.496 11.840 ( 6.206 0.000 -6.527) 9.006 12.459 ( 5.979 0.000 -14.516) 15.699 14.202 ( 6.667 0.000 6.416) 9.253 15.014 ( -2.752 0.000 -6.275) 6.852 15.180 ( -3.238 0.000 5.418) 6.312 15.603 ( 5.708 0.000 -14.174) 15.280 18.269 ( -63.727 0.000 2.399) 63.772 18.566 ( 19.502 0.000 -2.001) 19.605 19.938 ( 0.874 0.000 0.866) 1.230 20.022 ( -0.916 0.000 -0.642) 1.118 21.501 ( -23.568 0.000 9.675) 25.477 22.133 ( 54.002 0.000 -5.639) 54.296 23.757 ( 6.452 0.000 2.932) 7.087 24.097 ( -4.217 0.000 -4.583) 6.228 ======================= Grid point 280 (132/260) ======================= q-point: ( 0.10 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( 10.500 0.000 20.121) 22.696 1.833 ( 13.406 0.000 14.799) 19.968 3.039 ( 13.536 0.000 -2.193) 13.713 3.168 ( 3.124 0.000 -13.918) 14.265 3.476 ( 2.364 0.000 28.519) 28.617 3.643 ( -2.928 0.000 -2.891) 4.115 4.021 ( 0.663 0.000 4.061) 4.115 4.197 ( 10.655 0.000 13.623) 17.294 4.732 ( -12.106 0.000 11.167) 16.470 4.784 ( -4.359 0.000 -3.047) 5.319 5.706 ( 1.409 0.000 4.207) 4.436 5.775 ( -1.853 0.000 5.789) 6.078 6.060 ( 9.306 0.000 5.303) 10.711 7.146 ( -3.556 0.000 19.503) 19.825 7.224 ( 5.853 0.000 -13.297) 14.528 7.923 ( -5.063 0.000 9.993) 11.203 8.098 ( -10.016 0.000 -7.196) 12.334 9.334 ( 17.889 0.000 -9.474) 20.243 9.580 ( 3.167 0.000 32.400) 32.555 10.701 ( -6.898 0.000 -20.085) 21.236 10.759 ( 1.095 0.000 -0.129) 1.103 10.975 ( 22.533 0.000 -10.806) 24.991 11.881 ( -0.846 0.000 -7.704) 7.750 12.609 ( 11.975 0.000 -13.718) 18.209 14.345 ( 5.365 0.000 4.320) 6.888 14.929 ( -4.202 0.000 -11.282) 12.039 15.082 ( -8.259 0.000 3.746) 9.069 15.670 ( 3.792 0.000 -8.540) 9.344 17.196 ( -42.251 0.000 21.018) 47.190 18.979 ( 21.709 0.000 3.713) 22.025 19.876 ( -7.270 0.000 1.120) 7.356 19.967 ( -4.775 0.000 -0.896) 4.858 20.954 ( -32.059 0.000 3.705) 32.272 23.051 ( 39.501 0.000 -17.312) 43.128 23.935 ( 10.014 0.000 3.369) 10.566 23.974 ( -6.944 0.000 -6.154) 9.278 ======================= Grid point 281 (133/260) ======================= q-point: ( 0.20 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.833 ( 17.201 0.000 17.431) 24.489 2.147 ( 14.860 0.000 8.221) 16.983 3.174 ( 0.570 0.000 -15.624) 15.634 3.207 ( 2.444 0.000 -0.621) 2.522 3.556 ( -4.477 0.000 -4.174) 6.121 3.641 ( 9.655 0.000 4.091) 10.486 4.074 ( 3.171 0.000 19.527) 19.783 4.332 ( -5.861 0.000 5.769) 8.224 4.628 ( 4.230 0.000 18.549) 19.025 4.719 ( -1.079 0.000 -2.850) 3.047 5.716 ( -1.256 0.000 3.944) 4.139 5.774 ( 0.421 0.000 4.227) 4.248 6.241 ( 6.986 0.000 1.104) 7.073 7.131 ( -2.285 0.000 22.202) 22.319 7.326 ( 6.460 0.000 -9.442) 11.440 7.883 ( -1.475 0.000 11.076) 11.174 7.901 ( -8.276 0.000 -5.632) 10.010 9.673 ( -1.083 0.000 36.253) 36.269 9.673 ( 17.066 0.000 -5.319) 17.876 10.534 ( -3.203 0.000 -22.942) 23.164 10.830 ( 5.414 0.000 -2.582) 5.998 11.365 ( 16.850 0.000 -14.463) 22.206 11.789 ( -4.898 0.000 -5.995) 7.741 12.857 ( 16.140 0.000 -15.765) 22.562 14.346 ( -9.480 0.000 12.731) 15.873 14.784 ( -7.723 0.000 -14.697) 16.602 14.919 ( -5.693 0.000 2.937) 6.406 15.717 ( 2.370 0.000 -4.115) 4.748 16.777 ( -5.465 0.000 16.241) 17.136 19.406 ( 16.508 0.000 3.734) 16.925 19.686 ( -8.674 0.000 6.219) 10.673 19.832 ( -8.382 0.000 -1.334) 8.487 20.299 ( -33.280 0.000 0.205) 33.280 23.599 ( 19.003 0.000 -22.610) 29.535 23.815 ( -5.368 0.000 -4.280) 6.866 24.140 ( 9.496 0.000 2.008) 9.706 ======================= Grid point 282 (134/260) ======================= q-point: ( 0.30 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( 19.163 0.000 15.036) 24.358 2.446 ( 14.044 0.000 4.134) 14.639 3.120 ( -2.212 0.000 -16.700) 16.846 3.137 ( -8.547 0.000 1.783) 8.731 3.451 ( -5.485 0.000 -3.677) 6.604 3.844 ( 11.352 0.000 -11.683) 16.290 4.109 ( -14.111 0.000 7.061) 15.779 4.200 ( 2.633 0.000 16.437) 16.646 4.743 ( 4.112 0.000 3.256) 5.245 4.856 ( 11.004 0.000 15.382) 18.913 5.680 ( -3.077 0.000 3.467) 4.635 5.791 ( -0.017 0.000 2.059) 2.059 6.344 ( 3.849 0.000 3.649) 5.304 7.169 ( 1.187 0.000 22.824) 22.855 7.410 ( 3.138 0.000 -5.632) 6.447 7.753 ( -5.426 0.000 -2.713) 6.066 7.906 ( 0.681 0.000 14.457) 14.473 9.714 ( -2.963 0.000 38.369) 38.483 9.945 ( 10.586 0.000 -2.726) 10.931 10.499 ( 5.444 0.000 -28.179) 28.700 10.962 ( 8.275 0.000 -0.227) 8.278 11.374 ( -11.624 0.000 -12.121) 16.794 11.841 ( 9.746 0.000 -5.012) 10.960 13.158 ( 17.612 0.000 -20.278) 26.858 14.088 ( -16.591 0.000 20.515) 26.384 14.561 ( -11.025 0.000 -14.323) 18.075 14.892 ( 0.410 0.000 3.704) 3.727 15.740 ( 0.478 0.000 -2.361) 2.409 16.939 ( 16.657 0.000 4.129) 17.161 19.264 ( -18.241 0.000 -3.209) 18.521 19.643 ( -10.029 0.000 -1.811) 10.191 19.660 ( -26.724 0.000 -5.704) 27.326 19.977 ( 19.745 0.000 21.215) 28.982 23.547 ( -9.254 0.000 -14.933) 17.568 23.949 ( 11.002 0.000 -11.473) 15.895 24.302 ( 6.316 0.000 -0.004) 6.316 ======================= Grid point 283 (135/260) ======================= q-point: ( 0.40 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.639 ( 18.025 0.000 12.203) 21.767 2.714 ( 10.638 0.000 1.872) 10.802 2.924 ( -10.848 0.000 0.425) 10.856 3.025 ( -3.241 0.000 -16.003) 16.328 3.302 ( -9.951 0.000 1.681) 10.092 3.868 ( -10.464 0.000 4.705) 11.474 4.006 ( 4.877 0.000 -6.949) 8.490 4.191 ( -3.272 0.000 -2.834) 4.329 4.895 ( 8.419 0.000 10.457) 13.425 5.081 ( 8.037 0.000 12.433) 14.804 5.620 ( -3.378 0.000 2.708) 4.330 5.758 ( -3.836 0.000 1.204) 4.021 6.450 ( 5.981 0.000 8.910) 10.732 7.283 ( 5.241 0.000 20.654) 21.309 7.410 ( -1.801 0.000 -4.865) 5.188 7.684 ( -1.460 0.000 1.709) 2.248 7.965 ( 1.425 0.000 18.350) 18.405 9.735 ( -3.589 0.000 38.563) 38.730 10.086 ( 5.533 0.000 -7.690) 9.474 10.590 ( 8.665 0.000 -26.039) 27.443 11.033 ( -18.761 0.000 -8.933) 20.779 11.145 ( 9.195 0.000 3.299) 9.769 11.964 ( 2.083 0.000 -2.946) 3.608 13.413 ( 11.499 0.000 -27.959) 30.231 13.867 ( -9.523 0.000 18.724) 21.006 14.332 ( -7.169 0.000 -8.543) 11.153 14.917 ( 0.776 0.000 7.056) 7.098 15.720 ( -1.934 0.000 -2.877) 3.467 17.372 ( 25.397 0.000 -2.006) 25.476 18.881 ( -18.879 0.000 -5.843) 19.762 19.179 ( -18.900 0.000 -2.828) 19.111 19.447 ( -8.702 0.000 -1.948) 8.918 20.443 ( 20.890 0.000 22.802) 30.924 23.309 ( -11.047 0.000 -17.125) 20.379 24.088 ( 5.825 0.000 -9.217) 10.904 24.379 ( 1.526 0.000 -1.999) 2.515 ======================= Grid point 284 (136/260) ======================= q-point: (-0.50 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.574 ( -16.810 0.000 1.413) 16.869 2.926 ( -0.932 0.000 -10.098) 10.141 2.963 ( 4.776 0.000 0.006) 4.776 3.027 ( 13.163 0.000 -0.992) 13.200 3.070 ( -10.191 0.000 14.524) 17.742 3.752 ( -1.283 0.000 0.778) 1.500 3.878 ( -14.080 0.000 -2.965) 14.389 4.186 ( 1.362 0.000 -8.255) 8.366 5.073 ( 6.601 0.000 9.959) 11.949 5.214 ( 2.592 0.000 11.039) 11.339 5.569 ( -2.089 0.000 1.843) 2.786 5.668 ( -4.958 0.000 3.240) 5.923 6.616 ( 8.034 0.000 11.854) 14.320 7.343 ( -3.065 0.000 -6.440) 7.132 7.451 ( 6.866 0.000 16.290) 17.678 7.694 ( 1.622 0.000 4.322) 4.617 8.040 ( 1.524 0.000 21.030) 21.085 9.736 ( -5.225 0.000 34.186) 34.583 10.137 ( 1.670 0.000 -13.952) 14.051 10.631 ( -19.446 0.000 -2.971) 19.672 10.694 ( 6.888 0.000 -20.211) 21.353 11.305 ( 5.084 0.000 6.182) 8.004 11.906 ( -6.790 0.000 -1.079) 6.875 13.396 ( -6.345 0.000 -31.627) 32.257 13.789 ( -2.627 0.000 14.514) 14.750 14.337 ( 9.113 0.000 -4.951) 10.371 14.962 ( 2.021 0.000 9.649) 9.858 15.655 ( -3.536 0.000 -4.458) 5.690 17.890 ( 26.495 0.000 -2.209) 26.587 18.490 ( -17.891 0.000 -12.931) 22.075 18.957 ( -3.304 0.000 2.857) 4.367 19.317 ( -3.327 0.000 -1.356) 3.593 20.888 ( 18.556 0.000 24.929) 31.077 23.023 ( -13.822 0.000 -23.037) 26.866 24.155 ( 2.932 0.000 -5.240) 6.004 24.350 ( -3.711 0.000 -3.558) 5.142 ======================= Grid point 285 (137/260) ======================= q-point: (-0.40 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.220 ( -18.759 0.000 2.886) 18.980 2.658 ( -21.170 0.000 11.135) 23.920 2.919 ( 1.489 0.000 -7.641) 7.784 3.152 ( 2.682 0.000 1.862) 3.265 3.279 ( 11.565 0.000 -0.395) 11.571 3.535 ( -18.432 0.000 -3.476) 18.756 3.827 ( 7.437 0.000 3.531) 8.232 4.120 ( -6.858 0.000 -2.536) 7.312 5.195 ( 3.661 0.000 8.168) 8.951 5.246 ( -1.166 0.000 11.533) 11.592 5.539 ( -1.746 0.000 1.150) 2.091 5.597 ( -3.080 0.000 5.332) 6.158 6.802 ( 7.575 0.000 12.341) 14.481 7.276 ( -1.755 0.000 -9.221) 9.386 7.593 ( 3.427 0.000 10.447) 10.994 7.769 ( 5.149 0.000 3.470) 6.209 8.110 ( 0.489 0.000 21.323) 21.328 9.631 ( -12.769 0.000 18.998) 22.891 10.066 ( -5.882 0.000 -16.877) 17.872 10.316 ( -11.904 0.000 14.608) 18.844 10.769 ( 4.452 0.000 -14.383) 15.056 11.357 ( -1.162 0.000 7.204) 7.297 11.732 ( -9.318 0.000 -1.647) 9.463 13.119 ( -12.705 0.000 -27.755) 30.525 13.807 ( 1.002 0.000 12.197) 12.238 14.581 ( 14.923 0.000 -7.342) 16.631 15.038 ( 3.195 0.000 11.125) 11.575 15.570 ( -3.554 0.000 -6.794) 7.667 18.157 ( -11.615 0.000 -16.055) 19.816 18.384 ( 23.326 0.000 1.789) 23.395 19.035 ( 9.329 0.000 4.336) 10.288 19.338 ( 6.076 0.000 -0.332) 6.085 21.281 ( 15.258 0.000 26.136) 30.264 22.640 ( -19.298 0.000 -30.463) 36.061 24.189 ( 1.394 0.000 -1.828) 2.298 24.222 ( -8.114 0.000 -4.388) 9.224 ======================= Grid point 286 (138/260) ======================= q-point: (-0.30 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.873 ( -16.744 0.000 8.147) 18.621 2.242 ( -23.282 0.000 14.830) 27.604 2.981 ( 5.635 0.000 -2.004) 5.981 3.119 ( -20.339 0.000 3.543) 20.645 3.158 ( -0.498 0.000 -5.339) 5.362 3.514 ( 9.217 0.000 -0.811) 9.253 3.936 ( -10.190 0.000 1.314) 10.275 3.992 ( 6.535 0.000 5.803) 8.740 5.233 ( -2.356 0.000 6.520) 6.933 5.243 ( -1.744 0.000 12.553) 12.674 5.500 ( -2.176 0.000 1.200) 2.485 5.576 ( -0.110 0.000 6.857) 6.858 6.954 ( 4.583 0.000 11.184) 12.086 7.231 ( -0.373 0.000 -12.613) 12.619 7.571 ( -8.873 0.000 0.269) 8.877 7.914 ( 9.027 0.000 0.153) 9.028 8.154 ( -0.512 0.000 22.792) 22.798 9.347 ( -16.461 0.000 10.493) 19.521 9.823 ( -14.712 0.000 -15.247) 21.188 10.227 ( -3.494 0.000 27.333) 27.555 10.797 ( 1.040 0.000 -10.425) 10.477 11.312 ( -4.120 0.000 5.275) 6.693 11.581 ( -4.312 0.000 -2.853) 5.170 12.817 ( -11.293 0.000 -24.552) 27.025 13.873 ( 2.741 0.000 11.782) 12.096 14.848 ( 12.902 0.000 -6.293) 14.355 15.126 ( 2.762 0.000 11.361) 11.692 15.492 ( -2.129 0.000 -11.258) 11.458 17.986 ( -1.729 0.000 -15.577) 15.672 18.840 ( 22.834 0.000 7.217) 23.947 19.298 ( 15.146 0.000 3.425) 15.529 19.548 ( 14.343 0.000 1.193) 14.393 21.601 ( 10.867 0.000 25.903) 28.090 22.101 ( -28.219 0.000 -36.279) 45.962 24.024 ( -10.421 0.000 -4.307) 11.275 24.203 ( 0.247 0.000 -0.217) 0.328 ======================= Grid point 287 (139/260) ======================= q-point: (-0.20 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.631 ( -9.975 0.000 17.652) 20.276 1.827 ( -21.680 0.000 17.479) 27.848 2.762 ( -15.604 0.000 8.164) 17.611 3.087 ( 2.343 0.000 -3.606) 4.300 3.182 ( 7.399 0.000 -2.032) 7.673 3.599 ( -4.786 0.000 15.271) 16.003 3.820 ( 2.274 0.000 -8.347) 8.651 4.077 ( 0.539 0.000 6.523) 6.546 5.127 ( -8.904 0.000 6.486) 11.016 5.217 ( -4.342 0.000 11.254) 12.063 5.485 ( 0.998 0.000 3.109) 3.265 5.619 ( 2.354 0.000 7.213) 7.587 6.964 ( -11.531 0.000 2.287) 11.756 7.199 ( 0.231 0.000 -15.483) 15.484 7.263 ( -14.820 0.000 2.921) 15.105 8.116 ( 11.413 0.000 -3.893) 12.059 8.197 ( -1.499 0.000 23.673) 23.720 9.129 ( -6.675 0.000 14.503) 15.966 9.448 ( -18.790 0.000 -12.244) 22.427 10.256 ( 0.350 0.000 23.934) 23.936 10.770 ( -1.208 0.000 -8.424) 8.510 11.233 ( -4.786 0.000 1.580) 5.040 11.572 ( 3.967 0.000 -3.031) 4.992 12.578 ( -7.280 0.000 -21.588) 22.783 13.963 ( 3.671 0.000 11.592) 12.160 15.033 ( 5.813 0.000 -1.255) 5.947 15.188 ( 0.903 0.000 10.240) 10.280 15.455 ( 2.441 0.000 -18.358) 18.519 18.019 ( 8.009 0.000 -12.405) 14.766 19.314 ( 20.595 0.000 3.716) 20.927 19.604 ( 14.231 0.000 2.052) 14.378 19.893 ( 19.664 0.000 5.784) 20.497 21.372 ( -34.870 0.000 -32.450) 47.633 21.806 ( 3.486 0.000 23.294) 23.554 23.817 ( -8.844 0.000 -3.003) 9.340 24.197 ( -0.821 0.000 -0.547) 0.986 ======================= Grid point 288 (140/260) ======================= q-point: (-0.10 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.497 ( -14.877 0.000 20.226) 25.109 1.549 ( -3.802 0.000 24.544) 24.837 2.604 ( -1.156 0.000 11.034) 11.095 3.097 ( 1.841 0.000 -9.580) 9.755 3.398 ( 12.143 0.000 4.255) 12.867 3.490 ( -7.770 0.000 22.253) 23.570 3.907 ( 5.886 0.000 -8.525) 10.359 4.056 ( -3.523 0.000 7.820) 8.577 4.965 ( -7.493 0.000 5.938) 9.561 5.112 ( -8.244 0.000 9.217) 12.366 5.551 ( 4.105 0.000 4.828) 6.337 5.686 ( 2.760 0.000 6.912) 7.443 6.456 ( -29.821 0.000 1.816) 29.876 7.172 ( 0.813 0.000 -16.715) 16.734 7.181 ( -1.788 0.000 13.779) 13.894 8.159 ( -7.103 0.000 18.244) 19.578 8.311 ( 7.637 0.000 -6.645) 10.123 9.099 ( -11.188 0.000 -11.315) 15.912 9.173 ( 6.436 0.000 19.606) 20.636 10.359 ( 6.352 0.000 13.902) 15.284 10.730 ( -0.626 0.000 -7.587) 7.612 11.116 ( -7.241 0.000 -2.848) 7.780 11.697 ( 8.407 0.000 -4.107) 9.357 12.447 ( -1.149 0.000 -17.877) 17.914 14.070 ( 4.800 0.000 9.999) 11.091 15.066 ( -1.236 0.000 -1.323) 1.811 15.206 ( -1.105 0.000 8.062) 8.137 15.512 ( 6.784 0.000 -19.189) 20.353 18.230 ( 15.134 0.000 -7.659) 16.962 19.348 ( -28.701 0.000 -13.339) 31.650 19.840 ( 8.679 0.000 1.168) 8.757 20.073 ( -6.439 0.000 -2.933) 7.076 21.155 ( 33.093 0.000 1.693) 33.136 21.802 ( -9.429 0.000 17.269) 19.675 23.701 ( -1.701 0.000 0.013) 1.702 24.166 ( -2.111 0.000 -2.299) 3.121 ======================= Grid point 289 (141/260) ======================= q-point: ( 0.00 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.575 ( -1.200 17.156 18.381) 25.172 1.723 ( 3.299 11.154 21.619) 24.550 2.767 ( 9.142 1.523 7.198) 11.735 3.198 ( 4.303 5.318 -8.702) 11.069 3.471 ( -3.325 4.807 21.202) 21.993 3.581 ( 4.863 -2.723 3.188) 6.421 3.996 ( 1.551 1.522 -3.208) 3.874 4.051 ( 4.665 0.553 12.900) 13.729 4.842 ( -4.812 -2.658 0.769) 5.551 4.967 ( -8.889 2.168 7.703) 11.960 5.615 ( 1.879 -2.349 4.895) 5.745 5.818 ( 3.492 3.803 1.744) 5.449 6.025 ( -10.094 0.783 12.312) 15.940 7.221 ( -0.230 8.031 -2.940) 8.556 7.352 ( 1.285 13.006 3.333) 13.488 8.066 ( -6.250 4.493 10.172) 12.756 8.460 ( -9.018 13.386 -4.022) 16.634 9.004 ( 8.438 -4.388 -3.634) 10.182 9.473 ( 9.873 6.383 17.246) 20.872 10.425 ( 10.798 -5.804 2.167) 12.449 10.773 ( -4.089 -4.346 -0.638) 6.002 11.164 ( 0.682 18.800 -16.055) 24.732 11.848 ( 5.542 2.632 -6.682) 9.071 12.482 ( 5.170 2.245 -12.951) 14.124 14.140 ( 5.877 -5.825 7.234) 10.991 14.959 ( -4.269 -4.929 -2.672) 7.047 15.194 ( -2.303 1.241 0.102) 2.618 15.529 ( 5.707 -7.194 -13.835) 16.605 17.884 ( -35.153 -27.476 12.898) 46.444 18.658 ( -4.426 2.013 -10.731) 11.781 19.891 ( 0.453 -3.755 1.110) 3.942 20.043 ( 0.882 1.401 -2.158) 2.720 21.506 ( -21.773 0.508 9.229) 23.653 22.009 ( 45.211 -9.370 -1.872) 46.210 23.940 ( 7.754 13.647 -1.289) 15.749 24.149 ( -4.179 5.015 -3.920) 7.615 ======================= Grid point 290 (142/260) ======================= q-point: ( 0.10 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.648 ( 5.499 12.413 18.408) 22.873 1.949 ( 13.385 10.365 14.875) 22.535 2.982 ( 9.866 -2.623 -2.482) 10.506 3.280 ( 6.046 6.488 -9.606) 13.074 3.478 ( -0.640 1.630 19.349) 19.428 3.606 ( -1.819 -3.222 -1.130) 3.869 4.003 ( 0.618 0.816 11.718) 11.763 4.280 ( 13.067 3.873 11.462) 17.808 4.682 ( -11.762 -2.835 1.372) 12.177 4.832 ( -5.701 3.399 3.388) 7.452 5.639 ( -0.153 -3.586 5.246) 6.356 5.860 ( 0.772 4.877 1.887) 5.286 6.057 ( 7.475 -0.051 6.956) 10.210 7.220 ( -0.276 8.018 5.300) 9.615 7.392 ( 2.536 13.718 0.866) 13.977 7.981 ( -4.258 6.757 7.449) 10.921 8.246 ( -9.855 12.684 -3.219) 16.382 9.240 ( 13.536 -6.274 2.030) 15.057 9.673 ( 5.906 6.407 18.219) 20.196 10.527 ( -2.530 -10.943 -10.867) 15.628 10.804 ( 9.099 4.098 2.044) 10.186 11.238 ( 11.333 17.497 -18.774) 28.054 11.882 ( -1.116 1.039 -7.813) 7.961 12.622 ( 11.762 1.607 -12.373) 17.147 14.261 ( 3.796 -7.698 5.908) 10.420 14.843 ( -6.875 -7.145 -5.404) 11.292 15.115 ( -5.376 2.427 -3.970) 7.110 15.601 ( 4.046 -6.766 -7.676) 11.004 17.099 ( -35.227 -8.709 21.406) 42.131 18.870 ( 17.961 -9.645 0.727) 20.400 19.822 ( -7.049 -3.537 -0.600) 7.909 20.001 ( -5.284 1.787 -1.187) 5.703 20.997 ( -29.291 3.807 4.208) 29.836 22.825 ( 36.338 -17.071 -9.736) 41.312 24.025 ( -7.211 4.589 -5.421) 10.122 24.117 ( 9.409 12.755 -1.801) 15.952 ======================= Grid point 291 (143/260) ======================= q-point: ( 0.20 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.872 ( 12.662 4.828 15.948) 20.928 2.261 ( 14.474 9.111 10.789) 20.222 3.089 ( 2.115 -2.674 -7.722) 8.441 3.339 ( -0.777 6.728 -7.783) 10.317 3.538 ( -1.560 -0.664 -1.254) 2.109 3.562 ( 5.989 -6.686 -1.708) 9.138 4.105 ( 5.465 3.758 23.338) 24.262 4.402 ( -13.809 2.004 1.938) 14.088 4.588 ( 10.921 -1.369 15.276) 18.828 4.756 ( -1.097 3.320 -0.600) 3.548 5.645 ( -0.406 -2.833 5.130) 5.875 5.875 ( 0.336 5.580 1.547) 5.800 6.222 ( 6.790 -1.539 2.957) 7.564 7.231 ( -0.793 8.749 14.163) 16.666 7.455 ( 3.589 11.262 -2.523) 12.086 7.914 ( -4.495 7.636 3.953) 9.702 8.102 ( -3.903 14.773 3.273) 15.627 9.493 ( 8.442 -8.355 16.804) 20.579 9.792 ( 3.920 2.575 7.610) 8.939 10.457 ( 1.137 -6.371 -14.234) 15.636 10.977 ( 7.443 13.676 -1.901) 15.686 11.476 ( 11.684 7.981 -16.495) 21.732 11.797 ( -2.599 1.618 -6.701) 7.367 12.873 ( 15.994 1.805 -14.014) 21.342 14.247 ( -8.770 -8.781 12.907) 17.905 14.669 ( -8.352 -8.487 -8.564) 14.667 14.991 ( -4.857 4.316 -4.451) 7.876 15.654 ( 2.456 -6.137 -3.412) 7.439 16.755 ( -4.043 -2.053 15.765) 16.404 19.243 ( 16.668 -15.155 5.047) 23.086 19.614 ( -13.443 -3.259 -1.830) 13.952 19.846 ( -8.633 0.471 -0.382) 8.654 20.431 ( -26.944 10.142 3.168) 28.963 23.385 ( 23.186 -17.002 -13.887) 31.929 23.842 ( -9.467 3.560 -5.334) 11.434 24.282 ( 7.323 9.146 -2.622) 12.006 ======================= Grid point 292 (144/260) ======================= q-point: ( 0.30 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.195 ( 16.106 -1.016 12.317) 20.301 2.558 ( 13.072 7.217 9.311) 17.597 3.050 ( -3.911 -1.515 -7.667) 8.740 3.228 ( -7.059 3.969 -7.837) 11.269 3.459 ( -4.418 0.361 -4.917) 6.621 3.754 ( 11.540 -7.183 -9.581) 16.630 4.101 ( -15.301 -2.207 4.088) 15.991 4.248 ( 0.770 4.241 15.249) 15.846 4.724 ( 4.761 -1.251 7.263) 8.774 4.916 ( 12.046 5.378 10.682) 16.975 5.638 ( -1.533 -1.398 4.501) 4.956 5.875 ( -0.929 5.415 0.548) 5.522 6.337 ( 4.787 -0.406 5.106) 7.011 7.260 ( 0.288 7.941 18.320) 19.969 7.499 ( 1.105 7.436 -4.441) 8.732 7.830 ( -4.083 9.560 3.686) 11.030 8.099 ( 1.129 16.472 10.942) 19.808 9.594 ( -2.774 -9.671 26.587) 28.427 9.914 ( 8.219 -3.312 -3.286) 9.451 10.533 ( 8.889 1.738 -14.053) 16.719 11.103 ( 5.457 13.779 -1.360) 14.883 11.404 ( -10.956 2.439 -12.294) 16.647 11.916 ( 11.017 6.536 -6.115) 14.194 13.168 ( 16.645 1.221 -17.677) 24.311 14.021 ( -14.762 -5.979 19.012) 24.801 14.467 ( -10.154 -8.308 -12.064) 17.823 14.930 ( -1.189 2.869 0.827) 3.214 15.679 ( 0.470 -5.837 -1.925) 6.165 16.929 ( 16.981 -0.806 4.445) 17.572 19.261 ( -17.330 -0.489 -2.866) 17.572 19.380 ( -9.452 -14.703 -2.378) 17.640 19.764 ( -5.498 0.974 -1.412) 5.759 20.086 ( -0.590 9.465 15.394) 18.080 23.554 ( -7.335 -0.774 -18.550) 19.963 23.787 ( 10.402 -11.243 -2.682) 15.550 24.386 ( 3.736 5.310 -3.048) 7.172 ======================= Grid point 293 (145/260) ======================= q-point: ( 0.40 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.542 ( 16.170 -4.416 7.541) 18.380 2.773 ( 1.047 0.035 8.187) 8.254 2.943 ( -0.851 3.794 -3.382) 5.154 3.078 ( -4.266 4.144 -11.352) 12.816 3.324 ( -8.979 1.512 -3.047) 9.602 3.825 ( -10.676 -4.250 4.374) 12.295 3.953 ( 8.178 -6.417 -7.798) 12.995 4.179 ( -7.897 0.218 -1.842) 8.112 4.902 ( 9.246 1.394 12.197) 15.368 5.152 ( 8.650 5.829 10.887) 15.078 5.605 ( -2.638 0.257 3.922) 4.734 5.827 ( -3.917 4.967 0.053) 6.326 6.467 ( 7.080 1.703 9.357) 11.857 7.327 ( 2.105 4.000 17.457) 18.033 7.479 ( -1.424 6.225 -4.729) 7.946 7.779 ( -2.370 9.838 6.861) 12.226 8.171 ( 2.785 18.120 15.065) 23.728 9.567 ( -4.339 -13.747 21.259) 25.686 10.065 ( 6.746 -1.683 -1.636) 7.143 10.690 ( 8.650 6.531 -13.125) 17.022 11.013 ( -15.253 -0.569 -5.187) 16.121 11.312 ( 6.036 15.102 -2.637) 16.476 12.044 ( 1.936 6.813 -3.263) 7.798 13.400 ( 9.133 -1.080 -23.048) 24.815 13.826 ( -8.050 -3.636 15.185) 17.568 14.255 ( -6.549 -7.342 -7.599) 12.431 14.931 ( 0.330 1.253 5.587) 5.736 15.660 ( -1.882 -5.657 -2.473) 6.454 17.372 ( 26.034 0.143 -1.629) 26.085 18.880 ( -18.968 -0.106 -6.395) 20.018 19.146 ( -10.481 -2.730 -2.695) 11.161 19.508 ( -13.532 5.096 -1.997) 14.596 20.404 ( 19.293 -3.343 22.407) 29.757 23.297 ( -12.842 -1.427 -18.343) 22.437 23.978 ( 8.471 -9.172 -5.226) 13.535 24.414 ( -0.125 2.420 -3.444) 4.211 ======================= Grid point 294 (146/260) ======================= q-point: (-0.50 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.572 ( -15.140 0.336 1.605) 15.229 2.832 ( 6.691 -6.412 0.393) 9.276 2.944 ( 1.511 1.144 -6.690) 6.953 3.045 ( -10.647 -2.321 8.504) 13.823 3.192 ( 7.020 9.452 -3.329) 12.235 3.691 ( -3.588 -5.145 3.000) 6.954 3.926 ( -11.304 3.396 -3.509) 12.314 4.105 ( 3.504 -7.487 -8.173) 11.625 5.087 ( 6.027 2.422 10.811) 12.612 5.288 ( 2.489 5.599 10.261) 11.951 5.556 ( -3.094 0.882 4.158) 5.257 5.747 ( -3.356 5.557 0.915) 6.556 6.653 ( 8.932 3.462 11.779) 15.182 7.365 ( -1.802 1.724 1.027) 2.697 7.487 ( 3.320 3.986 7.400) 9.037 7.768 ( -0.380 8.109 9.262) 12.316 8.260 ( 2.318 18.714 15.977) 24.715 9.524 ( -4.654 -16.024 16.606) 23.541 10.145 ( 1.084 -0.799 -3.758) 3.992 10.637 ( -15.879 2.586 1.458) 16.154 10.836 ( 4.730 8.255 -14.865) 17.649 11.444 ( 5.585 14.098 3.805) 15.634 11.978 ( -7.355 6.205 -1.472) 9.735 13.354 ( -7.379 -3.663 -25.601) 26.894 13.752 ( -2.949 -3.467 10.218) 11.186 14.276 ( 9.750 -5.771 -4.307) 12.121 14.969 ( 2.005 0.752 8.138) 8.416 15.598 ( -3.371 -5.303 -3.826) 7.357 17.907 ( 27.569 1.703 -2.390) 27.725 18.497 ( -17.115 0.595 -12.317) 21.095 19.008 ( -3.557 4.666 1.982) 6.193 19.315 ( -4.138 -0.146 -0.943) 4.247 20.842 ( 18.945 -4.375 24.830) 31.537 22.965 ( -16.216 -5.329 -23.560) 29.093 24.100 ( 5.121 -4.861 -3.193) 7.749 24.366 ( -3.857 1.238 -4.242) 5.865 ======================= Grid point 295 (147/260) ======================= q-point: (-0.40 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.248 ( -17.395 2.768 2.701) 17.820 2.633 ( -19.743 -2.256 9.947) 22.222 2.911 ( 0.766 -0.989 -7.590) 7.693 3.111 ( 6.067 -2.729 2.594) 7.141 3.354 ( 8.605 5.306 -4.919) 11.243 3.545 ( -15.153 0.625 0.202) 15.167 3.822 ( 4.533 -0.137 2.830) 5.346 4.103 ( -3.001 -2.194 -3.349) 5.004 5.177 ( 0.783 0.317 10.311) 10.346 5.309 ( -1.764 3.557 8.515) 9.395 5.511 ( -2.352 1.512 5.455) 6.130 5.710 ( -1.058 7.051 1.459) 7.277 6.854 ( 8.090 4.697 12.426) 15.554 7.313 ( -2.009 3.017 -6.254) 7.228 7.569 ( 1.338 -2.009 6.880) 7.291 7.813 ( 2.841 6.227 10.015) 12.130 8.327 ( 1.094 17.791 14.301) 22.853 9.429 ( -8.745 -14.735 10.860) 20.286 10.056 ( -8.491 -2.234 -9.482) 12.922 10.376 ( -11.046 5.360 14.731) 19.176 10.890 ( 3.222 8.281 -12.284) 15.161 11.520 ( 0.700 16.022 5.879) 17.080 11.790 ( -10.004 5.189 -1.709) 11.399 13.083 ( -12.443 -3.155 -24.513) 27.670 13.754 ( 0.603 -5.006 10.574) 11.715 14.528 ( 15.077 -5.158 -6.702) 17.287 15.041 ( 3.036 0.269 9.170) 9.664 15.519 ( -3.349 -4.756 -5.840) 8.242 18.165 ( -11.799 0.833 -15.213) 19.271 18.427 ( 23.681 4.073 0.558) 24.035 19.004 ( 3.288 -2.804 3.382) 5.487 19.377 ( 9.884 3.545 0.739) 10.527 21.249 ( 16.129 -3.134 26.179) 30.908 22.536 ( -21.540 -9.324 -29.687) 37.845 24.167 ( 1.466 -1.672 -0.920) 2.406 24.253 ( -5.461 2.311 -5.231) 7.908 ======================= Grid point 296 (148/260) ======================= q-point: (-0.30 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.925 ( -15.612 4.787 7.684) 18.047 2.253 ( -20.481 1.214 14.855) 25.330 2.966 ( 5.460 -1.448 -2.000) 5.993 3.158 ( -2.528 1.189 -2.287) 3.610 3.211 ( -14.636 6.699 -0.375) 16.101 3.521 ( 8.347 0.620 -2.254) 8.669 3.946 ( 0.304 -0.809 10.377) 10.413 4.000 ( -1.849 2.182 -3.272) 4.346 5.182 ( -2.072 -4.514 10.661) 11.761 5.266 ( -4.635 2.227 6.204) 8.058 5.490 ( -1.043 2.425 6.249) 6.783 5.699 ( -0.436 7.987 2.349) 8.337 7.001 ( 2.909 3.793 10.681) 11.702 7.268 ( -0.877 2.827 -7.139) 7.728 7.509 ( -8.612 -4.697 -1.875) 9.987 7.926 ( 6.287 4.671 9.184) 12.070 8.383 ( 1.972 17.592 12.865) 21.884 9.234 ( -11.918 -8.978 8.455) 17.150 9.812 ( -13.611 -1.090 -10.048) 16.953 10.241 ( -7.199 2.730 22.426) 23.711 10.907 ( 0.837 6.142 -8.650) 10.642 11.483 ( -5.562 14.547 0.986) 15.605 11.641 ( -3.193 7.944 0.129) 8.563 12.797 ( -10.531 -1.602 -22.276) 24.692 13.813 ( 2.726 -5.671 11.012) 12.683 14.803 ( 13.510 -4.473 -6.385) 15.598 15.117 ( 2.323 -0.896 9.334) 9.660 15.446 ( -2.078 -4.132 -9.849) 10.881 17.964 ( -4.660 -1.687 -13.524) 14.404 18.865 ( 20.818 1.537 5.603) 21.613 19.175 ( 12.442 -8.273 0.833) 14.964 19.655 ( 16.546 7.239 2.415) 18.221 21.578 ( 10.083 -2.083 24.430) 26.511 21.975 ( -27.367 -10.761 -32.021) 43.475 24.067 ( -7.927 3.031 -4.897) 9.799 24.228 ( 1.050 2.504 -0.833) 2.840 ======================= Grid point 297 (149/260) ======================= q-point: (-0.20 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.695 ( -10.075 6.571 16.628) 20.522 1.924 ( -15.625 7.889 18.156) 25.220 2.866 ( -15.358 9.149 6.253) 18.939 3.089 ( 5.159 -0.664 -0.106) 5.202 3.200 ( 5.606 2.925 -5.527) 8.398 3.620 ( -1.112 0.987 10.323) 10.429 3.857 ( -1.484 4.018 -2.539) 4.979 4.063 ( 1.416 -1.341 4.951) 5.322 5.117 ( -8.200 -2.770 5.839) 10.441 5.178 ( -4.250 -1.373 9.940) 10.898 5.501 ( 0.885 1.894 5.846) 6.209 5.710 ( 0.994 7.114 3.157) 7.846 6.882 ( -19.589 -7.608 2.084) 21.118 7.264 ( 0.447 5.943 8.030) 10.000 7.318 ( -4.186 5.656 -14.415) 16.041 8.081 ( 6.268 3.266 9.138) 11.553 8.458 ( 2.367 17.383 9.525) 19.962 9.067 ( -5.503 -5.276 10.710) 13.146 9.483 ( -16.289 2.904 -7.969) 18.365 10.196 ( -2.138 -1.678 20.395) 20.575 10.887 ( -1.120 4.176 -5.642) 7.108 11.356 ( -5.866 9.793 -3.220) 11.861 11.646 ( 2.956 10.754 -1.474) 11.250 12.582 ( -6.272 0.557 -19.317) 20.318 13.905 ( 3.872 -5.579 11.180) 13.081 14.999 ( 6.133 -3.091 -1.586) 7.048 15.174 ( 1.706 -1.941 7.927) 8.337 15.405 ( 1.451 -4.379 -16.894) 17.512 17.926 ( 3.129 -8.212 -8.418) 12.169 19.326 ( 24.086 -4.777 6.439) 25.386 19.401 ( 7.618 -8.866 -4.139) 12.401 19.993 ( 14.755 4.997 2.757) 15.820 21.265 ( -28.010 -7.285 -25.045) 38.274 21.822 ( 3.185 0.561 21.302) 21.546 23.911 ( -5.763 7.168 -4.965) 10.452 24.236 ( -0.221 3.801 -0.697) 3.871 ======================= Grid point 298 (150/260) ======================= q-point: (-0.10 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.587 ( -5.283 10.521 20.382) 23.538 1.739 ( -7.840 13.675 21.674) 26.799 2.678 ( -3.784 6.988 9.663) 12.512 3.145 ( 3.002 3.568 -7.407) 8.753 3.383 ( 10.582 0.172 2.555) 10.887 3.549 ( -6.596 4.843 19.856) 21.476 3.904 ( 5.149 -0.195 -5.629) 7.631 4.059 ( -2.524 0.144 6.681) 7.144 4.950 ( -8.095 -1.337 5.482) 9.867 5.103 ( -6.176 -0.917 8.454) 10.509 5.552 ( 2.723 0.049 5.470) 6.110 5.751 ( 2.421 5.307 2.985) 6.553 6.386 ( -26.096 -5.357 6.222) 27.357 7.244 ( -1.308 7.729 -3.737) 8.684 7.317 ( 1.971 10.736 0.292) 10.919 8.149 ( -2.903 2.859 12.077) 12.745 8.518 ( 2.802 14.671 -0.683) 14.952 9.013 ( -6.121 -4.545 2.326) 7.971 9.281 ( 2.072 6.872 6.127) 9.437 10.252 ( 4.231 -4.177 13.017) 14.311 10.843 ( -2.302 0.896 -3.254) 4.085 11.241 ( -4.470 12.072 -8.554) 15.456 11.734 ( 6.282 6.415 -4.689) 10.129 12.472 ( -0.803 2.379 -15.618) 15.819 14.014 ( 4.792 -5.322 10.002) 12.302 15.027 ( -2.044 -3.439 0.618) 4.048 15.212 ( 0.008 0.197 5.022) 5.026 15.443 ( 6.210 -6.555 -19.575) 21.557 18.025 ( 6.244 -18.349 -0.582) 19.391 19.239 ( -28.083 -10.685 -15.926) 34.007 19.748 ( 14.826 -5.089 2.033) 15.806 20.059 ( -4.373 -1.282 -3.730) 5.889 21.177 ( 27.837 1.952 2.057) 27.981 21.814 ( -9.113 0.690 15.910) 18.348 23.850 ( 1.108 11.498 -2.990) 11.932 24.214 ( -1.834 4.629 -1.998) 5.365 ======================= Grid point 299 (151/260) ======================= q-point: ( 0.00 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.960 ( -1.416 17.541 15.420) 23.398 2.022 ( 3.485 16.918 19.348) 25.937 2.835 ( 2.844 5.068 5.492) 7.996 3.261 ( 3.897 -0.809 -2.232) 4.563 3.547 ( 1.782 0.582 1.117) 2.182 3.663 ( -3.174 12.844 15.682) 20.517 4.027 ( 4.400 -2.462 16.550) 17.301 4.050 ( 4.231 3.632 -5.418) 7.775 4.778 ( -6.114 -3.047 0.541) 6.853 5.014 ( -4.821 1.790 4.953) 7.140 5.536 ( 0.144 -5.624 4.431) 7.162 5.890 ( 2.382 2.516 -3.105) 4.653 6.068 ( -6.464 3.484 14.094) 15.892 7.465 ( 0.320 14.172 -9.059) 16.823 7.647 ( 2.295 13.884 10.406) 17.502 8.248 ( -3.206 12.996 10.644) 17.101 8.774 ( -11.726 14.735 -0.754) 18.846 8.918 ( 9.518 -2.659 3.174) 10.380 9.617 ( 10.392 6.693 8.133) 14.797 10.384 ( 2.873 0.270 3.310) 4.391 10.643 ( 0.971 -5.859 2.164) 6.321 11.373 ( 4.311 -0.895 -9.185) 10.185 12.095 ( 0.605 21.325 -11.680) 24.321 12.558 ( 4.245 5.296 -10.164) 12.222 13.978 ( 4.658 -9.082 7.219) 12.501 14.828 ( -6.721 -7.483 -1.959) 10.247 15.223 ( -0.510 1.179 -4.938) 5.103 15.301 ( 5.369 -14.441 -12.785) 20.021 17.311 ( -22.618 -25.401 19.270) 39.091 18.619 ( -7.958 -4.731 -19.028) 21.161 19.810 ( 0.974 -3.578 1.380) 3.957 20.068 ( 2.262 0.843 -4.961) 5.517 21.522 ( -17.909 1.066 8.366) 19.795 21.826 ( 31.006 -7.500 2.117) 31.970 24.172 ( 5.900 7.772 -2.403) 10.049 24.303 ( -2.264 8.712 -3.789) 9.766 ======================= Grid point 300 (152/260) ======================= q-point: ( 0.10 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.959 ( -0.214 16.103 15.447) 22.315 2.214 ( 10.154 13.931 15.285) 23.039 2.957 ( 7.038 0.090 1.062) 7.118 3.323 ( 3.418 -3.075 -3.714) 5.910 3.550 ( -1.035 0.901 -1.633) 2.133 3.617 ( -4.472 9.244 7.007) 12.432 4.061 ( 2.527 3.860 19.213) 19.760 4.285 ( 10.779 -2.183 8.320) 13.790 4.643 ( -7.129 -1.210 -3.586) 8.072 4.914 ( -5.605 4.048 2.996) 7.535 5.562 ( 1.464 -4.269 4.714) 6.526 5.940 ( 2.901 2.129 -3.731) 5.183 6.074 ( 3.197 2.530 11.864) 12.545 7.450 ( 0.259 12.762 -5.619) 13.946 7.704 ( 0.625 14.757 11.607) 18.786 8.234 ( -1.013 17.224 7.969) 19.005 8.561 ( -8.358 16.266 0.003) 18.287 9.136 ( 10.525 -2.927 7.170) 13.067 9.786 ( 3.222 3.551 7.811) 9.165 10.313 ( -3.205 -9.123 -8.491) 12.868 10.913 ( 19.516 6.147 8.731) 22.246 11.470 ( 7.441 1.141 -12.683) 14.749 12.033 ( -4.290 15.444 -12.110) 20.089 12.695 ( 11.703 5.815 -10.013) 16.464 14.059 ( 1.283 -10.576 7.052) 12.776 14.666 ( -8.888 -9.624 -4.947) 14.003 15.157 ( -3.456 0.728 -10.998) 11.551 15.394 ( 5.024 -12.328 -3.822) 13.851 16.876 ( -20.916 -11.603 21.114) 31.905 18.633 ( 9.827 -11.848 -7.389) 17.075 19.758 ( -5.989 -2.486 -1.424) 6.639 20.025 ( -5.885 0.613 -3.456) 6.852 21.092 ( -24.075 4.969 4.992) 25.084 22.471 ( 31.093 -15.748 -2.477) 34.941 24.143 ( -7.299 6.302 -3.755) 10.349 24.344 ( 5.878 8.230 -3.740) 10.783 ======================= Grid point 301 (153/260) ======================= q-point: ( 0.20 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.046 ( 5.732 11.331 13.931) 18.850 2.456 ( 10.504 8.866 13.644) 19.368 3.063 ( 3.081 -0.622 -3.464) 4.677 3.395 ( 4.730 -8.087 -5.464) 10.845 3.477 ( -6.160 6.925 -6.878) 11.542 3.551 ( -0.943 0.893 -0.367) 1.350 4.209 ( 3.186 2.421 16.951) 17.417 4.317 ( -7.447 -3.273 9.057) 12.174 4.613 ( 3.453 0.287 2.152) 4.079 4.864 ( 3.114 6.792 3.037) 8.066 5.608 ( 1.805 -1.256 4.959) 5.425 5.975 ( 1.268 3.619 -2.034) 4.340 6.200 ( 6.176 0.182 8.202) 10.268 7.455 ( 0.411 11.988 2.540) 12.262 7.710 ( -2.036 11.967 5.920) 13.505 8.213 ( -3.088 19.754 6.478) 21.017 8.477 ( -0.576 20.503 5.007) 21.113 9.341 ( 6.162 -6.332 14.158) 16.689 9.763 ( -2.848 -4.985 -1.518) 5.938 10.356 ( 8.554 -2.188 -5.872) 10.604 11.305 ( 15.810 15.485 7.506) 23.369 11.556 ( 0.972 -1.642 -12.568) 12.712 11.935 ( 1.252 12.553 -13.351) 18.368 12.947 ( 15.124 5.356 -9.829) 18.815 14.030 ( -6.715 -10.816 10.972) 16.807 14.463 ( -9.791 -11.298 -8.387) 17.142 15.057 ( -3.891 1.403 -8.167) 9.155 15.472 ( 3.260 -10.617 -1.415) 11.196 16.701 ( -0.010 -2.812 14.854) 15.117 18.874 ( 13.182 -18.264 -1.024) 22.548 19.571 ( -12.324 -1.387 -3.627) 12.922 19.850 ( -9.209 0.023 -1.606) 9.349 20.649 ( -21.183 10.105 5.295) 24.060 23.007 ( 23.873 -18.103 -6.251) 30.606 23.941 ( -11.614 5.325 -5.497) 13.909 24.435 ( 3.693 5.188 -3.452) 7.244 ======================= Grid point 302 (154/260) ======================= q-point: ( 0.30 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.239 ( 10.503 5.234 11.417) 16.372 2.672 ( 7.863 3.897 11.527) 14.487 3.060 ( -1.760 0.882 -5.672) 6.004 3.317 ( -7.186 5.301 -6.989) 11.339 3.432 ( -0.953 -3.289 -6.491) 7.339 3.607 ( 7.362 -6.065 -6.818) 11.725 3.982 ( -16.657 -8.444 0.562) 18.683 4.345 ( -3.880 3.817 5.506) 7.742 4.713 ( 8.951 0.798 12.541) 15.428 5.058 ( 11.709 7.494 8.198) 16.139 5.646 ( 0.748 1.771 4.759) 5.133 5.977 ( -0.980 3.993 -1.047) 4.243 6.346 ( 7.043 1.794 8.474) 11.163 7.462 ( -1.906 10.828 12.584) 16.710 7.671 ( -1.517 8.689 -2.805) 9.256 8.148 ( -4.817 18.874 7.438) 20.851 8.536 ( 3.961 24.541 9.829) 26.731 9.351 ( -6.455 -13.324 9.910) 17.816 9.838 ( 9.870 -3.034 0.561) 10.340 10.558 ( 11.882 0.945 -4.231) 12.648 11.355 ( -13.448 2.961 -6.854) 15.382 11.575 ( 8.525 18.983 -0.570) 20.817 12.072 ( 10.893 7.879 -8.986) 16.170 13.218 ( 13.773 3.514 -10.451) 17.643 13.870 ( -10.661 -7.640 13.982) 19.171 14.241 ( -10.487 -13.042 -11.095) 20.079 14.983 ( -2.182 1.742 -2.221) 3.567 15.511 ( 0.855 -9.703 -1.098) 9.802 16.917 ( 18.195 -0.046 5.283) 18.947 19.054 ( 3.834 -15.362 -2.541) 16.036 19.258 ( -17.783 -0.457 -3.962) 18.225 19.751 ( -0.717 -1.399 0.739) 1.737 20.307 ( -13.185 10.903 10.317) 19.979 23.370 ( 12.739 -15.335 -14.218) 24.487 23.691 ( -9.935 1.205 -1.579) 10.132 24.472 ( 0.929 2.860 -3.658) 4.736 ======================= Grid point 303 (155/260) ======================= q-point: ( 0.40 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.493 ( 12.428 -0.291 8.033) 14.801 2.760 ( -2.759 0.311 5.047) 5.760 3.002 ( -2.508 0.444 -4.178) 4.893 3.184 ( -4.832 4.644 -5.814) 8.872 3.362 ( -3.146 3.187 -8.719) 9.802 3.682 ( -12.233 -9.946 5.556) 16.717 3.757 ( 8.511 -10.335 -8.756) 15.997 4.193 ( -9.618 -0.151 -4.794) 10.748 4.966 ( 11.309 4.632 14.445) 18.921 5.287 ( 8.388 6.389 9.737) 14.352 5.656 ( -0.759 4.461 4.403) 6.313 5.927 ( -3.706 4.224 -0.036) 5.619 6.529 ( 9.511 4.583 10.008) 14.547 7.439 ( -3.086 6.557 14.466) 16.179 7.643 ( -0.911 8.921 -3.634) 9.676 8.068 ( -4.842 16.231 9.254) 19.301 8.643 ( 3.757 25.283 10.861) 27.773 9.245 ( -4.678 -15.539 5.139) 17.022 10.036 ( 7.750 -0.890 2.840) 8.302 10.782 ( 11.144 2.188 -3.926) 12.017 11.031 ( -16.369 2.074 -4.285) 17.047 11.725 ( 7.038 23.162 -0.813) 24.221 12.197 ( 1.861 6.910 -4.334) 8.366 13.382 ( 2.651 -0.343 -9.739) 10.099 13.736 ( -4.324 -4.443 5.477) 8.273 14.036 ( -5.605 -13.559 -6.140) 15.905 14.963 ( 0.099 1.686 2.341) 2.887 15.500 ( -1.481 -9.092 -1.664) 9.360 17.389 ( 27.656 1.702 -0.765) 27.719 18.870 ( -18.394 -1.127 -7.881) 20.043 19.084 ( 1.307 -2.899 -1.603) 3.562 19.620 ( -14.519 4.745 -2.138) 15.424 20.332 ( 11.987 -2.716 21.064) 24.388 23.234 ( -15.692 -5.060 -21.851) 27.374 23.767 ( 11.051 -9.760 2.251) 14.915 24.456 ( -1.588 1.508 -4.302) 4.827 ======================= Grid point 304 (156/260) ======================= q-point: (-0.50 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.603 ( -11.703 2.271 1.042) 11.967 2.725 ( 6.344 -3.266 2.274) 7.489 2.932 ( -4.419 -3.595 5.135) 7.669 3.006 ( -8.253 -0.038 -11.017) 13.766 3.377 ( 4.952 7.405 -6.794) 11.203 3.554 ( -2.434 -7.075 7.969) 10.931 3.897 ( 6.913 -11.874 -7.908) 15.853 3.984 ( -9.399 1.617 -5.018) 10.777 5.179 ( 6.475 5.884 11.499) 14.449 5.400 ( 0.185 4.607 9.720) 10.758 5.637 ( -1.905 6.579 4.690) 8.301 5.861 ( -2.121 5.112 0.903) 5.608 6.757 ( 10.706 6.504 11.189) 16.796 7.409 ( -2.929 2.664 9.735) 10.510 7.611 ( -1.782 7.128 -1.161) 7.438 8.013 ( -2.756 13.783 11.526) 18.177 8.713 ( 1.050 21.612 7.888) 23.031 9.195 ( -2.060 -12.565 5.645) 13.928 10.106 ( -1.469 -2.359 -1.436) 3.128 10.730 ( -13.266 5.831 4.813) 15.269 10.958 ( 7.133 3.890 -5.568) 9.850 11.860 ( 6.560 23.972 1.350) 24.890 12.122 ( -7.976 6.624 -2.109) 10.580 13.267 ( -9.738 -3.993 -12.302) 16.190 13.655 ( -4.523 -5.623 1.325) 7.337 14.099 ( 11.132 -11.269 -2.378) 16.018 14.993 ( 2.024 1.483 4.068) 4.780 15.452 ( -2.712 -8.177 -2.452) 8.957 17.962 ( 29.597 3.623 -2.854) 29.955 18.510 ( -15.055 0.504 -11.204) 18.773 19.132 ( -1.695 6.697 0.311) 6.915 19.318 ( -7.761 0.662 0.016) 7.789 20.715 ( 19.109 -7.541 24.693) 32.121 22.815 ( -20.929 -8.670 -24.592) 33.436 23.978 ( 9.308 -6.326 1.157) 11.313 24.392 ( -3.719 1.096 -5.525) 6.750 ======================= Grid point 305 (157/260) ======================= q-point: (-0.40 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.332 ( -14.982 4.889 0.829) 15.781 2.585 ( -15.711 -1.490 8.898) 18.117 2.873 ( 0.913 -2.578 -6.265) 6.836 3.063 ( 7.894 -1.841 1.069) 8.176 3.408 ( -0.034 -1.799 -7.648) 7.857 3.582 ( -0.109 4.074 5.371) 6.742 3.834 ( -1.645 1.064 -3.284) 3.824 4.004 ( 4.282 -7.512 -3.016) 9.158 5.226 ( -5.034 4.271 9.843) 11.852 5.377 ( -2.230 3.326 7.870) 8.830 5.612 ( -2.024 7.001 6.510) 9.772 5.851 ( 0.385 6.275 0.620) 6.318 6.980 ( 8.256 6.835 11.717) 15.880 7.356 ( -4.183 0.431 6.390) 7.649 7.561 ( -3.054 2.362 -3.170) 4.995 8.021 ( 1.065 12.214 13.145) 17.975 8.732 ( 0.203 17.401 3.883) 17.830 9.160 ( -3.701 -7.662 7.030) 11.038 9.986 ( -8.780 -3.751 -3.988) 10.347 10.526 ( -10.369 8.865 14.182) 19.678 11.027 ( 1.317 4.882 -7.462) 9.014 11.891 ( -10.347 7.711 -7.363) 14.857 12.001 ( 3.257 24.004 8.451) 25.656 13.012 ( -11.568 -2.932 -16.207) 20.127 13.609 ( -0.791 -8.615 6.095) 10.583 14.362 ( 15.100 -10.901 -4.589) 19.181 15.048 ( 2.113 0.126 4.145) 4.655 15.392 ( -2.393 -6.691 -3.737) 8.029 18.193 ( -11.138 1.889 -13.255) 17.416 18.544 ( 24.949 6.775 -2.725) 25.996 18.929 ( -8.677 -4.114 2.367) 9.890 19.471 ( 14.518 5.179 2.236) 15.576 21.152 ( 18.526 -6.203 26.472) 32.901 22.301 ( -25.091 -12.120 -27.979) 39.488 24.128 ( 4.941 -1.928 1.004) 5.398 24.297 ( -3.585 1.548 -6.819) 7.858 ======================= Grid point 306 (158/260) ======================= q-point: (-0.30 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.054 ( -12.715 7.227 6.660) 16.071 2.310 ( -13.929 4.758 13.696) 20.106 2.926 ( 5.087 -2.203 -1.393) 5.716 3.190 ( 4.437 1.968 -2.401) 5.415 3.330 ( -7.634 2.138 0.680) 7.956 3.556 ( 1.063 3.773 -5.676) 6.898 3.903 ( 4.718 -2.527 7.588) 9.285 4.050 ( 0.967 0.798 -2.982) 3.234 5.102 ( -7.282 -1.782 8.103) 11.039 5.329 ( -5.349 3.418 6.687) 9.220 5.580 ( -2.829 5.056 7.677) 9.618 5.861 ( 0.375 7.155 -0.353) 7.173 7.028 ( -9.710 -3.745 7.984) 13.117 7.327 ( 1.911 4.918 12.759) 13.807 7.490 ( -1.374 3.666 -11.819) 12.450 8.114 ( 5.031 11.766 12.830) 18.121 8.772 ( 3.538 16.901 3.787) 17.678 9.057 ( -8.339 -5.364 6.885) 12.071 9.781 ( -10.946 -1.750 -2.698) 11.409 10.363 ( -9.567 8.938 18.932) 23.019 10.990 ( -2.903 2.562 -7.669) 8.591 11.647 ( -11.233 3.484 -6.213) 13.301 12.079 ( 2.154 28.473 4.247) 28.869 12.772 ( -8.442 -0.120 -16.170) 18.241 13.645 ( 2.619 -10.213 8.148) 13.325 14.651 ( 14.838 -10.534 -5.968) 19.150 15.079 ( -0.126 -3.173 3.905) 5.034 15.347 ( -0.983 -4.382 -6.320) 7.753 17.940 ( -11.218 -0.097 -9.397) 14.634 18.810 ( 5.850 -8.537 1.463) 10.452 19.089 ( 20.523 1.869 -2.349) 20.741 19.791 ( 15.948 5.348 2.475) 17.002 21.524 ( 8.699 -2.939 20.913) 22.840 21.726 ( -22.113 -11.708 -22.773) 33.833 24.118 ( -4.005 1.945 -5.297) 6.919 24.291 ( 3.091 2.807 -1.919) 4.595 ======================= Grid point 307 (159/260) ======================= q-point: (-0.20 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.900 ( -5.070 12.445 15.513) 20.524 2.109 ( -9.534 9.697 16.687) 21.526 3.045 ( 4.562 -1.815 2.622) 5.566 3.088 ( -10.440 9.429 3.416) 14.477 3.322 ( 6.977 8.348 -7.163) 13.026 3.597 ( 2.447 -3.507 2.277) 4.845 3.960 ( -2.866 2.336 15.369) 15.807 4.054 ( 1.886 3.328 -7.534) 8.450 5.010 ( -3.895 -5.573 4.331) 8.062 5.195 ( -8.917 1.805 7.911) 12.056 5.543 ( -2.233 1.370 7.054) 7.525 5.864 ( 0.222 6.959 -1.389) 7.100 6.694 ( -22.248 -9.180 7.853) 25.317 7.427 ( 2.262 9.620 13.977) 17.118 7.483 ( 4.438 9.080 -15.029) 18.111 8.252 ( 5.071 11.709 11.325) 17.061 8.816 ( -5.929 12.678 7.502) 15.879 8.954 ( 2.843 -1.739 5.099) 6.091 9.545 ( -11.596 2.618 -2.158) 12.082 10.258 ( -4.851 7.623 19.221) 21.239 10.892 ( -5.274 -2.004 -6.349) 8.494 11.448 ( -7.010 0.207 -5.604) 8.977 12.102 ( 0.346 28.160 -3.598) 28.391 12.617 ( -3.903 3.389 -13.197) 14.173 13.739 ( 4.670 -10.030 8.957) 14.235 14.898 ( 10.124 -7.633 -4.231) 13.367 15.066 ( -0.779 -8.521 1.113) 8.628 15.320 ( -0.105 -2.588 -9.869) 10.203 17.728 ( -8.691 -9.545 -0.690) 12.927 18.992 ( 10.082 -17.886 -5.136) 21.164 19.448 ( 15.546 4.878 -2.930) 16.555 20.036 ( 5.739 -0.881 -2.299) 6.245 21.166 ( -14.553 -1.514 -14.661) 20.713 21.814 ( 4.839 -1.176 21.026) 21.608 24.042 ( -1.274 4.827 -6.558) 8.242 24.339 ( 1.615 5.284 -1.039) 5.622 ======================= Grid point 308 (160/260) ======================= q-point: (-0.10 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.902 ( 0.480 18.556 17.968) 25.834 2.015 ( -4.310 11.849 19.671) 23.365 2.873 ( -8.066 10.858 5.326) 14.537 3.172 ( 5.275 -1.635 0.673) 5.563 3.464 ( 7.172 7.149 -4.649) 11.143 3.652 ( 1.046 3.406 13.708) 14.164 3.919 ( -1.349 2.750 10.174) 10.625 4.066 ( -0.105 1.358 -3.195) 3.473 4.910 ( -7.369 -2.563 2.500) 8.192 5.079 ( -4.036 -1.174 7.685) 8.759 5.530 ( -0.608 -2.950 5.334) 6.125 5.867 ( 0.684 5.140 -2.419) 5.722 6.291 ( -18.639 -2.939 11.929) 22.324 7.464 ( 1.474 12.821 -5.348) 13.970 7.569 ( 3.990 12.281 3.933) 13.499 8.304 ( -3.118 11.453 11.572) 16.577 8.756 ( 2.636 3.066 3.397) 5.280 8.995 ( -6.089 6.503 4.305) 9.895 9.426 ( 3.629 6.791 2.257) 8.024 10.270 ( 2.241 5.983 15.530) 16.793 10.756 ( -7.048 -6.998 -4.838) 11.048 11.355 ( -1.069 -1.872 -6.104) 6.473 12.096 ( 1.049 25.497 -10.169) 27.470 12.550 ( -0.444 5.399 -10.467) 11.786 13.859 ( 5.294 -9.125 8.510) 13.554 14.939 ( -4.029 -4.884 1.245) 6.452 15.144 ( 7.294 -10.985 -3.855) 13.738 15.294 ( 0.282 -3.690 -14.507) 14.972 17.577 ( -9.180 -21.970 9.885) 25.781 18.960 ( -13.449 -14.239 -21.470) 29.062 19.698 ( 9.991 -0.245 0.582) 10.011 20.025 ( 0.299 -1.892 -5.589) 5.908 21.229 ( 19.966 2.823 3.177) 20.413 21.820 ( -8.546 -0.127 14.136) 16.519 24.061 ( 4.515 7.729 -4.616) 10.071 24.345 ( -0.763 7.124 -1.879) 7.407 ======================= Grid point 309 (161/260) ======================= q-point: ( 0.00 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.245 ( -0.351 10.247 15.466) 18.556 2.402 ( 2.783 18.362 16.008) 24.519 2.958 ( -2.831 5.912 2.690) 7.086 3.193 ( 2.308 -4.042 1.961) 5.050 3.516 ( -0.282 -5.456 7.266) 9.091 3.949 ( 2.548 5.831 2.587) 6.869 4.024 ( 0.054 10.346 22.315) 24.597 4.149 ( 4.960 5.751 -7.943) 10.989 4.730 ( -6.274 -1.241 -1.936) 6.682 5.023 ( -1.825 -1.301 2.882) 3.651 5.384 ( 0.626 -8.460 3.997) 9.378 5.906 ( -0.228 -0.784 -1.406) 1.626 6.161 ( -3.595 4.794 12.249) 13.636 7.736 ( -0.831 9.837 -15.339) 18.241 7.924 ( 3.627 14.259 18.008) 23.254 8.530 ( -1.432 9.895 15.136) 18.140 8.828 ( 7.040 -0.965 2.403) 7.501 9.128 ( -3.268 15.717 3.118) 16.353 9.724 ( 9.469 3.346 2.599) 10.374 10.306 ( -12.615 -8.322 -6.935) 16.627 10.661 ( 12.220 7.455 14.577) 20.430 11.249 ( 3.537 -8.694 -0.971) 9.436 12.563 ( -5.371 20.359 -7.261) 22.272 12.710 ( 5.889 9.644 -10.084) 15.145 13.801 ( 5.076 -6.754 2.669) 8.860 14.623 ( -7.217 -14.112 -8.357) 17.919 14.982 ( 5.217 -13.137 -4.439) 14.815 15.241 ( -0.222 0.356 -10.031) 10.040 16.882 ( -16.454 -15.501 18.858) 29.439 18.504 ( -6.777 -5.461 -25.598) 27.037 19.752 ( 1.068 -1.992 1.491) 2.708 20.078 ( 2.763 0.231 -7.310) 7.818 21.547 ( -14.243 1.266 7.628) 16.206 21.704 ( 19.966 -4.404 4.633) 20.965 24.296 ( 5.010 4.569 -1.045) 6.861 24.446 ( -1.933 4.667 -3.002) 5.876 ======================= Grid point 310 (162/260) ======================= q-point: ( 0.10 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.269 ( -0.296 12.773 12.559) 17.916 2.501 ( 3.991 13.596 15.886) 21.287 2.977 ( 3.290 1.615 2.167) 4.258 3.216 ( 0.229 -5.500 -0.024) 5.505 3.514 ( -1.478 -5.528 6.037) 8.318 3.855 ( -7.626 10.367 -4.890) 13.767 4.129 ( 4.004 3.254 18.134) 18.853 4.302 ( 6.908 5.697 4.660) 10.094 4.621 ( -3.498 -0.710 -3.067) 4.706 4.961 ( -3.903 -0.709 1.374) 4.198 5.459 ( 5.324 -5.174 3.716) 8.302 5.935 ( 3.246 -1.913 -1.763) 4.160 6.167 ( 1.161 5.261 11.548) 12.743 7.689 ( -0.097 9.116 -11.294) 14.514 8.000 ( -0.984 14.233 17.463) 22.550 8.574 ( 2.254 10.145 10.986) 15.122 8.869 ( -1.291 13.244 0.184) 13.308 9.178 ( 4.998 8.798 7.491) 12.590 9.788 ( -6.519 -3.460 0.433) 7.393 10.170 ( 4.084 -4.749 -5.394) 8.266 11.045 ( 22.670 6.057 12.783) 26.721 11.365 ( 7.500 -8.219 -3.436) 11.645 12.411 ( -7.440 18.241 -8.354) 21.398 12.859 ( 10.561 9.118 -8.737) 16.463 13.870 ( 0.988 -6.658 2.810) 7.294 14.434 ( -9.572 -13.322 -10.346) 19.394 15.037 ( 1.185 -11.721 -6.381) 13.398 15.238 ( 2.108 -1.372 -6.396) 6.873 16.657 ( -9.266 -8.764 19.363) 23.186 18.417 ( 3.276 -8.367 -15.889) 18.253 19.719 ( -4.910 -1.322 -1.089) 5.200 20.030 ( -6.080 -0.058 -6.066) 8.589 21.189 ( -19.556 4.038 5.421) 20.691 22.196 ( 25.255 -10.442 2.021) 27.403 24.269 ( -7.579 5.502 -2.853) 9.790 24.454 ( 3.250 2.655 -2.339) 4.804 ======================= Grid point 311 (163/260) ======================= q-point: ( 0.20 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.307 ( 1.803 12.755 11.216) 17.081 2.629 ( 5.152 8.128 14.122) 17.089 3.050 ( 2.481 -0.506 0.604) 2.603 3.224 ( 1.478 -7.769 -2.939) 8.437 3.486 ( -2.354 -6.977 4.464) 8.611 3.685 ( -7.691 10.854 -7.029) 15.046 4.107 ( -9.194 -4.915 -6.046) 12.052 4.454 ( 4.960 9.324 14.615) 18.031 4.568 ( -0.870 -3.281 2.690) 4.331 4.978 ( 6.648 2.799 5.207) 8.896 5.584 ( 5.973 -0.886 3.677) 7.070 5.999 ( 2.893 -1.142 -2.090) 3.747 6.256 ( 5.360 4.735 11.126) 13.227 7.689 ( 1.499 9.630 -4.420) 10.701 7.949 ( -6.770 11.217 11.761) 17.606 8.606 ( -2.883 14.434 7.439) 16.492 8.895 ( 4.556 17.062 4.984) 18.350 9.243 ( -2.699 -0.841 6.402) 6.998 9.650 ( -0.745 -4.265 -0.880) 4.418 10.343 ( 11.357 -0.169 -1.922) 11.519 11.448 ( 1.912 -7.162 -5.698) 9.350 11.560 ( 22.798 8.378 10.412) 26.427 12.273 ( -2.955 18.916 -9.916) 21.561 13.068 ( 11.614 4.913 -5.200) 13.640 13.847 ( -4.157 -5.994 4.657) 8.654 14.204 ( -10.938 -13.442 -12.303) 21.253 15.016 ( -1.147 -5.619 -5.745) 8.117 15.283 ( 2.900 -5.797 -3.262) 7.256 16.650 ( 5.332 -1.981 14.381) 15.465 18.541 ( 10.886 -12.999 -8.194) 18.831 19.548 ( -11.798 -0.862 -3.129) 12.236 19.849 ( -9.267 -0.088 -3.286) 9.832 20.834 ( -17.508 7.501 5.884) 19.935 22.671 ( 22.280 -13.508 -1.144) 26.080 24.043 ( -13.664 4.202 -5.716) 15.396 24.502 ( 1.679 1.631 -1.957) 3.051 ======================= Grid point 312 (164/260) ======================= q-point: ( 0.30 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.395 ( 4.689 9.248 9.998) 14.404 2.753 ( 4.219 4.530 9.449) 11.296 3.050 ( -2.144 -1.240 -1.513) 2.902 3.257 ( 1.483 -8.225 -5.239) 9.864 3.450 ( -2.002 -10.419 3.306) 11.113 3.541 ( -4.471 10.768 -6.223) 13.217 3.832 ( -14.333 -4.230 -12.468) 19.462 4.342 ( -9.518 -4.505 -5.926) 12.083 4.787 ( 13.065 6.162 18.631) 23.575 5.186 ( 10.660 3.953 9.222) 14.639 5.697 ( 4.448 2.939 3.447) 6.348 6.023 ( -0.270 0.400 -0.310) 0.573 6.425 ( 9.194 5.454 10.070) 14.686 7.688 ( -3.895 10.504 10.555) 15.392 7.848 ( -2.767 7.969 -0.991) 8.494 8.499 ( -8.525 11.492 7.308) 16.067 8.988 ( -1.175 5.716 1.491) 6.023 9.158 ( -0.014 8.950 3.886) 9.757 9.797 ( 11.518 -1.416 5.776) 12.963 10.572 ( 11.883 0.282 -1.204) 11.948 11.329 ( -10.620 -3.684 -8.697) 14.212 11.975 ( 14.817 14.402 12.556) 24.179 12.276 ( 4.686 14.670 -11.230) 19.060 13.276 ( 9.676 0.333 -1.113) 9.746 13.736 ( -7.767 -5.044 6.570) 11.355 13.955 ( -10.969 -13.135 -14.114) 22.182 14.987 ( -0.494 -1.524 -2.833) 3.254 15.319 ( 1.163 -7.531 -2.269) 7.951 16.932 ( 20.264 1.393 6.529) 21.335 18.761 ( 11.572 -12.170 -5.043) 17.535 19.250 ( -16.718 -0.362 -4.015) 17.197 19.722 ( -2.416 -1.176 0.672) 2.770 20.516 ( -16.122 8.722 8.339) 20.137 23.054 ( 16.095 -13.636 -6.523) 22.080 23.728 ( -15.466 1.644 -5.246) 16.414 24.510 ( -0.289 1.002 -2.865) 3.049 ======================= Grid point 313 (165/260) ======================= q-point: ( 0.40 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.526 ( 5.944 3.225 7.546) 10.133 2.808 ( -0.668 4.288 2.147) 4.841 2.972 ( -5.283 -2.676 -0.829) 5.980 3.202 ( -6.386 -2.539 -9.020) 11.340 3.388 ( -4.609 -9.942 1.142) 11.018 3.527 ( 2.431 2.020 0.144) 3.164 3.589 ( -3.505 -2.850 -13.785) 14.506 4.142 ( -8.656 -4.832 -7.174) 12.237 5.078 ( 11.844 5.594 15.181) 20.051 5.392 ( 7.046 3.420 10.480) 13.084 5.770 ( 2.059 5.806 3.299) 6.988 5.991 ( -2.760 1.861 1.772) 3.771 6.656 ( 11.638 7.076 9.474) 16.592 7.591 ( -7.176 8.132 14.009) 17.717 7.822 ( -1.322 7.743 -1.862) 8.073 8.337 ( -8.988 5.359 9.528) 14.152 8.891 ( -3.681 -4.894 -8.127) 10.176 9.261 ( 4.890 22.557 8.881) 24.731 10.018 ( 7.486 -1.455 3.942) 8.585 10.803 ( 11.445 0.330 -1.619) 11.563 11.066 ( -12.675 0.519 -2.267) 12.886 12.212 ( 7.859 20.450 9.907) 24.044 12.325 ( 0.495 8.215 -9.429) 12.515 13.385 ( -2.762 0.275 3.312) 4.321 13.640 ( 1.114 -8.812 0.898) 8.928 13.724 ( -8.719 -11.937 -10.647) 18.217 14.988 ( 0.985 0.375 -0.696) 1.263 15.319 ( -0.523 -7.251 -1.983) 7.535 17.442 ( 29.421 3.214 0.153) 29.597 18.825 ( -12.744 -3.131 -8.527) 15.649 19.039 ( 6.400 -1.235 -0.780) 6.565 19.678 ( -7.460 0.736 -0.755) 7.534 20.318 ( -2.200 1.362 17.764) 17.952 23.085 ( -13.590 -8.500 -22.219) 27.397 23.613 ( 7.903 -4.813 6.040) 11.050 24.478 ( -2.084 0.670 -4.501) 5.005 ======================= Grid point 314 (166/260) ======================= q-point: (-0.50 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.600 ( -3.226 -2.246 1.731) 4.295 2.761 ( -2.700 5.990 0.231) 6.575 2.836 ( -7.296 -4.439 1.817) 8.731 3.024 ( -5.039 1.303 -10.858) 12.041 3.335 ( -0.967 -7.978 0.467) 8.050 3.583 ( 4.085 6.810 2.128) 8.221 3.635 ( 6.959 -12.521 -10.061) 17.506 3.981 ( -5.946 -1.915 -6.172) 8.781 5.301 ( 6.930 5.214 11.747) 14.601 5.476 ( -1.379 2.838 9.825) 10.319 5.791 ( -0.734 7.192 3.638) 8.093 5.950 ( -1.145 3.284 3.084) 4.649 6.911 ( 11.334 7.615 9.749) 16.778 7.486 ( -6.609 5.237 11.950) 14.626 7.753 ( -5.107 6.073 -2.039) 8.192 8.215 ( -5.496 1.404 13.898) 15.011 8.843 ( 0.618 -2.130 -9.750) 10.000 9.337 ( 0.619 21.001 6.961) 22.133 10.054 ( -3.938 -2.927 -1.389) 5.099 10.849 ( -7.633 4.832 5.967) 10.827 11.019 ( 7.744 2.239 0.550) 8.080 12.218 ( -9.043 2.975 -4.958) 10.734 12.380 ( 7.746 24.870 5.638) 26.652 13.212 ( -11.258 -1.269 -1.769) 11.466 13.534 ( -7.104 -5.637 -5.548) 10.631 13.814 ( 11.719 -15.912 0.664) 19.773 15.014 ( 1.301 -0.189 -0.115) 1.320 15.299 ( -0.833 -5.413 -2.217) 5.908 18.049 ( 30.912 4.449 -3.384) 31.413 18.513 ( -12.825 -0.372 -10.433) 16.537 19.257 ( 9.459 4.727 0.310) 10.579 19.354 ( -18.492 2.950 -0.482) 18.732 20.548 ( 17.014 -7.989 24.895) 31.194 22.631 ( -23.834 -8.391 -24.754) 35.372 23.861 ( 12.760 -4.562 4.656) 14.328 24.408 ( -3.695 0.452 -6.632) 7.606 ======================= Grid point 315 (167/260) ======================= q-point: (-0.40 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.410 ( -12.222 2.019 -0.558) 12.400 2.611 ( -9.758 3.820 6.691) 12.433 2.825 ( 2.231 -1.324 -4.439) 5.142 3.029 ( 5.847 -1.649 -0.422) 6.090 3.330 ( 0.174 -3.697 -1.251) 3.907 3.665 ( 2.784 0.818 2.393) 3.762 3.781 ( 8.873 -7.345 -10.508) 15.592 3.887 ( -1.429 -0.091 -2.495) 2.877 5.331 ( -8.326 5.099 8.986) 13.269 5.443 ( -1.207 2.691 8.414) 8.916 5.758 ( -3.600 6.313 4.905) 8.768 5.962 ( 1.091 4.172 2.243) 4.860 7.084 ( -0.044 1.625 9.989) 10.120 7.398 ( -2.315 6.136 12.328) 13.964 7.642 ( -3.981 4.385 -6.338) 8.674 8.195 ( 0.148 0.820 16.898) 16.919 8.857 ( 2.503 1.523 -8.255) 8.760 9.315 ( -3.828 16.689 3.590) 17.494 9.914 ( -8.672 -3.287 0.878) 9.315 10.724 ( -8.091 9.404 14.910) 19.396 11.106 ( 0.747 2.976 -4.107) 5.126 11.970 ( -14.019 0.895 -5.483) 15.079 12.551 ( 7.694 26.704 6.340) 28.505 12.991 ( -9.526 1.232 -7.217) 12.015 13.419 ( -3.429 -8.974 -0.331) 9.613 14.072 ( 14.081 -17.010 -1.284) 22.119 15.023 ( -0.643 -2.865 0.161) 2.941 15.287 ( 0.416 -2.572 -3.552) 4.405 18.242 ( -8.525 2.714 -11.599) 14.648 18.672 ( 27.856 3.771 -4.827) 28.521 18.861 ( -22.344 -1.032 0.402) 22.371 19.578 ( 15.693 4.755 2.934) 16.658 21.000 ( 21.351 -7.879 27.322) 35.559 22.077 ( -25.846 -8.707 -25.726) 37.492 24.095 ( 9.275 -1.140 2.907) 9.787 24.312 ( -3.519 0.032 -8.455) 9.158 ======================= Grid point 316 (168/260) ======================= q-point: (-0.30 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.208 ( -7.735 7.099 6.479) 12.337 2.453 ( -7.802 8.768 9.191) 14.908 2.882 ( 4.168 -1.898 0.484) 4.606 3.194 ( 9.655 -4.982 1.603) 10.982 3.325 ( -0.623 2.218 0.800) 2.438 3.654 ( -3.449 3.519 -6.883) 8.465 3.863 ( 3.749 -1.077 1.887) 4.333 4.003 ( 9.724 -4.641 -4.564) 11.701 5.128 ( -12.093 3.545 7.291) 14.559 5.393 ( -6.294 2.548 6.667) 9.516 5.669 ( -6.524 3.231 5.986) 9.425 5.982 ( 0.416 4.262 -0.043) 4.282 6.890 ( -17.811 -7.142 9.889) 21.588 7.504 ( 7.068 10.140 11.790) 17.082 7.597 ( 1.090 6.312 -7.296) 9.709 8.290 ( 5.046 1.130 17.044) 17.811 8.889 ( 1.387 2.373 -5.102) 5.796 9.221 ( -5.526 14.475 3.223) 15.826 9.741 ( -9.148 -2.155 3.492) 10.027 10.589 ( -8.910 11.758 18.302) 23.507 11.034 ( -6.337 1.885 -6.892) 9.550 11.670 ( -14.362 -1.431 -4.720) 15.185 12.674 ( 2.438 27.149 0.723) 27.267 12.823 ( -4.904 5.993 -6.915) 10.382 13.411 ( 2.438 -11.752 2.523) 12.265 14.352 ( 14.434 -18.275 -4.423) 23.703 14.988 ( -2.923 -4.885 0.735) 5.740 15.294 ( 1.077 -0.882 -5.851) 6.014 17.976 ( -18.055 3.695 -5.047) 19.107 18.581 ( -2.609 -11.989 -3.310) 12.708 19.180 ( 23.471 5.307 -5.780) 24.748 19.866 ( 11.494 1.782 1.179) 11.690 21.460 ( 15.253 -3.433 24.435) 29.009 21.533 ( -19.725 -6.070 -19.685) 28.521 24.156 ( -2.122 1.810 -6.953) 7.491 24.325 ( 5.807 0.315 -1.055) 5.911 ======================= Grid point 317 (169/260) ======================= q-point: (-0.20 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.151 ( -0.694 9.860 14.955) 17.926 2.350 ( -4.755 14.588 11.379) 19.102 2.984 ( 5.165 -3.091 4.557) 7.550 3.242 ( -5.836 1.725 5.756) 8.376 3.443 ( 10.093 -1.100 1.399) 10.248 3.571 ( -0.026 7.218 -8.327) 11.020 3.946 ( 2.698 -1.138 7.736) 8.272 4.152 ( 5.272 2.155 -4.501) 7.259 4.938 ( -7.195 -0.472 3.428) 7.984 5.233 ( -10.660 1.635 6.624) 12.657 5.539 ( -7.476 -1.709 5.799) 9.615 5.973 ( -1.066 3.166 -1.749) 3.771 6.541 ( -18.002 -5.053 11.135) 21.762 7.645 ( 6.598 7.499 -15.135) 18.134 7.670 ( 5.362 12.164 18.123) 22.476 8.442 ( 5.748 1.259 16.386) 17.410 8.826 ( -7.974 2.211 1.652) 8.438 9.182 ( 1.964 12.861 3.103) 13.375 9.579 ( -7.092 0.433 1.598) 7.283 10.481 ( -5.473 12.522 18.870) 23.299 10.846 ( -10.479 -1.729 -7.742) 13.144 11.408 ( -10.699 -3.924 -2.664) 11.703 12.640 ( -1.703 18.254 -13.009) 22.480 12.774 ( -1.762 15.615 1.190) 15.759 13.516 ( 6.840 -10.303 3.576) 12.874 14.605 ( 11.941 -20.329 -7.737) 24.814 14.919 ( -3.940 -4.648 1.020) 6.178 15.294 ( 0.379 -0.504 -8.240) 8.265 17.568 ( -21.213 -5.539 5.555) 22.617 18.659 ( 8.483 -13.461 -14.072) 21.241 19.558 ( 15.224 5.497 -5.292) 17.030 19.976 ( -0.214 -4.272 -5.510) 6.975 21.185 ( -5.545 2.422 -7.418) 9.573 21.784 ( 7.107 -1.553 21.199) 22.412 24.117 ( 1.109 2.628 -7.669) 8.182 24.426 ( 3.866 2.808 -0.190) 4.782 ======================= Grid point 318 (170/260) ======================= q-point: (-0.10 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.206 ( 0.927 7.915 18.396) 20.048 2.328 ( 0.153 20.429 13.627) 24.557 3.057 ( -3.930 2.571 5.315) 7.093 3.132 ( 0.026 1.703 2.334) 2.889 3.501 ( 0.098 -6.392 4.092) 7.590 3.754 ( 13.135 8.551 0.090) 15.673 3.991 ( -0.444 3.164 15.071) 15.406 4.172 ( -1.381 7.977 -6.515) 10.391 4.849 ( -4.219 -2.629 -1.306) 5.140 5.062 ( -5.897 -0.394 6.872) 9.064 5.422 ( -4.992 -6.939 4.748) 9.778 5.937 ( -1.925 1.227 -1.967) 3.013 6.274 ( -11.096 1.021 12.482) 16.732 7.739 ( 5.036 11.157 -16.661) 20.674 7.804 ( 4.155 12.074 17.987) 22.058 8.550 ( -0.889 6.995 15.651) 17.166 8.699 ( -0.210 -2.158 5.520) 5.931 9.213 ( -2.882 11.342 3.548) 12.229 9.543 ( 5.421 3.920 -0.109) 6.691 10.476 ( 0.552 12.679 17.081) 21.280 10.600 ( -11.753 -7.329 -7.030) 15.533 11.255 ( -4.075 -6.740 -0.904) 7.927 12.608 ( 1.545 19.737 -14.135) 24.326 12.718 ( -3.513 12.488 -1.565) 13.067 13.669 ( 7.288 -7.862 3.275) 11.209 14.733 ( 0.151 -20.623 -9.270) 22.612 14.884 ( 3.055 -5.597 -0.438) 6.392 15.272 ( -0.352 -0.244 -10.066) 10.075 17.194 ( -18.708 -14.044 13.576) 27.047 18.697 ( -2.583 -10.457 -26.852) 28.932 19.711 ( 2.254 1.057 -0.427) 2.526 19.987 ( 5.935 -1.647 -7.344) 9.585 21.286 ( 13.940 2.498 4.324) 14.807 21.813 ( -7.791 -0.419 12.934) 15.105 24.178 ( 5.981 3.932 -4.169) 8.283 24.469 ( 0.601 4.365 -1.176) 4.560 ======================= Grid point 319 (171/260) ======================= q-point: ( 0.00 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.393 ( 2.109 3.827 13.451) 14.143 2.723 ( -1.410 10.199 13.292) 16.813 3.038 ( -3.214 1.633 4.835) 6.031 3.164 ( 0.767 2.537 4.212) 4.976 3.332 ( -0.641 -10.369 10.318) 14.642 3.966 ( 2.000 0.073 7.990) 8.237 4.261 ( 0.471 3.840 -7.879) 8.777 4.297 ( 6.982 8.412 9.645) 14.578 4.760 ( -5.656 5.453 -2.410) 8.217 4.935 ( -4.592 -7.713 1.396) 9.084 5.235 ( 3.359 -4.314 3.092) 6.282 5.880 ( -1.636 -1.028 1.957) 2.750 6.237 ( -2.309 2.089 10.888) 11.325 7.856 ( -1.493 2.497 -11.143) 11.517 8.238 ( 3.789 14.573 14.061) 20.602 8.512 ( -1.112 -8.889 17.865) 19.986 8.896 ( 13.106 3.983 2.134) 13.863 9.429 ( -0.729 10.781 5.066) 11.934 9.758 ( 9.308 0.261 -0.854) 9.351 10.124 ( -15.936 -7.063 -6.345) 18.550 10.849 ( 8.384 9.071 13.522) 18.314 11.060 ( 2.571 -8.749 5.982) 10.906 12.830 ( -4.823 6.130 -1.355) 7.916 12.944 ( 3.114 8.360 -7.301) 11.528 13.759 ( 5.278 3.427 -4.011) 7.463 14.251 ( -2.391 -17.001 -14.278) 22.330 14.827 ( 1.151 -2.886 0.106) 3.109 15.242 ( 0.129 -0.134 -11.761) 11.762 16.670 ( -14.123 -5.036 17.138) 22.772 18.420 ( -5.362 -2.236 -29.346) 29.916 19.726 ( 0.893 -0.576 1.505) 1.842 20.080 ( 2.800 0.005 -8.580) 9.026 21.573 ( -14.141 1.046 6.921) 15.779 21.638 ( 16.155 -1.941 6.327) 17.458 24.362 ( 6.097 1.712 -0.557) 6.357 24.503 ( -3.321 1.135 -1.864) 3.974 ======================= Grid point 320 (172/260) ======================= q-point: ( 0.10 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.459 ( 1.927 5.036 10.226) 11.561 2.742 ( 0.181 7.413 14.338) 16.142 3.008 ( 0.143 0.925 1.229) 1.545 3.161 ( -2.287 2.077 7.080) 7.724 3.331 ( -2.147 -10.428 8.577) 13.672 3.972 ( -3.012 1.918 1.641) 3.930 4.199 ( -3.120 2.042 -5.681) 6.795 4.508 ( 8.756 10.164 9.768) 16.595 4.634 ( -5.840 3.922 -1.526) 7.198 4.849 ( -2.943 -9.970 3.431) 10.947 5.380 ( 9.448 -1.867 1.447) 9.739 5.895 ( 2.592 -1.309 1.422) 3.234 6.252 ( 1.308 2.370 10.921) 11.252 7.813 ( 0.414 2.916 -10.865) 11.257 8.280 ( -4.987 11.346 19.853) 23.404 8.579 ( 6.341 -5.859 10.409) 13.523 9.113 ( 5.821 7.737 -4.179) 10.545 9.438 ( -0.788 12.566 8.322) 15.093 9.673 ( -12.978 -6.934 -1.522) 14.793 10.092 ( 11.173 -2.633 -2.339) 11.715 11.131 ( 15.415 1.287 9.984) 18.411 11.223 ( 13.228 -3.433 5.555) 14.753 12.721 ( -5.150 9.493 -1.168) 10.863 13.015 ( 4.841 4.588 -5.424) 8.597 13.819 ( 1.679 2.052 -4.946) 5.612 14.124 ( -6.733 -13.807 -14.922) 21.416 14.859 ( 2.031 -4.181 -0.728) 4.705 15.224 ( 0.674 -0.388 -10.572) 10.600 16.531 ( -3.512 -3.137 17.813) 18.425 18.299 ( 0.218 -2.917 -20.823) 21.028 19.701 ( -4.442 -0.390 -0.620) 4.502 20.027 ( -6.012 -0.129 -7.796) 9.846 21.250 ( -16.914 1.615 5.449) 17.843 22.047 ( 21.294 -3.722 4.573) 22.095 24.359 ( -8.834 2.752 -3.504) 9.894 24.473 ( 3.107 -0.229 -0.141) 3.119 ======================= Grid point 321 (173/260) ======================= q-point: ( 0.20 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.520 ( 2.283 6.298 7.693) 10.201 2.792 ( 1.707 6.322 13.402) 14.917 3.038 ( 2.221 -1.575 0.362) 2.747 3.121 ( -2.808 0.718 4.054) 4.983 3.279 ( -4.736 -11.001 7.919) 14.359 3.874 ( -5.730 5.622 -4.421) 9.164 4.061 ( -9.059 -0.168 -14.622) 17.202 4.453 ( -11.247 -3.570 -6.592) 13.516 4.683 ( 7.736 8.165 15.360) 19.038 4.960 ( 10.785 -3.525 11.370) 16.063 5.578 ( 9.694 0.189 1.178) 9.767 5.965 ( 3.437 -1.270 1.168) 3.845 6.343 ( 5.685 2.632 10.562) 12.280 7.829 ( 2.855 3.497 -6.960) 8.296 8.156 ( -10.381 7.207 16.055) 20.432 8.696 ( -1.828 -2.965 7.657) 8.413 9.122 ( -2.041 6.422 -6.031) 9.043 9.359 ( -1.545 5.894 -0.169) 6.095 9.611 ( 3.461 0.213 10.630) 11.182 10.330 ( 12.296 -0.793 -0.102) 12.322 11.309 ( 2.879 -4.555 -2.283) 5.853 11.671 ( 24.925 2.551 10.409) 27.131 12.651 ( -1.075 14.358 -0.065) 14.398 13.093 ( 3.652 -2.534 -2.284) 4.998 13.800 ( -2.866 1.712 -4.581) 5.668 13.937 ( -8.259 -10.830 -14.032) 19.555 14.900 ( 2.269 -3.481 -1.206) 4.326 15.220 ( 0.953 -1.272 -8.345) 8.495 16.623 ( 9.319 -0.597 14.449) 17.203 18.355 ( 9.081 -4.647 -12.613) 16.222 19.536 ( -11.751 -0.310 -2.625) 12.044 19.847 ( -9.131 -0.055 -4.459) 10.162 20.946 ( -15.382 2.912 5.804) 16.697 22.472 ( 20.571 -5.117 1.875) 21.281 24.105 ( -15.262 1.588 -6.355) 16.608 24.517 ( 1.248 0.187 -0.470) 1.346 ======================= Grid point 322 (174/260) ======================= q-point: ( 0.30 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.578 ( 1.691 6.444 6.429) 9.258 2.865 ( 2.919 5.641 9.427) 11.367 3.043 ( -4.753 1.374 1.997) 5.336 3.094 ( 1.761 -6.383 -3.139) 7.327 3.204 ( -3.714 -10.816 7.624) 13.745 3.714 ( -9.843 2.971 -14.310) 17.621 3.839 ( -7.499 5.062 -11.114) 14.331 4.204 ( -11.064 -6.774 -8.463) 15.490 4.914 ( 11.261 4.351 15.902) 19.966 5.217 ( 11.214 -0.194 12.840) 17.049 5.753 ( 7.308 1.829 1.542) 7.690 6.013 ( 0.783 -0.721 1.993) 2.259 6.527 ( 10.361 3.128 9.762) 14.575 7.867 ( -0.730 5.371 7.142) 8.966 7.986 ( -7.208 4.850 3.763) 9.468 8.511 ( -14.759 -5.851 5.435) 16.781 9.017 ( -5.114 3.640 -11.192) 12.833 9.517 ( 11.728 13.726 4.450) 18.594 9.750 ( 7.957 -3.605 11.775) 14.661 10.570 ( 11.864 -0.251 1.113) 11.919 11.245 ( -7.498 -3.075 -6.861) 10.618 12.129 ( 17.374 2.777 9.935) 20.206 12.680 ( 3.316 20.094 -0.441) 20.371 13.150 ( 2.615 -12.517 2.392) 13.009 13.649 ( -10.900 -2.757 -3.962) 11.921 13.783 ( -4.719 -3.008 -11.167) 12.491 14.942 ( 2.138 -1.768 -1.291) 3.060 15.222 ( 0.905 -2.050 -6.061) 6.461 16.962 ( 22.081 1.050 7.704) 23.410 18.578 ( 14.687 -4.829 -6.877) 16.921 19.244 ( -16.043 -0.148 -4.193) 16.583 19.705 ( -3.894 -0.428 0.456) 3.944 20.647 ( -16.567 3.487 7.379) 18.468 22.848 ( 16.320 -5.432 -2.933) 17.449 23.751 ( -17.662 0.535 -6.573) 18.853 24.521 ( -0.534 0.211 -2.148) 2.224 ======================= Grid point 323 (175/260) ======================= q-point: ( 0.40 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.605 ( -0.519 3.269 4.217) 5.361 2.910 ( -6.262 -0.339 4.416) 7.670 2.934 ( -0.424 5.166 0.208) 5.187 3.098 ( -1.001 -7.451 -2.090) 7.803 3.189 ( 0.687 -5.420 1.862) 5.772 3.464 ( -8.503 -2.380 -20.387) 22.217 3.736 ( -2.213 8.300 -3.225) 9.175 4.009 ( -6.324 -6.850 -8.135) 12.374 5.171 ( 10.695 2.650 14.213) 17.984 5.431 ( 6.967 0.707 12.106) 13.985 5.866 ( 3.642 2.812 2.103) 5.059 6.008 ( -1.539 0.090 3.777) 4.079 6.780 ( 12.633 3.727 8.731) 15.802 7.767 ( -8.662 7.472 12.592) 17.013 7.946 ( -0.973 4.051 2.097) 4.664 8.227 ( -14.031 -10.033 6.465) 18.420 8.916 ( -1.429 3.714 -15.733) 16.228 9.694 ( 4.145 16.370 9.637) 19.443 9.945 ( 7.241 -6.257 1.921) 9.760 10.806 ( 11.612 0.035 -0.154) 11.613 11.052 ( -8.971 -1.126 1.014) 9.098 12.351 ( 2.360 1.754 4.255) 5.173 12.754 ( 4.455 24.050 0.750) 24.470 13.235 ( 5.237 -21.120 3.968) 22.119 13.415 ( -11.150 -0.686 1.412) 11.260 13.652 ( -6.483 -0.903 -10.253) 12.164 14.974 ( 1.282 -1.089 -0.990) 1.952 15.229 ( 1.107 -1.625 -4.744) 5.136 17.502 ( 30.482 1.867 0.742) 30.548 18.763 ( -5.409 -2.025 -7.453) 9.429 19.028 ( 6.061 -0.124 -1.535) 6.254 19.672 ( -2.861 -0.557 1.182) 3.145 20.359 ( -11.893 1.582 14.531) 18.844 22.939 ( -10.330 -4.256 -19.132) 22.156 23.555 ( 4.022 -1.225 4.967) 6.508 24.487 ( -2.233 0.180 -4.496) 5.023 ======================= Grid point 324 (176/260) ======================= q-point: (-0.50 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.561 ( -4.813 -1.089 1.243) 5.089 2.764 ( -6.903 -1.795 1.312) 7.252 2.904 ( -3.025 5.801 -3.827) 7.580 3.043 ( -3.508 -0.682 -4.647) 5.863 3.227 ( 3.534 0.121 -0.341) 3.552 3.381 ( 3.488 -10.422 -9.324) 14.413 3.722 ( 0.955 5.039 -1.197) 5.266 3.919 ( -1.288 -3.260 -7.858) 8.604 5.378 ( 6.750 1.969 11.733) 13.679 5.517 ( -1.507 0.990 10.049) 10.210 5.902 ( -0.588 3.026 2.692) 4.092 5.994 ( -0.262 0.966 5.125) 5.222 7.032 ( 9.264 3.182 9.135) 13.394 7.637 ( -6.423 8.125 6.447) 12.200 7.849 ( -9.028 3.193 0.985) 9.626 8.059 ( -4.853 -11.263 17.454) 21.332 8.898 ( 3.197 3.762 -17.484) 18.168 9.730 ( -2.430 15.145 5.126) 16.173 9.961 ( -4.710 -6.832 -2.819) 8.764 10.913 ( -2.408 1.346 6.924) 7.453 11.052 ( 7.768 0.817 5.557) 9.586 12.249 ( -11.308 0.565 -1.854) 11.472 12.880 ( 7.528 22.449 3.572) 23.946 13.187 ( -8.233 -3.394 -0.664) 8.930 13.399 ( 2.749 -10.528 3.481) 11.424 13.507 ( -2.090 -7.714 -4.824) 9.335 14.982 ( -0.377 -1.713 -0.422) 1.804 15.247 ( 1.736 -0.426 -5.001) 5.311 18.126 ( 31.753 2.309 -3.777) 32.060 18.499 ( -12.226 -0.645 -9.921) 15.758 19.324 ( 17.177 1.811 1.605) 17.347 19.414 ( -23.110 1.880 -2.500) 23.320 20.416 ( 12.998 -3.763 25.517) 28.883 22.500 ( -24.219 -3.554 -24.057) 34.321 23.797 ( 14.428 -1.550 6.008) 15.705 24.413 ( -3.880 0.070 -7.209) 8.187 ======================= Grid point 325 (177/260) ======================= q-point: (-0.40 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.434 ( -7.176 0.625 1.334) 7.326 2.671 ( -2.725 0.998 0.674) 2.979 2.839 ( -1.829 1.782 -1.444) 2.934 2.996 ( -0.150 -1.190 -1.598) 1.998 3.322 ( 5.745 3.990 0.012) 6.995 3.492 ( 7.584 -11.152 -1.717) 13.596 3.767 ( 4.246 1.229 -2.695) 5.177 3.899 ( 0.610 0.456 -9.221) 9.253 5.413 ( -9.321 2.292 8.514) 12.830 5.479 ( -0.167 0.747 8.876) 8.909 5.853 ( -5.164 2.479 3.242) 6.582 6.020 ( 1.196 1.411 4.185) 4.576 7.073 ( -9.808 -0.996 10.876) 14.679 7.580 ( 0.899 7.680 0.756) 7.769 7.730 ( -0.639 4.592 0.525) 4.666 8.056 ( -0.573 -9.975 23.082) 25.152 8.949 ( 5.021 4.263 -14.407) 15.841 9.615 ( -7.696 10.434 -8.061) 15.267 9.836 ( -7.863 -4.351 10.517) 13.833 10.873 ( -4.758 4.017 15.951) 17.123 11.154 ( 0.750 1.437 -0.754) 1.788 11.955 ( -16.763 -1.179 -3.028) 17.075 13.026 ( 0.218 7.173 -1.998) 7.449 13.083 ( 3.952 15.130 4.479) 16.267 13.280 ( -7.377 -1.373 -5.500) 9.303 13.672 ( 12.127 -20.217 1.950) 23.656 14.958 ( -2.017 -2.236 0.353) 3.032 15.272 ( 1.980 0.195 -6.450) 6.750 18.293 ( -4.812 1.694 -11.575) 12.649 18.671 ( 8.997 -1.561 1.201) 9.210 18.901 ( -11.805 2.527 -7.680) 14.309 19.653 ( 14.587 2.090 2.665) 14.975 20.863 ( 23.452 -4.127 28.782) 37.356 21.955 ( -24.379 -2.925 -23.806) 34.199 24.081 ( 12.522 -0.258 4.164) 13.199 24.307 ( -4.543 -0.307 -9.713) 10.727 ======================= Grid point 326 (178/260) ======================= q-point: (-0.30 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.320 ( -4.664 3.063 6.033) 8.217 2.655 ( 0.461 9.404 4.429) 10.405 2.850 ( 2.633 -1.239 3.457) 4.518 3.014 ( 1.376 -9.058 3.172) 9.696 3.450 ( 6.602 8.286 1.594) 10.713 3.624 ( 4.432 -6.575 1.330) 8.040 3.867 ( 4.960 1.203 -6.324) 8.127 3.921 ( 6.648 -2.282 -9.305) 11.661 5.200 ( -12.906 2.326 7.408) 15.061 5.429 ( -6.787 0.837 6.764) 9.619 5.712 ( -9.757 0.972 3.455) 10.396 6.036 ( -0.616 1.133 1.918) 2.311 6.784 ( -18.323 -2.657 10.939) 21.505 7.624 ( 4.606 2.024 -9.466) 10.720 7.823 ( 5.952 13.939 13.054) 20.003 8.138 ( 3.805 -12.558 20.500) 24.340 9.004 ( 2.135 5.040 -8.364) 9.996 9.458 ( -5.338 7.284 -6.699) 11.244 9.688 ( -9.528 -2.666 12.338) 15.815 10.788 ( -7.147 5.714 16.446) 18.820 11.074 ( -7.971 1.757 -2.921) 8.669 11.609 ( -16.910 -3.006 -1.705) 17.260 12.952 ( -3.194 8.332 -5.851) 10.670 13.146 ( -5.135 -3.742 -2.182) 6.719 13.269 ( 9.865 16.333 2.799) 19.285 13.926 ( 13.002 -20.325 -3.168) 24.334 14.910 ( -2.850 -2.107 1.031) 3.691 15.290 ( 1.400 0.111 -8.319) 8.436 18.086 ( -27.206 6.019 1.420) 27.900 18.351 ( -0.498 -9.064 -9.737) 13.312 19.270 ( 23.767 2.635 -8.969) 25.539 19.877 ( 6.643 -0.143 -0.068) 6.645 21.390 ( 21.393 -2.182 27.435) 34.858 21.474 ( -18.021 -0.854 -17.627) 25.223 24.190 ( -2.688 1.200 -10.207) 10.623 24.315 ( 8.680 -0.713 1.786) 8.890 ======================= Grid point 327 (179/260) ======================= q-point: (-0.20 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.284 ( -1.045 3.182 11.460) 11.940 2.697 ( 1.641 17.381 8.960) 19.623 2.932 ( 3.828 -1.474 6.627) 7.794 3.065 ( 2.685 -14.600 9.404) 17.573 3.492 ( -4.400 3.355 -2.252) 5.974 3.720 ( 7.346 3.932 3.039) 8.869 3.964 ( 6.781 3.815 -2.801) 8.270 4.104 ( 11.219 -5.621 -7.879) 14.817 4.973 ( -10.422 2.159 5.264) 11.874 5.257 ( -11.225 0.624 5.842) 12.669 5.496 ( -12.217 -1.635 3.223) 12.741 6.001 ( -3.098 0.138 1.439) 3.419 6.483 ( -13.551 -1.044 10.580) 17.224 7.739 ( 9.209 2.214 -12.824) 15.942 7.966 ( 4.948 15.247 17.956) 24.070 8.275 ( 5.055 -13.472 17.030) 22.295 8.953 ( -6.876 5.167 1.217) 8.687 9.400 ( 0.623 7.772 -1.376) 7.918 9.554 ( -4.734 -2.846 5.501) 7.795 10.685 ( -6.307 4.513 10.426) 12.994 10.855 ( -12.557 3.031 0.575) 12.930 11.304 ( -13.382 -4.673 1.284) 14.232 12.890 ( -1.173 10.530 -8.513) 13.591 13.055 ( -4.168 -0.625 -0.078) 4.215 13.465 ( 9.390 10.351 -0.065) 13.975 14.147 ( 10.021 -20.191 -8.216) 23.992 14.857 ( -2.600 -1.508 1.336) 3.289 15.288 ( 0.511 -0.099 -10.122) 10.135 17.498 ( -29.514 -1.471 9.224) 30.956 18.461 ( 10.112 -5.107 -19.754) 22.772 19.661 ( 16.851 3.746 -7.923) 18.993 19.886 ( -4.056 -3.481 -5.412) 7.606 21.232 ( -2.787 1.433 -4.231) 5.265 21.759 ( 8.749 -0.695 21.244) 22.985 24.154 ( 2.007 0.926 -8.840) 9.112 24.459 ( 5.273 0.656 1.072) 5.421 ======================= Grid point 328 (180/260) ======================= q-point: (-0.10 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.322 ( 1.576 3.044 14.229) 14.636 2.727 ( -1.197 15.876 11.596) 19.696 3.024 ( 3.259 -0.794 9.380) 9.962 3.140 ( 1.259 -7.378 9.277) 11.920 3.363 ( -5.290 -2.318 -0.515) 5.798 3.873 ( 5.755 1.950 6.643) 9.002 4.108 ( 7.886 7.625 1.013) 11.016 4.263 ( 5.099 -0.973 -5.670) 7.687 4.842 ( -3.714 1.857 0.695) 4.210 5.055 ( -9.153 -0.513 4.531) 10.226 5.283 ( -8.582 -4.892 3.431) 10.457 5.934 ( -3.738 -0.641 2.471) 4.527 6.304 ( -7.082 1.102 9.990) 12.295 7.867 ( 4.363 2.653 -11.144) 12.258 8.111 ( 5.902 15.549 13.770) 21.592 8.417 ( 6.230 -12.582 14.903) 20.475 8.802 ( -6.196 4.332 9.667) 12.272 9.432 ( 0.221 8.675 3.578) 9.386 9.571 ( 6.937 -1.456 -1.837) 7.323 10.477 ( -15.914 -3.739 -6.579) 17.621 10.732 ( -0.225 9.861 15.611) 18.466 11.101 ( -7.294 -6.859 4.264) 10.882 12.871 ( 0.738 9.519 -7.158) 11.933 12.971 ( -3.971 3.632 -1.963) 5.728 13.634 ( 7.880 6.150 -2.325) 10.263 14.267 ( 4.077 -19.588 -12.094) 23.379 14.822 ( -0.940 -1.348 1.045) 1.947 15.268 ( -0.013 -0.161 -11.463) 11.464 17.002 ( -22.766 -4.527 13.801) 27.005 18.546 ( 1.970 -3.804 -29.808) 30.114 19.730 ( -3.155 0.584 -0.715) 3.287 19.961 ( 10.521 -0.675 -8.402) 13.481 21.324 ( 10.665 0.999 4.978) 11.812 21.806 ( -7.242 -0.201 12.325) 14.297 24.232 ( 6.687 1.295 -4.087) 7.943 24.525 ( 1.227 1.237 -0.189) 1.752 ======================= Grid point 369 (181/260) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( -1.243 0.000 17.878) 17.922 1.956 ( -0.819 0.000 12.888) 12.914 2.713 ( 10.478 0.000 -4.835) 11.540 2.902 ( 0.296 0.000 -11.274) 11.277 3.642 ( 2.753 0.000 1.504) 3.137 3.756 ( -2.384 0.000 -1.325) 2.727 4.180 ( 8.381 0.000 24.830) 26.206 4.276 ( 3.083 0.000 12.215) 12.598 4.858 ( -8.557 0.000 -0.575) 8.576 5.053 ( -7.432 0.000 0.925) 7.489 5.697 ( 2.743 0.000 1.552) 3.152 5.799 ( 2.147 0.000 -1.627) 2.694 6.259 ( -9.956 0.000 13.747) 16.973 6.855 ( 5.105 0.000 -16.513) 17.285 7.522 ( 0.309 0.000 19.325) 19.328 8.123 ( -6.373 0.000 -10.930) 12.652 8.279 ( -11.677 0.000 12.802) 17.328 8.810 ( 11.604 0.000 -14.368) 18.469 9.890 ( 15.747 0.000 24.574) 29.186 10.527 ( -6.837 0.000 -10.442) 12.481 10.595 ( 4.944 0.000 0.605) 4.981 10.802 ( -7.251 0.000 -7.865) 10.697 11.798 ( 1.271 0.000 2.403) 2.718 12.172 ( 7.550 0.000 -14.637) 16.470 14.346 ( 4.853 0.000 8.846) 10.090 14.812 ( -5.638 0.000 -13.609) 14.731 15.275 ( -5.820 0.000 4.334) 7.256 15.420 ( 8.754 0.000 -5.393) 10.282 18.333 ( -44.819 0.000 4.199) 45.015 18.509 ( 25.728 0.000 -3.883) 26.019 19.957 ( 0.734 0.000 1.110) 1.331 20.005 ( -0.790 0.000 -1.144) 1.390 21.687 ( -30.073 0.000 9.461) 31.526 22.010 ( 43.103 0.000 -7.142) 43.691 23.822 ( 7.569 0.000 3.921) 8.524 24.003 ( -6.148 0.000 -5.087) 7.980 ======================= Grid point 370 (182/260) ======================= q-point: ( 0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.878 ( 9.152 0.000 18.057) 20.243 2.048 ( 7.488 0.000 6.847) 10.146 2.885 ( 0.555 0.000 -15.691) 15.701 2.938 ( 12.877 0.000 -5.815) 14.129 3.611 ( -4.703 0.000 -0.156) 4.706 3.662 ( -6.381 0.000 -2.865) 6.995 4.400 ( 5.002 0.000 6.348) 8.082 4.425 ( 9.595 0.000 27.228) 28.869 4.693 ( -7.202 0.000 -4.317) 8.397 4.930 ( -4.839 0.000 8.545) 9.820 5.738 ( 1.145 0.000 -0.458) 1.233 5.811 ( -0.376 0.000 -2.031) 2.066 6.226 ( 2.403 0.000 12.172) 12.407 6.971 ( 9.749 0.000 -12.784) 16.077 7.565 ( -0.992 0.000 22.606) 22.627 7.946 ( -7.943 0.000 -8.695) 11.777 8.138 ( -4.902 0.000 12.386) 13.321 9.113 ( 20.387 0.000 -13.421) 24.408 10.204 ( 7.870 0.000 31.415) 32.386 10.302 ( -10.945 0.000 -20.242) 23.012 10.737 ( 0.986 0.000 -2.851) 3.017 10.792 ( 16.417 0.000 -8.326) 18.408 11.783 ( -3.020 0.000 -1.874) 3.554 12.314 ( 10.200 0.000 -16.603) 19.486 14.471 ( 5.394 0.000 8.995) 10.489 14.668 ( -6.011 0.000 -14.260) 15.475 15.139 ( -8.768 0.000 2.208) 9.042 15.557 ( 6.244 0.000 -4.270) 7.564 17.553 ( -33.936 0.000 16.499) 37.734 19.029 ( 25.898 0.000 1.804) 25.961 19.907 ( -5.537 0.000 2.169) 5.947 19.943 ( -5.314 0.000 -1.623) 5.557 21.034 ( -36.151 0.000 4.389) 36.416 22.742 ( 32.123 0.000 -15.368) 35.610 23.858 ( -6.857 0.000 -5.676) 8.901 23.999 ( 8.896 0.000 3.295) 9.487 ======================= Grid point 371 (183/260) ======================= q-point: ( 0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.166 ( 15.173 0.000 16.976) 22.768 2.250 ( 11.124 0.000 2.879) 11.490 2.843 ( -0.875 0.000 -18.858) 18.878 3.165 ( 9.129 0.000 -3.847) 9.906 3.500 ( -5.678 0.000 -1.204) 5.804 3.520 ( -4.429 0.000 -9.748) 10.707 4.409 ( -5.466 0.000 1.229) 5.602 4.516 ( -7.541 0.000 7.618) 10.719 4.704 ( 10.102 0.000 13.040) 16.495 4.957 ( 4.845 0.000 14.939) 15.705 5.738 ( -0.951 0.000 -1.514) 1.787 5.795 ( -0.489 0.000 -2.245) 2.298 6.341 ( 5.721 0.000 9.464) 11.059 7.161 ( 10.819 0.000 -7.577) 13.209 7.580 ( -2.242 0.000 21.865) 21.980 7.793 ( -5.609 0.000 -5.608) 7.932 8.145 ( 1.753 0.000 17.162) 17.251 9.510 ( 21.746 0.000 -12.736) 25.201 10.052 ( -8.613 0.000 -24.155) 25.645 10.346 ( 0.506 0.000 31.058) 31.062 10.803 ( 6.045 0.000 -1.835) 6.318 11.145 ( 17.359 0.000 -6.929) 18.691 11.687 ( -4.404 0.000 -3.850) 5.850 12.495 ( 12.182 0.000 -21.696) 24.882 14.504 ( -7.476 0.000 -13.268) 15.229 14.549 ( -2.278 0.000 10.263) 10.513 14.976 ( -5.650 0.000 2.595) 6.217 15.646 ( 3.550 0.000 -4.026) 5.367 17.123 ( -13.046 0.000 18.543) 22.673 19.397 ( 3.361 0.000 -2.666) 4.290 19.792 ( -9.137 0.000 -2.805) 9.558 19.849 ( 2.719 0.000 8.365) 8.795 20.355 ( -28.869 0.000 6.114) 29.510 23.161 ( 12.900 0.000 -22.963) 26.339 23.751 ( -0.878 0.000 -2.171) 2.342 24.170 ( 7.515 0.000 1.182) 7.608 ======================= Grid point 372 (184/260) ======================= q-point: ( 0.30 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.483 ( 11.736 0.000 0.706) 11.757 2.522 ( 16.283 0.000 14.531) 21.824 2.776 ( -1.111 0.000 -18.470) 18.504 3.135 ( -9.946 0.000 -2.067) 10.159 3.394 ( -4.427 0.000 -1.843) 4.795 3.592 ( 12.834 0.000 -13.903) 18.921 4.236 ( -11.574 0.000 4.977) 12.599 4.353 ( -9.537 0.000 -0.859) 9.576 4.936 ( 9.256 0.000 16.027) 18.508 5.126 ( 7.817 0.000 12.442) 14.694 5.697 ( -2.635 0.000 -1.673) 3.121 5.777 ( -1.016 0.000 -3.456) 3.602 6.484 ( 6.665 0.000 10.358) 12.317 7.316 ( 4.847 0.000 -4.060) 6.323 7.594 ( -0.582 0.000 18.744) 18.753 7.712 ( -1.243 0.000 -1.754) 2.150 8.253 ( 3.979 0.000 22.784) 23.129 9.854 ( 1.027 0.000 -11.255) 11.302 9.898 ( 13.300 0.000 -28.343) 31.309 10.387 ( -2.857 0.000 27.242) 27.392 10.968 ( 10.756 0.000 -0.188) 10.758 11.250 ( -7.302 0.000 3.668) 8.171 11.735 ( 10.743 0.000 -6.278) 12.443 12.683 ( 11.914 0.000 -28.436) 30.831 14.324 ( -7.514 0.000 -9.966) 12.481 14.388 ( -13.736 0.000 11.800) 18.108 14.982 ( 3.307 0.000 5.631) 6.530 15.674 ( 0.214 0.000 -4.847) 4.852 17.107 ( 7.044 0.000 12.324) 14.195 19.172 ( -18.762 0.000 -6.011) 19.702 19.584 ( -10.572 0.000 -4.170) 11.365 19.585 ( -25.027 0.000 -2.033) 25.110 20.413 ( 21.113 0.000 23.879) 31.874 23.142 ( -6.519 0.000 -25.087) 25.920 23.845 ( 8.352 0.000 -1.003) 8.412 24.290 ( 4.296 0.000 -1.231) 4.469 ======================= Grid point 373 (185/260) ======================= q-point: ( 0.40 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.704 ( 9.094 0.000 -1.344) 9.193 2.705 ( 0.834 0.000 -14.209) 14.234 2.860 ( 10.586 0.000 8.397) 13.512 2.895 ( -11.043 0.000 -2.945) 11.429 3.335 ( -0.488 0.000 2.303) 2.354 3.835 ( 13.145 0.000 -10.730) 16.969 3.999 ( -13.156 0.000 7.606) 15.197 4.127 ( -12.816 0.000 -4.265) 13.507 5.132 ( 7.163 0.000 13.159) 14.982 5.292 ( 6.064 0.000 9.346) 11.140 5.634 ( -3.173 0.000 -1.336) 3.443 5.732 ( -2.653 0.000 -3.589) 4.463 6.658 ( 8.375 0.000 11.773) 14.448 7.315 ( -3.099 0.000 -4.945) 5.836 7.646 ( 1.830 0.000 15.094) 15.204 7.733 ( 2.201 0.000 2.951) 3.681 8.385 ( 3.435 0.000 26.017) 26.243 9.764 ( -0.433 0.000 -27.340) 27.344 10.176 ( 14.085 0.000 -14.253) 20.038 10.338 ( -7.956 0.000 17.901) 19.589 11.048 ( -12.317 0.000 16.296) 20.427 11.205 ( 12.087 0.000 1.959) 12.244 11.908 ( 5.369 0.000 -2.587) 5.960 12.801 ( 6.044 0.000 -34.494) 35.019 14.155 ( -11.224 0.000 11.479) 16.055 14.201 ( -2.044 0.000 -5.507) 5.874 15.069 ( 3.495 0.000 8.690) 9.367 15.633 ( -2.952 0.000 -6.297) 6.955 17.414 ( 20.659 0.000 6.111) 21.544 18.725 ( -23.671 0.000 -9.327) 25.442 19.180 ( -14.330 0.000 2.275) 14.509 19.379 ( -8.415 0.000 -4.976) 9.776 20.916 ( 22.484 0.000 26.303) 34.603 22.881 ( -13.180 0.000 -26.136) 29.271 24.004 ( 7.273 0.000 -0.301) 7.279 24.327 ( -0.080 0.000 -3.275) 3.276 ======================= Grid point 374 (186/260) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.568 ( -14.421 0.000 -0.660) 14.436 2.713 ( 3.117 0.000 -9.247) 9.758 2.938 ( -3.464 0.000 -1.769) 3.889 2.971 ( 11.484 0.000 -3.570) 12.027 3.400 ( 0.921 0.000 16.640) 16.665 3.808 ( -4.170 0.000 4.607) 6.214 3.823 ( -16.278 0.000 -4.307) 16.838 4.039 ( 8.430 0.000 -7.144) 11.050 5.274 ( 4.465 0.000 10.276) 11.204 5.399 ( 2.810 0.000 7.811) 8.301 5.573 ( -2.669 0.000 -1.409) 3.018 5.666 ( -2.991 0.000 -2.779) 4.083 6.859 ( 8.883 0.000 12.058) 14.976 7.211 ( -5.331 0.000 -7.224) 8.978 7.718 ( 1.969 0.000 10.417) 10.601 7.782 ( 1.783 0.000 4.243) 4.603 8.497 ( 1.859 0.000 27.046) 27.110 9.699 ( -0.410 0.000 -29.995) 29.998 10.134 ( -15.052 0.000 7.023) 16.609 10.395 ( 11.172 0.000 -11.074) 15.731 10.893 ( -8.332 0.000 29.019) 30.191 11.415 ( 7.629 0.000 3.999) 8.613 11.911 ( -4.709 0.000 2.563) 5.361 12.741 ( -3.986 0.000 -35.413) 35.636 14.017 ( -4.987 0.000 9.199) 10.464 14.246 ( 7.617 0.000 -4.513) 8.854 15.162 ( 3.786 0.000 10.870) 11.511 15.539 ( -4.698 0.000 -7.627) 8.957 17.902 ( 26.432 0.000 3.638) 26.682 18.240 ( -21.670 0.000 -12.540) 25.036 19.039 ( -1.089 0.000 5.439) 5.547 19.259 ( -1.935 0.000 -4.527) 4.923 21.395 ( 19.497 0.000 27.638) 33.823 22.512 ( -17.982 0.000 -28.917) 34.052 24.124 ( 4.794 0.000 1.391) 4.992 24.271 ( -4.622 0.000 -4.555) 6.489 ======================= Grid point 375 (187/260) ======================= q-point: (-0.40 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.289 ( -13.504 0.000 5.465) 14.567 2.730 ( -7.876 0.000 -1.739) 8.066 2.839 ( 2.442 0.000 -1.509) 2.871 3.184 ( 10.103 0.000 -8.035) 12.908 3.311 ( -10.396 0.000 13.738) 17.229 3.473 ( -16.836 0.000 -3.384) 17.173 3.919 ( 10.194 0.000 5.584) 11.623 4.130 ( 1.256 0.000 1.450) 1.918 5.353 ( 1.269 0.000 7.513) 7.619 5.443 ( -0.025 0.000 7.014) 7.015 5.523 ( -1.991 0.000 -1.416) 2.443 5.615 ( -1.213 0.000 -2.242) 2.549 7.046 ( 6.971 0.000 11.312) 13.287 7.088 ( -4.863 0.000 -10.253) 11.348 7.733 ( -3.257 0.000 4.660) 5.685 7.830 ( 2.618 0.000 2.311) 3.492 8.581 ( 0.635 0.000 27.502) 27.509 9.589 ( -4.272 0.000 -30.772) 31.067 9.821 ( -16.861 0.000 6.308) 18.003 10.567 ( 8.077 0.000 -6.977) 10.673 10.816 ( -7.039 0.000 28.544) 29.399 11.503 ( -0.149 0.000 6.663) 6.665 11.776 ( -8.642 0.000 8.409) 12.058 12.521 ( -9.299 0.000 -33.469) 34.736 13.993 ( 0.329 0.000 7.340) 7.348 14.451 ( 13.395 0.000 -6.260) 14.786 15.264 ( 3.784 0.000 11.885) 12.473 15.421 ( -5.415 0.000 -8.669) 10.221 17.855 ( -13.127 0.000 -15.024) 19.951 18.438 ( 26.321 0.000 4.281) 26.667 19.138 ( 8.931 0.000 6.248) 10.900 19.308 ( 8.089 0.000 -2.713) 8.532 21.803 ( 15.232 0.000 27.940) 31.823 22.037 ( -23.304 0.000 -31.452) 39.144 24.131 ( -8.205 0.000 -4.901) 9.557 24.198 ( 2.181 0.000 2.256) 3.138 ======================= Grid point 376 (188/260) ======================= q-point: (-0.30 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.087 ( -8.579 0.000 14.300) 16.676 2.451 ( -17.408 0.000 5.925) 18.389 2.992 ( 10.075 0.000 2.891) 10.481 3.056 ( -16.666 0.000 -9.723) 19.294 3.144 ( -7.940 0.000 4.911) 9.336 3.432 ( 9.615 0.000 -4.113) 10.458 4.107 ( -4.395 0.000 11.414) 12.231 4.119 ( 7.436 0.000 7.280) 10.406 5.338 ( -4.317 0.000 3.606) 5.625 5.415 ( -3.507 0.000 -0.894) 3.620 5.511 ( 0.643 0.000 5.601) 5.638 5.623 ( 2.291 0.000 -0.528) 2.351 6.978 ( -3.526 0.000 -13.582) 14.033 7.157 ( 0.477 0.000 7.907) 7.922 7.587 ( -11.299 0.000 3.168) 11.735 7.906 ( 5.138 0.000 -1.335) 5.308 8.655 ( 0.383 0.000 28.477) 28.479 9.384 ( -9.718 0.000 -28.876) 30.468 9.535 ( -13.062 0.000 9.640) 16.234 10.671 ( 3.241 0.000 -3.083) 4.474 10.719 ( -8.158 0.000 19.489) 21.128 11.443 ( -7.215 0.000 7.759) 10.595 11.664 ( -4.364 0.000 13.832) 14.504 12.270 ( -7.564 0.000 -31.835) 32.721 14.048 ( 3.245 0.000 7.042) 7.754 14.720 ( 14.871 0.000 -6.968) 16.423 15.283 ( -6.407 0.000 -10.123) 11.980 15.351 ( 1.970 0.000 11.425) 11.594 17.683 ( -0.444 0.000 -15.882) 15.888 18.949 ( 23.838 0.000 4.996) 24.356 19.383 ( 13.487 0.000 5.218) 14.461 19.565 ( 17.864 0.000 0.440) 17.869 21.452 ( -28.348 0.000 -31.137) 42.109 22.111 ( 9.277 0.000 27.012) 28.561 23.940 ( -9.581 0.000 -4.313) 10.507 24.220 ( -0.405 0.000 1.676) 1.725 ======================= Grid point 377 (189/260) ======================= q-point: (-0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.018 ( -3.230 0.000 21.759) 21.997 2.117 ( -17.479 0.000 11.709) 21.039 2.730 ( -12.530 0.000 -8.968) 15.409 3.016 ( -4.994 0.000 -0.974) 5.088 3.232 ( 12.441 0.000 4.901) 13.372 3.612 ( 9.228 0.000 -6.707) 11.408 4.038 ( -5.352 0.000 20.422) 21.112 4.228 ( 1.725 0.000 8.977) 9.141 5.211 ( -8.571 0.000 1.894) 8.778 5.321 ( -5.304 0.000 -3.256) 6.224 5.558 ( 2.493 0.000 6.361) 6.832 5.684 ( 3.398 0.000 0.377) 3.419 6.890 ( -1.868 0.000 -16.380) 16.486 6.981 ( -19.491 0.000 1.365) 19.539 7.451 ( -2.366 0.000 12.830) 13.047 8.027 ( 7.710 0.000 -5.388) 9.406 8.676 ( -6.313 0.000 25.404) 26.177 9.089 ( -13.311 0.000 -24.337) 27.739 9.398 ( -1.609 0.000 13.626) 13.720 10.607 ( -5.891 0.000 11.811) 13.199 10.681 ( -1.446 0.000 -0.744) 1.627 11.269 ( -10.987 0.000 1.047) 11.037 11.667 ( 1.003 0.000 13.763) 13.800 12.112 ( -1.564 0.000 -25.693) 25.740 14.140 ( 4.087 0.000 7.668) 8.689 14.991 ( 13.327 0.000 -4.906) 14.201 15.126 ( -6.434 0.000 -13.500) 14.955 15.384 ( -1.037 0.000 9.653) 9.708 17.764 ( 11.681 0.000 -14.296) 18.462 19.333 ( 10.760 0.000 0.000) 10.760 19.658 ( 12.574 0.000 3.418) 13.030 19.972 ( 17.742 0.000 1.898) 17.844 20.871 ( -16.351 0.000 -20.751) 26.419 22.260 ( -1.091 0.000 23.748) 23.773 23.764 ( -6.384 0.000 -2.328) 6.795 24.191 ( -2.631 0.000 -0.178) 2.637 ======================= Grid point 378 (190/260) ======================= q-point: (-0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.849 ( -11.735 0.000 15.715) 19.613 1.995 ( -4.986 0.000 20.356) 20.958 2.590 ( 1.331 0.000 -6.789) 6.918 2.937 ( -2.072 0.000 -6.397) 6.724 3.486 ( 11.149 0.000 4.586) 12.055 3.746 ( 4.837 0.000 -6.413) 8.033 4.027 ( 0.236 0.000 26.206) 26.207 4.245 ( -1.395 0.000 11.306) 11.392 5.033 ( -9.307 0.000 1.513) 9.429 5.196 ( -6.602 0.000 -2.447) 7.041 5.629 ( 3.288 0.000 4.137) 5.285 5.748 ( 2.968 0.000 -0.011) 2.968 6.555 ( -21.236 0.000 7.831) 22.634 6.838 ( 0.753 0.000 -17.652) 17.668 7.475 ( 0.333 0.000 15.923) 15.927 8.159 ( 5.507 0.000 -9.080) 10.620 8.509 ( -13.727 0.000 17.431) 22.187 8.808 ( -7.651 0.000 -18.709) 20.213 9.551 ( 11.909 0.000 19.615) 22.947 10.556 ( -1.295 0.000 7.064) 7.181 10.628 ( -3.286 0.000 -1.895) 3.793 11.029 ( -11.987 0.000 -8.275) 14.566 11.738 ( 2.967 0.000 8.566) 9.066 12.091 ( 3.966 0.000 -17.694) 18.134 14.239 ( 4.154 0.000 8.416) 9.386 14.960 ( -6.479 0.000 -11.705) 13.379 15.233 ( 11.554 0.000 -7.272) 13.652 15.356 ( -3.648 0.000 7.150) 8.027 18.061 ( 20.543 0.000 -10.125) 22.903 19.152 ( -31.021 0.000 -6.973) 31.795 19.869 ( 7.683 0.000 1.837) 7.899 20.016 ( -2.162 0.000 -3.029) 3.721 21.163 ( 39.255 0.000 -1.235) 39.275 22.132 ( -16.889 0.000 16.832) 23.844 23.714 ( 1.801 0.000 1.559) 2.382 24.117 ( -4.473 0.000 -2.741) 5.246 ======================= Grid point 379 (191/260) ======================= q-point: ( 0.00 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.906 ( -0.073 13.285 15.552) 20.454 2.069 ( -1.927 10.333 12.724) 16.503 2.747 ( 7.130 3.461 -2.916) 8.445 2.992 ( 2.399 7.367 -11.491) 13.859 3.600 ( 2.785 -3.190 2.403) 4.869 3.746 ( -4.182 0.084 -2.194) 4.723 4.179 ( 10.445 0.452 21.501) 23.908 4.342 ( 2.949 4.284 15.514) 16.363 4.824 ( -8.986 -3.195 -1.276) 9.622 5.049 ( -6.960 -0.311 -0.479) 6.983 5.676 ( 1.121 -2.126 1.849) 3.033 5.792 ( 2.880 -0.672 -3.616) 4.671 6.298 ( -8.901 3.716 15.679) 18.408 6.942 ( 4.679 8.011 -16.859) 19.243 7.664 ( 1.283 12.668 18.912) 22.799 8.171 ( -6.359 5.971 -2.531) 9.082 8.441 ( -11.217 13.471 4.646) 18.135 8.829 ( 10.952 1.663 -11.817) 16.197 9.876 ( 13.847 -1.250 21.457) 25.567 10.409 ( -2.684 -4.027 -4.348) 6.506 10.737 ( 0.787 -1.015 -2.012) 2.387 10.899 ( -4.253 15.334 -11.206) 19.463 11.820 ( 1.003 2.991 3.576) 4.768 12.216 ( 6.403 4.160 -14.123) 16.055 14.297 ( 4.576 -4.746 9.498) 11.562 14.789 ( -6.012 -2.604 -13.852) 15.323 15.221 ( -5.173 -4.856 2.993) 7.700 15.363 ( 8.246 -5.483 -4.766) 10.989 18.103 ( -25.542 -18.741 10.370) 33.334 18.470 ( 7.723 -5.556 -9.225) 13.252 19.918 ( -0.678 -3.226 1.689) 3.704 19.999 ( 1.419 -0.703 -2.361) 2.843 21.676 ( -27.576 -0.795 8.353) 28.825 21.939 ( 37.991 -5.637 -5.033) 38.735 23.947 ( 7.885 10.100 1.699) 12.926 24.071 ( -5.998 6.177 -4.105) 9.538 ======================= Grid point 380 (192/260) ======================= q-point: ( 0.10 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.980 ( 4.380 9.396 15.178) 18.380 2.178 ( 9.655 11.449 8.638) 17.289 2.865 ( 4.265 1.117 -7.715) 8.886 3.052 ( 7.206 7.125 -11.973) 15.686 3.586 ( -3.864 -3.158 0.900) 5.071 3.619 ( -7.530 -1.560 -2.320) 8.033 4.452 ( 8.091 3.189 15.082) 17.410 4.464 ( 5.975 4.272 15.254) 16.931 4.660 ( -4.398 -4.221 -0.018) 6.096 4.907 ( -7.382 -1.191 3.687) 8.338 5.690 ( 0.251 -3.156 0.207) 3.173 5.838 ( 2.282 1.105 -3.608) 4.410 6.264 ( 1.132 3.682 14.308) 14.818 7.039 ( 8.474 6.342 -13.213) 16.930 7.718 ( -0.978 13.147 20.508) 24.380 8.033 ( -6.158 9.354 -3.347) 11.689 8.278 ( -5.170 12.255 7.756) 15.397 9.118 ( 18.982 0.453 -10.710) 21.800 10.071 ( -2.900 -7.154 10.387) 12.941 10.327 ( 0.640 -3.853 -1.903) 4.345 10.819 ( 5.303 11.467 -1.666) 12.743 10.943 ( 12.808 10.461 -9.934) 19.291 11.792 ( -4.116 1.352 -1.189) 4.492 12.354 ( 10.577 4.009 -15.192) 18.940 14.403 ( 3.380 -6.255 8.869) 11.368 14.640 ( -5.984 -3.378 -12.829) 14.554 15.096 ( -7.415 -3.464 1.134) 8.263 15.499 ( 6.316 -5.624 -4.123) 9.409 17.470 ( -30.097 -7.575 17.249) 35.507 18.881 ( 24.356 -13.801 0.583) 28.001 19.813 ( -9.068 -5.068 -0.281) 10.392 19.978 ( -3.924 0.538 -1.000) 4.085 21.080 ( -31.932 4.015 4.243) 32.462 22.620 ( 30.802 -10.169 -11.453) 34.400 23.923 ( -7.700 5.838 -4.879) 10.825 24.112 ( 7.987 9.003 0.833) 12.064 ======================= Grid point 381 (193/260) ======================= q-point: ( 0.20 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.155 ( 9.786 2.873 12.197) 15.900 2.434 ( 13.310 12.553 8.111) 20.013 2.865 ( -0.882 2.508 -15.067) 15.300 3.201 ( 6.907 2.730 -6.928) 10.157 3.458 ( -4.744 -5.114 -7.571) 10.295 3.497 ( -5.212 -0.114 -0.704) 5.261 4.354 ( -9.817 -3.642 -3.655) 11.091 4.598 ( -4.443 5.254 12.781) 14.515 4.765 ( 7.518 4.918 9.125) 12.805 4.881 ( 7.862 -6.143 14.093) 17.267 5.690 ( -0.211 -1.967 -0.548) 2.053 5.859 ( 0.622 3.367 -3.138) 4.644 6.362 ( 5.046 2.184 11.560) 12.801 7.204 ( 9.991 4.327 -7.785) 13.385 7.694 ( -5.219 9.217 14.863) 18.251 7.935 ( -3.229 14.143 0.843) 14.531 8.283 ( 2.388 12.494 14.627) 19.385 9.492 ( 20.275 -1.831 -10.045) 22.700 9.882 ( -10.732 -11.189 -11.075) 19.053 10.431 ( 4.667 1.211 16.290) 16.988 10.916 ( 6.499 14.186 -6.034) 16.730 11.256 ( 14.509 8.359 -3.666) 17.142 11.687 ( -3.135 0.318 -4.145) 5.207 12.548 ( 12.517 5.327 -19.459) 23.743 14.405 ( -5.211 -8.261 -3.912) 10.522 14.506 ( -6.825 -5.418 2.533) 9.074 14.975 ( -3.355 0.067 1.353) 3.618 15.589 ( 3.554 -5.506 -3.957) 7.655 17.095 ( -11.237 -2.497 18.432) 21.731 19.298 ( 12.785 -13.620 0.836) 18.699 19.571 ( -14.524 -9.512 -2.664) 17.565 19.870 ( -5.042 -0.485 2.909) 5.842 20.517 ( -22.778 11.434 5.764) 26.130 23.063 ( 16.105 -8.932 -18.917) 26.401 23.774 ( -4.910 2.795 -1.725) 5.908 24.252 ( 5.882 6.367 -0.918) 8.716 ======================= Grid point 382 (194/260) ======================= q-point: ( 0.30 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.400 ( 12.139 -1.216 8.306) 14.759 2.720 ( 13.229 11.274 8.504) 19.350 2.792 ( -2.266 1.779 -16.594) 16.842 3.130 ( -10.010 -0.028 -4.043) 10.795 3.386 ( -4.777 -1.201 -2.679) 5.607 3.545 ( 12.024 -4.154 -11.452) 17.117 4.137 ( -11.369 -6.560 -0.396) 13.132 4.421 ( -12.173 2.610 2.453) 12.689 4.963 ( 8.670 1.822 16.154) 18.424 5.127 ( 11.266 1.384 10.669) 15.578 5.675 ( -1.271 -0.143 -0.863) 1.543 5.848 ( -1.184 4.589 -3.222) 5.731 6.504 ( 6.716 1.935 11.612) 13.553 7.363 ( 6.117 4.433 -4.266) 8.676 7.618 ( -4.048 4.171 11.477) 12.865 7.900 ( -1.175 15.465 4.097) 16.042 8.398 ( 4.523 13.211 20.039) 24.425 9.650 ( -6.027 -16.484 -18.190) 25.277 9.869 ( 16.161 -0.313 -5.238) 16.992 10.539 ( 2.267 6.895 13.131) 15.004 11.067 ( 10.156 11.778 -5.517) 16.502 11.279 ( -9.723 2.555 6.186) 11.803 11.808 ( 13.081 6.270 -5.749) 15.604 12.741 ( 11.418 5.753 -25.844) 28.834 14.248 ( -7.418 -7.187 -7.971) 13.047 14.318 ( -12.968 -6.571 10.544) 17.959 14.988 ( 2.709 0.494 4.735) 5.477 15.618 ( 0.266 -5.401 -4.672) 7.146 17.102 ( 7.815 -0.243 12.636) 14.859 19.169 ( -19.456 -0.520 -6.137) 20.408 19.326 ( -10.689 -14.158 -2.798) 17.959 19.742 ( -12.828 4.596 -1.052) 13.667 20.434 ( 12.858 2.565 20.225) 24.103 23.116 ( -4.911 -2.984 -25.143) 25.791 23.794 ( 6.385 -3.745 2.282) 7.746 24.333 ( 2.676 3.431 -2.600) 5.069 ======================= Grid point 383 (195/260) ======================= q-point: ( 0.40 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.647 ( 10.159 -2.389 3.688) 11.069 2.717 ( -1.118 0.639 -13.882) 13.942 2.875 ( -8.921 -0.242 -0.780) 8.958 3.002 ( 7.635 9.151 1.843) 12.059 3.302 ( -2.563 -3.168 1.671) 4.404 3.769 ( 11.538 -6.784 -9.997) 16.706 3.916 ( -10.001 -5.655 2.347) 11.727 4.159 ( -14.404 0.945 -0.142) 14.435 5.157 ( 7.297 2.413 13.155) 15.236 5.340 ( 7.790 4.402 8.564) 12.385 5.638 ( -2.103 1.537 -0.693) 2.696 5.796 ( -3.176 4.861 -3.071) 6.568 6.684 ( 8.759 2.461 12.404) 15.383 7.375 ( -3.238 5.554 -5.329) 8.351 7.633 ( 2.156 1.380 12.957) 13.208 7.897 ( -0.265 13.009 4.648) 13.817 8.527 ( 3.287 12.725 21.691) 25.362 9.523 ( -2.267 -18.012 -18.589) 25.983 10.130 ( 9.674 -1.217 -1.494) 9.864 10.554 ( -2.096 11.125 -2.938) 11.695 11.074 ( -10.515 2.510 17.261) 20.367 11.296 ( 12.104 10.310 0.193) 15.901 11.995 ( 5.037 7.313 -1.935) 9.088 12.847 ( 4.820 4.622 -31.768) 32.463 14.091 ( -10.572 -5.927 10.767) 16.212 14.136 ( -1.983 -6.217 -4.648) 8.011 15.063 ( 3.090 -0.597 7.921) 8.523 15.580 ( -2.669 -4.981 -5.868) 8.147 17.422 ( 21.139 0.922 6.587) 22.160 18.722 ( -22.975 -0.314 -9.045) 24.693 19.132 ( -6.747 -3.471 0.435) 7.600 19.453 ( -13.370 5.709 -3.459) 14.944 20.866 ( 21.712 -4.450 25.516) 33.798 22.852 ( -14.362 -2.932 -26.501) 30.284 23.954 ( 8.011 -4.278 1.993) 9.298 24.342 ( -1.066 1.186 -4.050) 4.352 ======================= Grid point 384 (196/260) ======================= q-point: (-0.50 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.566 ( -12.984 0.141 -0.708) 13.004 2.711 ( 2.234 -0.341 -8.919) 9.201 2.888 ( 4.236 -1.580 1.487) 4.759 3.061 ( 1.152 4.402 -7.012) 8.359 3.331 ( -0.029 -5.253 15.010) 15.903 3.757 ( -1.045 -4.279 -0.636) 4.450 3.852 ( -15.741 0.671 -1.733) 15.850 3.990 ( 8.929 -3.928 -4.030) 10.554 5.300 ( 4.260 2.992 10.605) 11.814 5.455 ( 1.488 4.302 6.398) 7.852 5.598 ( -1.586 3.086 0.566) 3.516 5.725 ( -2.730 4.968 -2.993) 6.411 6.897 ( 9.528 3.439 12.372) 15.990 7.267 ( -5.504 5.096 -7.276) 10.450 7.706 ( 1.662 0.570 11.520) 11.654 7.907 ( 0.262 10.268 3.872) 10.977 8.615 ( 0.814 10.326 20.822) 23.256 9.460 ( -0.764 -16.981 -17.499) 24.396 10.167 ( -7.827 0.193 3.243) 8.474 10.523 ( 4.201 9.466 -15.477) 18.622 10.956 ( -7.188 5.685 27.493) 28.980 11.519 ( 9.052 10.106 2.039) 13.719 11.989 ( -5.125 7.061 3.545) 9.418 12.769 ( -5.081 2.814 -32.369) 32.886 13.955 ( -5.079 -5.806 9.020) 11.868 14.190 ( 8.048 -5.283 -4.606) 10.672 15.147 ( 3.421 -1.411 9.955) 10.621 15.495 ( -4.282 -4.167 -6.937) 9.155 17.918 ( 26.560 1.628 3.696) 26.865 18.255 ( -20.699 1.328 -12.302) 24.115 19.073 ( -1.210 3.159 4.590) 5.702 19.266 ( -2.397 0.684 -3.984) 4.700 21.346 ( 20.182 -4.594 27.449) 34.379 22.453 ( -19.604 -5.500 -28.722) 35.207 24.098 ( 5.864 -2.354 2.434) 6.772 24.274 ( -4.741 0.146 -5.212) 7.047 ======================= Grid point 385 (197/260) ======================= q-point: (-0.40 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.312 ( -12.257 2.149 5.226) 13.497 2.726 ( -6.842 -0.325 -0.269) 6.855 2.831 ( 1.105 -0.877 -1.020) 1.740 3.186 ( 7.802 -0.630 -4.014) 8.797 3.269 ( -5.697 -2.119 6.750) 9.083 3.524 ( -15.634 3.631 -2.896) 16.309 3.870 ( 8.795 -4.336 2.580) 10.139 4.123 ( 4.293 -1.345 3.187) 5.513 5.365 ( -0.180 0.293 8.331) 8.339 5.430 ( -3.740 1.155 2.898) 4.870 5.579 ( -1.089 5.448 2.161) 5.961 5.695 ( 0.265 5.942 -1.895) 6.242 7.095 ( 7.140 4.322 11.102) 13.889 7.142 ( -4.701 4.860 -10.475) 12.468 7.718 ( -3.762 -0.831 8.304) 9.154 7.930 ( 1.883 9.013 1.839) 9.390 8.665 ( 0.175 7.297 20.406) 21.672 9.388 ( -3.396 -13.166 -14.382) 19.792 9.925 ( -14.364 5.286 -1.025) 15.340 10.612 ( 5.064 3.821 -6.010) 8.738 10.875 ( -7.045 5.285 21.960) 23.660 11.619 ( -0.516 8.907 2.138) 9.174 11.868 ( -6.801 10.026 11.786) 16.902 12.541 ( -9.679 2.084 -30.394) 31.966 13.928 ( 0.242 -6.171 7.238) 9.515 14.399 ( 13.423 -4.906 -6.555) 15.724 15.238 ( 3.238 -2.471 10.708) 11.456 15.387 ( -4.884 -3.152 -7.761) 9.697 17.873 ( -13.314 1.714 -14.862) 20.027 18.461 ( 26.046 2.125 3.352) 26.347 19.077 ( 2.362 -4.501 3.844) 6.372 19.381 ( 12.596 5.594 -0.049) 13.782 21.767 ( 14.852 -3.295 26.611) 30.652 21.955 ( -23.018 -7.456 -29.064) 37.817 24.133 ( -7.220 -0.115 -5.232) 8.917 24.199 ( 2.939 0.212 1.946) 3.531 ======================= Grid point 386 (198/260) ======================= q-point: (-0.30 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.131 ( -7.761 4.072 13.872) 16.409 2.477 ( -14.926 2.398 7.014) 16.665 2.974 ( 9.665 -1.438 2.560) 10.101 3.121 ( -9.637 3.927 -5.588) 11.812 3.149 ( -10.485 2.164 -0.140) 10.706 3.445 ( 8.661 0.949 -3.674) 9.456 4.015 ( 3.497 -5.062 3.435) 7.046 4.191 ( 1.790 2.748 12.920) 13.330 5.308 ( -5.735 -6.444 0.885) 8.672 5.373 ( -3.462 1.973 4.333) 5.887 5.568 ( -0.093 5.631 1.835) 5.923 5.708 ( 0.889 5.572 0.439) 5.659 7.033 ( -3.294 5.044 -13.404) 14.695 7.189 ( -2.230 2.004 5.815) 6.543 7.592 ( -8.487 1.212 8.621) 12.158 8.002 ( 5.059 9.080 0.210) 10.397 8.734 ( 1.737 6.944 21.716) 22.866 9.254 ( -6.880 -8.708 -11.306) 15.843 9.637 ( -13.974 6.775 -1.848) 15.639 10.628 ( -5.054 0.605 11.604) 12.672 10.804 ( -1.705 3.346 1.971) 4.242 11.525 ( -7.769 4.880 4.247) 10.110 11.792 ( -5.067 14.298 14.764) 21.168 12.300 ( -6.718 3.088 -28.439) 29.385 13.983 ( 3.385 -6.250 7.017) 9.988 14.666 ( 14.714 -5.215 -7.630) 17.376 15.252 ( -5.604 -3.150 -6.802) 9.359 15.323 ( 1.245 -2.483 8.034) 8.500 17.683 ( -2.115 0.206 -15.445) 15.590 18.956 ( 23.265 0.090 4.417) 23.681 19.210 ( 9.319 -11.275 2.737) 14.882 19.696 ( 17.778 7.627 1.678) 19.418 21.360 ( -27.166 -7.515 -28.273) 39.922 22.102 ( 9.867 -1.210 26.392) 28.202 23.962 ( -7.973 1.625 -5.610) 9.884 24.241 ( 0.647 2.019 1.711) 2.725 ======================= Grid point 387 (199/260) ======================= q-point: (-0.20 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.046 ( -6.432 4.397 18.181) 19.780 2.240 ( -9.643 9.122 14.473) 19.639 2.826 ( -12.461 8.551 -8.096) 17.145 3.042 ( -3.358 2.372 -1.922) 4.538 3.214 ( 12.140 -1.426 4.384) 12.986 3.620 ( 9.275 0.486 -5.942) 11.026 4.021 ( -3.298 -1.105 12.963) 13.422 4.259 ( 1.109 2.196 14.529) 14.736 5.171 ( -8.005 -4.937 -0.412) 9.414 5.292 ( -5.017 -1.008 0.170) 5.120 5.589 ( 1.504 3.381 3.292) 4.953 5.728 ( 1.012 3.070 0.319) 3.249 6.931 ( -12.250 0.516 -1.886) 12.405 6.981 ( -8.726 3.116 -11.104) 14.462 7.542 ( 0.049 8.414 14.394) 16.673 8.122 ( 6.893 8.942 -2.295) 11.521 8.757 ( -6.174 6.903 16.647) 19.049 9.092 ( -7.540 -0.001 -11.332) 13.611 9.420 ( -4.677 2.762 6.772) 8.682 10.521 ( -6.841 -0.799 13.376) 15.046 10.785 ( -0.825 1.547 -4.333) 4.674 11.351 ( -10.974 6.389 1.434) 12.779 11.735 ( -2.197 8.462 9.458) 12.880 12.175 ( -0.615 6.182 -20.513) 21.433 14.080 ( 4.447 -5.794 7.752) 10.651 14.933 ( 13.705 -5.846 -7.703) 16.773 15.104 ( -6.899 -1.957 -10.070) 12.363 15.347 ( -1.122 -3.487 8.113) 8.902 17.720 ( 8.762 -3.852 -12.883) 16.050 19.326 ( 2.194 -5.441 -2.579) 6.409 19.432 ( 19.093 -13.336 4.438) 23.708 20.004 ( 8.382 0.390 -1.629) 8.547 20.881 ( -7.637 1.774 -15.090) 17.005 22.251 ( -1.426 -1.024 22.467) 22.536 23.826 ( -3.794 4.948 -3.774) 7.288 24.232 ( -1.710 3.846 0.145) 4.212 ======================= Grid point 388 (200/260) ======================= q-point: (-0.10 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.934 ( -6.465 8.679 15.127) 18.600 2.144 ( -6.740 12.089 18.983) 23.493 2.669 ( -0.420 7.022 -5.611) 8.999 2.994 ( -0.433 5.073 -7.047) 8.694 3.456 ( 10.369 -2.243 4.167) 11.398 3.760 ( 4.919 1.381 -7.291) 8.903 4.010 ( 0.362 -0.728 22.384) 22.399 4.292 ( -0.618 3.081 15.575) 15.888 5.001 ( -8.857 -3.248 0.043) 9.434 5.181 ( -5.986 -1.172 -1.968) 6.410 5.635 ( 2.160 0.471 3.357) 4.019 5.752 ( 1.695 0.250 -1.749) 2.448 6.554 ( -19.263 0.191 10.830) 22.100 6.924 ( 1.308 7.867 -18.142) 19.818 7.596 ( 1.419 10.973 16.213) 19.629 8.230 ( 2.798 7.053 -3.455) 8.337 8.610 ( -8.258 8.077 8.081) 14.097 8.859 ( -10.406 5.319 -12.172) 16.874 9.554 ( 12.246 0.233 17.468) 21.334 10.446 ( -3.072 -1.752 7.698) 8.472 10.754 ( -0.966 -0.161 -4.672) 4.773 11.105 ( -12.252 9.562 -7.211) 17.133 11.763 ( 2.409 3.833 7.048) 8.376 12.160 ( 2.761 6.396 -15.069) 16.601 14.187 ( 4.487 -5.046 8.734) 11.040 14.943 ( -6.591 -2.002 -12.744) 14.487 15.164 ( 10.851 -6.290 -5.619) 13.743 15.316 ( -3.226 -3.752 5.471) 7.377 17.953 ( 16.243 -9.883 -6.969) 20.251 19.003 ( -31.367 -14.456 -8.370) 35.538 19.782 ( 13.130 -5.466 1.571) 14.309 19.999 ( -1.328 -1.810 -2.398) 3.285 21.192 ( 33.270 2.627 -0.750) 33.382 22.114 ( -16.801 -1.714 14.962) 22.562 23.821 ( 3.729 8.720 -0.078) 9.484 24.175 ( -3.840 5.325 -2.011) 6.866 ======================= Grid point 389 (201/260) ======================= q-point: ( 0.00 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.234 ( 0.730 16.692 12.762) 21.024 2.346 ( -2.402 15.281 12.459) 19.862 2.845 ( 3.543 5.339 -0.406) 6.421 3.136 ( 2.301 4.741 -9.887) 11.203 3.562 ( 1.905 0.710 2.921) 3.559 3.796 ( -5.296 4.915 -5.926) 9.344 4.185 ( 12.469 -0.561 17.887) 21.811 4.413 ( 3.307 2.894 21.002) 21.457 4.731 ( -9.364 -5.442 -4.361) 11.676 5.043 ( -5.610 -0.276 -2.883) 6.314 5.603 ( -0.692 -5.102 2.672) 5.801 5.776 ( 3.128 -0.711 -7.078) 7.771 6.405 ( -6.885 6.298 19.653) 21.756 7.160 ( 3.618 12.107 -18.097) 22.072 7.974 ( 2.130 15.248 18.148) 23.799 8.394 ( -3.071 15.269 2.188) 15.728 8.760 ( -13.084 14.425 -0.036) 19.475 8.879 ( 11.538 4.591 -4.732) 13.289 9.847 ( 11.795 -1.419 13.799) 18.208 10.308 ( -9.932 -7.061 -8.952) 15.121 10.757 ( 9.249 5.024 8.665) 13.634 11.174 ( -1.121 7.666 -11.457) 13.831 11.996 ( -1.316 15.725 1.652) 15.866 12.343 ( 4.466 8.207 -11.946) 15.165 14.147 ( 4.201 -9.731 10.466) 14.896 14.679 ( -7.226 -8.799 -14.140) 18.154 15.095 ( -1.576 -7.035 -0.733) 7.247 15.212 ( 5.344 -7.838 -3.160) 9.999 17.659 ( -16.368 -22.056 17.094) 32.351 18.284 ( 1.543 -11.377 -16.359) 19.986 19.846 ( -0.952 -3.272 2.386) 4.160 19.977 ( 2.807 -1.263 -4.352) 5.331 21.663 ( -22.096 -0.303 6.260) 22.968 21.824 ( 27.819 -4.800 -1.896) 28.294 24.153 ( 6.719 8.565 0.347) 10.891 24.235 ( -4.556 8.715 -3.266) 10.362 ======================= Grid point 390 (202/260) ======================= q-point: ( 0.10 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.233 ( -0.942 13.851 12.001) 18.351 2.465 ( 9.268 15.002 10.545) 20.546 2.929 ( 4.037 4.069 -1.878) 6.032 3.161 ( 3.157 2.308 -11.941) 12.565 3.533 ( -5.074 -0.024 1.087) 5.189 3.641 ( -7.986 3.541 -3.040) 9.249 4.489 ( 2.058 -9.656 5.802) 11.451 4.517 ( 0.151 1.570 5.467) 5.690 4.569 ( 7.297 4.670 19.565) 21.397 4.909 ( -7.018 1.150 -3.963) 8.141 5.619 ( 1.799 -3.922 1.311) 4.510 5.842 ( 4.471 -0.649 -5.963) 7.482 6.374 ( -0.996 6.611 18.581) 19.747 7.214 ( 5.946 9.754 -15.083) 18.921 8.016 ( -2.937 14.252 15.541) 21.290 8.360 ( -1.176 21.108 3.433) 21.417 8.579 ( -4.257 14.796 2.491) 15.596 9.142 ( 15.296 2.506 -3.910) 15.986 9.921 ( -10.336 -7.978 -0.387) 13.063 10.215 ( 6.372 -4.900 2.829) 8.521 11.062 ( 18.941 9.881 7.100) 22.512 11.184 ( 4.874 9.875 -16.174) 19.567 11.895 ( -8.093 10.825 -1.931) 13.653 12.491 ( 11.908 9.363 -10.984) 18.711 14.223 ( 0.615 -10.772 9.583) 14.430 14.499 ( -7.966 -10.573 -11.194) 17.336 15.025 ( -3.540 -3.143 -2.080) 5.171 15.332 ( 6.180 -9.891 -3.442) 12.160 17.270 ( -20.659 -10.806 19.226) 30.219 18.514 ( 18.307 -19.609 -4.919) 27.274 19.736 ( -9.335 -2.370 -0.805) 9.665 19.965 ( -3.861 -1.450 -2.653) 4.904 21.178 ( -24.861 5.029 3.871) 25.659 22.390 ( 27.240 -10.810 -5.658) 29.848 24.068 ( -9.122 7.405 -3.762) 12.337 24.300 ( 5.685 8.066 -1.023) 9.920 ======================= Grid point 391 (203/260) ======================= q-point: ( 0.20 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.293 ( 4.360 9.623 10.705) 15.040 2.690 ( 10.085 11.136 10.861) 18.538 2.953 ( -0.816 5.316 -8.123) 9.742 3.231 ( 6.304 -1.738 -10.404) 12.288 3.374 ( -9.247 0.300 -4.802) 10.424 3.510 ( -4.976 1.270 -1.279) 5.292 4.237 ( -13.181 -8.581 -5.442) 16.643 4.631 ( -9.350 -5.889 6.817) 12.984 4.779 ( 9.762 3.512 16.557) 19.538 4.920 ( 12.786 7.023 6.083) 15.805 5.666 ( 2.237 -0.893 0.954) 2.591 5.909 ( 3.117 1.327 -4.540) 5.665 6.437 ( 3.215 4.952 15.761) 16.831 7.333 ( 8.817 7.539 -10.482) 15.635 7.917 ( -8.717 12.062 9.894) 17.871 8.338 ( -2.583 22.331 5.338) 23.105 8.612 ( 5.015 17.712 8.760) 20.387 9.419 ( 8.572 -6.053 -4.663) 11.483 9.680 ( -5.351 -6.404 -6.412) 10.524 10.405 ( 9.253 -1.957 8.810) 12.925 11.258 ( 5.613 10.516 -16.004) 19.956 11.468 ( 15.112 14.842 8.079) 22.670 11.732 ( -2.864 6.091 -6.908) 9.645 12.721 ( 13.273 11.128 -13.339) 21.861 14.186 ( -5.639 -12.300 -0.136) 13.532 14.318 ( -9.069 -12.254 0.395) 15.250 14.977 ( -0.606 -0.172 -0.695) 0.938 15.424 ( 3.728 -9.951 -3.633) 11.230 17.035 ( -6.435 -2.830 18.645) 19.927 18.857 ( 14.283 -24.077 -0.724) 28.004 19.496 ( -13.987 -0.775 -3.807) 14.517 19.846 ( -5.944 -1.577 1.052) 6.239 20.748 ( -18.685 10.272 5.015) 21.904 22.835 ( 18.668 -11.935 -11.566) 24.994 23.859 ( -10.304 4.697 -2.554) 11.609 24.382 ( 2.859 5.517 -2.114) 6.563 ======================= Grid point 392 (204/260) ======================= q-point: ( 0.30 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.441 ( 8.021 4.683 8.730) 12.747 2.837 ( -1.391 3.566 -2.862) 4.779 2.924 ( 3.258 5.632 0.543) 6.529 3.180 ( -6.427 6.162 -6.679) 11.131 3.319 ( -0.163 -5.041 -5.562) 7.508 3.458 ( 3.371 -3.513 -6.664) 8.253 3.973 ( -12.183 -9.782 -2.119) 15.767 4.395 ( -13.331 -5.196 0.595) 14.320 5.014 ( 10.219 4.073 14.772) 18.418 5.214 ( 13.248 6.165 8.965) 17.143 5.701 ( 1.034 2.212 0.935) 2.615 5.935 ( 0.256 3.522 -3.275) 4.816 6.567 ( 6.590 4.246 13.965) 16.014 7.490 ( 7.751 7.326 -6.509) 12.495 7.766 ( -7.725 9.380 9.586) 15.477 8.284 ( -3.796 19.877 4.740) 20.784 8.749 ( 5.196 18.608 11.434) 22.450 9.293 ( -9.220 -16.523 -10.660) 21.717 9.875 ( 15.448 1.110 0.099) 15.488 10.590 ( 7.266 -0.300 4.955) 8.800 11.259 ( -4.751 1.559 -4.903) 7.003 11.529 ( 1.911 23.888 0.720) 23.975 11.955 ( 15.992 7.271 -3.890) 17.993 12.926 ( 10.167 11.711 -18.614) 24.228 14.036 ( -7.142 -12.959 -6.732) 16.257 14.130 ( -11.261 -11.020 9.897) 18.607 14.994 ( 1.676 -0.171 2.869) 3.327 15.459 ( 0.718 -9.440 -4.212) 10.362 17.108 ( 9.864 1.044 13.589) 16.824 18.989 ( -0.916 -16.040 -3.958) 16.546 19.176 ( -16.110 -0.488 -4.265) 16.672 19.780 ( -4.022 -0.292 1.934) 4.472 20.532 ( -2.026 6.579 13.240) 14.923 23.003 ( -0.066 -7.662 -22.205) 23.490 23.730 ( -0.370 -2.046 4.385) 4.853 24.404 ( -0.015 2.985 -3.437) 4.553 ======================= Grid point 393 (205/260) ======================= q-point: ( 0.40 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.625 ( 7.954 0.003 4.182) 8.986 2.746 ( -4.300 2.489 -6.613) 8.272 2.876 ( -6.551 0.670 -5.125) 8.344 3.194 ( 4.419 3.273 5.882) 8.052 3.216 ( -5.927 0.286 -5.758) 8.268 3.574 ( 6.612 -11.028 -9.206) 15.814 3.781 ( -5.492 -7.583 2.641) 9.728 4.133 ( -12.678 -3.514 -1.669) 13.262 5.236 ( 8.701 5.080 12.346) 15.936 5.454 ( 8.487 5.840 7.753) 12.893 5.709 ( -0.459 4.845 0.905) 4.950 5.904 ( -2.490 5.112 -2.294) 6.132 6.759 ( 9.572 4.764 13.244) 17.021 7.526 ( -3.534 8.380 -6.335) 11.083 7.716 ( 0.472 6.211 12.652) 14.102 8.220 ( -3.392 16.879 3.692) 17.608 8.833 ( 0.721 11.756 8.094) 14.291 9.158 ( -1.793 -12.703 -8.822) 15.570 10.123 ( 7.645 0.445 3.608) 8.465 10.684 ( 2.363 2.462 -8.015) 8.711 11.142 ( -5.704 3.770 15.857) 17.268 11.645 ( 8.793 21.187 -5.728) 23.644 12.168 ( 5.356 8.991 0.574) 10.481 12.998 ( 1.113 9.707 -24.157) 26.058 13.926 ( -7.104 -9.833 6.427) 13.728 13.948 ( -3.050 -11.327 -0.045) 11.731 15.044 ( 2.240 -1.250 5.736) 6.283 15.437 ( -1.738 -8.397 -4.859) 9.856 17.458 ( 22.132 2.657 7.583) 23.546 18.709 ( -20.629 -0.968 -8.062) 22.170 19.062 ( 2.753 -3.101 -1.159) 4.305 19.576 ( -15.242 5.500 -2.312) 16.368 20.759 ( 17.556 -5.048 23.399) 29.685 22.758 ( -16.465 -6.051 -26.830) 32.055 23.849 ( 8.689 -5.331 5.840) 11.749 24.366 ( -2.781 1.011 -4.933) 5.752 ======================= Grid point 394 (206/260) ======================= q-point: (-0.50 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.584 ( -10.938 1.458 -1.330) 11.115 2.698 ( 1.740 -0.610 -6.256) 6.522 2.880 ( 3.101 0.496 1.847) 3.643 3.054 ( -4.957 -5.653 0.825) 7.564 3.283 ( 0.562 1.335 1.890) 2.381 3.631 ( 4.100 -7.736 -6.020) 10.625 3.781 ( -2.696 -6.486 2.303) 7.392 3.936 ( -1.805 -1.627 -2.243) 3.307 5.397 ( 4.387 5.789 10.327) 12.626 5.545 ( -1.603 4.109 4.715) 6.457 5.707 ( 0.639 6.898 2.981) 7.542 5.847 ( -1.996 6.382 -2.310) 7.075 6.993 ( 10.672 5.716 12.569) 17.451 7.402 ( -6.222 7.295 -7.495) 12.170 7.750 ( -1.307 3.393 13.669) 14.144 8.174 ( -1.627 14.427 1.549) 14.601 8.830 ( -1.833 4.618 5.804) 7.640 9.152 ( 1.833 -7.381 -6.948) 10.301 10.161 ( -4.676 0.094 7.345) 8.708 10.691 ( 2.124 6.454 -13.965) 15.530 11.100 ( -4.526 7.548 22.634) 24.285 11.795 ( 5.845 14.049 -7.852) 17.123 12.194 ( -1.729 13.234 8.673) 15.917 12.864 ( -8.103 6.310 -24.003) 26.108 13.792 ( -5.792 -9.398 8.383) 13.861 14.034 ( 9.347 -9.579 -4.346) 14.072 15.106 ( 2.460 -2.475 7.205) 8.005 15.376 ( -3.079 -6.880 -5.371) 9.256 17.969 ( 26.604 3.187 3.501) 27.022 18.287 ( -18.202 1.568 -11.455) 21.564 19.162 ( -0.435 5.061 2.661) 5.734 19.289 ( -4.223 1.641 -2.699) 5.273 21.215 ( 21.164 -7.662 27.112) 35.237 22.301 ( -22.693 -8.603 -28.228) 37.226 24.036 ( 8.259 -3.368 4.665) 10.066 24.274 ( -5.144 -0.188 -6.604) 8.373 ======================= Grid point 395 (207/260) ======================= q-point: (-0.40 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.373 ( -9.733 3.451 4.438) 11.240 2.724 ( -5.338 0.533 3.266) 6.281 2.797 ( 0.520 -2.331 -0.077) 2.390 3.137 ( 5.283 -3.199 5.191) 8.068 3.262 ( 0.615 0.337 -5.407) 5.452 3.588 ( -10.290 1.834 -6.715) 12.424 3.762 ( 7.175 -5.237 0.257) 8.887 4.048 ( 7.671 -6.039 4.075) 10.579 5.388 ( -8.023 2.816 5.531) 10.143 5.499 ( -1.881 4.322 5.171) 6.997 5.721 ( -0.645 7.306 4.177) 8.440 5.827 ( 0.043 6.442 -2.510) 6.914 7.201 ( 6.182 5.167 10.260) 13.045 7.268 ( -4.895 6.696 -11.079) 13.840 7.709 ( -5.634 0.172 14.748) 15.789 8.178 ( 2.084 13.885 0.820) 14.065 8.817 ( 0.049 4.375 6.836) 8.116 9.162 ( -0.230 -6.101 -5.593) 8.280 10.014 ( -10.804 3.930 6.587) 13.250 10.709 ( 1.502 5.189 -7.061) 8.890 11.021 ( -8.261 8.648 17.109) 20.875 11.766 ( -6.463 4.841 -6.389) 10.297 12.221 ( 1.353 22.308 14.263) 26.512 12.619 ( -10.392 5.643 -22.199) 25.152 13.745 ( -0.660 -11.106 6.768) 13.023 14.252 ( 13.193 -9.159 -6.614) 17.370 15.165 ( 1.435 -4.522 7.273) 8.683 15.300 ( -3.118 -4.892 -5.630) 8.084 17.925 ( -12.968 3.208 -14.309) 19.576 18.522 ( 25.424 3.578 0.798) 25.687 18.980 ( -7.505 -4.638 2.814) 9.261 19.507 ( 15.885 6.140 1.528) 17.099 21.674 ( 15.511 -5.498 24.823) 29.782 21.761 ( -22.194 -10.246 -24.831) 34.845 24.120 ( -5.262 -0.966 -5.386) 7.592 24.205 ( 4.577 0.103 0.868) 4.660 ======================= Grid point 396 (208/260) ======================= q-point: (-0.30 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.244 ( -5.022 6.522 12.633) 15.079 2.546 ( -9.814 3.972 9.692) 14.354 2.943 ( 9.758 -1.230 2.942) 10.265 3.148 ( -1.282 1.670 -1.089) 2.370 3.278 ( -6.917 6.644 -5.940) 11.282 3.453 ( 4.442 -0.431 -4.406) 6.271 3.901 ( 6.295 -5.705 -1.144) 8.572 4.200 ( 5.531 -2.843 10.904) 12.553 5.204 ( -10.010 -1.976 2.216) 10.441 5.436 ( -5.788 3.436 3.934) 7.796 5.705 ( -1.779 6.357 3.847) 7.640 5.816 ( -0.715 4.929 -2.477) 5.563 7.167 ( -3.869 6.731 -9.386) 12.181 7.187 ( -9.192 -2.071 1.508) 9.542 7.676 ( 0.605 7.007 16.892) 18.297 8.259 ( 5.424 14.678 2.135) 15.793 8.895 ( 6.050 6.142 8.880) 12.376 9.091 ( -6.096 -5.160 -3.257) 8.625 9.782 ( -13.387 6.923 2.587) 15.292 10.698 ( -3.036 4.333 6.815) 8.628 10.867 ( -8.567 4.958 3.564) 10.521 11.593 ( -9.037 1.960 0.628) 9.268 12.208 ( -7.294 21.700 5.059) 23.446 12.425 ( -2.687 10.753 -14.852) 18.532 13.790 ( 3.431 -12.231 6.673) 14.349 14.506 ( 13.815 -10.233 -8.679) 19.259 15.154 ( -4.012 -5.972 0.149) 7.196 15.258 ( -0.121 -3.557 0.345) 3.576 17.705 ( -5.803 2.304 -14.487) 15.775 18.851 ( 4.949 -12.130 2.717) 13.379 19.068 ( 17.696 -0.161 0.412) 17.702 19.822 ( 13.823 4.070 0.537) 14.420 21.210 ( -21.501 -5.580 -22.705) 31.764 22.053 ( 11.683 -3.392 26.000) 28.705 23.985 ( -5.101 0.416 -7.733) 9.273 24.295 ( 3.235 2.823 1.670) 4.607 ======================= Grid point 397 (209/260) ======================= q-point: (-0.20 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.212 ( -2.517 11.182 15.123) 18.976 2.425 ( -4.685 7.704 16.198) 18.539 3.044 ( -11.177 11.356 -5.762) 16.943 3.092 ( 1.448 0.814 -0.403) 1.709 3.219 ( 10.617 4.288 -1.397) 11.536 3.610 ( 9.499 -2.166 -2.280) 10.006 3.990 ( 2.328 -2.436 2.086) 3.963 4.301 ( 1.259 1.472 17.920) 18.024 5.031 ( -7.268 -6.493 -1.953) 9.940 5.302 ( -7.817 1.329 2.146) 8.214 5.668 ( -2.821 2.718 4.604) 6.046 5.789 ( -1.105 3.115 -4.589) 5.655 6.881 ( -18.583 -3.294 11.251) 21.972 7.131 ( 1.507 9.057 -18.420) 20.581 7.769 ( 3.720 12.537 16.832) 21.315 8.380 ( 5.592 15.086 2.413) 16.269 8.889 ( -9.963 3.043 -1.472) 10.520 9.098 ( 7.286 2.141 9.764) 12.369 9.525 ( -10.844 6.822 0.315) 12.816 10.614 ( -7.464 9.150 17.460) 21.078 10.731 ( -4.529 -4.917 -8.989) 11.203 11.429 ( -8.152 0.947 3.138) 8.786 12.040 ( -6.310 17.910 -6.482) 20.065 12.389 ( -0.704 15.399 -6.152) 16.597 13.897 ( 5.413 -11.776 7.648) 15.049 14.744 ( 12.050 -12.311 -11.680) 20.814 15.045 ( -5.747 -3.748 -2.696) 7.372 15.253 ( -1.335 -5.039 2.476) 5.771 17.633 ( 1.115 -3.706 -9.327) 10.098 18.897 ( -3.035 -25.068 -3.960) 25.560 19.417 ( 16.297 2.762 -0.248) 16.531 19.964 ( 0.380 -3.668 -4.426) 5.760 20.960 ( 3.480 5.462 -7.530) 9.932 22.214 ( -1.624 -2.428 19.899) 20.112 23.924 ( 1.046 3.857 -5.291) 6.631 24.335 ( 0.484 5.388 0.374) 5.423 ======================= Grid point 398 (210/260) ======================= q-point: (-0.10 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.197 ( -1.266 15.814 12.432) 20.155 2.403 ( -3.795 11.179 19.399) 22.709 2.851 ( -5.017 9.904 -4.711) 12.060 3.112 ( 1.878 4.614 -6.383) 8.097 3.439 ( 9.550 2.221 1.963) 9.999 3.793 ( 8.347 1.019 -6.250) 10.478 4.013 ( 0.089 0.703 13.949) 13.967 4.344 ( -0.477 2.378 20.925) 21.065 4.896 ( -6.544 -6.492 -3.889) 10.005 5.160 ( -6.364 -0.719 -0.436) 6.419 5.626 ( -2.224 -2.303 4.384) 5.428 5.762 ( 0.042 1.070 -6.953) 7.035 6.574 ( -14.396 1.808 16.652) 22.086 7.137 ( 3.056 11.872 -19.207) 22.786 7.879 ( 3.304 14.750 17.421) 23.064 8.448 ( -0.805 13.386 2.702) 13.680 8.752 ( 0.015 4.441 -3.423) 5.607 9.043 ( -13.375 11.697 1.126) 17.804 9.560 ( 11.980 0.430 10.519) 15.948 10.495 ( -7.632 3.104 2.602) 8.640 10.662 ( -0.456 -3.284 1.896) 3.820 11.277 ( -6.882 3.552 -3.288) 8.413 11.979 ( 0.764 17.155 -2.345) 17.331 12.351 ( -1.181 12.209 -8.717) 15.048 14.026 ( 5.501 -10.475 9.087) 14.918 14.831 ( -3.090 -10.580 -16.882) 20.161 15.014 ( 5.814 -6.459 0.594) 8.710 15.214 ( -2.681 -5.413 0.790) 6.092 17.692 ( 4.633 -13.912 1.135) 14.707 18.607 ( -21.614 -21.211 -13.846) 33.299 19.714 ( 12.737 -1.156 0.809) 12.815 19.946 ( 0.605 -3.100 -2.502) 4.029 21.260 ( 24.078 3.705 0.118) 24.362 22.068 ( -16.078 -2.460 11.416) 19.872 24.003 ( 6.997 7.713 -1.310) 10.496 24.315 ( -2.390 7.359 -1.275) 7.842 ======================= Grid point 399 (211/260) ======================= q-point: ( 0.00 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.536 ( -2.119 11.186 14.191) 18.194 2.673 ( 1.899 15.576 11.275) 19.321 2.955 ( -0.493 5.244 -1.416) 5.455 3.170 ( 1.115 -0.269 -5.179) 5.304 3.611 ( -0.185 1.629 4.407) 4.702 3.923 ( -3.566 6.100 -8.796) 11.283 4.155 ( 11.264 -1.080 11.740) 16.306 4.486 ( 3.212 2.791 22.508) 22.906 4.630 ( -6.642 -1.870 -7.658) 10.308 5.027 ( -4.461 -1.638 -3.180) 5.718 5.467 ( -0.778 -7.601 4.737) 8.990 5.762 ( 1.709 -0.661 -10.014) 10.180 6.538 ( -4.873 5.935 23.243) 24.479 7.403 ( 2.022 10.406 -19.383) 22.092 8.255 ( 2.287 11.856 15.941) 19.998 8.719 ( 4.241 11.122 -4.424) 12.698 8.878 ( -3.499 4.121 11.535) 12.739 9.164 ( -0.129 17.506 -0.196) 17.508 9.808 ( 10.495 -2.647 5.717) 12.241 10.132 ( -12.029 -9.027 -10.278) 18.216 10.916 ( 9.601 8.662 11.858) 17.544 11.217 ( 0.332 -1.653 -3.034) 3.471 12.432 ( -2.485 23.496 -3.961) 23.957 12.558 ( 2.324 12.246 -7.138) 14.363 13.909 ( 4.755 -12.320 8.483) 15.695 14.398 ( -6.630 -18.154 -14.305) 24.045 14.939 ( 1.704 -6.921 0.496) 7.145 15.090 ( 0.978 -3.847 -6.234) 7.391 17.254 ( -12.500 -15.812 19.770) 28.233 18.048 ( 0.498 -10.189 -22.147) 24.384 19.791 ( -0.666 -1.945 2.671) 3.371 19.952 ( 2.806 -1.089 -5.781) 6.517 21.664 ( -17.202 0.310 4.616) 17.813 21.748 ( 19.259 -2.589 0.371) 19.436 24.296 ( 6.097 5.297 1.080) 8.149 24.388 ( -3.989 5.490 -3.041) 7.437 ======================= Grid point 400 (212/260) ======================= q-point: ( 0.10 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.510 ( -2.480 11.873 11.632) 16.805 2.767 ( 4.970 13.366 11.271) 18.176 2.997 ( 3.305 2.005 1.014) 3.997 3.163 ( -0.337 -0.533 -7.091) 7.119 3.569 ( -4.106 1.315 2.174) 4.828 3.762 ( -9.621 7.704 -5.606) 13.540 4.250 ( -7.624 -11.135 1.266) 13.554 4.531 ( 2.399 -0.997 -1.424) 2.963 4.687 ( 8.610 6.550 22.014) 24.528 4.937 ( -2.075 1.047 -4.266) 4.858 5.521 ( 4.803 -5.349 3.053) 7.810 5.818 ( 5.501 -1.406 -7.990) 9.802 6.518 ( -2.320 6.580 22.120) 23.194 7.409 ( 3.584 8.280 -17.286) 19.499 8.303 ( -2.629 13.379 13.091) 18.902 8.792 ( 3.009 6.419 -7.330) 10.197 8.798 ( -1.974 15.720 9.933) 18.699 9.281 ( 7.462 11.963 4.046) 14.668 9.748 ( -12.838 -7.543 -4.537) 15.566 10.133 ( 10.767 -3.812 1.537) 11.525 11.230 ( 18.958 6.336 4.957) 20.594 11.265 ( 5.511 -0.837 -5.776) 8.027 12.262 ( -9.392 22.336 -5.317) 24.807 12.731 ( 12.315 12.856 -5.028) 18.499 13.979 ( 0.041 -11.994 7.943) 14.386 14.206 ( -9.056 -17.110 -12.183) 22.874 14.951 ( 0.050 -4.551 -1.827) 4.904 15.137 ( 4.350 -7.363 -4.669) 9.743 17.058 ( -10.337 -8.794 21.580) 25.493 18.142 ( 11.776 -14.880 -12.595) 22.776 19.707 ( -7.848 -0.644 -0.087) 7.875 19.929 ( -4.004 -1.845 -4.404) 6.231 21.274 ( -19.433 3.951 3.523) 20.141 22.199 ( 22.806 -7.262 -1.444) 23.978 24.205 ( -10.478 5.378 -3.594) 12.314 24.428 ( 3.805 4.215 -0.427) 5.694 ======================= Grid point 401 (213/260) ======================= q-point: ( 0.20 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.515 ( 0.611 10.769 9.530) 14.394 2.888 ( 3.697 7.896 12.494) 15.235 3.043 ( -0.088 3.202 -1.446) 3.514 3.142 ( 0.828 -4.375 -6.663) 8.014 3.480 ( -4.417 3.588 -3.711) 6.794 3.558 ( -8.869 6.833 -5.201) 12.345 4.000 ( -14.251 -13.037 -4.503) 19.832 4.468 ( -9.266 -8.453 -2.907) 12.875 4.899 ( 8.502 6.244 17.524) 20.454 5.061 ( 13.006 6.066 5.165) 15.252 5.639 ( 5.894 -1.686 2.318) 6.554 5.917 ( 5.392 -0.331 -5.688) 7.844 6.555 ( 1.733 5.877 18.699) 19.678 7.488 ( 7.990 6.670 -14.348) 17.726 8.179 ( -10.969 12.568 9.751) 19.323 8.762 ( -4.374 16.464 6.341) 18.177 8.911 ( 7.801 6.625 -3.415) 10.789 9.276 ( -9.725 -3.630 -0.763) 10.409 9.669 ( 8.670 5.384 2.887) 10.606 10.361 ( 11.001 -2.678 2.399) 11.573 11.313 ( 0.844 -1.483 -7.083) 7.286 11.686 ( 23.356 4.860 -0.420) 23.860 12.100 ( -4.595 26.216 -4.283) 26.958 12.974 ( 12.812 11.680 -5.064) 18.061 13.915 ( -7.555 -13.506 -5.743) 16.506 14.024 ( -7.179 -14.918 2.593) 16.758 14.953 ( 0.671 -2.348 -0.753) 2.556 15.211 ( 3.694 -9.324 -4.255) 10.894 16.992 ( -0.294 -1.095 20.142) 20.174 18.402 ( 15.192 -18.461 -6.150) 24.687 19.492 ( -13.459 0.114 -2.470) 13.684 19.812 ( -5.508 -1.605 -0.745) 5.785 20.933 ( -15.934 7.304 4.437) 18.081 22.606 ( 18.306 -9.347 -5.711) 21.333 23.946 ( -14.082 3.305 -3.894) 14.979 24.470 ( 0.682 2.963 -1.391) 3.343 ======================= Grid point 402 (214/260) ======================= q-point: ( 0.30 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.570 ( 2.802 7.109 7.114) 10.440 2.932 ( -3.115 4.970 8.396) 10.242 2.983 ( -2.971 2.495 -6.484) 7.556 3.162 ( 0.776 -6.447 -4.339) 7.809 3.384 ( -4.559 -2.422 -7.928) 9.460 3.410 ( -3.962 9.188 -5.001) 11.186 3.734 ( -10.380 -11.980 0.166) 15.853 4.238 ( -11.533 -9.148 -4.683) 15.447 5.124 ( 10.295 5.677 14.127) 18.379 5.342 ( 12.508 5.455 7.933) 15.785 5.748 ( 4.397 2.035 2.026) 5.252 5.986 ( 2.338 1.412 -3.354) 4.326 6.675 ( 6.578 5.757 15.239) 17.569 7.641 ( 9.209 6.577 -10.392) 15.364 7.975 ( -10.773 9.995 9.243) 17.360 8.660 ( -6.549 15.034 5.514) 17.300 8.866 ( -10.797 -12.372 -7.323) 17.980 9.225 ( 5.430 13.827 0.124) 14.855 9.928 ( 13.274 4.248 7.418) 15.788 10.563 ( 8.930 -2.132 -1.308) 9.274 11.259 ( -4.257 -0.792 1.655) 4.635 12.006 ( 6.484 14.061 -15.912) 22.203 12.162 ( 13.005 18.979 7.473) 24.191 13.187 ( 9.135 11.880 -8.324) 17.143 13.718 ( -8.453 -17.172 -9.267) 21.266 13.895 ( -8.137 -10.742 9.252) 16.347 14.975 ( 1.374 -1.720 1.412) 2.615 15.255 ( 1.605 -9.297 -4.289) 10.364 17.150 ( 12.232 2.893 15.206) 19.728 18.669 ( 12.134 -13.752 -4.317) 18.841 19.170 ( -17.455 -0.182 -3.988) 17.905 19.757 ( -0.972 -1.457 2.655) 3.181 20.679 ( -9.870 6.824 8.984) 14.990 22.829 ( 3.670 -8.170 -16.552) 18.820 23.703 ( -7.071 -0.877 2.585) 7.580 24.452 ( -1.897 1.685 -3.088) 3.997 ======================= Grid point 403 (215/260) ======================= q-point: ( 0.40 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.637 ( 1.959 1.064 2.231) 3.154 2.826 ( -6.606 4.976 -0.086) 8.271 2.913 ( -2.432 3.116 -7.268) 8.273 3.074 ( -9.059 -6.463 -0.136) 11.129 3.339 ( 3.188 -5.808 -8.548) 10.815 3.352 ( -2.055 -2.371 -2.721) 4.153 3.638 ( -0.450 -3.660 5.391) 6.531 4.024 ( -8.604 -6.602 -5.111) 11.989 5.350 ( 9.056 5.316 11.813) 15.806 5.559 ( 7.025 3.966 7.057) 10.718 5.818 ( 2.244 5.156 1.873) 5.927 5.994 ( -0.758 3.304 -1.467) 3.694 6.877 ( 10.366 6.284 13.023) 17.792 7.696 ( -4.587 7.378 -6.865) 11.073 7.867 ( -0.867 7.909 10.826) 13.435 8.544 ( -5.773 13.044 0.297) 14.267 8.666 ( -5.700 -16.817 -2.413) 17.920 9.307 ( 1.936 15.165 -5.611) 16.285 10.146 ( 5.355 1.603 10.288) 11.708 10.705 ( 6.850 0.162 -8.316) 10.775 11.219 ( -0.970 3.364 15.336) 15.731 12.057 ( 2.957 15.696 -15.216) 22.060 12.398 ( 7.769 14.725 7.015) 18.067 13.215 ( -4.897 9.883 -15.410) 18.951 13.645 ( 4.074 -15.861 -1.739) 16.468 13.743 ( -8.947 -8.670 8.575) 15.124 15.010 ( 1.650 -1.921 2.893) 3.845 15.258 ( -0.228 -8.111 -4.309) 9.187 17.529 ( 22.647 3.849 8.351) 24.443 18.681 ( -15.912 -1.704 -6.162) 17.149 19.008 ( 9.412 -2.046 -2.406) 9.928 19.662 ( -11.631 2.588 -0.864) 11.946 20.683 ( 8.570 -2.001 20.346) 22.168 22.617 ( -17.757 -6.795 -26.112) 32.300 23.749 ( 8.409 -4.056 8.103) 12.362 24.383 ( -4.160 0.545 -5.325) 6.779 ======================= Grid point 404 (216/260) ======================= q-point: (-0.50 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.598 ( -7.453 -0.615 -0.719) 7.513 2.711 ( -0.910 1.946 -5.960) 6.336 2.879 ( -6.766 -1.939 2.810) 7.579 2.947 ( 2.997 -1.244 2.366) 4.016 3.288 ( -2.550 -2.278 -2.787) 4.411 3.445 ( 7.647 -9.642 -8.807) 15.133 3.686 ( 2.486 -1.273 6.118) 6.726 3.884 ( -3.976 -3.441 -4.497) 6.919 5.514 ( 4.370 4.971 9.595) 11.656 5.620 ( -2.468 2.946 4.780) 6.133 5.852 ( 0.735 6.339 2.956) 7.033 5.970 ( -0.883 5.018 -1.064) 5.205 7.125 ( 10.956 6.526 11.961) 17.484 7.542 ( -7.552 5.562 -6.890) 11.638 7.838 ( -6.313 4.992 12.983) 15.275 8.456 ( -1.938 11.454 -4.382) 12.415 8.653 ( 2.923 -13.846 5.576) 15.210 9.273 ( -2.468 10.642 -12.068) 16.279 10.185 ( -3.298 1.996 14.151) 14.667 10.798 ( 4.269 3.899 -11.423) 12.803 11.257 ( -0.960 7.274 21.299) 22.528 12.016 ( -4.583 7.139 -14.179) 16.523 12.545 ( 6.748 19.296 9.652) 22.606 13.007 ( -10.642 6.523 -14.459) 19.101 13.593 ( -7.527 -8.977 7.195) 13.748 13.804 ( 10.515 -12.179 -2.199) 16.240 15.047 ( 1.124 -3.078 3.482) 4.782 15.233 ( -1.106 -6.234 -4.477) 7.755 18.043 ( 26.394 3.660 2.608) 26.774 18.312 ( -15.738 0.722 -10.021) 18.672 19.268 ( 4.958 4.747 1.035) 6.942 19.333 ( -9.596 2.370 -1.651) 10.022 21.049 ( 20.503 -7.670 27.095) 34.833 22.123 ( -24.400 -7.833 -27.648) 37.697 23.970 ( 10.735 -2.805 6.654) 12.938 24.266 ( -5.920 -0.456 -7.914) 9.894 ======================= Grid point 405 (217/260) ======================= q-point: (-0.40 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.441 ( -6.539 2.995 4.209) 8.333 2.732 ( -4.817 -2.310 4.269) 6.838 2.777 ( 4.067 3.154 1.202) 5.285 3.069 ( 6.647 -3.541 3.610) 8.352 3.259 ( 1.078 -0.256 -5.252) 5.367 3.559 ( 3.513 -4.732 -10.113) 11.705 3.710 ( 0.799 0.456 0.436) 1.018 3.895 ( 5.413 -7.598 2.176) 9.579 5.471 ( -10.216 4.409 4.738) 12.093 5.582 ( -1.946 3.328 5.871) 7.023 5.850 ( -1.994 4.759 4.624) 6.929 5.955 ( -0.607 5.557 -2.857) 6.278 7.285 ( -0.914 2.631 9.543) 9.942 7.396 ( -4.922 4.958 -9.344) 11.666 7.743 ( -2.500 3.497 15.181) 15.777 8.457 ( 2.521 11.662 0.319) 11.936 8.752 ( 4.722 -7.810 7.187) 11.616 9.197 ( -1.825 6.186 -12.190) 13.792 10.098 ( -8.684 3.932 14.509) 17.360 10.811 ( -0.272 4.309 -10.929) 11.751 11.227 ( -7.307 10.796 20.103) 23.960 11.830 ( -10.332 1.535 -8.939) 13.748 12.702 ( 3.237 21.089 7.492) 22.613 12.776 ( -6.601 10.497 -10.751) 16.411 13.491 ( -3.707 -12.359 5.622) 14.075 14.020 ( 11.712 -13.264 -4.415) 18.237 15.061 ( -0.769 -5.008 3.558) 6.191 15.202 ( -0.733 -4.132 -4.964) 6.500 17.998 ( -10.754 3.513 -13.492) 17.607 18.598 ( 25.607 3.429 -2.208) 25.929 18.892 ( -18.977 -3.521 2.641) 19.481 19.622 ( 15.724 4.582 1.630) 16.459 21.540 ( 19.449 -7.280 26.002) 33.277 21.580 ( -21.305 -6.137 -22.986) 31.937 24.102 ( -4.827 -0.626 -7.204) 8.695 24.197 ( 7.216 -0.865 1.651) 7.453 ======================= Grid point 406 (218/260) ======================= q-point: (-0.30 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.392 ( -0.184 7.246 12.056) 14.067 2.629 ( -5.543 4.149 8.772) 11.175 2.929 ( 7.983 -0.223 4.041) 8.951 3.216 ( 8.527 2.829 -0.569) 9.002 3.317 ( 5.050 -2.248 -0.940) 5.607 3.486 ( -6.287 4.829 -8.833) 11.869 3.800 ( 6.934 -3.691 -5.043) 9.335 4.059 ( 9.407 -10.152 6.089) 15.121 5.237 ( -13.548 4.179 3.820) 14.683 5.500 ( -7.321 2.471 3.872) 8.643 5.788 ( -5.604 1.483 6.045) 8.375 5.923 ( -1.650 5.011 -5.682) 7.753 7.110 ( -15.852 -3.806 12.207) 20.367 7.309 ( -0.589 5.726 -14.132) 15.259 7.855 ( 7.290 9.567 16.250) 20.218 8.554 ( 6.380 11.732 4.472) 14.084 8.854 ( 3.162 -6.128 7.430) 10.137 9.147 ( -0.655 6.553 -8.460) 10.721 9.910 ( -12.803 5.046 10.734) 17.453 10.747 ( -3.703 1.041 -9.424) 10.179 11.066 ( -12.232 12.813 16.744) 24.375 11.608 ( -10.569 -0.712 -1.002) 10.640 12.537 ( -8.349 12.534 -12.032) 19.277 12.834 ( 1.425 24.949 6.234) 25.756 13.490 ( 2.677 -16.095 4.973) 17.058 14.238 ( 11.386 -15.657 -7.384) 20.719 15.027 ( -3.213 -5.520 2.802) 6.975 15.182 ( -0.348 -3.540 -4.995) 6.132 17.789 ( -8.199 5.794 -13.841) 17.099 18.560 ( -11.021 -14.429 0.840) 18.176 19.105 ( 22.343 2.394 -1.839) 22.546 19.861 ( 6.802 0.084 -1.553) 6.978 21.152 ( -12.357 -0.253 -16.988) 21.008 21.973 ( 14.240 -3.929 25.864) 29.785 23.983 ( -3.025 -0.404 -9.771) 10.236 24.343 ( 5.883 1.637 2.145) 6.472 ======================= Grid point 407 (219/260) ======================= q-point: (-0.20 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.471 ( 4.179 10.763 16.246) 19.931 2.560 ( -3.596 8.038 11.084) 14.156 3.064 ( 4.747 -2.024 2.896) 5.918 3.270 ( -9.782 9.621 -3.000) 14.044 3.408 ( 8.868 11.405 -6.660) 15.908 3.506 ( 12.082 -7.004 3.614) 14.425 3.921 ( 6.093 -3.507 -4.436) 8.313 4.262 ( 8.260 -6.683 10.003) 14.593 4.981 ( -12.192 2.460 1.433) 12.520 5.328 ( -10.108 0.876 2.541) 10.459 5.663 ( -7.964 -2.717 6.745) 10.785 5.865 ( -2.509 3.626 -8.534) 9.606 6.821 ( -15.121 -2.232 17.062) 22.907 7.316 ( 4.657 8.022 -18.432) 20.634 8.031 ( 6.038 12.262 17.503) 22.207 8.697 ( 5.960 13.671 5.441) 15.875 8.840 ( -6.094 -5.739 4.244) 9.385 9.202 ( 7.894 5.949 -0.332) 9.890 9.667 ( -12.642 6.096 5.880) 15.216 10.620 ( -7.213 -4.374 -11.149) 13.981 10.871 ( -9.793 13.665 17.097) 23.978 11.416 ( -9.060 -2.090 3.827) 10.055 12.391 ( -2.984 16.313 -12.569) 20.809 12.806 ( -4.727 22.582 2.335) 23.189 13.607 ( 7.107 -15.191 5.829) 17.756 14.421 ( 8.630 -18.751 -11.053) 23.414 14.958 ( -3.946 -4.070 2.438) 6.171 15.157 ( -1.181 -4.006 -5.209) 6.677 17.596 ( -8.937 0.576 -4.251) 9.913 18.403 ( -6.112 -21.433 -10.262) 24.536 19.482 ( 15.925 3.309 -2.478) 16.453 19.876 ( -1.949 -4.342 -4.281) 6.401 21.081 ( 6.971 5.538 -4.094) 9.800 22.161 ( -1.077 -2.444 17.517) 17.720 23.981 ( 4.920 1.786 -5.802) 7.814 24.431 ( 2.659 3.602 0.623) 4.521 ======================= Grid point 408 (220/260) ======================= q-point: (-0.10 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.535 ( -1.546 12.050 11.979) 17.061 2.595 ( 3.591 11.155 16.659) 20.368 3.061 ( -8.837 9.594 -4.643) 13.845 3.139 ( 2.747 -0.991 -1.318) 3.204 3.547 ( 5.605 3.752 1.558) 6.923 3.802 ( 15.169 2.696 -0.397) 15.412 4.007 ( 2.775 -1.486 1.155) 3.353 4.397 ( 2.296 0.479 17.972) 18.124 4.784 ( -7.450 -1.604 -4.722) 8.964 5.144 ( -7.938 -1.068 0.878) 8.057 5.529 ( -6.318 -6.463 6.233) 10.979 5.794 ( -2.070 1.623 -10.407) 10.734 6.621 ( -9.188 2.426 21.173) 23.208 7.380 ( 5.154 10.617 -20.319) 23.498 8.164 ( 3.384 12.404 18.096) 22.199 8.705 ( -2.861 5.722 -2.747) 6.962 8.829 ( 3.426 7.095 10.221) 12.905 9.285 ( -6.326 10.512 3.797) 12.843 9.572 ( 7.647 0.830 2.938) 8.234 10.405 ( -11.651 -7.337 -11.332) 17.833 10.799 ( -0.780 11.538 15.483) 19.325 11.274 ( -5.681 -2.563 2.316) 6.649 12.374 ( 3.640 18.910 -9.727) 21.575 12.680 ( -7.567 18.747 -2.048) 20.319 13.769 ( 7.241 -13.259 7.146) 16.712 14.496 ( 0.961 -20.503 -14.386) 25.065 14.911 ( -0.560 -3.883 2.688) 4.756 15.116 ( -1.469 -3.837 -5.980) 7.255 17.428 ( -8.895 -10.547 9.591) 16.803 18.208 ( -9.103 -15.992 -22.475) 29.047 19.716 ( 7.856 0.951 0.423) 7.925 19.881 ( 3.724 -2.977 -3.362) 5.834 21.334 ( 17.486 3.150 0.816) 17.786 22.021 ( -14.784 -1.921 8.524) 17.174 24.127 ( 9.346 4.308 -0.882) 10.329 24.449 ( -0.970 5.035 -0.992) 5.223 ======================= Grid point 409 (221/260) ======================= q-point: ( 0.00 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.684 ( -0.364 3.331 16.318) 16.658 2.920 ( 0.779 6.076 7.333) 9.555 3.052 ( -4.910 3.185 -1.677) 6.088 3.190 ( 2.726 3.087 -3.901) 5.673 3.564 ( -0.410 -4.742 13.407) 14.226 4.006 ( -1.008 1.669 -6.039) 6.346 4.191 ( 2.849 3.703 3.423) 5.792 4.431 ( 7.310 -4.581 0.212) 8.629 4.757 ( -3.481 10.208 5.064) 11.915 4.952 ( -4.677 -6.291 -0.250) 7.843 5.326 ( 0.081 -4.493 6.953) 8.279 5.751 ( 0.346 -0.351 -11.402) 11.413 6.629 ( -3.500 2.435 25.282) 25.640 7.558 ( 0.545 3.962 -19.377) 19.785 8.465 ( 3.191 7.524 9.794) 12.757 8.744 ( 5.305 -3.347 -1.169) 6.381 9.032 ( -2.557 5.461 18.365) 19.329 9.512 ( 3.316 14.365 1.924) 14.867 9.737 ( 11.104 -4.235 -0.822) 11.912 9.955 ( -14.914 -7.097 -10.511) 19.577 11.069 ( 5.623 5.660 8.879) 11.937 11.160 ( 1.509 -3.345 3.698) 5.209 12.808 ( -0.212 9.668 -0.805) 9.704 12.851 ( -0.815 12.870 -2.743) 13.185 13.715 ( 4.356 -3.167 0.221) 5.390 13.987 ( -3.752 -18.069 -12.629) 22.362 14.841 ( -0.052 -2.355 1.674) 2.890 15.038 ( 0.694 -1.293 -9.047) 9.165 17.029 ( -11.170 -5.550 20.090) 23.647 17.896 ( 0.675 -3.940 -25.326) 25.639 19.765 ( -0.433 -0.595 2.680) 2.779 19.936 ( 2.407 -0.428 -6.426) 6.875 21.673 ( -16.630 0.394 3.616) 17.023 21.712 ( 16.845 -0.959 1.753) 16.963 24.371 ( 7.246 1.846 1.403) 7.608 24.460 ( -5.204 1.630 -2.513) 6.004 ======================= Grid point 410 (222/260) ======================= q-point: ( 0.10 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.691 ( -1.693 4.855 13.231) 14.195 2.956 ( 0.939 3.227 7.429) 8.154 3.017 ( 0.633 0.587 0.145) 0.875 3.216 ( 0.688 5.787 -2.374) 6.293 3.526 ( -5.312 -4.728 11.385) 13.423 3.910 ( -6.429 4.765 -6.327) 10.201 4.082 ( -11.935 -4.160 -5.147) 13.648 4.496 ( -3.161 -1.514 -7.267) 8.068 4.828 ( 7.114 6.370 15.453) 18.166 4.929 ( 4.243 -2.354 3.583) 6.032 5.424 ( 7.609 -3.072 4.076) 9.162 5.793 ( 5.782 -0.794 -9.248) 10.936 6.621 ( -2.720 2.787 23.960) 24.274 7.532 ( 2.229 3.158 -18.334) 18.737 8.561 ( 0.502 11.020 8.772) 14.094 8.754 ( -0.621 -6.249 2.871) 6.905 9.056 ( 1.193 6.314 3.294) 7.221 9.514 ( -12.605 4.331 -3.017) 13.665 9.695 ( 3.264 5.160 5.617) 8.296 10.026 ( 13.690 -6.112 -4.197) 15.569 11.225 ( 4.572 -1.651 0.836) 4.933 11.321 ( 17.343 2.287 3.043) 17.756 12.703 ( -5.130 16.322 -0.983) 17.137 12.956 ( 6.889 6.520 -0.747) 9.515 13.770 ( 0.905 -6.502 0.333) 6.573 13.853 ( -6.366 -13.383 -12.194) 19.191 14.857 ( 1.254 -3.061 0.947) 3.441 15.048 ( 2.136 -1.815 -7.679) 8.175 16.929 ( -3.797 -3.287 23.116) 23.655 17.929 ( 7.953 -5.322 -17.761) 20.175 19.702 ( -6.824 -0.027 0.727) 6.862 19.898 ( -4.230 -0.869 -5.611) 7.080 21.333 ( -16.506 1.514 3.296) 16.900 22.096 ( 19.758 -2.523 0.826) 19.935 24.282 ( -11.498 1.930 -4.205) 12.394 24.481 ( 3.110 1.149 0.865) 3.427 ======================= Grid point 411 (223/260) ======================= q-point: ( 0.20 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.695 ( -0.489 5.422 9.788) 11.200 2.980 ( 0.059 0.825 3.991) 4.076 3.039 ( 1.059 -1.766 -0.208) 2.070 3.200 ( -2.864 8.667 4.688) 10.261 3.433 ( -5.915 -6.129 6.746) 10.866 3.751 ( -12.760 2.630 -5.301) 14.065 3.785 ( -9.359 -1.190 -13.204) 16.228 4.302 ( -12.284 -6.234 -8.758) 16.324 5.004 ( 8.065 3.138 14.824) 17.165 5.151 ( 13.340 2.274 8.459) 15.958 5.606 ( 9.282 -1.099 2.597) 9.701 5.905 ( 6.494 -0.534 -6.304) 9.066 6.652 ( 1.453 2.756 19.818) 20.061 7.587 ( 7.460 2.547 -17.163) 18.887 8.410 ( -13.430 8.326 8.318) 17.857 8.821 ( -2.309 -6.611 3.814) 7.973 9.023 ( -4.917 5.852 -1.071) 7.719 9.297 ( -0.357 1.700 -6.573) 6.799 9.854 ( 7.779 8.810 13.623) 17.992 10.283 ( 13.023 -4.085 -5.170) 14.595 11.270 ( -0.200 -1.588 -0.837) 1.806 11.752 ( 23.626 1.687 -3.017) 23.878 12.637 ( -0.980 22.551 -0.881) 22.589 13.090 ( 6.247 -4.069 1.320) 7.571 13.680 ( -7.043 -5.040 -11.621) 14.493 13.768 ( -2.329 -8.844 1.707) 9.303 14.891 ( 1.916 -2.521 0.768) 3.258 15.080 ( 2.532 -3.002 -6.244) 7.376 16.986 ( 4.440 0.121 22.444) 22.879 18.130 ( 15.228 -7.009 -10.816) 19.950 19.495 ( -13.789 0.126 -1.431) 13.864 19.786 ( -4.862 -0.701 -1.993) 5.301 21.040 ( -14.224 2.736 4.090) 15.051 22.469 ( 17.250 -3.522 -2.423) 17.772 23.991 ( -16.178 1.083 -4.919) 16.944 24.509 ( -0.243 0.872 -0.488) 1.028 ======================= Grid point 412 (224/260) ======================= q-point: ( 0.30 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.702 ( -1.035 4.453 5.989) 7.534 2.978 ( -0.651 0.384 0.060) 0.758 3.039 ( -1.744 -2.490 -2.259) 3.788 3.133 ( -4.126 8.591 7.054) 11.857 3.309 ( -8.277 -3.916 -6.430) 11.189 3.409 ( -14.470 -9.279 -2.151) 17.324 3.698 ( -0.968 7.643 -6.454) 10.051 4.044 ( -10.550 -8.199 -7.826) 15.485 5.217 ( 9.790 2.609 13.631) 16.984 5.421 ( 11.317 1.962 8.369) 14.212 5.780 ( 7.444 0.911 2.008) 7.763 5.999 ( 3.748 0.049 -3.262) 4.969 6.776 ( 7.037 3.037 15.454) 17.251 7.739 ( 10.633 2.488 -14.089) 17.826 8.153 ( -13.092 6.141 6.562) 15.880 8.610 ( -15.062 -8.467 3.487) 17.627 8.886 ( -7.895 5.539 0.488) 9.656 9.449 ( 11.034 5.569 -11.109) 16.618 10.037 ( 6.876 4.682 16.990) 18.917 10.510 ( 11.256 -2.302 -7.534) 13.739 11.241 ( -1.905 -0.675 5.986) 6.317 12.141 ( 14.943 2.836 -9.596) 17.983 12.665 ( 3.799 23.912 0.262) 24.214 13.199 ( 4.093 -16.618 1.612) 17.191 13.523 ( -5.955 4.841 -8.140) 11.188 13.700 ( -5.033 -7.972 2.550) 9.766 14.933 ( 2.054 -1.635 0.860) 2.763 15.114 ( 2.051 -3.599 -5.259) 6.694 17.208 ( 13.635 1.943 16.945) 21.836 18.457 ( 18.731 -5.750 -5.576) 20.371 19.168 ( -17.782 -0.070 -3.563) 18.135 19.733 ( -0.703 -0.648 2.328) 2.517 20.786 ( -12.189 2.894 7.370) 14.535 22.701 ( 4.809 -3.455 -12.744) 14.052 23.690 ( -10.476 -0.351 0.898) 10.520 24.475 ( -2.740 0.527 -2.658) 3.854 ======================= Grid point 413 (225/260) ======================= q-point: ( 0.40 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.666 ( -3.604 1.353 1.825) 4.260 2.921 ( -9.862 0.860 -3.668) 10.557 2.951 ( -2.650 1.091 0.594) 2.927 3.026 ( -6.426 3.210 -9.675) 12.050 3.167 ( 1.337 -4.545 -2.350) 5.289 3.260 ( -3.946 -7.617 3.789) 9.378 3.691 ( 0.904 6.030 -1.484) 6.275 3.876 ( -4.939 -6.937 -5.602) 10.193 5.432 ( 8.592 2.214 11.689) 14.675 5.613 ( 5.836 1.288 6.770) 9.030 5.900 ( 4.106 2.273 1.891) 5.060 6.037 ( 0.826 0.924 -0.794) 1.472 6.989 ( 10.876 3.409 12.414) 16.853 7.808 ( -6.344 2.919 -6.456) 9.510 8.037 ( 2.879 8.011 4.221) 9.502 8.342 ( -10.225 -12.403 2.000) 16.198 8.737 ( -7.040 4.829 2.578) 8.918 9.543 ( 1.063 6.223 -19.702) 20.688 10.178 ( 2.815 1.136 18.498) 18.746 10.703 ( 10.260 -0.164 -8.655) 13.424 11.270 ( 2.445 1.314 16.639) 16.869 12.256 ( -0.227 4.396 -13.351) 14.058 12.775 ( 6.465 19.255 1.511) 20.368 13.218 ( -3.051 -15.313 -4.733) 16.315 13.459 ( 1.670 4.313 1.007) 4.733 13.587 ( -6.838 -6.345 3.985) 10.144 14.971 ( 1.430 -1.425 1.033) 2.268 15.135 ( 1.249 -3.102 -4.977) 5.997 17.596 ( 22.366 2.040 8.569) 24.038 18.648 ( -10.639 -1.053 -4.201) 11.487 18.979 ( 12.101 -0.694 -3.396) 12.588 19.689 ( -7.639 0.386 0.598) 7.672 20.668 ( 0.565 0.034 17.844) 17.852 22.508 ( -18.233 -3.079 -25.116) 31.188 23.690 ( 7.981 -1.506 8.737) 11.929 24.390 ( -4.913 0.164 -5.476) 7.359 ======================= Grid point 414 (226/260) ======================= q-point: (-0.50 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.577 ( -5.240 -0.799 1.045) 5.402 2.720 ( -6.164 -1.016 -5.251) 8.161 2.882 ( -3.216 2.517 1.336) 4.297 2.971 ( 0.042 1.493 -2.614) 3.011 3.210 ( 2.159 -3.576 -0.666) 4.229 3.274 ( 5.887 -5.427 -3.037) 8.564 3.716 ( 1.483 3.102 0.460) 3.469 3.804 ( -1.888 -3.922 -4.310) 6.126 5.588 ( 4.182 1.910 9.160) 10.249 5.661 ( -2.529 0.989 4.935) 5.633 5.948 ( 0.195 2.524 2.335) 3.444 6.043 ( 0.154 1.820 -0.111) 1.830 7.235 ( 10.092 3.272 11.546) 15.680 7.618 ( -8.888 1.743 -6.132) 10.938 7.948 ( -12.103 4.636 8.897) 15.720 8.390 ( 10.863 -8.565 3.393) 14.243 8.634 ( -3.613 4.243 2.206) 5.994 9.438 ( -5.053 4.318 -22.525) 23.486 10.225 ( -2.428 1.325 19.110) 19.309 10.852 ( 5.974 1.318 -10.156) 11.856 11.376 ( 2.527 3.393 22.088) 22.489 12.114 ( -10.239 2.422 -12.360) 16.231 12.915 ( 7.361 13.971 1.599) 15.872 13.092 ( -6.858 0.639 -7.525) 10.202 13.460 ( -6.803 -2.539 6.041) 9.445 13.557 ( 6.302 -10.144 3.307) 12.392 14.990 ( 0.120 -1.837 1.468) 2.354 15.142 ( 0.730 -2.201 -5.590) 6.052 18.105 ( 26.877 1.808 1.461) 26.977 18.318 ( -15.288 -0.037 -8.642) 17.561 19.342 ( 16.646 2.066 0.517) 16.781 19.374 ( -20.042 1.217 -1.557) 20.139 20.927 ( 18.500 -3.394 27.453) 33.278 22.003 ( -24.371 -3.185 -27.265) 36.708 23.928 ( 12.315 -1.073 7.675) 14.551 24.258 ( -6.639 -0.242 -8.659) 10.914 ======================= Grid point 415 (227/260) ======================= q-point: (-0.40 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.497 ( -2.706 2.045 5.833) 6.747 2.681 ( 1.595 -1.889 1.095) 2.705 2.858 ( 0.986 3.272 2.557) 4.268 2.992 ( 2.344 -3.196 0.389) 3.983 3.288 ( 6.531 3.636 -3.394) 8.209 3.431 ( 10.064 -6.763 -4.070) 12.790 3.732 ( -0.699 1.173 -3.483) 3.741 3.778 ( 0.883 -3.234 -1.198) 3.560 5.542 ( -9.641 1.936 4.600) 10.857 5.629 ( -2.228 1.168 6.083) 6.582 5.915 ( -4.268 1.535 3.451) 5.699 6.039 ( -0.655 2.186 -2.142) 3.129 7.314 ( -8.686 0.501 13.700) 16.229 7.460 ( -5.008 1.352 -9.511) 10.833 7.835 ( 3.298 3.750 7.833) 9.290 8.565 ( -0.343 -2.983 27.518) 27.681 8.665 ( 10.523 2.386 -14.073) 17.733 9.303 ( -3.077 2.956 -18.209) 18.703 10.161 ( -8.312 1.766 17.754) 19.683 10.875 ( -1.103 1.608 -12.563) 12.713 11.422 ( -3.830 6.230 23.810) 24.908 11.838 ( -14.040 -0.364 -9.137) 16.756 12.934 ( -6.620 8.142 -7.273) 12.768 13.072 ( 7.185 2.818 0.651) 7.745 13.356 ( -4.803 7.320 7.112) 11.280 13.704 ( 7.953 -16.719 0.510) 18.521 14.981 ( -1.418 -2.184 2.194) 3.405 15.140 ( 0.391 -1.634 -6.880) 7.082 18.055 ( -7.744 1.626 -12.969) 15.192 18.649 ( 26.941 1.215 -3.096) 27.146 18.843 ( -28.855 -1.132 1.488) 28.915 19.687 ( 13.762 1.615 0.984) 13.892 21.426 ( 22.138 -2.931 27.922) 35.754 21.492 ( -18.622 -2.283 -22.322) 29.159 24.096 ( -6.202 -0.017 -10.646) 12.321 24.177 ( 10.173 -0.721 4.512) 11.152 ======================= Grid point 416 (228/260) ======================= q-point: (-0.30 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.502 ( 0.589 2.523 12.814) 13.074 2.744 ( 3.814 6.426 4.283) 8.612 2.937 ( 4.934 1.661 4.523) 6.896 3.076 ( 6.346 -10.332 3.208) 12.542 3.454 ( 10.517 10.616 -2.259) 15.113 3.572 ( 0.290 1.699 -4.445) 4.768 3.731 ( 6.720 -4.086 -9.740) 12.519 3.839 ( 5.420 -8.063 2.353) 9.996 5.323 ( -12.918 2.859 5.003) 14.145 5.534 ( -8.288 0.789 3.462) 9.017 5.792 ( -9.041 -0.363 5.103) 10.389 5.999 ( -2.531 1.944 -5.425) 6.294 7.052 ( -17.200 -1.524 16.573) 23.934 7.390 ( 0.939 1.986 -13.924) 14.096 8.037 ( 11.505 6.286 9.459) 16.166 8.617 ( 0.468 -3.688 25.160) 25.433 8.836 ( 7.510 3.328 -7.140) 10.884 9.249 ( 1.041 2.607 -12.231) 12.549 9.982 ( -12.928 1.812 15.375) 20.169 10.764 ( -6.709 0.526 -13.838) 15.387 11.321 ( -10.959 9.738 20.995) 25.607 11.558 ( -12.504 -3.805 -1.996) 13.221 12.804 ( -4.478 12.926 -7.313) 15.512 13.154 ( -0.745 -14.969 1.666) 15.080 13.345 ( 3.524 22.692 4.164) 23.338 13.864 ( 8.163 -19.460 -3.618) 21.411 14.946 ( -2.575 -2.047 2.765) 4.297 15.125 ( -0.204 -1.614 -8.263) 8.421 17.932 ( -3.623 6.845 -16.036) 17.808 18.291 ( -24.621 -9.965 2.534) 26.681 19.145 ( 23.353 1.166 -3.847) 23.696 19.849 ( 2.106 -0.675 -2.609) 3.421 21.168 ( -6.690 0.968 -13.734) 15.307 21.909 ( 16.453 -1.840 25.912) 30.749 23.975 ( -2.055 -0.254 -11.282) 11.470 24.364 ( 7.423 0.422 2.862) 7.967 ======================= Grid point 417 (229/260) ======================= q-point: (-0.20 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.558 ( 1.553 1.132 16.414) 16.526 2.838 ( 3.851 13.810 4.642) 15.070 3.032 ( 4.095 -0.834 3.074) 5.187 3.257 ( 9.336 -11.782 9.943) 18.023 3.428 ( -9.010 4.021 -3.578) 10.495 3.720 ( 14.548 15.191 -3.871) 21.387 3.865 ( 6.846 -1.544 -7.175) 10.037 4.037 ( 12.594 -13.785 2.080) 18.787 5.078 ( -12.365 4.412 5.180) 14.114 5.333 ( -11.966 -0.315 1.497) 12.063 5.595 ( -11.616 -2.628 7.166) 13.900 5.918 ( -3.853 1.299 -8.743) 9.642 6.791 ( -12.399 -0.685 19.971) 23.517 7.436 ( 6.963 3.138 -18.068) 19.616 8.262 ( 7.954 8.785 12.474) 17.206 8.667 ( -1.826 -7.287 20.780) 22.096 8.931 ( 4.146 5.863 -1.924) 7.434 9.293 ( 5.860 2.351 -7.553) 9.845 9.757 ( -12.020 2.296 12.721) 17.652 10.560 ( -10.621 -1.388 -13.976) 17.609 11.135 ( -10.583 10.544 16.847) 22.517 11.338 ( -9.920 -5.386 3.999) 11.975 12.735 ( -0.817 16.098 -6.549) 17.398 13.087 ( -5.287 -6.204 1.985) 8.390 13.468 ( 7.034 11.813 0.763) 13.770 13.992 ( 5.725 -20.721 -7.783) 22.863 14.897 ( -2.827 -1.531 2.920) 4.343 15.095 ( -0.763 -1.675 -9.284) 9.465 17.655 ( -21.320 4.071 5.257) 22.332 18.047 ( -0.890 -11.418 -20.746) 23.697 19.541 ( 17.219 1.894 -4.477) 17.892 19.802 ( -3.499 -2.277 -3.045) 5.167 21.167 ( 7.061 2.282 -2.964) 7.990 22.123 ( -0.366 -1.016 16.154) 16.190 24.003 ( 7.003 0.482 -6.112) 9.308 24.480 ( 3.859 1.130 1.016) 4.148 ======================= Grid point 418 (230/260) ======================= q-point: (-0.10 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.630 ( 1.640 1.596 17.108) 17.261 2.894 ( 0.864 10.834 5.388) 12.131 3.123 ( 4.457 0.664 -0.520) 4.536 3.214 ( -10.120 3.984 -1.436) 10.970 3.465 ( 7.193 -7.451 11.463) 15.448 3.972 ( 5.461 -0.172 -7.728) 9.465 4.001 ( 12.917 12.377 2.350) 18.043 4.270 ( 9.522 -11.221 2.824) 14.986 4.878 ( -8.602 7.315 3.296) 11.763 5.101 ( -10.516 -3.212 0.239) 10.998 5.400 ( -8.780 -4.417 8.470) 12.975 5.817 ( -3.666 0.534 -11.232) 11.827 6.661 ( -5.988 1.089 23.316) 24.097 7.542 ( 6.340 4.237 -20.542) 21.912 8.393 ( 2.653 8.992 13.394) 16.349 8.659 ( 0.298 -5.608 6.738) 8.772 9.010 ( 1.765 5.603 13.697) 14.904 9.437 ( 8.314 3.424 -3.863) 9.786 9.604 ( -3.533 1.955 6.044) 7.269 10.284 ( -14.221 -3.547 -12.533) 19.285 11.023 ( -3.401 8.994 13.055) 16.214 11.192 ( -5.520 -5.122 5.360) 9.243 12.744 ( 2.965 16.095 -4.812) 17.058 12.970 ( -6.592 2.461 0.355) 7.046 13.605 ( 6.494 2.774 -0.057) 7.062 14.042 ( 1.149 -20.650 -10.997) 23.424 14.855 ( -1.847 -1.389 2.539) 3.434 15.059 ( -0.565 -1.491 -9.626) 9.757 17.278 ( -17.831 -3.673 14.631) 23.356 17.977 ( -1.394 -5.806 -28.697) 29.312 19.741 ( 1.915 1.064 1.301) 2.548 19.830 ( 8.685 -1.661 -5.039) 10.177 21.382 ( 14.072 1.234 1.191) 14.176 21.993 ( -13.799 -0.707 7.033) 15.504 24.185 ( 10.594 1.362 -0.528) 10.694 24.517 ( -0.257 1.622 -0.660) 1.770 ======================= Grid point 459 (231/260) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.015 ( -1.559 0.000 -7.240) 7.406 2.015 ( 1.559 0.000 7.240) 7.406 2.717 ( -6.203 0.000 -6.439) 8.941 2.717 ( 6.203 0.000 6.439) 8.941 3.689 ( -1.118 0.000 -3.488) 3.663 3.689 ( 1.118 0.000 3.488) 3.663 4.436 ( 2.679 0.000 -1.304) 2.979 4.436 ( -2.679 0.000 1.304) 2.979 4.948 ( 2.755 0.000 -9.765) 10.146 4.948 ( -2.755 0.000 9.765) 10.146 5.741 ( 0.318 0.000 -3.332) 3.347 5.741 ( -0.318 0.000 3.332) 3.347 6.543 ( 7.570 0.000 -15.690) 17.420 6.543 ( -7.570 0.000 15.690) 17.420 7.870 ( -4.220 0.000 -15.852) 16.404 7.870 ( 4.220 0.000 15.852) 16.404 8.532 ( 13.077 0.000 -13.912) 19.093 8.532 ( -13.077 0.000 13.912) 19.093 10.292 ( -18.617 0.000 -16.063) 24.589 10.292 ( 18.617 0.000 16.063) 24.589 10.649 ( 0.041 0.000 -5.965) 5.965 10.649 ( -0.041 0.000 5.965) 5.965 11.925 ( 4.990 0.000 -10.348) 11.489 11.925 ( -4.990 0.000 10.349) 11.489 14.551 ( -5.367 0.000 -12.529) 13.630 14.551 ( 5.367 0.000 12.529) 13.630 15.346 ( 8.022 0.000 -3.251) 8.655 15.346 ( -8.022 0.000 3.251) 8.655 18.423 ( -33.445 0.000 4.848) 33.795 18.423 ( 33.445 0.000 -4.848) 33.795 19.981 ( -0.682 0.000 -1.294) 1.463 19.981 ( 0.682 0.000 1.294) 1.463 21.859 ( -36.133 0.000 8.453) 37.109 21.859 ( 36.133 0.000 -8.453) 37.109 23.907 ( -7.454 0.000 -4.788) 8.860 23.907 ( 7.454 0.000 4.788) 8.860 ======================= Grid point 461 (232/260) ======================= q-point: ( 0.10 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.065 ( 7.487 0.000 -5.621) 9.362 2.159 ( 10.726 0.000 7.831) 13.281 2.590 ( -4.662 0.000 -12.002) 12.875 2.872 ( 8.863 0.000 -0.073) 8.863 3.576 ( -8.869 0.000 -4.890) 10.128 3.644 ( -5.640 0.000 3.678) 6.733 4.386 ( -1.263 0.000 -9.335) 9.420 4.464 ( 0.818 0.000 -10.597) 10.628 4.978 ( 2.244 0.000 19.631) 19.759 5.031 ( 5.956 0.000 2.009) 6.285 5.728 ( -0.523 0.000 -5.598) 5.623 5.730 ( -1.282 0.000 0.558) 1.398 6.507 ( -0.219 0.000 16.406) 16.407 6.740 ( 14.854 0.000 -11.069) 18.525 7.751 ( -4.067 0.000 -12.116) 12.781 7.940 ( -1.846 0.000 14.952) 15.066 8.430 ( 0.111 0.000 18.572) 18.572 8.828 ( 18.982 0.000 -15.903) 24.763 9.924 ( -14.215 0.000 -19.307) 23.975 10.656 ( 4.810 0.000 -3.083) 5.714 10.661 ( 2.646 0.000 -4.642) 5.344 10.742 ( 17.740 0.000 20.730) 27.284 11.834 ( -6.343 0.000 7.909) 10.139 11.990 ( 4.806 0.000 -16.224) 16.921 14.421 ( -5.225 0.000 -11.041) 12.214 14.691 ( 5.596 0.000 13.693) 14.792 15.172 ( -9.961 0.000 1.528) 10.078 15.473 ( 5.672 0.000 -5.029) 7.581 17.837 ( -26.555 0.000 13.164) 29.639 19.066 ( 28.717 0.000 2.567) 28.831 19.907 ( -6.375 0.000 -2.005) 6.683 19.958 ( -2.079 0.000 2.927) 3.590 21.113 ( -38.660 0.000 3.623) 38.830 22.445 ( 24.564 0.000 -15.740) 29.174 23.765 ( -5.010 0.000 -3.784) 6.278 24.061 ( 6.938 0.000 3.082) 7.592 ======================= Grid point 462 (233/260) ======================= q-point: ( 0.20 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.255 ( 11.861 0.000 -2.869) 12.203 2.417 ( 8.907 0.000 -10.652) 13.885 2.512 ( 4.031 0.000 4.092) 5.744 3.068 ( 11.275 0.000 -5.322) 12.468 3.350 ( -11.637 0.000 -7.448) 13.817 3.517 ( -7.389 0.000 2.986) 7.969 4.338 ( -1.798 0.000 -9.522) 9.690 4.409 ( -4.125 0.000 -9.312) 10.185 5.101 ( 5.168 0.000 18.253) 18.970 5.172 ( 6.882 0.000 6.685) 9.594 5.693 ( -2.222 0.000 -1.783) 2.849 5.700 ( -0.763 0.000 -6.993) 7.034 6.584 ( 3.940 0.000 14.964) 15.474 7.040 ( 15.717 0.000 -4.804) 16.435 7.665 ( -1.982 0.000 -8.571) 8.797 7.888 ( -4.659 0.000 10.259) 11.267 8.576 ( 7.438 0.000 26.747) 27.762 9.154 ( 16.103 0.000 -23.370) 28.380 9.671 ( -5.797 0.000 -15.742) 16.776 10.683 ( -0.509 0.000 2.901) 2.945 10.746 ( 7.216 0.000 -4.253) 8.376 11.199 ( 22.355 0.000 9.611) 24.334 11.715 ( -7.500 0.000 10.625) 13.005 12.049 ( 5.687 0.000 -23.472) 24.151 14.292 ( -5.543 0.000 -8.953) 10.530 14.774 ( -4.465 0.000 13.216) 13.950 15.018 ( -1.808 0.000 2.085) 2.760 15.544 ( 2.736 0.000 -6.788) 7.318 17.465 ( -13.850 0.000 16.781) 21.759 19.348 ( -3.779 0.000 -1.831) 4.199 19.728 ( -10.678 0.000 -3.675) 11.293 19.961 ( -6.875 0.000 3.088) 7.537 20.545 ( -7.667 0.000 13.491) 15.517 22.715 ( 6.587 0.000 -23.489) 24.395 23.735 ( 3.098 0.000 0.468) 3.133 24.186 ( 5.090 0.000 0.462) 5.111 ======================= Grid point 463 (234/260) ======================= q-point: ( 0.30 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.407 ( 1.622 0.000 -18.257) 18.329 2.492 ( 11.855 0.000 0.122) 11.855 2.811 ( 15.115 0.000 14.241) 20.767 3.069 ( -11.906 0.000 -4.343) 12.674 3.329 ( 13.942 0.000 -12.824) 18.943 3.386 ( -5.488 0.000 0.955) 5.570 4.259 ( -5.032 0.000 -3.323) 6.030 4.261 ( -8.964 0.000 -6.982) 11.362 5.243 ( 5.229 0.000 13.854) 14.808 5.317 ( 5.898 0.000 6.449) 8.739 5.638 ( -2.572 0.000 -3.106) 4.033 5.668 ( -0.905 0.000 -7.593) 7.647 6.717 ( 6.132 0.000 13.280) 14.627 7.251 ( 4.321 0.000 -3.153) 5.350 7.666 ( 4.364 0.000 -3.558) 5.630 7.836 ( -2.343 0.000 6.979) 7.362 8.787 ( 6.555 0.000 31.276) 31.956 9.245 ( 0.627 0.000 -32.633) 32.639 9.717 ( 11.724 0.000 -8.946) 14.747 10.635 ( -5.388 0.000 2.696) 6.025 10.931 ( 12.105 0.000 -4.626) 12.959 11.586 ( -1.478 0.000 -0.480) 1.554 11.646 ( 13.251 0.000 24.371) 27.740 12.109 ( 6.260 0.000 -29.402) 30.061 14.171 ( -4.520 0.000 -6.484) 7.904 14.576 ( -13.983 0.000 8.295) 16.258 15.110 ( 6.187 0.000 7.806) 9.960 15.546 ( -0.858 0.000 -8.547) 8.590 17.380 ( 1.674 0.000 15.417) 15.508 19.053 ( -21.476 0.000 -5.971) 22.291 19.489 ( -11.847 0.000 -5.530) 13.074 19.568 ( -21.881 0.000 -0.124) 21.881 20.898 ( 24.833 0.000 26.766) 36.512 22.634 ( -7.406 0.000 -27.150) 28.142 23.868 ( 8.540 0.000 2.862) 9.007 24.257 ( 2.175 0.000 -1.996) 2.952 ======================= Grid point 464 (235/260) ======================= q-point: ( 0.40 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.450 ( 6.113 0.000 -11.208) 12.767 2.696 ( 6.118 0.000 0.834) 6.175 2.842 ( -7.361 0.000 -1.868) 7.595 3.022 ( -0.027 0.000 8.290) 8.290 3.399 ( 9.486 0.000 4.042) 10.311 3.594 ( 14.930 0.000 -14.245) 20.636 4.029 ( -12.539 0.000 -5.652) 13.754 4.115 ( -9.607 0.000 3.607) 10.262 5.362 ( 3.983 0.000 9.886) 10.658 5.422 ( 3.308 0.000 2.618) 4.219 5.587 ( -1.637 0.000 -1.730) 2.381 5.629 ( -1.400 0.000 -6.955) 7.094 6.882 ( 7.586 0.000 11.266) 13.582 7.212 ( -5.307 0.000 -6.309) 8.244 7.773 ( 4.684 0.000 0.493) 4.710 7.825 ( -0.285 0.000 3.871) 3.881 8.961 ( 3.632 0.000 32.821) 33.022 9.162 ( -0.497 0.000 -32.301) 32.305 9.966 ( 14.380 0.000 -9.033) 16.982 10.477 ( -11.022 0.000 3.167) 11.468 11.172 ( 12.740 0.000 -7.579) 14.824 11.495 ( -6.732 0.000 15.127) 16.557 11.962 ( 10.580 0.000 16.036) 19.211 12.153 ( 4.412 0.000 -30.143) 30.464 14.105 ( -0.268 0.000 -4.879) 4.886 14.327 ( -12.062 0.000 7.076) 13.984 15.245 ( 5.320 0.000 9.393) 10.796 15.477 ( -3.752 0.000 -9.844) 10.534 17.592 ( 16.021 0.000 11.955) 19.990 18.555 ( -26.039 0.000 -7.762) 27.171 19.243 ( -10.936 0.000 3.727) 11.553 19.265 ( -8.568 0.000 -6.613) 10.823 21.451 ( 23.644 0.000 29.255) 37.615 22.348 ( -14.497 0.000 -28.541) 32.011 24.044 ( 7.907 0.000 3.816) 8.780 24.258 ( -1.468 0.000 -3.665) 3.948 ======================= Grid point 465 (236/260) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.589 ( 9.199 0.000 -3.523) 9.851 2.589 ( -9.199 0.000 3.523) 9.851 2.925 ( -7.871 0.000 0.843) 7.916 2.925 ( 7.871 0.000 -0.843) 7.916 3.675 ( -11.582 0.000 -11.319) 16.195 3.675 ( 11.582 0.000 11.319) 16.195 3.912 ( 9.879 0.000 -6.013) 11.566 3.912 ( -9.879 0.000 6.013) 11.566 5.437 ( -1.492 0.000 -5.466) 5.666 5.437 ( 1.492 0.000 5.466) 5.666 5.586 ( -1.181 0.000 -4.458) 4.612 5.586 ( 1.181 0.000 4.458) 4.612 7.059 ( -7.784 0.000 -8.868) 11.800 7.059 ( 7.784 0.000 8.868) 11.800 7.825 ( 0.847 0.000 -0.831) 1.187 7.825 ( -0.847 0.000 0.831) 1.187 9.079 ( -1.021 0.000 -32.612) 32.628 9.079 ( 1.021 0.000 32.612) 32.628 10.233 ( 14.068 0.000 -6.087) 15.328 10.233 ( -14.068 0.000 6.087) 15.328 11.371 ( 9.406 0.000 -12.821) 15.901 11.371 ( -9.407 0.000 12.821) 15.901 12.126 ( -1.644 0.000 -23.863) 23.920 12.126 ( 1.644 0.000 23.863) 23.920 14.154 ( 6.456 0.000 -5.480) 8.468 14.154 ( -6.456 0.000 5.480) 8.468 15.367 ( -4.860 0.000 -10.114) 11.222 15.367 ( 4.860 0.000 10.114) 11.222 18.027 ( -24.426 0.000 -9.171) 26.091 18.027 ( 24.426 0.000 9.171) 26.091 19.154 ( -0.481 0.000 -6.084) 6.103 19.154 ( 0.481 0.000 6.084) 6.103 21.945 ( -19.510 0.000 -29.422) 35.304 21.945 ( 19.510 0.000 29.423) 35.304 24.184 ( -5.104 0.000 -4.237) 6.633 24.184 ( 5.104 0.000 4.237) 6.633 ======================= Grid point 471 (237/260) ======================= q-point: ( 0.00 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.134 ( -3.068 10.708 -6.134) 12.716 2.134 ( 3.068 10.708 6.134) 12.716 2.790 ( -3.605 6.323 -7.938) 10.770 2.790 ( 3.605 6.323 7.938) 10.770 3.664 ( -2.187 -1.692 -4.312) 5.122 3.664 ( 2.187 -1.692 4.312) 5.122 4.465 ( -5.211 2.146 -6.420) 8.543 4.465 ( 5.211 2.146 6.420) 8.543 4.922 ( 1.170 -2.423 -11.020) 11.344 4.922 ( -1.170 -2.423 11.020) 11.344 5.718 ( 0.918 -2.024 -3.113) 3.825 5.718 ( -0.918 -2.024 3.113) 3.825 6.615 ( 6.999 6.539 -16.988) 19.502 6.615 ( -6.999 6.539 16.988) 19.502 7.994 ( -4.644 11.317 -14.207) 18.748 7.994 ( 4.644 11.317 14.207) 18.748 8.603 ( 11.662 6.635 -10.644) 17.126 8.603 ( -11.662 6.635 10.644) 17.126 10.232 ( -14.671 -5.162 -14.314) 21.137 10.232 ( 14.671 -5.162 14.314) 21.137 10.748 ( -4.145 8.503 -4.086) 10.304 10.748 ( 4.145 8.503 4.086) 10.304 11.967 ( 3.408 4.268 -10.851) 12.148 11.967 ( -3.408 4.268 10.851) 12.148 14.515 ( -5.429 -3.620 -13.217) 14.739 14.515 ( 5.429 -3.620 13.217) 14.739 15.288 ( 1.824 -5.388 -2.550) 6.234 15.288 ( -1.824 -5.388 2.550) 6.234 18.292 ( -16.876 -11.924 -3.805) 21.011 18.292 ( 16.876 -11.924 3.805) 21.011 19.955 ( -0.986 -2.228 -1.783) 3.019 19.955 ( 0.986 -2.228 1.783) 3.019 21.823 ( -31.649 -2.931 5.874) 32.322 21.823 ( 31.649 -2.931 -5.874) 32.322 23.997 ( -7.380 7.806 -3.390) 11.265 23.997 ( 7.380 7.806 3.390) 11.265 ======================= Grid point 473 (238/260) ======================= q-point: ( 0.10 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.127 ( 4.297 7.049 -2.871) 8.741 2.311 ( 11.788 12.384 4.651) 17.719 2.677 ( -4.546 7.723 -10.128) 13.524 2.916 ( 7.211 3.749 -0.448) 8.139 3.539 ( -8.909 -2.723 -4.457) 10.327 3.643 ( -4.894 -0.098 4.571) 6.698 4.341 ( -4.437 -1.942 -12.562) 13.464 4.558 ( 2.934 5.745 -8.628) 10.773 4.968 ( 4.161 -6.007 2.905) 7.864 4.978 ( 3.646 0.273 18.858) 19.209 5.677 ( -1.753 -2.159 -0.920) 2.930 5.759 ( 2.044 0.175 -3.423) 3.991 6.578 ( -1.054 6.489 17.609) 18.796 6.785 ( 13.439 4.257 -12.879) 19.094 7.863 ( -5.097 10.289 -10.062) 15.267 8.081 ( -0.744 12.864 11.743) 17.434 8.497 ( 0.452 6.064 14.314) 15.552 8.892 ( 17.935 6.050 -11.556) 22.176 9.888 ( -14.847 -3.744 -16.596) 22.581 10.513 ( 10.285 -6.839 4.999) 13.324 10.715 ( 0.821 4.889 -3.304) 5.958 10.949 ( 15.225 12.738 7.285) 21.146 11.837 ( -7.418 1.169 4.325) 8.666 12.075 ( 6.183 7.849 -10.976) 14.843 14.373 ( -5.944 -4.755 -10.703) 13.134 14.657 ( 4.953 -3.684 13.807) 15.124 15.122 ( -8.850 -4.322 1.258) 9.929 15.416 ( 5.768 -5.367 -4.758) 9.204 17.760 ( -23.848 -6.945 12.802) 27.944 18.905 ( 29.096 -15.542 2.488) 33.080 19.805 ( -11.369 -5.809 -0.740) 12.788 19.971 ( -1.449 -0.760 0.489) 1.708 21.153 ( -33.367 3.438 3.122) 33.689 22.384 ( 24.204 -5.321 -13.117) 28.039 23.847 ( -6.393 7.039 -2.751) 9.899 24.138 ( 6.062 6.703 1.745) 9.204 ======================= Grid point 474 (239/260) ======================= q-point: ( 0.20 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.268 ( 9.746 2.917 -2.195) 10.407 2.528 ( 1.888 8.450 -15.127) 17.430 2.631 ( 9.289 10.807 8.938) 16.821 3.076 ( 9.283 0.493 -5.210) 10.657 3.319 ( -11.245 -2.581 -6.441) 13.213 3.524 ( -7.227 0.649 3.445) 8.032 4.227 ( -5.009 -5.853 -8.812) 11.704 4.528 ( -3.570 5.911 -11.049) 13.029 5.083 ( 5.822 -5.770 9.821) 12.792 5.137 ( 7.699 1.195 14.781) 16.709 5.645 ( -1.027 -0.355 -3.130) 3.313 5.778 ( 0.721 3.125 -4.441) 5.479 6.637 ( 2.945 4.903 16.180) 17.161 7.059 ( 15.175 1.776 -6.878) 16.755 7.755 ( -3.696 8.482 -6.408) 11.254 8.036 ( -4.279 13.423 6.649) 15.579 8.644 ( 7.901 5.921 21.113) 23.308 9.200 ( 13.318 4.015 -18.224) 22.926 9.623 ( -5.688 -4.045 -12.568) 14.376 10.688 ( 5.160 -4.331 6.633) 9.454 10.746 ( 5.253 6.057 -9.785) 12.650 11.335 ( 20.652 10.837 5.673) 24.002 11.703 ( -7.233 -0.182 8.720) 11.331 12.163 ( 6.019 10.609 -18.264) 21.962 14.232 ( -6.025 -5.830 -8.684) 12.071 14.704 ( -6.082 -6.764 12.892) 15.778 15.011 ( 0.075 -0.530 2.346) 2.407 15.490 ( 2.815 -5.167 -6.407) 8.699 17.435 ( -11.819 -2.600 16.540) 20.495 19.301 ( 5.483 -9.173 0.214) 10.689 19.510 ( -16.848 -12.789 -3.665) 21.467 19.944 ( -3.061 -1.913 4.096) 5.460 20.657 ( -11.708 8.608 8.982) 17.084 22.674 ( 8.072 -3.888 -21.303) 23.110 23.773 ( 0.127 3.354 1.498) 3.676 24.239 ( 3.834 4.632 -0.499) 6.034 ======================= Grid point 475 (240/260) ======================= q-point: ( 0.30 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.432 ( 4.130 1.729 -14.646) 15.315 2.522 ( 7.207 4.162 -0.664) 8.349 2.917 ( 12.915 8.899 11.232) 19.291 3.049 ( -11.565 -1.670 -4.209) 12.420 3.284 ( 8.818 -3.605 -9.697) 13.594 3.407 ( -2.417 1.026 -0.413) 2.658 4.092 ( -7.442 -8.204 -3.812) 11.714 4.382 ( -8.846 3.238 -6.188) 11.271 5.228 ( 6.331 -2.901 9.237) 11.568 5.322 ( 7.798 2.539 9.025) 12.195 5.618 ( -0.998 1.868 -4.085) 4.601 5.766 ( -0.929 5.280 -4.628) 7.083 6.758 ( 5.739 3.774 14.302) 15.866 7.280 ( 6.156 2.491 -4.179) 7.847 7.716 ( 1.725 5.251 -1.620) 5.760 7.973 ( -2.985 12.201 2.882) 12.887 8.842 ( 6.189 4.729 23.976) 25.209 9.204 ( -3.692 -4.221 -24.188) 24.829 9.730 ( 14.353 2.406 -7.775) 16.500 10.677 ( -4.901 2.036 1.185) 5.438 10.942 ( 13.562 2.978 -6.847) 15.482 11.596 ( -4.279 0.462 8.465) 9.496 11.747 ( 16.818 9.272 12.583) 22.960 12.228 ( 5.366 11.448 -25.218) 28.209 14.105 ( -4.646 -6.338 -6.330) 10.091 14.509 ( -13.414 -6.273 8.831) 17.242 15.103 ( 5.586 -0.784 7.045) 9.025 15.495 ( -0.637 -4.792 -7.988) 9.337 17.381 ( 2.813 0.287 15.619) 15.872 19.051 ( -22.096 -0.578 -5.688) 22.823 19.269 ( -9.045 -13.021 -3.126) 16.160 19.721 ( -16.867 6.884 -1.099) 18.251 20.858 ( 21.233 -2.918 23.943) 32.134 22.615 ( -7.326 -2.016 -26.629) 27.692 23.862 ( 7.063 -0.608 4.599) 8.450 24.284 ( 0.959 2.337 -2.535) 3.579 ======================= Grid point 476 (241/260) ======================= q-point: ( 0.40 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.468 ( 4.952 1.706 -11.008) 12.190 2.699 ( 4.589 0.513 1.961) 5.016 2.837 ( -5.351 -0.428 -1.603) 5.603 3.071 ( -2.381 4.085 4.988) 6.873 3.370 ( 8.830 -2.661 3.068) 9.719 3.559 ( 12.480 -3.592 -10.242) 16.540 3.918 ( -8.726 -6.867 -1.828) 11.254 4.162 ( -12.392 0.721 -0.438) 12.421 5.365 ( 5.351 0.287 7.412) 9.146 5.465 ( 4.369 3.896 2.519) 6.373 5.594 ( 0.041 3.365 -2.065) 3.949 5.721 ( -2.670 5.939 -4.160) 7.727 6.923 ( 7.700 3.694 12.108) 14.817 7.263 ( -5.024 4.572 -6.705) 9.544 7.803 ( 5.048 3.400 3.003) 6.786 7.929 ( -1.890 9.198 -0.319) 9.395 8.980 ( 2.344 1.487 23.249) 23.414 9.097 ( -1.130 -5.609 -22.340) 23.061 10.009 ( 14.830 4.430 -7.656) 17.267 10.520 ( -10.757 3.124 1.162) 11.262 11.206 ( 13.948 3.871 -8.712) 16.894 11.533 ( -5.422 3.076 16.002) 17.173 12.050 ( 10.173 7.896 13.682) 18.790 12.254 ( 2.973 10.025 -27.559) 29.476 14.041 ( -0.076 -6.156 -4.903) 7.870 14.268 ( -11.968 -5.517 7.433) 15.130 15.225 ( 4.865 -1.900 8.661) 10.114 15.435 ( -3.284 -3.982 -9.122) 10.480 17.608 ( 16.364 1.593 12.245) 20.500 18.562 ( -25.339 0.646 -7.072) 26.316 19.131 ( -2.918 -5.363 -1.292) 6.241 19.395 ( -14.480 6.998 -1.966) 16.202 21.383 ( 23.860 -6.030 28.228) 37.450 22.318 ( -15.587 -3.023 -28.445) 32.576 24.027 ( 7.785 -1.580 5.097) 9.438 24.263 ( -2.353 0.392 -4.044) 4.695 ======================= Grid point 477 (242/260) ======================= q-point: ( 0.50 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.588 ( 5.702 0.002 -2.939) 6.415 2.588 ( -5.702 0.002 2.939) 6.415 2.945 ( -4.918 1.615 -3.970) 6.523 2.945 ( 4.918 1.615 3.970) 6.523 3.598 ( -5.154 -6.569 -11.890) 14.529 3.598 ( 5.154 -6.569 11.890) 14.529 3.914 ( 1.119 -0.567 -2.234) 2.562 3.914 ( -1.119 -0.567 2.234) 2.562 5.464 ( -2.803 2.761 -5.568) 6.817 5.464 ( 2.803 2.761 5.568) 6.817 5.645 ( -2.942 5.216 -4.554) 7.524 5.645 ( 2.942 5.216 4.554) 7.524 7.107 ( -8.101 4.294 -9.471) 13.182 7.107 ( 8.101 4.294 9.471) 13.182 7.886 ( -0.985 5.643 -5.997) 8.293 7.886 ( 0.985 5.643 5.997) 8.293 9.046 ( 0.563 -2.773 -23.274) 23.446 9.046 ( -0.563 -2.773 23.274) 23.446 10.279 ( 0.627 4.151 -8.037) 9.067 10.279 ( -0.627 4.151 8.037) 9.067 11.421 ( 8.730 4.438 -15.082) 17.982 11.421 ( -8.730 4.438 15.082) 17.982 12.210 ( -2.247 8.061 -21.987) 23.526 12.210 ( 2.247 8.061 21.987) 23.526 14.094 ( 6.607 -5.634 -5.740) 10.409 14.094 ( -6.607 -5.634 5.740) 10.409 15.336 ( -4.359 -2.898 -9.367) 10.730 15.336 ( 4.359 -2.898 9.367) 10.730 18.044 ( -24.112 1.608 -9.118) 25.828 18.044 ( 24.112 1.608 9.118) 25.828 19.172 ( -3.295 1.789 -4.949) 6.209 19.172 ( 3.295 1.789 4.949) 6.209 21.892 ( -20.617 -5.014 -29.115) 36.026 21.892 ( 20.617 -5.014 29.115) 36.026 24.173 ( -5.543 -0.965 -4.918) 7.473 24.173 ( 5.543 -0.965 4.918) 7.473 ======================= Grid point 483 (243/260) ======================= q-point: ( 0.00 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.419 ( -4.896 15.693 -4.673) 17.090 2.419 ( 4.896 15.693 4.673) 17.090 2.932 ( -1.533 6.057 -9.591) 11.446 2.932 ( 1.533 6.057 9.591) 11.446 3.659 ( -2.586 1.930 -6.705) 7.441 3.659 ( 2.586 1.930 6.705) 7.441 4.485 ( -8.326 -1.122 -11.873) 14.545 4.485 ( 8.326 -1.122 11.873) 14.545 4.869 ( -2.752 -1.804 -14.904) 15.263 4.869 ( 2.752 -1.804 14.904) 15.263 5.662 ( 2.562 -3.374 -4.208) 5.972 5.662 ( -2.562 -3.374 4.208) 5.972 6.792 ( 5.649 9.855 -19.981) 22.984 6.792 ( -5.649 9.855 19.981) 22.984 8.283 ( -3.261 14.668 -12.491) 19.540 8.283 ( 3.261 14.668 12.491) 19.540 8.796 ( -7.720 11.875 1.633) 14.258 8.796 ( 7.720 11.875 -1.633) 14.258 10.100 ( -12.975 -7.161 -12.009) 19.074 10.100 ( 12.975 -7.161 12.009) 19.074 10.951 ( -6.593 9.726 -11.221) 16.247 10.951 ( 6.593 9.726 11.221) 16.247 12.122 ( 0.133 11.300 -9.557) 14.800 12.122 ( -0.133 11.300 9.557) 14.800 14.386 ( -5.569 -9.249 -14.410) 18.005 14.386 ( 5.569 -9.249 14.410) 18.005 15.142 ( -0.215 -8.001 -3.097) 8.582 15.142 ( 0.215 -8.001 3.097) 8.582 17.975 ( -2.748 -17.159 -13.912) 22.261 17.975 ( 2.748 -17.159 13.912) 22.261 19.902 ( -0.340 -2.571 -2.978) 3.949 19.902 ( 0.340 -2.571 2.978) 3.949 21.764 ( -26.153 -2.398 3.124) 26.447 21.764 ( 26.153 -2.398 -3.124) 26.447 24.180 ( -6.973 8.752 -2.216) 11.408 24.180 ( 6.973 8.752 2.216) 11.408 ======================= Grid point 485 (244/260) ======================= q-point: ( 0.10 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.348 ( -0.071 13.436 -1.663) 13.539 2.611 ( 11.354 15.505 2.967) 19.445 2.856 ( -3.159 7.700 -9.324) 12.498 2.999 ( 3.392 3.793 2.160) 5.528 3.508 ( -10.040 1.014 -4.291) 10.965 3.656 ( -4.513 1.503 5.810) 7.509 4.292 ( -8.301 -3.870 -13.527) 16.336 4.664 ( 6.839 4.614 -5.407) 9.864 4.798 ( -1.353 -9.603 0.694) 9.722 5.001 ( 6.964 2.001 16.816) 18.311 5.641 ( 0.258 -1.546 1.983) 2.527 5.735 ( 4.813 -2.418 -4.573) 7.066 6.755 ( -2.795 9.964 20.295) 22.782 6.903 ( 10.013 6.578 -16.986) 20.786 8.139 ( -6.772 15.091 -6.403) 17.737 8.412 ( 3.337 16.531 4.721) 17.513 8.657 ( -1.047 9.381 5.127) 10.742 9.071 ( 15.367 11.062 -2.414) 19.087 9.776 ( -15.354 -6.499 -10.898) 19.919 10.370 ( 10.871 -7.166 9.437) 16.080 10.878 ( 1.932 9.734 -14.956) 17.949 11.191 ( 15.075 9.276 5.829) 18.636 11.930 ( -9.594 9.114 3.836) 13.778 12.311 ( 9.610 14.815 -5.624) 18.532 14.218 ( -7.593 -10.365 -10.474) 16.577 14.514 ( 2.321 -10.581 14.141) 17.813 15.023 ( -4.714 -4.523 0.443) 6.548 15.260 ( 5.568 -9.184 -3.614) 11.332 17.584 ( -16.895 -9.010 12.217) 22.713 18.466 ( 24.491 -24.593 1.144) 34.727 19.725 ( -12.431 -1.871 -0.426) 12.578 19.930 ( -1.509 -2.809 -0.755) 3.277 21.238 ( -24.954 4.451 2.263) 25.449 22.257 ( 22.465 -6.272 -8.267) 24.746 24.011 ( -8.988 7.723 -1.943) 12.008 24.297 ( 4.242 7.683 0.521) 8.792 ======================= Grid point 486 (245/260) ======================= q-point: ( 0.20 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.394 ( 4.628 8.961 -1.978) 10.277 2.726 ( -2.663 9.528 -14.076) 17.205 2.891 ( 10.639 12.572 8.859) 18.701 3.083 ( 5.386 0.423 -2.839) 6.103 3.274 ( -11.935 -0.245 -5.097) 12.980 3.539 ( -7.594 0.424 3.663) 8.442 4.099 ( -8.666 -7.154 -7.713) 13.629 4.584 ( -8.646 -2.503 -10.044) 13.487 4.949 ( 11.181 -3.268 5.910) 13.062 5.202 ( 9.284 3.920 13.653) 16.969 5.668 ( 1.786 1.887 0.664) 2.682 5.815 ( 3.970 0.362 -4.825) 6.259 6.773 ( 0.405 7.705 18.489) 20.034 7.111 ( 13.737 3.037 -12.164) 18.598 7.990 ( -6.740 13.246 -3.925) 15.371 8.390 ( -4.269 18.948 0.539) 19.430 8.784 ( 8.861 6.689 8.164) 13.781 9.276 ( -1.563 1.341 -8.336) 8.587 9.569 ( 4.733 1.497 -4.439) 6.659 10.573 ( 7.233 -6.378 7.879) 12.453 10.938 ( 7.302 11.117 -16.625) 21.291 11.523 ( 15.332 4.281 -4.693) 16.595 11.797 ( -3.404 12.068 14.227) 18.964 12.469 ( 7.969 18.164 -11.289) 22.823 14.047 ( -7.258 -11.976 -8.345) 16.302 14.499 ( -7.063 -12.607 12.634) 19.195 14.997 ( 1.979 -0.960 2.118) 3.053 15.337 ( 3.031 -9.202 -5.065) 10.933 17.380 ( -6.646 -2.080 16.354) 17.775 18.853 ( 11.704 -26.846 0.716) 29.295 19.436 ( -15.817 0.658 -2.198) 15.982 19.888 ( -1.782 -3.226 3.201) 4.881 20.844 ( -13.821 8.877 5.156) 17.216 22.565 ( 10.129 -6.117 -16.330) 20.167 23.852 ( -5.623 3.711 1.833) 6.983 24.350 ( 1.241 5.475 -1.224) 5.746 ======================= Grid point 487 (246/260) ======================= q-point: ( 0.30 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.485 ( 4.026 3.884 -8.345) 10.047 2.662 ( 1.004 8.112 -5.076) 9.621 3.010 ( -10.523 -1.287 -1.911) 10.772 3.129 ( 7.549 9.264 4.865) 12.902 3.202 ( 6.230 -2.419 -4.829) 8.245 3.402 ( -5.041 -1.954 0.541) 5.434 3.920 ( -8.115 -8.441 -2.606) 11.995 4.358 ( -11.879 -5.997 -4.985) 14.210 5.187 ( 11.269 0.812 4.041) 11.999 5.410 ( 8.799 4.880 8.199) 12.979 5.700 ( 1.092 5.089 0.265) 5.212 5.858 ( 1.266 3.375 -4.386) 5.677 6.861 ( 4.565 5.739 16.078) 17.671 7.341 ( 9.804 3.147 -8.317) 13.236 7.878 ( -3.029 9.545 -0.999) 10.064 8.287 ( -5.620 16.442 -2.731) 17.589 8.941 ( 3.319 3.159 7.743) 8.997 9.099 ( -6.766 -3.729 -8.270) 11.317 9.840 ( 16.802 7.845 -2.788) 18.752 10.656 ( -0.734 -3.503 2.746) 4.511 11.097 ( 12.106 10.408 -11.559) 19.710 11.621 ( -0.474 2.363 1.560) 2.870 11.988 ( 14.288 13.682 11.976) 23.126 12.563 ( 4.413 19.686 -17.423) 26.657 13.908 ( -4.702 -12.637 -6.000) 14.758 14.327 ( -11.724 -10.823 9.796) 18.723 15.075 ( 4.184 -1.884 5.142) 6.892 15.355 ( 0.107 -8.398 -6.286) 10.491 17.403 ( 5.408 2.177 16.285) 17.297 18.913 ( -4.307 -14.359 -3.694) 15.439 19.104 ( -15.307 -0.924 -3.042) 15.633 19.813 ( -9.428 1.903 1.259) 9.700 20.824 ( 10.542 0.464 17.432) 20.378 22.546 ( -7.107 -4.460 -24.983) 26.354 23.841 ( 3.525 -1.363 6.905) 7.872 24.342 ( -1.639 2.910 -2.943) 4.452 ======================= Grid point 488 (247/260) ======================= q-point: ( 0.40 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.513 ( 2.903 2.330 -9.657) 10.350 2.732 ( -1.211 2.917 1.006) 3.315 2.823 ( -0.808 -0.816 -1.166) 1.636 3.149 ( -7.836 1.974 -0.145) 8.082 3.301 ( 7.765 -3.695 -1.416) 8.715 3.450 ( 5.292 -5.783 1.840) 8.052 3.791 ( -2.939 -5.226 -1.207) 6.116 4.106 ( -12.525 -5.914 -1.815) 13.969 5.399 ( 8.952 3.421 4.193) 10.460 5.560 ( 4.227 4.720 1.112) 6.433 5.717 ( 1.169 7.494 1.865) 7.811 5.844 ( -1.772 5.571 -3.597) 6.863 7.020 ( 7.974 5.413 13.589) 16.660 7.382 ( -3.746 6.494 -8.345) 11.218 7.906 ( 5.173 5.736 2.175) 8.024 8.162 ( -6.026 11.708 -4.836) 14.028 8.941 ( -0.117 -5.241 -0.513) 5.267 9.045 ( -1.516 1.833 0.978) 2.572 10.145 ( 14.301 8.114 -3.311) 16.773 10.570 ( -7.420 1.501 0.696) 7.602 11.337 ( 13.144 8.038 -7.251) 17.028 11.612 ( -2.060 4.860 7.849) 9.458 12.263 ( 10.149 12.273 11.807) 19.825 12.555 ( -0.893 17.786 -20.648) 27.267 13.856 ( 1.106 -11.366 -4.878) 12.418 14.112 ( -11.496 -9.194 8.107) 16.805 15.168 ( 3.706 -3.521 6.647) 8.385 15.319 ( -2.023 -6.900 -7.094) 10.101 17.660 ( 16.695 3.343 12.757) 21.275 18.579 ( -23.412 0.949 -5.089) 23.978 19.030 ( 5.443 -4.341 -2.236) 7.312 19.536 ( -16.325 6.329 -1.712) 17.592 21.234 ( 22.509 -7.493 25.947) 35.158 22.224 ( -17.963 -5.816 -28.312) 34.030 23.981 ( 7.694 -2.768 7.542) 11.124 24.272 ( -4.481 0.459 -4.647) 6.472 ======================= Grid point 489 (248/260) ======================= q-point: ( 0.50 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.595 ( 3.485 0.762 -2.331) 4.261 2.595 ( -3.485 0.762 2.331) 4.261 2.970 ( -5.615 0.257 -5.570) 7.913 2.970 ( 5.615 0.257 5.570) 7.913 3.441 ( 2.124 -7.663 -10.702) 13.332 3.441 ( -2.124 -7.663 10.702) 13.332 3.872 ( -5.081 -3.344 -3.443) 6.990 3.872 ( 5.081 -3.344 3.443) 6.990 5.546 ( -4.063 4.725 -4.481) 7.675 5.546 ( 4.063 4.725 4.481) 7.675 5.779 ( -3.023 7.102 -4.282) 8.827 5.779 ( 3.023 7.102 4.282) 8.827 7.221 ( -8.866 6.293 -10.847) 15.358 7.221 ( 8.866 6.293 10.847) 15.358 8.032 ( -1.453 7.426 -13.621) 15.582 8.032 ( 1.453 7.426 13.621) 15.582 8.986 ( 0.856 -2.332 -9.508) 9.827 8.986 ( -0.856 -2.332 9.508) 9.827 10.389 ( 0.555 5.952 -14.899) 16.054 10.389 ( -0.555 5.952 14.899) 16.054 11.537 ( 4.169 6.433 -19.282) 20.750 11.537 ( -4.169 6.433 19.282) 20.750 12.447 ( -5.320 14.042 -17.880) 23.349 12.447 ( 5.320 14.042 17.880) 23.349 13.933 ( 7.537 -9.448 -6.211) 13.589 13.933 ( -7.537 -9.448 6.211) 13.589 15.251 ( -3.015 -5.130 -7.415) 9.507 15.251 ( 3.015 -5.130 7.415) 9.507 18.089 ( -23.085 2.547 -8.597) 24.765 18.089 ( 23.085 2.547 8.597) 24.765 19.225 ( -11.064 3.189 -2.453) 11.773 19.225 ( 11.064 3.189 2.453) 11.773 21.751 ( -22.597 -8.029 -28.511) 37.256 21.751 ( 22.597 -8.029 28.511) 37.256 24.146 ( -6.830 -1.609 -6.431) 9.518 24.146 ( 6.830 -1.609 6.431) 9.518 ======================= Grid point 495 (249/260) ======================= q-point: ( 0.00 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.743 ( -3.058 14.593 -5.137) 15.770 2.743 ( 3.058 14.593 5.137) 15.770 3.013 ( -1.950 1.912 -8.753) 9.169 3.013 ( 1.950 1.912 8.753) 9.169 3.741 ( -0.238 4.996 -8.889) 10.200 3.741 ( 0.238 4.996 8.889) 10.200 4.412 ( -9.073 -5.124 -12.897) 16.581 4.412 ( 9.073 -5.124 12.897) 16.581 4.866 ( -5.630 1.208 -14.221) 15.342 4.866 ( 5.630 1.208 14.221) 15.342 5.583 ( 2.393 -4.020 -7.788) 9.085 5.583 ( -2.393 -4.020 7.788) 9.085 6.992 ( 3.949 8.712 -23.099) 25.001 6.992 ( -3.949 8.712 23.099) 25.001 8.530 ( 0.654 8.261 -12.574) 15.059 8.530 ( -0.654 8.261 12.574) 15.059 9.092 ( -3.220 15.883 -6.938) 17.629 9.092 ( 3.220 15.883 6.938) 17.629 9.944 ( -12.728 -7.848 -8.342) 17.122 9.944 ( 12.728 -7.848 8.342) 17.122 11.111 ( -5.194 5.329 -8.082) 10.986 11.111 ( 5.194 5.329 8.082) 10.986 12.440 ( -6.735 18.530 -2.983) 19.940 12.440 ( 6.735 18.530 2.983) 19.940 14.122 ( -5.677 -15.915 -13.336) 21.526 14.122 ( 5.677 -15.915 13.336) 21.526 14.989 ( -0.211 -6.095 -4.060) 7.326 14.989 ( 0.211 -6.095 4.060) 7.326 17.641 ( 3.556 -13.825 -19.889) 24.482 17.641 ( -3.556 -13.825 19.889) 24.482 19.856 ( 0.837 -1.732 -3.951) 4.395 19.856 ( -0.837 -1.732 3.951) 4.395 21.729 ( -21.296 -1.029 1.583) 21.380 21.729 ( 21.296 -1.029 -1.583) 21.380 24.333 ( -6.697 5.653 -2.432) 9.095 24.333 ( 6.697 5.653 2.432) 9.095 ======================= Grid point 497 (250/260) ======================= q-point: ( 0.10 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.646 ( -2.881 14.288 0.589) 14.588 2.911 ( 7.321 10.872 -6.283) 14.535 2.953 ( -0.114 3.564 -2.461) 4.332 3.061 ( 1.323 2.187 5.500) 6.065 3.615 ( -9.641 8.542 -3.802) 13.430 3.691 ( -6.881 1.450 5.158) 8.721 4.162 ( -11.943 -7.942 -9.504) 17.205 4.569 ( -1.034 -10.969 2.990) 11.416 4.795 ( 5.310 6.914 -8.800) 12.387 5.046 ( 9.286 1.723 12.431) 15.612 5.606 ( 3.087 -1.771 6.405) 7.327 5.666 ( 6.828 -3.891 -6.901) 10.458 6.961 ( -4.523 9.057 23.022) 25.150 7.036 ( 6.322 5.752 -21.093) 22.759 8.435 ( -6.324 12.245 -4.994) 14.658 8.639 ( 7.835 5.171 -1.341) 9.483 8.922 ( -5.685 14.919 1.126) 16.005 9.331 ( 9.690 12.200 0.192) 15.581 9.649 ( -11.503 -4.320 -4.954) 13.249 10.215 ( 11.590 -7.762 7.244) 15.718 11.068 ( 3.150 7.842 -12.237) 14.872 11.303 ( 12.324 1.844 0.360) 12.466 12.244 ( -8.236 20.325 3.402) 22.193 12.667 ( 11.549 18.339 -1.290) 21.711 13.942 ( -8.852 -15.703 -10.497) 20.860 14.223 ( 0.625 -16.803 12.873) 21.177 14.947 ( -0.509 -2.780 -0.002) 2.827 15.066 ( 4.138 -8.681 -1.580) 9.746 17.428 ( -8.356 -5.164 13.155) 16.418 17.973 ( 18.493 -21.357 -1.652) 28.299 19.714 ( -10.290 0.416 0.577) 10.315 19.866 ( -2.014 -3.074 -1.710) 4.053 21.325 ( -18.835 3.597 1.661) 19.247 22.143 ( 19.801 -4.363 -4.426) 20.753 24.144 ( -11.166 4.877 -2.367) 12.412 24.432 ( 2.680 5.008 0.668) 5.719 ======================= Grid point 498 (251/260) ======================= q-point: ( 0.20 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.618 ( -0.486 11.930 -0.090) 11.940 2.857 ( -2.528 2.457 -16.130) 16.511 3.073 ( 1.386 -1.116 0.983) 2.033 3.127 ( 5.221 10.291 10.167) 15.379 3.395 ( -9.579 11.422 -4.255) 15.502 3.524 ( -10.085 -2.116 1.035) 10.357 3.918 ( -10.659 -9.965 -3.588) 15.026 4.405 ( -11.506 -12.558 -4.580) 17.637 5.004 ( 13.194 6.558 -0.709) 14.751 5.275 ( 10.863 2.637 9.642) 14.762 5.704 ( 4.765 1.365 5.653) 7.518 5.797 ( 7.249 -1.906 -6.468) 9.900 6.934 ( -2.168 7.317 19.677) 21.105 7.173 ( 11.807 2.545 -17.452) 21.223 8.260 ( -9.636 11.715 -3.638) 15.599 8.731 ( -2.903 11.311 -4.105) 12.378 8.913 ( 6.527 6.722 0.860) 9.409 9.231 ( -12.670 -4.099 -3.514) 13.772 9.726 ( 14.179 11.843 0.940) 18.498 10.432 ( 8.526 -7.091 6.391) 12.800 11.151 ( 7.163 8.466 -10.954) 15.587 11.553 ( 12.362 0.469 -9.605) 15.662 12.171 ( 0.658 22.027 9.436) 23.972 12.875 ( 9.636 19.592 -4.776) 22.350 13.742 ( -8.792 -16.773 -8.359) 20.701 14.199 ( -5.452 -15.895 11.376) 20.293 14.969 ( 2.234 -1.616 1.448) 3.114 15.134 ( 3.051 -9.521 -2.836) 10.392 17.373 ( -0.760 1.753 17.704) 17.807 18.322 ( 16.174 -23.039 -1.250) 28.177 19.463 ( -15.207 1.519 -0.380) 15.287 19.820 ( -1.244 -3.100 1.610) 3.708 21.009 ( -13.091 6.716 3.666) 15.163 22.442 ( 10.641 -5.213 -11.566) 16.558 23.914 ( -10.440 2.094 0.895) 10.686 24.447 ( -0.960 3.625 -0.996) 3.880 ======================= Grid point 499 (252/260) ======================= q-point: ( 0.30 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.600 ( -1.190 7.179 -6.009) 9.438 2.795 ( 0.236 3.268 -9.770) 10.305 3.010 ( -9.400 0.364 -2.864) 9.833 3.152 ( -0.063 3.196 4.613) 5.612 3.311 ( -9.482 -6.974 -0.386) 11.777 3.368 ( 2.933 10.200 1.871) 10.776 3.744 ( -6.134 -8.305 0.933) 10.367 4.158 ( -11.619 -12.048 -4.176) 17.251 5.264 ( 12.528 5.510 1.539) 13.772 5.498 ( 9.389 3.236 5.418) 11.313 5.801 ( 3.652 4.260 4.619) 7.268 5.902 ( 4.350 0.874 -5.138) 6.789 6.985 ( 3.399 5.972 16.322) 17.710 7.397 ( 12.942 1.797 -14.036) 19.177 8.067 ( -8.325 7.690 -2.636) 11.636 8.574 ( -10.141 9.370 -4.888) 14.647 8.955 ( -6.302 1.308 10.024) 11.912 9.102 ( 2.741 1.812 -11.963) 12.406 10.034 ( 15.815 10.284 0.342) 18.868 10.565 ( 3.303 -4.845 4.823) 7.593 11.295 ( 9.101 7.361 -2.474) 11.963 11.706 ( 5.958 5.772 -12.870) 15.312 12.316 ( 10.111 17.707 9.777) 22.614 12.996 ( 3.182 21.110 -10.070) 23.604 13.588 ( -4.035 -17.857 -5.277) 19.053 14.076 ( -8.922 -13.180 9.206) 18.387 15.027 ( 2.788 -2.555 3.191) 4.948 15.169 ( 1.180 -8.837 -3.792) 9.688 17.476 ( 7.257 4.712 17.646) 19.653 18.599 ( 12.781 -14.442 -2.961) 19.511 19.109 ( -19.663 0.647 -2.039) 19.779 19.814 ( -2.516 -1.178 3.036) 4.115 20.876 ( 0.046 3.803 11.920) 12.512 22.445 ( -7.361 -4.824 -22.759) 24.401 23.809 ( -0.007 -1.615 7.854) 8.018 24.394 ( -3.955 1.953 -2.932) 5.296 ======================= Grid point 500 (253/260) ======================= q-point: ( 0.40 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.565 ( 0.399 2.955 -7.598) 8.162 2.780 ( -9.195 -0.577 -3.263) 9.774 2.840 ( 3.137 3.966 -1.995) 5.436 3.113 ( -9.209 -5.189 1.562) 10.685 3.208 ( 4.306 -4.060 -3.266) 6.760 3.392 ( -3.054 -0.447 6.246) 6.967 3.703 ( 1.931 -2.937 1.513) 3.827 3.946 ( -8.783 -8.454 -3.129) 12.586 5.492 ( 9.667 4.825 2.828) 11.168 5.644 ( 4.028 3.125 0.501) 5.122 5.868 ( 2.313 6.366 4.006) 7.869 5.940 ( 0.605 3.549 -3.721) 5.177 7.138 ( 8.314 5.633 13.550) 16.866 7.515 ( -1.035 5.782 -10.841) 12.330 7.994 ( 3.891 1.781 -4.416) 6.150 8.352 ( -10.822 5.946 -1.323) 12.419 8.898 ( -0.901 1.719 12.384) 12.535 9.082 ( -2.620 1.248 -14.045) 14.341 10.319 ( 12.448 8.124 -1.499) 14.940 10.586 ( -1.965 0.084 4.072) 4.522 11.495 ( 10.016 6.306 6.346) 13.430 11.748 ( 0.991 8.051 -11.992) 14.478 12.543 ( 9.896 14.112 9.251) 19.562 12.934 ( -6.069 17.158 -13.117) 22.434 13.590 ( 4.903 -13.246 -4.142) 14.719 13.903 ( -10.060 -10.589 7.517) 16.427 15.087 ( 2.341 -3.929 4.175) 6.192 15.166 ( -0.438 -7.295 -4.370) 8.515 17.739 ( 15.754 3.996 12.856) 20.723 18.598 ( -20.547 0.777 -2.227) 20.682 18.952 ( 13.793 -3.134 -3.243) 14.512 19.645 ( -14.520 3.887 -0.936) 15.060 21.104 ( 17.461 -4.553 23.380) 29.534 22.092 ( -20.396 -6.314 -28.247) 35.409 23.922 ( 7.841 -2.638 9.672) 12.727 24.279 ( -6.639 0.178 -5.245) 8.462 ======================= Grid point 501 (254/260) ======================= q-point: ( 0.50 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.614 ( -0.134 0.840 -2.227) 2.383 2.614 ( 0.134 0.840 2.227) 2.384 2.950 ( -2.904 -1.742 -1.885) 3.875 2.950 ( 2.904 -1.742 1.885) 3.875 3.305 ( 5.919 -5.253 -4.990) 9.355 3.305 ( -5.919 -5.253 4.990) 9.355 3.794 ( -3.934 -3.551 -4.813) 7.159 3.794 ( 3.934 -3.551 4.813) 7.159 5.640 ( -3.805 3.875 -2.944) 6.177 5.640 ( 3.805 3.875 2.944) 6.177 5.918 ( -1.578 5.784 -3.748) 7.071 5.918 ( 1.578 5.784 3.748) 7.071 7.354 ( -9.718 6.124 -11.414) 16.193 7.354 ( 9.718 6.124 11.414) 16.193 8.148 ( 1.988 3.079 -17.792) 18.166 8.148 ( -1.988 3.079 17.792) 18.166 8.969 ( -2.878 0.660 -18.055) 18.295 8.969 ( 2.878 0.660 18.055) 18.295 10.507 ( 2.246 5.015 -17.284) 18.137 10.507 ( -2.246 5.015 17.284) 18.137 11.678 ( -1.778 6.809 -20.628) 21.796 11.678 ( 1.778 6.809 20.628) 21.796 12.749 ( -8.792 13.908 -11.898) 20.305 12.749 ( 8.792 13.908 11.898) 20.305 13.725 ( 9.101 -9.860 -5.875) 14.648 13.725 ( -9.101 -9.860 5.875) 14.648 15.136 ( -1.215 -5.535 -5.268) 7.737 15.136 ( 1.215 -5.535 5.268) 7.737 18.142 ( -21.678 2.293 -7.239) 22.970 18.142 ( 21.678 2.293 7.239) 22.970 19.297 ( -18.318 3.432 -0.947) 18.661 19.297 ( 18.318 3.432 0.947) 18.661 21.583 ( -23.280 -7.564 -28.197) 37.339 21.583 ( 23.280 -7.564 28.197) 37.339 24.112 ( -8.482 -1.532 -7.920) 11.706 24.112 ( 8.482 -1.532 7.920) 11.706 ======================= Grid point 507 (255/260) ======================= q-point: ( 0.00 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.972 ( -0.824 5.848 -10.173) 11.763 2.972 ( 0.824 5.848 10.173) 11.763 3.035 ( -1.640 0.981 -7.200) 7.449 3.035 ( 1.640 0.981 7.200) 7.449 3.817 ( 0.601 1.714 -12.185) 12.320 3.817 ( -0.601 1.714 12.185) 12.320 4.323 ( -1.915 -2.467 -7.639) 8.253 4.323 ( 1.915 -2.467 7.639) 8.253 4.895 ( -2.814 1.040 -6.012) 6.719 4.895 ( 2.814 1.040 6.012) 6.719 5.513 ( 1.633 -2.074 -12.098) 12.383 5.513 ( -1.633 -2.074 12.098) 12.383 7.125 ( 2.610 3.506 -25.061) 25.439 7.125 ( -2.610 3.506 25.061) 25.439 8.632 ( 1.237 2.096 -7.770) 8.142 8.632 ( -1.237 2.096 7.770) 8.142 9.395 ( 4.621 11.199 -14.571) 18.950 9.395 ( -4.621 11.199 14.571) 18.950 9.780 ( -12.212 -7.082 -6.001) 15.340 9.780 ( 12.212 -7.082 6.001) 15.340 11.178 ( -2.164 1.450 -2.268) 3.454 11.178 ( 2.164 1.450 2.268) 3.454 12.813 ( -6.719 13.869 -1.031) 15.445 12.813 ( 6.719 13.869 1.031) 15.445 13.788 ( -4.414 -12.826 -7.468) 15.484 13.788 ( 4.414 -12.826 7.468) 15.484 14.903 ( 0.841 -2.135 -4.973) 5.477 14.903 ( -0.841 -2.135 4.973) 5.477 17.438 ( 6.103 -5.134 -22.389) 23.767 17.438 ( -6.103 -5.134 22.389) 23.767 19.832 ( 1.451 -0.588 -4.350) 4.623 19.832 ( -1.451 -0.588 4.350) 4.623 21.717 ( -18.465 -0.235 0.940) 18.491 21.717 ( 18.465 -0.235 -0.940) 18.491 24.411 ( -6.967 1.849 -2.495) 7.627 24.411 ( 6.967 1.849 2.495) 7.627 ======================= Grid point 509 (256/260) ======================= q-point: ( 0.10 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.889 ( -3.304 7.571 0.913) 8.311 2.954 ( -3.081 -0.233 -7.032) 7.681 3.040 ( 1.179 0.441 4.218) 4.402 3.168 ( 8.183 5.680 1.562) 10.083 3.706 ( -8.504 0.986 -8.808) 12.283 3.764 ( -6.868 1.932 7.789) 10.562 4.052 ( -15.817 0.164 -0.118) 15.818 4.350 ( -6.004 -8.660 -6.488) 12.375 4.943 ( 8.057 6.303 -2.140) 10.451 5.049 ( 10.369 -1.787 6.489) 12.362 5.576 ( 5.258 -0.722 8.815) 10.289 5.594 ( 7.775 -2.426 -7.845) 11.308 7.100 ( -5.480 3.746 24.536) 25.418 7.123 ( 3.816 2.240 -23.316) 23.733 8.612 ( -3.491 4.349 -7.536) 9.375 8.693 ( 7.085 0.927 -0.307) 7.152 9.197 ( -8.954 10.898 2.478) 14.321 9.391 ( -11.868 -5.779 -5.081) 14.144 9.734 ( 10.965 9.960 -5.010) 15.638 10.048 ( 11.859 -7.890 9.425) 17.080 11.191 ( 3.519 3.739 -4.560) 6.867 11.302 ( 10.813 -1.074 -4.746) 11.858 12.693 ( -4.587 20.034 0.616) 20.562 12.965 ( 7.706 5.150 0.867) 9.309 13.660 ( -6.517 -6.035 -6.304) 10.891 13.859 ( 0.798 -16.329 7.453) 17.967 14.906 ( 0.818 -1.121 2.449) 2.815 14.934 ( 2.479 -3.403 -2.190) 4.746 17.389 ( -1.724 1.068 20.732) 20.831 17.627 ( 14.151 -10.758 -10.093) 20.441 19.731 ( -8.874 0.954 2.246) 9.204 19.812 ( -2.461 -1.840 -3.117) 4.377 21.378 ( -15.656 1.385 1.373) 15.777 22.082 ( 17.876 -1.519 -2.456) 18.108 24.210 ( -12.349 1.575 -2.873) 12.776 24.501 ( 1.865 1.636 1.029) 2.686 ======================= Grid point 510 (257/260) ======================= q-point: ( 0.20 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.840 ( -2.274 6.900 1.525) 7.424 2.874 ( -3.026 0.746 -11.071) 11.501 3.047 ( -0.995 -0.629 0.754) 1.398 3.300 ( 0.784 3.406 4.750) 5.898 3.486 ( -9.487 1.255 -5.891) 11.238 3.617 ( -7.411 3.580 1.821) 8.429 3.752 ( -13.941 -0.865 4.132) 14.566 4.138 ( -11.780 -11.107 -7.573) 17.874 5.140 ( 11.181 4.898 0.001) 12.206 5.299 ( 12.607 -0.156 5.409) 13.719 5.723 ( 6.678 0.422 9.607) 11.707 5.755 ( 9.507 -1.503 -8.624) 12.923 7.053 ( -3.280 3.452 20.577) 21.121 7.205 ( 9.841 0.529 -21.217) 23.394 8.439 ( -11.563 4.786 -4.995) 13.474 8.841 ( 1.791 1.555 0.623) 2.453 9.055 ( -2.097 4.621 -8.780) 10.141 9.156 ( -9.185 -2.425 2.438) 9.807 9.976 ( 13.569 10.124 -6.904) 18.284 10.282 ( 9.361 -6.818 11.425) 16.267 11.267 ( 4.646 2.624 -0.545) 5.364 11.566 ( 16.676 0.667 -14.725) 22.257 12.648 ( -0.129 21.904 2.438) 22.040 13.109 ( 6.377 -6.383 0.023) 9.023 13.517 ( -6.278 5.037 -5.121) 9.540 13.853 ( -2.865 -16.812 6.392) 18.213 14.940 ( 1.769 -0.879 3.134) 3.704 14.982 ( 2.744 -4.200 -2.548) 5.627 17.446 ( 2.052 4.081 23.660) 24.097 17.945 ( 19.758 -11.608 -7.568) 24.133 19.489 ( -15.903 0.807 1.024) 15.956 19.770 ( -0.450 -1.386 0.342) 1.497 21.109 ( -11.963 2.558 3.195) 12.644 22.365 ( 10.315 -2.016 -8.828) 13.726 23.940 ( -13.074 0.587 0.153) 13.088 24.497 ( -2.081 1.187 -0.736) 2.506 ======================= Grid point 511 (258/260) ======================= q-point: ( 0.30 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.760 ( -5.603 6.748 -4.819) 10.007 2.815 ( -0.677 -0.209 -10.082) 10.107 3.003 ( -3.641 0.442 -2.340) 4.350 3.133 ( -11.236 -8.341 -3.142) 14.343 3.327 ( -9.283 10.662 8.884) 16.697 3.524 ( -10.523 -1.557 5.975) 12.201 3.603 ( 4.068 0.004 -1.225) 4.249 3.915 ( -8.178 -9.433 -5.384) 13.596 5.366 ( 11.147 3.244 1.614) 11.721 5.538 ( 9.937 0.788 3.247) 10.484 5.864 ( 5.476 1.632 6.964) 9.008 5.904 ( 6.800 -0.273 -6.000) 9.073 7.089 ( 2.890 3.230 16.204) 16.774 7.408 ( 14.473 -0.299 -18.746) 23.685 8.175 ( -13.045 2.620 -4.021) 13.900 8.674 ( -13.139 1.646 5.003) 14.155 9.020 ( -5.897 2.920 10.519) 12.408 9.122 ( 5.015 0.142 -21.658) 22.232 10.230 ( 13.539 7.244 -7.224) 16.970 10.464 ( 6.109 -4.402 13.070) 15.084 11.388 ( 7.267 1.965 7.260) 10.459 11.822 ( 11.596 3.811 -21.237) 24.495 12.700 ( 4.439 17.943 3.457) 18.804 13.192 ( 1.029 -18.114 -1.874) 18.240 13.416 ( -1.694 18.239 -3.636) 18.675 13.782 ( -5.337 -15.178 4.779) 16.784 14.984 ( 1.795 -1.178 3.554) 4.152 15.025 ( 2.038 -4.138 -2.894) 5.446 17.573 ( 6.293 3.459 19.958) 21.210 18.363 ( 23.306 -6.915 -4.348) 24.696 19.120 ( -20.758 0.327 -0.970) 20.783 19.789 ( 0.216 -0.825 3.280) 3.389 20.946 ( -4.452 2.121 9.633) 10.822 22.368 ( -8.019 -2.122 -21.265) 22.826 23.782 ( -2.040 -0.742 8.128) 8.413 24.420 ( -5.185 0.633 -2.954) 6.000 ======================= Grid point 512 (259/260) ======================= q-point: ( 0.40 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.644 ( -3.753 4.570 -6.258) 8.610 2.737 ( -6.157 -3.441 -7.130) 10.029 2.910 ( -1.799 1.759 -2.624) 3.636 2.990 ( -4.227 -4.355 0.768) 6.117 3.212 ( -3.023 4.158 3.909) 6.458 3.343 ( -8.535 -4.844 4.791) 10.920 3.684 ( 3.462 0.972 0.858) 3.697 3.798 ( -3.385 -4.948 -2.516) 6.502 5.571 ( 8.622 2.230 2.290) 9.196 5.686 ( 4.189 0.965 0.498) 4.328 5.962 ( 2.991 2.409 4.610) 6.000 5.988 ( 2.795 1.090 -3.772) 4.820 7.234 ( 8.276 2.963 12.558) 15.329 7.599 ( 3.343 2.009 -13.968) 14.503 7.992 ( 0.537 -0.820 -7.489) 7.553 8.425 ( -13.570 1.602 9.394) 16.582 8.961 ( -2.644 2.576 15.498) 15.932 9.093 ( -1.831 -0.030 -25.122) 25.189 10.458 ( 10.446 4.493 -8.608) 14.262 10.574 ( 1.806 -1.085 13.354) 13.520 11.585 ( 9.527 2.208 14.526) 17.511 11.900 ( 1.279 4.860 -21.986) 22.553 12.821 ( 6.608 11.651 3.890) 13.948 13.123 ( -6.119 -3.853 -4.133) 8.329 13.454 ( 4.925 6.032 -2.464) 8.168 13.675 ( -6.126 -11.475 3.533) 13.479 15.022 ( 1.182 -1.835 3.635) 4.240 15.047 ( 0.859 -3.385 -3.253) 4.772 17.806 ( 13.917 1.914 12.533) 18.827 18.609 ( -17.657 0.274 0.230) 17.661 18.905 ( 19.311 -1.220 -4.026) 19.764 19.695 ( -11.532 1.087 0.036) 11.583 21.048 ( 11.928 -1.070 21.592) 24.691 21.990 ( -22.012 -2.891 -28.391) 36.041 23.881 ( 8.045 -1.082 10.920) 13.607 24.281 ( -7.892 0.010 -5.724) 9.749 ======================= Grid point 513 (260/260) ======================= q-point: ( 0.50 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 3.67e-09 3.67e-09 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.622 ( 0.044 -0.008 -3.795) 3.795 2.622 ( -0.044 -0.008 3.795) 3.795 2.925 ( 2.755 -0.448 -2.502) 3.748 2.925 ( -2.755 -0.448 2.502) 3.748 3.225 ( -0.041 -2.252 -1.548) 2.733 3.225 ( 0.041 -2.252 1.548) 2.733 3.742 ( -1.818 -1.287 -2.193) 3.126 3.742 ( 1.818 -1.287 2.193) 3.126 5.696 ( -3.002 1.410 -1.726) 3.739 5.696 ( 3.002 1.410 1.726) 3.739 6.003 ( -0.318 2.180 -3.232) 3.912 6.003 ( 0.318 2.180 3.232) 3.912 7.453 ( -10.312 2.818 -10.472) 14.965 7.453 ( 10.312 2.818 10.472) 14.965 8.170 ( 10.424 -0.072 -13.476) 17.037 8.170 ( -10.424 -0.072 13.476) 17.037 8.993 ( -1.261 1.005 -23.157) 23.213 8.993 ( 1.261 1.005 23.157) 23.213 10.582 ( 3.729 1.951 -17.125) 17.635 10.582 ( -3.729 1.951 17.125) 17.635 11.793 ( -6.347 3.365 -20.136) 21.379 11.793 ( 6.347 3.365 20.136) 21.379 12.972 ( -7.524 6.294 -4.582) 10.827 12.972 ( 7.524 6.294 4.582) 10.827 13.561 ( 3.998 -4.863 -2.615) 6.816 13.561 ( -3.998 -4.863 2.615) 6.816 15.045 ( -0.076 -2.588 -4.202) 4.935 15.045 ( 0.076 -2.588 4.202) 4.935 18.176 ( -20.858 0.911 -5.771) 21.661 18.176 ( 20.858 0.911 5.771) 21.661 19.353 ( -21.605 1.577 -0.565) 21.670 19.353 ( 21.605 1.577 0.565) 21.670 21.465 ( -22.564 -3.169 -28.303) 36.335 21.465 ( 22.564 -3.169 28.303) 36.335 24.088 ( -9.641 -0.632 -8.801) 13.069 24.088 ( 9.641 -0.632 8.801) 13.069 =================== 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 3/32400 10.0 3973.069 3866.603 3970.449 0.000 711.845 0.000 3/32400 20.0 704.626 443.288 705.972 0.000 159.821 0.000 3/32400 30.0 246.818 146.369 241.413 0.000 51.477 0.000 3/32400 40.0 125.231 74.173 122.325 0.000 25.107 0.000 3/32400 50.0 77.506 46.010 76.200 0.000 15.354 0.000 3/32400 60.0 53.963 32.104 53.492 0.000 10.639 0.000 3/32400 70.0 40.546 24.189 40.523 0.000 7.955 0.000 3/32400 80.0 32.115 19.230 32.346 0.000 6.261 0.000 3/32400 90.0 26.431 15.898 26.813 0.000 5.113 0.000 3/32400 100.0 22.393 13.535 22.864 0.000 4.295 0.000 3/32400 110.0 19.403 11.787 19.925 0.000 3.689 0.000 3/32400 120.0 17.115 10.448 17.663 0.000 3.225 0.000 3/32400 130.0 15.318 9.392 15.874 0.000 2.860 0.000 3/32400 140.0 13.873 8.539 14.425 0.000 2.567 0.000 3/32400 150.0 12.690 7.836 13.229 0.000 2.328 0.000 3/32400 160.0 11.705 7.246 12.225 0.000 2.130 0.000 3/32400 170.0 10.872 6.744 11.371 0.000 1.963 0.000 3/32400 180.0 10.161 6.311 10.635 0.000 1.820 0.000 3/32400 190.0 9.545 5.934 9.994 0.000 1.698 0.000 3/32400 200.0 9.007 5.602 9.430 0.000 1.592 0.000 3/32400 210.0 8.532 5.307 8.931 0.000 1.499 0.000 3/32400 220.0 8.110 5.044 8.485 0.000 1.417 0.000 3/32400 230.0 7.733 4.807 8.084 0.000 1.344 0.000 3/32400 240.0 7.392 4.592 7.721 0.000 1.279 0.000 3/32400 250.0 7.084 4.397 7.392 0.000 1.220 0.000 3/32400 260.0 6.803 4.218 7.091 0.000 1.167 0.000 3/32400 270.0 6.545 4.054 6.814 0.000 1.119 0.000 3/32400 280.0 6.308 3.903 6.560 0.000 1.075 0.000 3/32400 290.0 6.089 3.763 6.325 0.000 1.034 0.000 3/32400 300.0 5.885 3.633 6.107 0.000 0.997 0.000 3/32400 310.0 5.696 3.512 5.904 0.000 0.963 0.000 3/32400 320.0 5.520 3.399 5.714 0.000 0.931 0.000 3/32400 330.0 5.355 3.294 5.537 0.000 0.901 0.000 3/32400 340.0 5.199 3.194 5.371 0.000 0.873 0.000 3/32400 350.0 5.054 3.101 5.215 0.000 0.847 0.000 3/32400 360.0 4.916 3.014 5.068 0.000 0.823 0.000 3/32400 370.0 4.786 2.931 4.929 0.000 0.800 0.000 3/32400 380.0 4.663 2.853 4.798 0.000 0.778 0.000 3/32400 390.0 4.547 2.778 4.674 0.000 0.758 0.000 3/32400 400.0 4.436 2.708 4.556 0.000 0.739 0.000 3/32400 410.0 4.331 2.641 4.445 0.000 0.721 0.000 3/32400 420.0 4.231 2.578 4.338 0.000 0.703 0.000 3/32400 430.0 4.135 2.517 4.237 0.000 0.687 0.000 3/32400 440.0 4.044 2.460 4.140 0.000 0.671 0.000 3/32400 450.0 3.957 2.405 4.048 0.000 0.656 0.000 3/32400 460.0 3.873 2.352 3.960 0.000 0.642 0.000 3/32400 470.0 3.793 2.302 3.876 0.000 0.628 0.000 3/32400 480.0 3.716 2.253 3.795 0.000 0.615 0.000 3/32400 490.0 3.643 2.207 3.717 0.000 0.602 0.000 3/32400 500.0 3.572 2.163 3.643 0.000 0.590 0.000 3/32400 510.0 3.504 2.120 3.572 0.000 0.579 0.000 3/32400 520.0 3.438 2.079 3.503 0.000 0.568 0.000 3/32400 530.0 3.375 2.040 3.437 0.000 0.557 0.000 3/32400 540.0 3.315 2.002 3.374 0.000 0.547 0.000 3/32400 550.0 3.256 1.966 3.312 0.000 0.537 0.000 3/32400 560.0 3.199 1.930 3.253 0.000 0.528 0.000 3/32400 570.0 3.145 1.897 3.196 0.000 0.518 0.000 3/32400 580.0 3.092 1.864 3.142 0.000 0.510 0.000 3/32400 590.0 3.041 1.832 3.088 0.000 0.501 0.000 3/32400 600.0 2.991 1.802 3.037 0.000 0.493 0.000 3/32400 610.0 2.944 1.772 2.987 0.000 0.485 0.000 3/32400 620.0 2.897 1.743 2.939 0.000 0.477 0.000 3/32400 630.0 2.852 1.716 2.893 0.000 0.469 0.000 3/32400 640.0 2.809 1.689 2.848 0.000 0.462 0.000 3/32400 650.0 2.767 1.663 2.804 0.000 0.455 0.000 3/32400 660.0 2.726 1.638 2.762 0.000 0.448 0.000 3/32400 670.0 2.686 1.613 2.721 0.000 0.442 0.000 3/32400 680.0 2.647 1.589 2.681 0.000 0.435 0.000 3/32400 690.0 2.610 1.566 2.642 0.000 0.429 0.000 3/32400 700.0 2.573 1.544 2.605 0.000 0.423 0.000 3/32400 710.0 2.538 1.522 2.568 0.000 0.417 0.000 3/32400 720.0 2.503 1.501 2.532 0.000 0.411 0.000 3/32400 730.0 2.470 1.481 2.498 0.000 0.406 0.000 3/32400 740.0 2.437 1.461 2.464 0.000 0.400 0.000 3/32400 750.0 2.405 1.441 2.432 0.000 0.395 0.000 3/32400 760.0 2.374 1.422 2.400 0.000 0.390 0.000 3/32400 770.0 2.344 1.404 2.369 0.000 0.385 0.000 3/32400 780.0 2.314 1.386 2.338 0.000 0.380 0.000 3/32400 790.0 2.286 1.368 2.309 0.000 0.375 0.000 3/32400 800.0 2.258 1.351 2.280 0.000 0.371 0.000 3/32400 810.0 2.230 1.334 2.252 0.000 0.366 0.000 3/32400 820.0 2.203 1.318 2.225 0.000 0.362 0.000 3/32400 830.0 2.177 1.302 2.198 0.000 0.357 0.000 3/32400 840.0 2.152 1.287 2.172 0.000 0.353 0.000 3/32400 850.0 2.127 1.272 2.146 0.000 0.349 0.000 3/32400 860.0 2.103 1.257 2.122 0.000 0.345 0.000 3/32400 870.0 2.079 1.242 2.097 0.000 0.341 0.000 3/32400 880.0 2.056 1.228 2.073 0.000 0.337 0.000 3/32400 890.0 2.033 1.215 2.050 0.000 0.333 0.000 3/32400 900.0 2.011 1.201 2.028 0.000 0.330 0.000 3/32400 910.0 1.989 1.188 2.005 0.000 0.326 0.000 3/32400 920.0 1.967 1.175 1.984 0.000 0.323 0.000 3/32400 930.0 1.947 1.162 1.962 0.000 0.319 0.000 3/32400 940.0 1.926 1.150 1.941 0.000 0.316 0.000 3/32400 950.0 1.906 1.138 1.921 0.000 0.313 0.000 3/32400 960.0 1.887 1.126 1.901 0.000 0.309 0.000 3/32400 970.0 1.867 1.114 1.882 0.000 0.306 0.000 3/32400 980.0 1.849 1.103 1.862 0.000 0.303 0.000 3/32400 990.0 1.830 1.092 1.844 0.000 0.300 0.000 3/32400 1000.0 1.812 1.081 1.825 0.000 0.297 0.000 3/32400 Thermal conductivity related properties were written into "kappa-m10910.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 00:14:54]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|