----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 20:18:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.411945680032738 0.000000000000000 0.000000000000000 b 0.000000000000000 6.997023870000000 0.000000000000000 c -4.813833992883406 0.000000000000000 6.588081366955952 Atomic positions (fractional): *1 O 0.58770471515385 0.28680660032378 0.37526210130910 15.999 2 O 0.41229528484615 0.78680660032378 0.12473789869090 15.999 3 O 0.41229528484615 0.71319339967622 0.62473789869090 15.999 4 O 0.58770471515385 0.21319339967622 0.87526210130910 15.999 *5 O 0.33563747637910 0.39467568126615 0.02628812892714 15.999 6 O 0.66436252362090 0.89467568126615 0.47371187107286 15.999 7 O 0.66436252362090 0.60532431873385 0.97371187107286 15.999 8 O 0.33563747637910 0.10532431873385 0.52628812892714 15.999 *9 O 0.19148783243040 0.00429238852418 0.75099881697956 15.999 10 O 0.80851216756960 0.50429238852418 0.74900118302044 15.999 11 O 0.80851216756960 0.99570761147582 0.24900118302044 15.999 12 O 0.19148783243040 0.49570761147582 0.25099881697956 15.999 *13 O 0.11522349948283 0.33252538261613 0.61820027988867 15.999 14 O 0.88477650051717 0.83252538261612 0.88179972011133 15.999 15 O 0.88477650051717 0.66747461738388 0.38179972011133 15.999 16 O 0.11522349948283 0.16747461738388 0.11820027988867 15.999 *17 P 0.30929970071321 0.33755228859783 0.19668055806709 30.974 18 P 0.69070029928679 0.83755228859783 0.30331944193291 30.974 19 P 0.69070029928679 0.66244771140217 0.80331944193292 30.974 20 P 0.30929970071321 0.16244771140217 0.69668055806708 30.974 *21 Pr 0.81798251637728 0.34221704137524 0.21780774446794 140.908 22 Pr 0.18201748362272 0.84221704137524 0.28219225553206 140.908 23 Pr 0.18201748362272 0.65778295862476 0.78219225553206 140.908 24 Pr 0.81798251637728 0.15778295862476 0.71780774446794 140.908 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.411945680032738 0.000000000000000 0.000000000000000 b 0.000000000000000 6.997023870000000 0.000000000000000 c -4.813833992883406 0.000000000000000 6.588081366955952 Atomic positions (fractional): *1 O 0.58770471515385 0.28680660032378 0.37526210130910 15.999 > 1 2 O 0.41229528484615 0.78680660032378 0.12473789869090 15.999 > 2 3 O 0.41229528484615 0.71319339967622 0.62473789869090 15.999 > 3 4 O 0.58770471515385 0.21319339967622 0.87526210130910 15.999 > 4 *5 O 0.33563747637910 0.39467568126615 0.02628812892714 15.999 > 5 6 O 0.66436252362090 0.89467568126615 0.47371187107286 15.999 > 6 7 O 0.66436252362090 0.60532431873385 0.97371187107286 15.999 > 7 8 O 0.33563747637910 0.10532431873385 0.52628812892714 15.999 > 8 *9 O 0.19148783243040 0.00429238852418 0.75099881697956 15.999 > 9 10 O 0.80851216756960 0.50429238852418 0.74900118302044 15.999 > 10 11 O 0.80851216756960 0.99570761147582 0.24900118302044 15.999 > 11 12 O 0.19148783243040 0.49570761147582 0.25099881697956 15.999 > 12 *13 O 0.11522349948283 0.33252538261613 0.61820027988867 15.999 > 13 14 O 0.88477650051717 0.83252538261612 0.88179972011133 15.999 > 14 15 O 0.88477650051717 0.66747461738388 0.38179972011133 15.999 > 15 16 O 0.11522349948283 0.16747461738388 0.11820027988867 15.999 > 16 *17 P 0.30929970071321 0.33755228859783 0.19668055806709 30.974 > 17 18 P 0.69070029928679 0.83755228859783 0.30331944193291 30.974 > 18 19 P 0.69070029928679 0.66244771140217 0.80331944193292 30.974 > 19 20 P 0.30929970071321 0.16244771140217 0.69668055806708 30.974 > 20 *21 Pr 0.81798251637728 0.34221704137524 0.21780774446794 140.908 > 21 22 Pr 0.18201748362272 0.84221704137524 0.28219225553206 140.908 > 22 23 Pr 0.18201748362272 0.65778295862476 0.78219225553206 140.908 > 23 24 Pr 0.81798251637728 0.15778295862476 0.71780774446794 140.908 > 24 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.823891360065476 0.000000000000000 0.000000000000000 b 0.000000000000000 13.994047739999999 0.000000000000000 c -4.813833992883406 0.000000000000000 6.588081366955952 Atomic positions (fractional): *1 O 0.29385235757693 0.14340330016189 0.37526210130910 15.999 > 1 2 O 0.79385235757693 0.14340330016189 0.37526210130910 15.999 > 1 3 O 0.29385235757693 0.64340330016189 0.37526210130910 15.999 > 1 4 O 0.79385235757693 0.64340330016189 0.37526210130910 15.999 > 1 5 O 0.20614764242307 0.39340330016189 0.12473789869090 15.999 > 2 6 O 0.70614764242307 0.39340330016189 0.12473789869090 15.999 > 2 7 O 0.20614764242307 0.89340330016189 0.12473789869090 15.999 > 2 8 O 0.70614764242307 0.89340330016189 0.12473789869090 15.999 > 2 9 O 0.20614764242307 0.35659669983811 0.62473789869090 15.999 > 3 10 O 0.70614764242307 0.35659669983811 0.62473789869090 15.999 > 3 11 O 0.20614764242307 0.85659669983811 0.62473789869090 15.999 > 3 12 O 0.70614764242307 0.85659669983811 0.62473789869090 15.999 > 3 13 O 0.29385235757693 0.10659669983811 0.87526210130910 15.999 > 4 14 O 0.79385235757693 0.10659669983811 0.87526210130910 15.999 > 4 15 O 0.29385235757693 0.60659669983811 0.87526210130910 15.999 > 4 16 O 0.79385235757693 0.60659669983811 0.87526210130910 15.999 > 4 *17 O 0.16781873818955 0.19733784063308 0.02628812892714 15.999 > 5 18 O 0.66781873818955 0.19733784063308 0.02628812892714 15.999 > 5 19 O 0.16781873818955 0.69733784063308 0.02628812892714 15.999 > 5 20 O 0.66781873818955 0.69733784063308 0.02628812892714 15.999 > 5 21 O 0.33218126181045 0.44733784063308 0.47371187107286 15.999 > 6 22 O 0.83218126181045 0.44733784063308 0.47371187107286 15.999 > 6 23 O 0.33218126181045 0.94733784063308 0.47371187107286 15.999 > 6 24 O 0.83218126181045 0.94733784063308 0.47371187107286 15.999 > 6 25 O 0.33218126181045 0.30266215936692 0.97371187107286 15.999 > 7 26 O 0.83218126181045 0.30266215936692 0.97371187107286 15.999 > 7 27 O 0.33218126181045 0.80266215936692 0.97371187107286 15.999 > 7 28 O 0.83218126181045 0.80266215936692 0.97371187107286 15.999 > 7 29 O 0.16781873818955 0.05266215936692 0.52628812892714 15.999 > 8 30 O 0.66781873818955 0.05266215936692 0.52628812892714 15.999 > 8 31 O 0.16781873818955 0.55266215936692 0.52628812892714 15.999 > 8 32 O 0.66781873818955 0.55266215936692 0.52628812892714 15.999 > 8 *33 O 0.09574391621520 0.00214619426209 0.75099881697956 15.999 > 9 34 O 0.59574391621520 0.00214619426209 0.75099881697956 15.999 > 9 35 O 0.09574391621520 0.50214619426209 0.75099881697956 15.999 > 9 36 O 0.59574391621520 0.50214619426209 0.75099881697956 15.999 > 9 37 O 0.40425608378480 0.25214619426209 0.74900118302044 15.999 > 10 38 O 0.90425608378480 0.25214619426209 0.74900118302044 15.999 > 10 39 O 0.40425608378480 0.75214619426209 0.74900118302044 15.999 > 10 40 O 0.90425608378480 0.75214619426209 0.74900118302044 15.999 > 10 41 O 0.40425608378480 0.49785380573791 0.24900118302044 15.999 > 11 42 O 0.90425608378480 0.49785380573791 0.24900118302044 15.999 > 11 43 O 0.40425608378480 0.99785380573791 0.24900118302044 15.999 > 11 44 O 0.90425608378480 0.99785380573791 0.24900118302044 15.999 > 11 45 O 0.09574391621520 0.24785380573791 0.25099881697956 15.999 > 12 46 O 0.59574391621520 0.24785380573791 0.25099881697956 15.999 > 12 47 O 0.09574391621520 0.74785380573791 0.25099881697956 15.999 > 12 48 O 0.59574391621520 0.74785380573791 0.25099881697956 15.999 > 12 *49 O 0.05761174974142 0.16626269130806 0.61820027988867 15.999 > 13 50 O 0.55761174974142 0.16626269130806 0.61820027988867 15.999 > 13 51 O 0.05761174974142 0.66626269130806 0.61820027988867 15.999 > 13 52 O 0.55761174974142 0.66626269130806 0.61820027988867 15.999 > 13 53 O 0.44238825025858 0.41626269130806 0.88179972011133 15.999 > 14 54 O 0.94238825025858 0.41626269130806 0.88179972011133 15.999 > 14 55 O 0.44238825025858 0.91626269130806 0.88179972011133 15.999 > 14 56 O 0.94238825025858 0.91626269130806 0.88179972011133 15.999 > 14 57 O 0.44238825025858 0.33373730869194 0.38179972011133 15.999 > 15 58 O 0.94238825025858 0.33373730869194 0.38179972011133 15.999 > 15 59 O 0.44238825025858 0.83373730869194 0.38179972011133 15.999 > 15 60 O 0.94238825025858 0.83373730869194 0.38179972011133 15.999 > 15 61 O 0.05761174974142 0.08373730869194 0.11820027988867 15.999 > 16 62 O 0.55761174974142 0.08373730869194 0.11820027988867 15.999 > 16 63 O 0.05761174974142 0.58373730869194 0.11820027988867 15.999 > 16 64 O 0.55761174974142 0.58373730869194 0.11820027988867 15.999 > 16 *65 P 0.15464985035660 0.16877614429891 0.19668055806709 30.974 > 17 66 P 0.65464985035660 0.16877614429891 0.19668055806709 30.974 > 17 67 P 0.15464985035660 0.66877614429891 0.19668055806709 30.974 > 17 68 P 0.65464985035660 0.66877614429891 0.19668055806709 30.974 > 17 69 P 0.34535014964340 0.41877614429891 0.30331944193291 30.974 > 18 70 P 0.84535014964340 0.41877614429891 0.30331944193291 30.974 > 18 71 P 0.34535014964340 0.91877614429891 0.30331944193291 30.974 > 18 72 P 0.84535014964340 0.91877614429891 0.30331944193291 30.974 > 18 73 P 0.34535014964340 0.33122385570109 0.80331944193292 30.974 > 19 74 P 0.84535014964340 0.33122385570109 0.80331944193292 30.974 > 19 75 P 0.34535014964340 0.83122385570109 0.80331944193292 30.974 > 19 76 P 0.84535014964340 0.83122385570109 0.80331944193292 30.974 > 19 77 P 0.15464985035660 0.08122385570109 0.69668055806708 30.974 > 20 78 P 0.65464985035660 0.08122385570109 0.69668055806708 30.974 > 20 79 P 0.15464985035660 0.58122385570109 0.69668055806708 30.974 > 20 80 P 0.65464985035660 0.58122385570109 0.69668055806708 30.974 > 20 *81 Pr 0.40899125818864 0.17110852068762 0.21780774446794 140.908 > 21 82 Pr 0.90899125818864 0.17110852068762 0.21780774446794 140.908 > 21 83 Pr 0.40899125818864 0.67110852068762 0.21780774446794 140.908 > 21 84 Pr 0.90899125818864 0.67110852068762 0.21780774446794 140.908 > 21 85 Pr 0.09100874181136 0.42110852068762 0.28219225553206 140.908 > 22 86 Pr 0.59100874181136 0.42110852068762 0.28219225553206 140.908 > 22 87 Pr 0.09100874181136 0.92110852068762 0.28219225553206 140.908 > 22 88 Pr 0.59100874181136 0.92110852068762 0.28219225553206 140.908 > 22 89 Pr 0.09100874181136 0.32889147931238 0.78219225553206 140.908 > 23 90 Pr 0.59100874181136 0.32889147931238 0.78219225553206 140.908 > 23 91 Pr 0.09100874181136 0.82889147931238 0.78219225553206 140.908 > 23 92 Pr 0.59100874181136 0.82889147931238 0.78219225553206 140.908 > 23 93 Pr 0.40899125818864 0.07889147931238 0.71780774446794 140.908 > 24 94 Pr 0.90899125818864 0.07889147931238 0.71780774446794 140.908 > 24 95 Pr 0.40899125818864 0.57889147931238 0.71780774446794 140.908 > 24 96 Pr 0.90899125818864 0.57889147931238 0.71780774446794 140.908 > 24 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.7546459 0.0000000 -0.0190289 0.0000000 3.4609431 0.0000000 -0.0190291 0.0000000 3.4721040 -------------------------- Born effective charges -------------------------- 1 O -2.1108490 0.0658112 -0.2781995 0.0867586 -1.2109619 0.5316504 -0.3025344 0.4915367 -2.3402221 2 O -2.1108490 -0.0658112 -0.2781995 -0.0867586 -1.2109619 -0.5316504 -0.3025344 -0.4915367 -2.3402221 3 O -2.1108490 0.0658112 -0.2781995 0.0867586 -1.2109619 0.5316504 -0.3025344 0.4915367 -2.3402221 4 O -2.1108490 -0.0658112 -0.2781995 -0.0867586 -1.2109619 -0.5316504 -0.3025344 -0.4915367 -2.3402221 5 O -2.1598234 -0.2429643 0.3175465 -0.2360033 -1.5073763 0.5464286 0.3408580 0.4434450 -2.1030786 6 O -2.1598234 0.2429643 0.3175465 0.2360033 -1.5073763 -0.5464286 0.3408580 -0.4434450 -2.1030786 7 O -2.1598234 -0.2429643 0.3175465 -0.2360033 -1.5073763 0.5464286 0.3408580 0.4434450 -2.1030786 8 O -2.1598234 0.2429643 0.3175465 0.2360033 -1.5073763 -0.5464286 0.3408580 -0.4434450 -2.1030786 9 O -2.2536439 -0.4246484 0.1454782 -0.4288111 -2.4467004 0.2321080 0.1021192 0.3000120 -1.0892941 10 O -2.2536439 0.4246484 0.1454782 0.4288111 -2.4467004 -0.2321080 0.1021192 -0.3000120 -1.0892941 11 O -2.2536439 -0.4246484 0.1454782 -0.4288111 -2.4467004 0.2321080 0.1021192 0.3000120 -1.0892941 12 O -2.2536439 0.4246484 0.1454782 0.4288111 -2.4467004 -0.2321080 0.1021192 -0.3000120 -1.0892941 13 O -1.8119690 0.4220899 -0.1092641 0.4626702 -2.2462958 0.1377841 -0.1028583 0.0840944 -1.7815206 14 O -1.8119690 -0.4220899 -0.1092641 -0.4626702 -2.2462958 -0.1377841 -0.1028583 -0.0840944 -1.7815206 15 O -1.8119690 0.4220899 -0.1092641 0.4626702 -2.2462958 0.1377841 -0.1028583 0.0840944 -1.7815206 16 O -1.8119690 -0.4220899 -0.1092641 -0.4626702 -2.2462958 -0.1377841 -0.1028583 -0.0840944 -1.7815206 17 P 4.1109987 -0.0547946 0.0065174 -0.0006054 3.2900344 -0.0592795 0.0574414 -0.0181159 3.2250895 18 P 4.1109987 0.0547946 0.0065174 0.0006054 3.2900344 0.0592795 0.0574414 0.0181159 3.2250895 19 P 4.1109987 -0.0547946 0.0065174 -0.0006054 3.2900344 -0.0592795 0.0574414 -0.0181159 3.2250895 20 P 4.1109987 0.0547946 0.0065174 0.0006054 3.2900344 0.0592795 0.0574414 0.0181159 3.2250895 21 Pr 4.2252865 0.1660485 -0.0820785 0.0709278 4.1213001 -0.0952750 -0.0950260 -0.1835426 4.0890260 22 Pr 4.2252865 -0.1660485 -0.0820785 -0.0709278 4.1213001 0.0952750 -0.0950260 0.1835426 4.0890260 23 Pr 4.2252865 0.1660485 -0.0820785 0.0709278 4.1213001 -0.0952750 -0.0950260 -0.1835426 4.0890260 24 Pr 4.2252865 -0.1660485 -0.0820785 -0.0709278 4.1213001 0.0952750 -0.0950260 0.1835426 4.0890260 ---------------------------------------------------------------------------- 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: 288/288 Permutation basis: 10656/10656 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2700 Number of blocks in projector: 2700 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 238 eigenvectors found. (2) Block: 500 / 576 (2) 240 eigenvectors found. (2) Block: 576 / 576 (2) 64 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 22 eigenvectors found. (1) 564 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 238 eigenvectors found. (2) Block: 500 / 576 (2) 240 eigenvectors found. (2) Block: 576 / 576 (2) 64 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 22 eigenvectors found. (1) 564 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 239 eigenvectors found. (2) Block: 500 / 576 (2) 241 eigenvectors found. (2) Block: 576 / 576 (2) 71 eigenvectors found. (2) Complementary block size: 25 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 565 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 324 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 324 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 324 Use standard eigh solver. Tree of FC basis block matrices: - (2700, 2647), data: False |-- (324, 318), data: True |-- (324, 318), data: True |-- (324, 318), data: True |-- (576, 565), data: False |-- (576, 565), data: False |-- (576, 14), data: (576, 25) @ (25, 14) |-- (76, 71), data: True |-- (250, 241), data: True |-- (250, 239), data: True |-- (576, 564), data: False |-- (576, 564), data: False |-- (576, 22), data: (576, 34) @ (34, 22) |-- (76, 64), data: True |-- (250, 240), data: True |-- (250, 238), data: True |-- (576, 564), data: False |-- (576, 564), data: False |-- (576, 22), data: (576, 34) @ (34, 22) |-- (76, 64), data: True |-- (250, 240), data: True |-- (250, 238), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 720 - Time: 0.723 Solver_block: 200 / 720 - Time: 0.659 Solver_block: 300 / 720 - Time: 0.647 Solver_block: 400 / 720 - Time: 0.647 Solver_block: 500 / 720 - Time: 0.649 Solver_block: 600 / 720 - Time: 0.645 Solver_block: 700 / 720 - Time: 0.648 Solver_block: 720 / 720 - Time: 0.224 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 4.947 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 288/288 Permutation basis: 10656/10656 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2700 Number of blocks in projector: 2700 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 238 eigenvectors found. (2) Block: 500 / 576 (2) 240 eigenvectors found. (2) Block: 576 / 576 (2) 64 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 22 eigenvectors found. (1) 564 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 238 eigenvectors found. (2) Block: 500 / 576 (2) 240 eigenvectors found. (2) Block: 576 / 576 (2) 64 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 22 eigenvectors found. (1) 564 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 239 eigenvectors found. (2) Block: 500 / 576 (2) 241 eigenvectors found. (2) Block: 576 / 576 (2) 71 eigenvectors found. (2) Complementary block size: 25 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 565 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 324 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 324 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 324 Use standard eigh solver. Tree of FC basis block matrices: - (2700, 2647), data: False |-- (324, 318), data: True |-- (324, 318), data: True |-- (324, 318), data: True |-- (576, 565), data: False |-- (576, 565), data: False |-- (576, 14), data: (576, 25) @ (25, 14) |-- (76, 71), data: True |-- (250, 241), data: True |-- (250, 239), data: True |-- (576, 564), data: False |-- (576, 564), data: False |-- (576, 22), data: (576, 34) @ (34, 22) |-- (76, 64), data: True |-- (250, 240), data: True |-- (250, 238), data: True |-- (576, 564), data: False |-- (576, 564), data: False |-- (576, 22), data: (576, 34) @ (34, 22) |-- (76, 64), data: True |-- (250, 240), data: True |-- (250, 238), data: True Max drift after symmetrization by symfc projector: -0.00000000 (yy) -0.00000000 (yy) 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 2026-01-07 20:18:50]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 20:18:51]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.411945680032738 0.000000000000000 0.000000000000000 b 0.000000000000000 6.997023870000000 0.000000000000000 c -4.813833992883406 0.000000000000000 6.588081366955952 Atomic positions (fractional): 1 O 0.58770471515385 0.28680660032378 0.37526210130910 15.999 2 O 0.41229528484615 0.78680660032378 0.12473789869090 15.999 3 O 0.41229528484615 0.71319339967622 0.62473789869090 15.999 4 O 0.58770471515385 0.21319339967622 0.87526210130910 15.999 5 O 0.33563747637910 0.39467568126615 0.02628812892714 15.999 6 O 0.66436252362090 0.89467568126615 0.47371187107286 15.999 7 O 0.66436252362090 0.60532431873385 0.97371187107286 15.999 8 O 0.33563747637910 0.10532431873385 0.52628812892714 15.999 9 O 0.19148783243040 0.00429238852418 0.75099881697956 15.999 10 O 0.80851216756960 0.50429238852418 0.74900118302044 15.999 11 O 0.80851216756960 0.99570761147582 0.24900118302044 15.999 12 O 0.19148783243040 0.49570761147582 0.25099881697956 15.999 13 O 0.11522349948283 0.33252538261613 0.61820027988867 15.999 14 O 0.88477650051717 0.83252538261612 0.88179972011133 15.999 15 O 0.88477650051717 0.66747461738388 0.38179972011133 15.999 16 O 0.11522349948283 0.16747461738388 0.11820027988867 15.999 17 P 0.30929970071321 0.33755228859783 0.19668055806709 30.974 18 P 0.69070029928679 0.83755228859783 0.30331944193291 30.974 19 P 0.69070029928679 0.66244771140217 0.80331944193292 30.974 20 P 0.30929970071321 0.16244771140217 0.69668055806708 30.974 21 Pr 0.81798251637728 0.34221704137524 0.21780774446794 140.908 22 Pr 0.18201748362272 0.84221704137524 0.28219225553206 140.908 23 Pr 0.18201748362272 0.65778295862476 0.78219225553206 140.908 24 Pr 0.81798251637728 0.15778295862476 0.71780774446794 140.908 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.823891360065476 0.000000000000000 0.000000000000000 b 0.000000000000000 13.994047739999999 0.000000000000000 c -4.813833992883406 0.000000000000000 6.588081366955952 Atomic positions (fractional): 1 O 0.29385235757693 0.14340330016189 0.37526210130910 15.999 > 1 2 O 0.79385235757693 0.14340330016189 0.37526210130910 15.999 > 1 3 O 0.29385235757693 0.64340330016189 0.37526210130910 15.999 > 1 4 O 0.79385235757693 0.64340330016189 0.37526210130910 15.999 > 1 5 O 0.20614764242307 0.39340330016189 0.12473789869090 15.999 > 5 6 O 0.70614764242307 0.39340330016189 0.12473789869090 15.999 > 5 7 O 0.20614764242307 0.89340330016189 0.12473789869090 15.999 > 5 8 O 0.70614764242307 0.89340330016189 0.12473789869090 15.999 > 5 9 O 0.20614764242307 0.35659669983811 0.62473789869090 15.999 > 9 10 O 0.70614764242307 0.35659669983811 0.62473789869090 15.999 > 9 11 O 0.20614764242307 0.85659669983811 0.62473789869090 15.999 > 9 12 O 0.70614764242307 0.85659669983811 0.62473789869090 15.999 > 9 13 O 0.29385235757693 0.10659669983811 0.87526210130910 15.999 > 13 14 O 0.79385235757693 0.10659669983811 0.87526210130910 15.999 > 13 15 O 0.29385235757693 0.60659669983811 0.87526210130910 15.999 > 13 16 O 0.79385235757693 0.60659669983811 0.87526210130910 15.999 > 13 17 O 0.16781873818955 0.19733784063308 0.02628812892714 15.999 > 17 18 O 0.66781873818955 0.19733784063308 0.02628812892714 15.999 > 17 19 O 0.16781873818955 0.69733784063308 0.02628812892714 15.999 > 17 20 O 0.66781873818955 0.69733784063308 0.02628812892714 15.999 > 17 21 O 0.33218126181045 0.44733784063308 0.47371187107286 15.999 > 21 22 O 0.83218126181045 0.44733784063308 0.47371187107286 15.999 > 21 23 O 0.33218126181045 0.94733784063308 0.47371187107286 15.999 > 21 24 O 0.83218126181045 0.94733784063308 0.47371187107286 15.999 > 21 25 O 0.33218126181045 0.30266215936692 0.97371187107286 15.999 > 25 26 O 0.83218126181045 0.30266215936692 0.97371187107286 15.999 > 25 27 O 0.33218126181045 0.80266215936692 0.97371187107286 15.999 > 25 28 O 0.83218126181045 0.80266215936692 0.97371187107286 15.999 > 25 29 O 0.16781873818955 0.05266215936692 0.52628812892714 15.999 > 29 30 O 0.66781873818955 0.05266215936692 0.52628812892714 15.999 > 29 31 O 0.16781873818955 0.55266215936692 0.52628812892714 15.999 > 29 32 O 0.66781873818955 0.55266215936692 0.52628812892714 15.999 > 29 33 O 0.09574391621520 0.00214619426209 0.75099881697956 15.999 > 33 34 O 0.59574391621520 0.00214619426209 0.75099881697956 15.999 > 33 35 O 0.09574391621520 0.50214619426209 0.75099881697956 15.999 > 33 36 O 0.59574391621520 0.50214619426209 0.75099881697956 15.999 > 33 37 O 0.40425608378480 0.25214619426209 0.74900118302044 15.999 > 37 38 O 0.90425608378480 0.25214619426209 0.74900118302044 15.999 > 37 39 O 0.40425608378480 0.75214619426209 0.74900118302044 15.999 > 37 40 O 0.90425608378480 0.75214619426209 0.74900118302044 15.999 > 37 41 O 0.40425608378480 0.49785380573791 0.24900118302044 15.999 > 41 42 O 0.90425608378480 0.49785380573791 0.24900118302044 15.999 > 41 43 O 0.40425608378480 0.99785380573791 0.24900118302044 15.999 > 41 44 O 0.90425608378480 0.99785380573791 0.24900118302044 15.999 > 41 45 O 0.09574391621520 0.24785380573791 0.25099881697956 15.999 > 45 46 O 0.59574391621520 0.24785380573791 0.25099881697956 15.999 > 45 47 O 0.09574391621520 0.74785380573791 0.25099881697956 15.999 > 45 48 O 0.59574391621520 0.74785380573791 0.25099881697956 15.999 > 45 49 O 0.05761174974142 0.16626269130806 0.61820027988867 15.999 > 49 50 O 0.55761174974142 0.16626269130806 0.61820027988867 15.999 > 49 51 O 0.05761174974142 0.66626269130806 0.61820027988867 15.999 > 49 52 O 0.55761174974142 0.66626269130806 0.61820027988867 15.999 > 49 53 O 0.44238825025858 0.41626269130806 0.88179972011133 15.999 > 53 54 O 0.94238825025858 0.41626269130806 0.88179972011133 15.999 > 53 55 O 0.44238825025858 0.91626269130806 0.88179972011133 15.999 > 53 56 O 0.94238825025858 0.91626269130806 0.88179972011133 15.999 > 53 57 O 0.44238825025858 0.33373730869194 0.38179972011133 15.999 > 57 58 O 0.94238825025858 0.33373730869194 0.38179972011133 15.999 > 57 59 O 0.44238825025858 0.83373730869194 0.38179972011133 15.999 > 57 60 O 0.94238825025858 0.83373730869194 0.38179972011133 15.999 > 57 61 O 0.05761174974142 0.08373730869194 0.11820027988867 15.999 > 61 62 O 0.55761174974142 0.08373730869194 0.11820027988867 15.999 > 61 63 O 0.05761174974142 0.58373730869194 0.11820027988867 15.999 > 61 64 O 0.55761174974142 0.58373730869194 0.11820027988867 15.999 > 61 65 P 0.15464985035660 0.16877614429891 0.19668055806709 30.974 > 65 66 P 0.65464985035660 0.16877614429891 0.19668055806709 30.974 > 65 67 P 0.15464985035660 0.66877614429891 0.19668055806709 30.974 > 65 68 P 0.65464985035660 0.66877614429891 0.19668055806709 30.974 > 65 69 P 0.34535014964340 0.41877614429891 0.30331944193291 30.974 > 69 70 P 0.84535014964340 0.41877614429891 0.30331944193291 30.974 > 69 71 P 0.34535014964340 0.91877614429891 0.30331944193291 30.974 > 69 72 P 0.84535014964340 0.91877614429891 0.30331944193291 30.974 > 69 73 P 0.34535014964340 0.33122385570109 0.80331944193292 30.974 > 73 74 P 0.84535014964340 0.33122385570109 0.80331944193292 30.974 > 73 75 P 0.34535014964340 0.83122385570109 0.80331944193292 30.974 > 73 76 P 0.84535014964340 0.83122385570109 0.80331944193292 30.974 > 73 77 P 0.15464985035660 0.08122385570109 0.69668055806708 30.974 > 77 78 P 0.65464985035660 0.08122385570109 0.69668055806708 30.974 > 77 79 P 0.15464985035660 0.58122385570109 0.69668055806708 30.974 > 77 80 P 0.65464985035660 0.58122385570109 0.69668055806708 30.974 > 77 81 Pr 0.40899125818864 0.17110852068762 0.21780774446794 140.908 > 81 82 Pr 0.90899125818864 0.17110852068762 0.21780774446794 140.908 > 81 83 Pr 0.40899125818864 0.67110852068762 0.21780774446794 140.908 > 81 84 Pr 0.90899125818864 0.67110852068762 0.21780774446794 140.908 > 81 85 Pr 0.09100874181136 0.42110852068762 0.28219225553206 140.908 > 85 86 Pr 0.59100874181136 0.42110852068762 0.28219225553206 140.908 > 85 87 Pr 0.09100874181136 0.92110852068762 0.28219225553206 140.908 > 85 88 Pr 0.59100874181136 0.92110852068762 0.28219225553206 140.908 > 85 89 Pr 0.09100874181136 0.32889147931238 0.78219225553206 140.908 > 89 90 Pr 0.59100874181136 0.32889147931238 0.78219225553206 140.908 > 89 91 Pr 0.09100874181136 0.82889147931238 0.78219225553206 140.908 > 89 92 Pr 0.59100874181136 0.82889147931238 0.78219225553206 140.908 > 89 93 Pr 0.40899125818864 0.07889147931238 0.71780774446794 140.908 > 93 94 Pr 0.90899125818864 0.07889147931238 0.71780774446794 140.908 > 93 95 Pr 0.40899125818864 0.57889147931238 0.71780774446794 140.908 > 93 96 Pr 0.90899125818864 0.57889147931238 0.71780774446794 140.908 > 93 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.7546459 0.0000000 -0.0190289 0.0000000 3.4609431 0.0000000 -0.0190291 0.0000000 3.4721040 -------------------------- Born effective charges -------------------------- 1 O -2.1108490 0.0658112 -0.2781995 0.0867586 -1.2109619 0.5316504 -0.3025344 0.4915367 -2.3402221 2 O -2.1108490 -0.0658112 -0.2781995 -0.0867586 -1.2109619 -0.5316504 -0.3025344 -0.4915367 -2.3402221 3 O -2.1108490 0.0658112 -0.2781995 0.0867586 -1.2109619 0.5316504 -0.3025344 0.4915367 -2.3402221 4 O -2.1108490 -0.0658112 -0.2781995 -0.0867586 -1.2109619 -0.5316504 -0.3025344 -0.4915367 -2.3402221 5 O -2.1598234 -0.2429643 0.3175465 -0.2360033 -1.5073763 0.5464286 0.3408580 0.4434450 -2.1030786 6 O -2.1598234 0.2429643 0.3175465 0.2360033 -1.5073763 -0.5464286 0.3408580 -0.4434450 -2.1030786 7 O -2.1598234 -0.2429643 0.3175465 -0.2360033 -1.5073763 0.5464286 0.3408580 0.4434450 -2.1030786 8 O -2.1598234 0.2429643 0.3175465 0.2360033 -1.5073763 -0.5464286 0.3408580 -0.4434450 -2.1030786 9 O -2.2536439 -0.4246484 0.1454782 -0.4288111 -2.4467004 0.2321080 0.1021192 0.3000120 -1.0892941 10 O -2.2536439 0.4246484 0.1454782 0.4288111 -2.4467004 -0.2321080 0.1021192 -0.3000120 -1.0892941 11 O -2.2536439 -0.4246484 0.1454782 -0.4288111 -2.4467004 0.2321080 0.1021192 0.3000120 -1.0892941 12 O -2.2536439 0.4246484 0.1454782 0.4288111 -2.4467004 -0.2321080 0.1021192 -0.3000120 -1.0892941 13 O -1.8119690 0.4220899 -0.1092641 0.4626702 -2.2462958 0.1377841 -0.1028583 0.0840944 -1.7815206 14 O -1.8119690 -0.4220899 -0.1092641 -0.4626702 -2.2462958 -0.1377841 -0.1028583 -0.0840944 -1.7815206 15 O -1.8119690 0.4220899 -0.1092641 0.4626702 -2.2462958 0.1377841 -0.1028583 0.0840944 -1.7815206 16 O -1.8119690 -0.4220899 -0.1092641 -0.4626702 -2.2462958 -0.1377841 -0.1028583 -0.0840944 -1.7815206 17 P 4.1109987 -0.0547946 0.0065174 -0.0006054 3.2900344 -0.0592795 0.0574414 -0.0181159 3.2250895 18 P 4.1109987 0.0547946 0.0065174 0.0006054 3.2900344 0.0592795 0.0574414 0.0181159 3.2250895 19 P 4.1109987 -0.0547946 0.0065174 -0.0006054 3.2900344 -0.0592795 0.0574414 -0.0181159 3.2250895 20 P 4.1109987 0.0547946 0.0065174 0.0006054 3.2900344 0.0592795 0.0574414 0.0181159 3.2250895 21 Pr 4.2252865 0.1660485 -0.0820785 0.0709278 4.1213001 -0.0952750 -0.0950260 -0.1835426 4.0890260 22 Pr 4.2252865 -0.1660485 -0.0820785 -0.0709278 4.1213001 0.0952750 -0.0950260 0.1835426 4.0890260 23 Pr 4.2252865 0.1660485 -0.0820785 0.0709278 4.1213001 -0.0952750 -0.0950260 -0.1835426 4.0890260 24 Pr 4.2252865 -0.1660485 -0.0820785 -0.0709278 4.1213001 0.0952750 -0.0950260 0.1835426 4.0890260 ---------------------------------------------------------------------------- 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] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 17, 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] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] 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] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 65, 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] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 81, 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] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000005 (xxx) 0.00000005 (xxx) 0.00000005 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000007 (xz) 0.00000007 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 20:19:12]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 20:19:12]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.411945680032738 0.000000000000000 0.000000000000000 b 0.000000000000000 6.997023870000000 0.000000000000000 c -4.813833992883406 0.000000000000000 6.588081366955952 Atomic positions (fractional): 1 O 0.58770471515385 0.28680660032378 0.37526210130910 15.999 2 O 0.41229528484615 0.78680660032378 0.12473789869090 15.999 3 O 0.41229528484615 0.71319339967622 0.62473789869090 15.999 4 O 0.58770471515385 0.21319339967622 0.87526210130910 15.999 5 O 0.33563747637910 0.39467568126615 0.02628812892714 15.999 6 O 0.66436252362090 0.89467568126615 0.47371187107286 15.999 7 O 0.66436252362090 0.60532431873385 0.97371187107286 15.999 8 O 0.33563747637910 0.10532431873385 0.52628812892714 15.999 9 O 0.19148783243040 0.00429238852418 0.75099881697956 15.999 10 O 0.80851216756960 0.50429238852418 0.74900118302044 15.999 11 O 0.80851216756960 0.99570761147582 0.24900118302044 15.999 12 O 0.19148783243040 0.49570761147582 0.25099881697956 15.999 13 O 0.11522349948283 0.33252538261613 0.61820027988867 15.999 14 O 0.88477650051717 0.83252538261612 0.88179972011133 15.999 15 O 0.88477650051717 0.66747461738388 0.38179972011133 15.999 16 O 0.11522349948283 0.16747461738388 0.11820027988867 15.999 17 P 0.30929970071321 0.33755228859783 0.19668055806709 30.974 18 P 0.69070029928679 0.83755228859783 0.30331944193291 30.974 19 P 0.69070029928679 0.66244771140217 0.80331944193292 30.974 20 P 0.30929970071321 0.16244771140217 0.69668055806708 30.974 21 Pr 0.81798251637728 0.34221704137524 0.21780774446794 140.908 22 Pr 0.18201748362272 0.84221704137524 0.28219225553206 140.908 23 Pr 0.18201748362272 0.65778295862476 0.78219225553206 140.908 24 Pr 0.81798251637728 0.15778295862476 0.71780774446794 140.908 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.823891360065476 0.000000000000000 0.000000000000000 b 0.000000000000000 13.994047739999999 0.000000000000000 c -4.813833992883406 0.000000000000000 6.588081366955952 Atomic positions (fractional): 1 O 0.29385235757693 0.14340330016189 0.37526210130910 15.999 > 1 2 O 0.79385235757693 0.14340330016189 0.37526210130910 15.999 > 1 3 O 0.29385235757693 0.64340330016189 0.37526210130910 15.999 > 1 4 O 0.79385235757693 0.64340330016189 0.37526210130910 15.999 > 1 5 O 0.20614764242307 0.39340330016189 0.12473789869090 15.999 > 5 6 O 0.70614764242307 0.39340330016189 0.12473789869090 15.999 > 5 7 O 0.20614764242307 0.89340330016189 0.12473789869090 15.999 > 5 8 O 0.70614764242307 0.89340330016189 0.12473789869090 15.999 > 5 9 O 0.20614764242307 0.35659669983811 0.62473789869090 15.999 > 9 10 O 0.70614764242307 0.35659669983811 0.62473789869090 15.999 > 9 11 O 0.20614764242307 0.85659669983811 0.62473789869090 15.999 > 9 12 O 0.70614764242307 0.85659669983811 0.62473789869090 15.999 > 9 13 O 0.29385235757693 0.10659669983811 0.87526210130910 15.999 > 13 14 O 0.79385235757693 0.10659669983811 0.87526210130910 15.999 > 13 15 O 0.29385235757693 0.60659669983811 0.87526210130910 15.999 > 13 16 O 0.79385235757693 0.60659669983811 0.87526210130910 15.999 > 13 17 O 0.16781873818955 0.19733784063308 0.02628812892714 15.999 > 17 18 O 0.66781873818955 0.19733784063308 0.02628812892714 15.999 > 17 19 O 0.16781873818955 0.69733784063308 0.02628812892714 15.999 > 17 20 O 0.66781873818955 0.69733784063308 0.02628812892714 15.999 > 17 21 O 0.33218126181045 0.44733784063308 0.47371187107286 15.999 > 21 22 O 0.83218126181045 0.44733784063308 0.47371187107286 15.999 > 21 23 O 0.33218126181045 0.94733784063308 0.47371187107286 15.999 > 21 24 O 0.83218126181045 0.94733784063308 0.47371187107286 15.999 > 21 25 O 0.33218126181045 0.30266215936692 0.97371187107286 15.999 > 25 26 O 0.83218126181045 0.30266215936692 0.97371187107286 15.999 > 25 27 O 0.33218126181045 0.80266215936692 0.97371187107286 15.999 > 25 28 O 0.83218126181045 0.80266215936692 0.97371187107286 15.999 > 25 29 O 0.16781873818955 0.05266215936692 0.52628812892714 15.999 > 29 30 O 0.66781873818955 0.05266215936692 0.52628812892714 15.999 > 29 31 O 0.16781873818955 0.55266215936692 0.52628812892714 15.999 > 29 32 O 0.66781873818955 0.55266215936692 0.52628812892714 15.999 > 29 33 O 0.09574391621520 0.00214619426209 0.75099881697956 15.999 > 33 34 O 0.59574391621520 0.00214619426209 0.75099881697956 15.999 > 33 35 O 0.09574391621520 0.50214619426209 0.75099881697956 15.999 > 33 36 O 0.59574391621520 0.50214619426209 0.75099881697956 15.999 > 33 37 O 0.40425608378480 0.25214619426209 0.74900118302044 15.999 > 37 38 O 0.90425608378480 0.25214619426209 0.74900118302044 15.999 > 37 39 O 0.40425608378480 0.75214619426209 0.74900118302044 15.999 > 37 40 O 0.90425608378480 0.75214619426209 0.74900118302044 15.999 > 37 41 O 0.40425608378480 0.49785380573791 0.24900118302044 15.999 > 41 42 O 0.90425608378480 0.49785380573791 0.24900118302044 15.999 > 41 43 O 0.40425608378480 0.99785380573791 0.24900118302044 15.999 > 41 44 O 0.90425608378480 0.99785380573791 0.24900118302044 15.999 > 41 45 O 0.09574391621520 0.24785380573791 0.25099881697956 15.999 > 45 46 O 0.59574391621520 0.24785380573791 0.25099881697956 15.999 > 45 47 O 0.09574391621520 0.74785380573791 0.25099881697956 15.999 > 45 48 O 0.59574391621520 0.74785380573791 0.25099881697956 15.999 > 45 49 O 0.05761174974142 0.16626269130806 0.61820027988867 15.999 > 49 50 O 0.55761174974142 0.16626269130806 0.61820027988867 15.999 > 49 51 O 0.05761174974142 0.66626269130806 0.61820027988867 15.999 > 49 52 O 0.55761174974142 0.66626269130806 0.61820027988867 15.999 > 49 53 O 0.44238825025858 0.41626269130806 0.88179972011133 15.999 > 53 54 O 0.94238825025858 0.41626269130806 0.88179972011133 15.999 > 53 55 O 0.44238825025858 0.91626269130806 0.88179972011133 15.999 > 53 56 O 0.94238825025858 0.91626269130806 0.88179972011133 15.999 > 53 57 O 0.44238825025858 0.33373730869194 0.38179972011133 15.999 > 57 58 O 0.94238825025858 0.33373730869194 0.38179972011133 15.999 > 57 59 O 0.44238825025858 0.83373730869194 0.38179972011133 15.999 > 57 60 O 0.94238825025858 0.83373730869194 0.38179972011133 15.999 > 57 61 O 0.05761174974142 0.08373730869194 0.11820027988867 15.999 > 61 62 O 0.55761174974142 0.08373730869194 0.11820027988867 15.999 > 61 63 O 0.05761174974142 0.58373730869194 0.11820027988867 15.999 > 61 64 O 0.55761174974142 0.58373730869194 0.11820027988867 15.999 > 61 65 P 0.15464985035660 0.16877614429891 0.19668055806709 30.974 > 65 66 P 0.65464985035660 0.16877614429891 0.19668055806709 30.974 > 65 67 P 0.15464985035660 0.66877614429891 0.19668055806709 30.974 > 65 68 P 0.65464985035660 0.66877614429891 0.19668055806709 30.974 > 65 69 P 0.34535014964340 0.41877614429891 0.30331944193291 30.974 > 69 70 P 0.84535014964340 0.41877614429891 0.30331944193291 30.974 > 69 71 P 0.34535014964340 0.91877614429891 0.30331944193291 30.974 > 69 72 P 0.84535014964340 0.91877614429891 0.30331944193291 30.974 > 69 73 P 0.34535014964340 0.33122385570109 0.80331944193292 30.974 > 73 74 P 0.84535014964340 0.33122385570109 0.80331944193292 30.974 > 73 75 P 0.34535014964340 0.83122385570109 0.80331944193292 30.974 > 73 76 P 0.84535014964340 0.83122385570109 0.80331944193292 30.974 > 73 77 P 0.15464985035660 0.08122385570109 0.69668055806708 30.974 > 77 78 P 0.65464985035660 0.08122385570109 0.69668055806708 30.974 > 77 79 P 0.15464985035660 0.58122385570109 0.69668055806708 30.974 > 77 80 P 0.65464985035660 0.58122385570109 0.69668055806708 30.974 > 77 81 Pr 0.40899125818864 0.17110852068762 0.21780774446794 140.908 > 81 82 Pr 0.90899125818864 0.17110852068762 0.21780774446794 140.908 > 81 83 Pr 0.40899125818864 0.67110852068762 0.21780774446794 140.908 > 81 84 Pr 0.90899125818864 0.67110852068762 0.21780774446794 140.908 > 81 85 Pr 0.09100874181136 0.42110852068762 0.28219225553206 140.908 > 85 86 Pr 0.59100874181136 0.42110852068762 0.28219225553206 140.908 > 85 87 Pr 0.09100874181136 0.92110852068762 0.28219225553206 140.908 > 85 88 Pr 0.59100874181136 0.92110852068762 0.28219225553206 140.908 > 85 89 Pr 0.09100874181136 0.32889147931238 0.78219225553206 140.908 > 89 90 Pr 0.59100874181136 0.32889147931238 0.78219225553206 140.908 > 89 91 Pr 0.09100874181136 0.82889147931238 0.78219225553206 140.908 > 89 92 Pr 0.59100874181136 0.82889147931238 0.78219225553206 140.908 > 89 93 Pr 0.40899125818864 0.07889147931238 0.71780774446794 140.908 > 93 94 Pr 0.90899125818864 0.07889147931238 0.71780774446794 140.908 > 93 95 Pr 0.40899125818864 0.57889147931238 0.71780774446794 140.908 > 93 96 Pr 0.90899125818864 0.57889147931238 0.71780774446794 140.908 > 93 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.7546459 0.0000000 -0.0190289 0.0000000 3.4609431 0.0000000 -0.0190291 0.0000000 3.4721040 -------------------------- Born effective charges -------------------------- 1 O -2.1108490 0.0658112 -0.2781995 0.0867586 -1.2109619 0.5316504 -0.3025344 0.4915367 -2.3402221 2 O -2.1108490 -0.0658112 -0.2781995 -0.0867586 -1.2109619 -0.5316504 -0.3025344 -0.4915367 -2.3402221 3 O -2.1108490 0.0658112 -0.2781995 0.0867586 -1.2109619 0.5316504 -0.3025344 0.4915367 -2.3402221 4 O -2.1108490 -0.0658112 -0.2781995 -0.0867586 -1.2109619 -0.5316504 -0.3025344 -0.4915367 -2.3402221 5 O -2.1598234 -0.2429643 0.3175465 -0.2360033 -1.5073763 0.5464286 0.3408580 0.4434450 -2.1030786 6 O -2.1598234 0.2429643 0.3175465 0.2360033 -1.5073763 -0.5464286 0.3408580 -0.4434450 -2.1030786 7 O -2.1598234 -0.2429643 0.3175465 -0.2360033 -1.5073763 0.5464286 0.3408580 0.4434450 -2.1030786 8 O -2.1598234 0.2429643 0.3175465 0.2360033 -1.5073763 -0.5464286 0.3408580 -0.4434450 -2.1030786 9 O -2.2536439 -0.4246484 0.1454782 -0.4288111 -2.4467004 0.2321080 0.1021192 0.3000120 -1.0892941 10 O -2.2536439 0.4246484 0.1454782 0.4288111 -2.4467004 -0.2321080 0.1021192 -0.3000120 -1.0892941 11 O -2.2536439 -0.4246484 0.1454782 -0.4288111 -2.4467004 0.2321080 0.1021192 0.3000120 -1.0892941 12 O -2.2536439 0.4246484 0.1454782 0.4288111 -2.4467004 -0.2321080 0.1021192 -0.3000120 -1.0892941 13 O -1.8119690 0.4220899 -0.1092641 0.4626702 -2.2462958 0.1377841 -0.1028583 0.0840944 -1.7815206 14 O -1.8119690 -0.4220899 -0.1092641 -0.4626702 -2.2462958 -0.1377841 -0.1028583 -0.0840944 -1.7815206 15 O -1.8119690 0.4220899 -0.1092641 0.4626702 -2.2462958 0.1377841 -0.1028583 0.0840944 -1.7815206 16 O -1.8119690 -0.4220899 -0.1092641 -0.4626702 -2.2462958 -0.1377841 -0.1028583 -0.0840944 -1.7815206 17 P 4.1109987 -0.0547946 0.0065174 -0.0006054 3.2900344 -0.0592795 0.0574414 -0.0181159 3.2250895 18 P 4.1109987 0.0547946 0.0065174 0.0006054 3.2900344 0.0592795 0.0574414 0.0181159 3.2250895 19 P 4.1109987 -0.0547946 0.0065174 -0.0006054 3.2900344 -0.0592795 0.0574414 -0.0181159 3.2250895 20 P 4.1109987 0.0547946 0.0065174 0.0006054 3.2900344 0.0592795 0.0574414 0.0181159 3.2250895 21 Pr 4.2252865 0.1660485 -0.0820785 0.0709278 4.1213001 -0.0952750 -0.0950260 -0.1835426 4.0890260 22 Pr 4.2252865 -0.1660485 -0.0820785 -0.0709278 4.1213001 0.0952750 -0.0950260 0.1835426 4.0890260 23 Pr 4.2252865 0.1660485 -0.0820785 0.0709278 4.1213001 -0.0952750 -0.0950260 -0.1835426 4.0890260 24 Pr 4.2252865 -0.1660485 -0.0820785 -0.0709278 4.1213001 0.0952750 -0.0950260 0.1835426 4.0890260 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000005 (xxx) 0.00000005 (xxx) 0.00000005 (xxx) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- 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 7 8 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.62, Number of G-points: 291, Lambda: 0.12 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/168) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 2.592 ( 0.000 0.000 0.000) 0.000 2.681 ( 0.000 0.000 0.000) 0.000 2.751 ( 0.000 0.000 0.000) 0.000 3.097 ( 0.000 0.000 0.000) 0.000 3.578 ( 0.000 0.000 0.000) 0.000 3.747 ( 0.000 0.000 0.000) 0.000 3.839 ( 0.000 0.000 0.000) 0.000 3.903 ( 0.000 0.000 0.000) 0.000 4.293 ( 0.000 0.000 0.000) 0.000 4.459 ( 0.000 0.000 0.000) 0.000 4.641 ( 0.000 0.000 0.000) 0.000 4.714 ( 0.000 0.000 0.000) 0.000 4.817 ( 0.000 0.000 0.000) 0.000 5.189 ( 0.000 0.000 0.000) 0.000 5.415 ( 0.000 0.000 0.000) 0.000 5.493 ( 0.000 0.000 0.000) 0.000 5.789 ( 0.000 0.000 0.000) 0.000 5.824 ( 0.000 0.000 0.000) 0.000 6.153 ( 0.000 0.000 0.000) 0.000 6.182 ( 0.000 0.000 0.000) 0.000 6.482 ( 0.000 0.000 0.000) 0.000 6.686 ( 0.000 0.000 0.000) 0.000 6.751 ( 0.000 0.000 0.000) 0.000 6.956 ( 0.000 0.000 0.000) 0.000 7.275 ( 0.000 0.000 0.000) 0.000 7.455 ( 0.000 0.000 0.000) 0.000 7.634 ( 0.000 0.000 0.000) 0.000 7.784 ( 0.000 0.000 0.000) 0.000 7.926 ( 0.000 0.000 0.000) 0.000 8.452 ( 0.000 0.000 0.000) 0.000 8.561 ( 0.000 0.000 0.000) 0.000 8.648 ( 0.000 0.000 0.000) 0.000 8.807 ( 0.000 0.000 0.000) 0.000 11.228 ( 0.000 0.000 0.000) 0.000 11.306 ( 0.000 0.000 0.000) 0.000 11.518 ( 0.000 0.000 0.000) 0.000 11.853 ( 0.000 0.000 0.000) 0.000 13.642 ( 0.000 0.000 0.000) 0.000 14.133 ( 0.000 0.000 0.000) 0.000 14.459 ( 0.000 0.000 0.000) 0.000 14.909 ( 0.000 0.000 0.000) 0.000 15.222 ( 0.000 0.000 0.000) 0.000 15.291 ( 0.000 0.000 0.000) 0.000 15.853 ( 0.000 0.000 0.000) 0.000 15.973 ( 0.000 0.000 0.000) 0.000 16.085 ( 0.000 0.000 0.000) 0.000 16.275 ( 0.000 0.000 0.000) 0.000 16.387 ( 0.000 0.000 0.000) 0.000 16.827 ( 0.000 0.000 0.000) 0.000 17.624 ( 0.000 0.000 0.000) 0.000 17.891 ( 0.000 0.000 0.000) 0.000 17.956 ( 0.000 0.000 0.000) 0.000 18.186 ( 0.000 0.000 0.000) 0.000 27.650 ( 0.000 0.000 0.000) 0.000 27.702 ( 0.000 0.000 0.000) 0.000 27.892 ( 0.000 0.000 0.000) 0.000 28.135 ( 0.000 0.000 0.000) 0.000 28.848 ( 0.000 0.000 0.000) 0.000 29.011 ( 0.000 0.000 0.000) 0.000 29.041 ( 0.000 0.000 0.000) 0.000 29.848 ( 0.000 0.000 0.000) 0.000 29.894 ( 0.000 0.000 0.000) 0.000 30.005 ( 0.000 0.000 0.000) 0.000 30.184 ( 0.000 0.000 0.000) 0.000 30.996 ( 0.000 0.000 0.000) 0.000 31.209 ( 0.000 0.000 0.000) 0.000 31.470 ( 0.000 0.000 0.000) 0.000 31.571 ( 0.000 0.000 0.000) 0.000 31.975 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/168) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.537 ( 24.958 0.000 12.697) 28.002 0.671 ( 16.361 0.000 35.622) 39.200 1.200 ( 59.859 0.000 18.568) 62.672 2.514 ( 7.807 0.000 -19.654) 21.148 2.762 ( 9.531 0.000 -1.034) 9.587 2.902 ( 9.886 0.000 8.526) 13.055 3.262 ( 15.847 0.000 5.427) 16.750 3.568 ( -1.813 0.000 -8.509) 8.700 3.793 ( -3.216 0.000 0.244) 3.225 3.871 ( 5.694 0.000 3.435) 6.650 3.973 ( 5.253 0.000 -1.848) 5.568 4.362 ( 1.814 0.000 2.615) 3.183 4.439 ( 0.555 0.000 2.529) 2.589 4.657 ( -5.529 0.000 9.949) 11.383 4.820 ( -1.869 0.000 7.601) 7.827 4.904 ( 5.826 0.000 7.699) 9.655 5.210 ( 3.510 0.000 -0.819) 3.605 5.472 ( -0.881 0.000 -2.472) 2.624 5.737 ( -8.672 0.000 12.260) 15.017 5.827 ( 2.812 0.000 -3.138) 4.214 5.915 ( 3.004 0.000 10.791) 11.201 6.138 ( -3.234 0.000 -2.219) 3.922 6.483 ( 3.349 0.000 -2.988) 4.488 6.684 ( -0.081 0.000 -0.567) 0.572 6.773 ( -0.159 0.000 3.646) 3.649 6.869 ( 12.139 0.000 -13.495) 18.152 6.955 ( -1.306 0.000 -0.506) 1.401 7.290 ( 1.787 0.000 -0.921) 2.010 7.522 ( -5.831 0.000 -7.517) 9.514 7.825 ( 0.144 0.000 5.229) 5.231 7.930 ( 0.071 0.000 0.172) 0.186 8.386 ( -10.933 0.000 5.055) 12.045 8.449 ( 3.333 0.000 -18.397) 18.697 8.661 ( 6.489 0.000 -6.843) 9.431 8.847 ( 10.692 0.000 -4.197) 11.486 9.445 ( -1.096 0.000 -5.387) 5.497 11.234 ( 1.145 0.000 -1.159) 1.629 11.292 ( -1.333 0.000 -0.527) 1.433 11.540 ( 0.816 0.000 2.476) 2.607 11.846 ( -1.613 0.000 1.156) 1.985 13.624 ( -0.351 0.000 -2.514) 2.538 14.108 ( -2.212 0.000 -1.742) 2.815 14.379 ( -8.725 0.000 -1.710) 8.891 14.827 ( -8.659 0.000 -1.782) 8.841 15.192 ( -1.355 0.000 -2.639) 2.967 15.299 ( -0.817 0.000 2.211) 2.357 15.952 ( -0.379 0.000 -3.198) 3.221 16.046 ( -15.598 0.000 20.928) 26.101 16.105 ( -0.189 0.000 4.018) 4.022 16.245 ( 3.542 0.000 -10.569) 11.147 16.414 ( -14.341 0.000 16.145) 21.595 16.803 ( -1.160 0.000 -2.511) 2.765 17.946 ( 6.828 0.000 -0.369) 6.838 18.000 ( 5.272 0.000 0.184) 5.275 18.264 ( 7.410 0.000 2.538) 7.833 18.467 ( 30.219 0.000 -40.310) 50.380 27.662 ( 1.381 0.000 0.272) 1.408 27.788 ( 0.035 0.000 -1.338) 1.338 27.895 ( 1.424 0.000 -1.334) 1.951 28.112 ( -0.738 0.000 -2.864) 2.957 28.868 ( 1.893 0.000 0.848) 2.075 29.017 ( 0.125 0.000 0.701) 0.712 29.171 ( 7.232 0.000 -17.223) 18.680 29.802 ( -8.590 0.000 5.709) 10.314 29.947 ( -1.777 0.000 -6.213) 6.463 30.036 ( -6.941 0.000 19.642) 20.833 30.190 ( -3.754 0.000 4.910) 6.181 31.072 ( 6.383 0.000 3.905) 7.483 31.190 ( -2.647 0.000 0.138) 2.650 31.445 ( -4.975 0.000 2.943) 5.781 32.037 ( 9.386 0.000 -2.291) 9.662 34.085 ( 15.177 0.000 -20.503) 25.509 ======================= Grid point 2 (3/168) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.062 ( 24.284 0.000 11.561) 26.896 1.309 ( 15.064 0.000 32.563) 35.879 2.223 ( 48.065 0.000 9.426) 48.981 2.443 ( 11.938 0.000 -18.461) 21.985 2.920 ( 13.667 0.000 -2.885) 13.968 3.202 ( 17.150 0.000 5.235) 17.931 3.387 ( -3.267 0.000 -1.924) 3.792 3.734 ( -5.214 0.000 -1.427) 5.406 3.738 ( 21.929 0.000 4.506) 22.387 3.964 ( -1.626 0.000 -2.859) 3.289 4.007 ( 6.223 0.000 8.961) 10.910 4.296 ( -5.426 0.000 -2.373) 5.922 4.630 ( 9.739 0.000 7.734) 12.436 4.683 ( -6.851 0.000 11.282) 13.200 4.894 ( 1.920 0.000 4.451) 4.847 5.158 ( 11.932 0.000 9.478) 15.238 5.279 ( 6.653 0.000 -1.519) 6.824 5.415 ( -2.187 0.000 -2.049) 2.997 5.788 ( 0.171 0.000 8.342) 8.344 5.845 ( 5.876 0.000 -5.829) 8.277 6.060 ( -2.581 0.000 -2.325) 3.474 6.101 ( 8.094 0.000 5.674) 9.884 6.523 ( 4.541 0.000 -0.682) 4.592 6.660 ( -2.179 0.000 -1.027) 2.409 6.816 ( -0.017 0.000 3.628) 3.628 6.849 ( -8.781 0.000 -4.609) 9.917 6.922 ( 9.380 0.000 -6.480) 11.400 7.223 ( -5.613 0.000 -9.855) 11.342 7.395 ( 0.623 0.000 -2.791) 2.860 7.919 ( -1.530 0.000 -0.683) 1.676 7.932 ( 2.460 0.000 11.459) 11.721 8.260 ( -10.787 0.000 3.622) 11.379 8.310 ( 4.529 0.000 -15.855) 16.489 8.697 ( 7.620 0.000 -6.033) 9.719 8.955 ( 5.088 0.000 1.427) 5.284 9.335 ( -9.422 0.000 1.042) 9.480 11.226 ( 1.262 0.000 -3.920) 4.118 11.256 ( -2.317 0.000 -0.396) 2.350 11.590 ( 0.811 0.000 3.489) 3.582 11.839 ( -2.042 0.000 3.099) 3.711 13.579 ( -0.314 0.000 -4.250) 4.262 14.008 ( -6.740 0.000 -3.979) 7.827 14.172 ( -14.009 0.000 -2.227) 14.185 14.626 ( -12.609 0.000 -2.794) 12.915 15.152 ( 0.988 0.000 -2.592) 2.774 15.307 ( -2.179 0.000 2.986) 3.697 15.896 ( -0.613 0.000 -4.691) 4.731 16.045 ( -4.528 0.000 6.597) 8.002 16.149 ( 1.777 0.000 -12.589) 12.713 16.168 ( 0.372 0.000 6.283) 6.294 16.378 ( -11.971 0.000 13.611) 18.126 16.738 ( -1.706 0.000 -4.562) 4.871 18.075 ( 9.456 0.000 -0.321) 9.462 18.109 ( 7.875 0.000 0.143) 7.877 18.442 ( 10.033 0.000 3.338) 10.573 18.480 ( 13.938 0.000 -17.998) 22.764 27.696 ( 2.271 0.000 0.564) 2.340 27.771 ( -0.257 0.000 -1.099) 1.129 27.904 ( 2.341 0.000 -2.330) 3.303 28.051 ( -1.188 0.000 -4.908) 5.050 28.923 ( 3.305 0.000 1.363) 3.575 29.026 ( 0.001 0.000 0.300) 0.300 29.075 ( 0.673 0.000 -9.396) 9.420 29.732 ( -6.381 0.000 2.900) 7.009 29.837 ( -2.505 0.000 -6.451) 6.920 30.161 ( 0.873 0.000 9.730) 9.769 30.162 ( -6.568 0.000 4.344) 7.874 31.120 ( -4.928 0.000 -2.332) 5.452 31.260 ( 9.515 0.000 6.032) 11.266 31.402 ( -6.309 0.000 5.698) 8.501 32.198 ( 13.743 0.000 -2.171) 13.913 34.089 ( 6.139 0.000 -7.967) 10.059 ======================= Grid point 3 (4/168) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.548 ( 22.259 0.000 9.530) 24.213 1.866 ( 12.157 0.000 27.215) 29.807 2.478 ( 13.219 0.000 -10.314) 16.767 2.800 ( 19.324 0.000 -1.066) 19.354 3.097 ( 10.098 0.000 -6.484) 12.000 3.435 ( 13.470 0.000 5.343) 14.491 3.473 ( 4.267 0.000 0.587) 4.307 3.589 ( 0.772 0.000 -7.581) 7.620 3.910 ( 2.152 0.000 -1.494) 2.619 3.912 ( -2.899 0.000 0.683) 2.978 4.197 ( -6.067 0.000 2.639) 6.616 4.392 ( 18.666 0.000 11.970) 22.175 4.704 ( -2.799 0.000 6.185) 6.789 4.814 ( 5.762 0.000 0.586) 5.792 4.982 ( 2.218 0.000 6.848) 7.199 5.284 ( -0.151 0.000 -4.636) 4.638 5.357 ( 5.356 0.000 -2.208) 5.793 5.505 ( 7.372 0.000 8.663) 11.376 5.852 ( 4.694 0.000 -8.608) 9.804 5.919 ( 4.182 0.000 7.086) 8.228 6.033 ( 0.834 0.000 1.430) 1.656 6.289 ( 7.517 0.000 6.260) 9.782 6.583 ( -6.183 0.000 0.072) 6.184 6.596 ( 4.655 0.000 -0.448) 4.677 6.668 ( -3.500 0.000 -5.367) 6.407 6.862 ( 1.953 0.000 2.508) 3.179 6.973 ( -7.911 0.000 -11.869) 14.264 7.024 ( 10.148 0.000 -1.476) 10.254 7.413 ( 1.790 0.000 0.150) 1.796 7.860 ( -4.010 0.000 -1.903) 4.439 8.081 ( -5.178 0.000 4.627) 6.944 8.216 ( 2.653 0.000 11.992) 12.282 8.218 ( 3.285 0.000 -12.484) 12.909 8.751 ( 7.002 0.000 -5.269) 8.763 9.036 ( 3.718 0.000 0.046) 3.718 9.198 ( -11.473 0.000 5.375) 12.670 11.180 ( 0.046 0.000 -5.661) 5.661 11.218 ( -2.097 0.000 0.122) 2.101 11.632 ( -0.456 0.000 2.965) 3.000 11.857 ( -1.168 0.000 4.283) 4.439 13.524 ( 0.109 0.000 -4.810) 4.811 13.817 ( -9.733 0.000 -5.591) 11.225 13.922 ( -14.202 0.000 -1.617) 14.294 14.405 ( -11.159 0.000 -2.228) 11.379 15.172 ( 4.003 0.000 -1.156) 4.167 15.295 ( -3.033 0.000 2.118) 3.700 15.838 ( 0.107 0.000 -4.467) 4.468 16.038 ( 0.381 0.000 -8.918) 8.927 16.060 ( 0.929 0.000 1.208) 1.524 16.250 ( 0.081 0.000 7.301) 7.301 16.344 ( -9.487 0.000 9.409) 13.361 16.652 ( -1.507 0.000 -6.035) 6.220 18.217 ( 8.491 0.000 0.267) 8.495 18.229 ( 7.040 0.000 -0.209) 7.043 18.486 ( 7.096 0.000 -9.964) 12.232 18.626 ( 8.505 0.000 2.770) 8.944 27.741 ( 2.336 0.000 0.818) 2.475 27.759 ( -0.185 0.000 -0.167) 0.249 27.913 ( 2.382 0.000 -2.652) 3.565 27.971 ( -1.191 0.000 -5.517) 5.645 28.977 ( -0.315 0.000 -6.385) 6.393 28.996 ( 3.759 0.000 1.381) 4.005 29.035 ( -0.891 0.000 0.929) 1.287 29.676 ( -3.659 0.000 1.168) 3.841 29.733 ( -2.427 0.000 -4.872) 5.443 30.095 ( -6.876 0.000 2.923) 7.471 30.272 ( 1.801 0.000 5.754) 6.029 30.992 ( -6.172 0.000 -3.921) 7.312 31.383 ( -4.644 0.000 5.727) 7.373 31.478 ( 8.874 0.000 5.817) 10.611 32.393 ( 12.763 0.000 -0.918) 12.796 34.094 ( 2.804 0.000 -3.428) 4.429 ======================= Grid point 4 (5/168) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.960 ( 18.023 0.000 6.751) 19.246 2.284 ( 7.506 0.000 17.818) 19.334 2.565 ( 4.071 0.000 -2.408) 4.730 2.955 ( 7.272 0.000 -3.292) 7.983 3.082 ( -0.943 0.000 -3.455) 3.581 3.336 ( 0.254 0.000 -9.376) 9.379 3.572 ( -7.007 0.000 -2.729) 7.520 3.779 ( 16.587 0.000 2.277) 16.742 3.891 ( -0.116 0.000 -1.116) 1.122 3.950 ( 4.082 0.000 3.735) 5.533 4.179 ( -2.039 0.000 4.217) 4.684 4.631 ( -0.509 0.000 7.304) 7.322 4.732 ( 2.869 0.000 -4.120) 5.021 4.812 ( -1.403 0.000 -4.327) 4.548 5.165 ( 7.743 0.000 8.877) 11.779 5.228 ( -0.636 0.000 -2.965) 3.033 5.396 ( 2.486 0.000 -1.274) 2.793 5.589 ( -1.670 0.000 -1.332) 2.137 5.832 ( 3.081 0.000 -4.199) 5.208 6.035 ( 3.190 0.000 2.020) 3.776 6.120 ( 4.339 0.000 4.614) 6.333 6.475 ( 4.268 0.000 8.650) 9.646 6.559 ( 1.259 0.000 2.377) 2.690 6.594 ( -0.935 0.000 -3.091) 3.230 6.638 ( 2.699 0.000 -2.098) 3.419 6.758 ( -4.650 0.000 -7.400) 8.739 6.939 ( 4.312 0.000 2.156) 4.821 7.208 ( 11.315 0.000 2.522) 11.593 7.435 ( 0.367 0.000 0.677) 0.770 7.758 ( -5.813 0.000 -1.779) 6.079 7.993 ( -4.886 0.000 -0.825) 4.955 8.099 ( -1.927 0.000 -9.972) 10.157 8.460 ( 4.105 0.000 14.749) 15.310 8.777 ( 4.662 0.000 -6.749) 8.203 9.036 ( -3.177 0.000 0.403) 3.202 9.157 ( -1.530 0.000 4.247) 4.515 11.115 ( -0.568 0.000 -4.145) 4.184 11.199 ( -0.834 0.000 0.474) 0.960 11.640 ( -1.517 0.000 1.426) 2.082 11.890 ( -0.283 0.000 3.035) 3.048 13.477 ( 0.291 0.000 -3.743) 3.754 13.621 ( -6.848 0.000 -4.172) 8.019 13.723 ( -8.992 0.000 -0.321) 8.998 14.247 ( -6.319 0.000 -1.119) 6.417 15.228 ( 3.330 0.000 -0.131) 3.332 15.268 ( -2.228 0.000 0.760) 2.354 15.802 ( 0.576 0.000 -2.812) 2.871 15.966 ( 0.011 0.000 -4.215) 4.215 16.099 ( 3.601 0.000 -1.038) 3.748 16.297 ( -7.075 0.000 5.481) 8.950 16.333 ( -0.198 0.000 7.183) 7.185 16.560 ( -0.841 0.000 -6.468) 6.522 18.313 ( 3.975 0.000 -0.337) 3.989 18.338 ( 5.650 0.000 1.367) 5.813 18.470 ( 2.220 0.000 -5.699) 6.116 18.756 ( 4.707 0.000 1.512) 4.944 27.763 ( -0.004 0.000 0.923) 0.923 27.782 ( 1.493 0.000 0.763) 1.677 27.897 ( -0.795 0.000 -4.316) 4.388 27.917 ( 1.484 0.000 -1.937) 2.440 28.916 ( -0.432 0.000 -3.172) 3.201 29.030 ( -0.721 0.000 0.545) 0.903 29.062 ( 2.715 0.000 0.901) 2.860 29.644 ( -1.512 0.000 0.371) 1.557 29.657 ( -1.656 0.000 -2.621) 3.100 30.029 ( -4.394 0.000 1.506) 4.645 30.344 ( 1.137 0.000 2.712) 2.940 30.866 ( -4.283 0.000 -2.839) 5.138 31.380 ( -2.383 0.000 3.279) 4.054 31.646 ( 5.266 0.000 3.518) 6.333 32.551 ( 7.584 0.000 -0.103) 7.585 34.097 ( 1.084 0.000 -1.259) 1.661 ======================= Grid point 5 (6/168) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 84 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.185 ( -0.000 0.000 0.000) 0.000 2.457 ( -0.000 0.000 0.000) 0.000 2.537 ( 0.000 0.000 0.000) 0.000 2.993 ( 0.000 0.000 -0.000) 0.000 3.044 ( -0.000 0.000 0.000) 0.000 3.381 ( -0.000 0.000 0.000) 0.000 3.393 ( 0.000 0.000 -0.000) 0.000 3.844 ( 0.000 0.000 0.000) 0.000 3.971 ( 0.000 0.000 0.000) 0.000 4.016 ( 0.000 0.000 -0.000) 0.000 4.195 ( 0.000 0.000 0.000) 0.000 4.665 ( 0.000 0.000 0.000) 0.000 4.707 ( 0.000 0.000 -0.000) 0.000 4.759 ( 0.000 0.000 0.000) 0.000 5.203 ( 0.000 0.000 0.000) 0.000 5.292 ( -0.000 0.000 -0.000) 0.000 5.410 ( 0.000 0.000 0.000) 0.000 5.550 ( 0.000 0.000 0.000) 0.000 5.832 ( 0.000 0.000 0.000) 0.000 6.068 ( 0.000 0.000 0.000) 0.000 6.195 ( 0.000 0.000 0.000) 0.000 6.566 ( 0.000 0.000 0.000) 0.000 6.568 ( 0.000 0.000 -0.000) 0.000 6.609 ( 0.000 0.000 0.000) 0.000 6.642 ( 0.000 0.000 0.000) 0.000 6.668 ( 0.000 0.000 -0.000) 0.000 7.003 ( 0.000 0.000 0.000) 0.000 7.340 ( -0.000 0.000 0.000) 0.000 7.441 ( 0.000 0.000 -0.000) 0.000 7.687 ( 0.000 0.000 -0.000) 0.000 7.946 ( 0.000 0.000 0.000) 0.000 8.000 ( 0.000 0.000 0.000) 0.000 8.601 ( 0.000 0.000 0.000) 0.000 8.757 ( 0.000 0.000 -0.000) 0.000 9.010 ( 0.000 0.000 0.000) 0.000 9.176 ( 0.000 0.000 -0.000) 0.000 11.085 ( 0.000 0.000 0.000) 0.000 11.197 ( 0.000 0.000 0.000) 0.000 11.632 ( 0.000 0.000 0.000) 0.000 11.907 ( 0.000 0.000 0.000) 0.000 13.456 ( 0.000 0.000 0.000) 0.000 13.540 ( 0.000 0.000 0.000) 0.000 13.650 ( -0.000 0.000 0.000) 0.000 14.190 ( 0.000 0.000 0.000) 0.000 15.253 ( 0.000 0.000 0.000) 0.000 15.255 ( 0.000 0.000 0.000) 0.000 15.790 ( 0.000 0.000 0.000) 0.000 15.942 ( 0.000 0.000 0.000) 0.000 16.128 ( 0.000 0.000 0.000) 0.000 16.267 ( 0.000 0.000 0.000) 0.000 16.386 ( 0.000 0.000 0.000) 0.000 16.502 ( 0.000 0.000 -0.000) 0.000 18.343 ( 0.000 0.000 0.000) 0.000 18.421 ( -0.000 0.000 -0.000) 0.000 18.424 ( 0.000 0.000 0.000) 0.000 18.802 ( 0.000 0.000 0.000) 0.000 27.772 ( 0.000 0.000 0.000) 0.000 27.799 ( 0.000 0.000 0.000) 0.000 27.862 ( 0.000 0.000 -0.000) 0.000 27.917 ( 0.000 0.000 0.000) 0.000 28.894 ( 0.000 0.000 0.000) 0.000 29.027 ( 0.000 0.000 0.000) 0.000 29.090 ( 0.000 0.000 0.000) 0.000 29.628 ( 0.000 0.000 0.000) 0.000 29.635 ( 0.000 0.000 0.000) 0.000 30.002 ( 0.000 0.000 0.000) 0.000 30.368 ( 0.000 0.000 0.000) 0.000 30.814 ( 0.000 0.000 0.000) 0.000 31.381 ( 0.000 0.000 0.000) 0.000 31.709 ( 0.000 0.000 0.000) 0.000 32.612 ( 0.000 0.000 0.000) 0.000 34.099 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 11 (7/168) ======================= q-point: ( 0.00 0.14 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.539 ( 0.000 26.190 0.000) 26.190 0.723 ( 0.000 34.810 0.000) 34.810 1.310 ( 0.000 61.663 0.000) 61.663 2.629 ( 0.000 3.440 0.000) 3.440 2.669 ( 0.000 -5.252 0.000) 5.252 2.754 ( 0.000 -1.608 0.000) 1.608 3.135 ( 0.000 2.992 0.000) 2.992 3.528 ( 0.000 -2.513 0.000) 2.513 3.724 ( 0.000 -2.002 0.000) 2.002 3.835 ( 0.000 -2.727 0.000) 2.727 3.954 ( 0.000 1.392 0.000) 1.392 4.247 ( 0.000 -3.636 0.000) 3.636 4.469 ( 0.000 1.547 0.000) 1.547 4.513 ( 0.000 -9.746 0.000) 9.746 4.794 ( 0.000 6.083 0.000) 6.083 4.959 ( 0.000 0.336 0.000) 0.336 5.217 ( 0.000 2.108 0.000) 2.108 5.242 ( 0.000 -5.614 0.000) 5.614 5.752 ( 0.000 12.220 0.000) 12.220 5.787 ( 0.000 -0.167 0.000) 0.167 5.857 ( 0.000 -2.523 0.000) 2.523 6.128 ( 0.000 -1.911 0.000) 1.911 6.470 ( 0.000 -0.108 0.000) 0.108 6.686 ( 0.000 0.756 0.000) 0.756 6.745 ( 0.000 -0.141 0.000) 0.141 6.977 ( 0.000 1.825 0.000) 1.825 7.075 ( 0.000 2.024 0.000) 2.024 7.364 ( 0.000 -5.503 0.000) 5.503 7.450 ( 0.000 -1.232 0.000) 1.232 7.907 ( 0.000 -1.050 0.000) 1.050 7.908 ( 0.000 8.870 0.000) 8.870 8.371 ( 0.000 -3.785 0.000) 3.785 8.414 ( 0.000 -3.314 0.000) 3.314 8.553 ( 0.000 -1.209 0.000) 1.209 8.814 ( 0.000 0.665 0.000) 0.665 9.143 ( 0.000 -6.032 0.000) 6.032 11.165 ( 0.000 -3.429 0.000) 3.429 11.401 ( 0.000 6.612 0.000) 6.612 11.474 ( 0.000 -5.126 0.000) 5.126 11.864 ( 0.000 0.644 0.000) 0.644 13.678 ( 0.000 3.550 0.000) 3.550 14.225 ( 0.000 4.040 0.000) 4.040 14.416 ( 0.000 -4.143 0.000) 4.143 14.880 ( 0.000 -2.843 0.000) 2.843 15.326 ( 0.000 3.370 0.000) 3.370 15.834 ( 0.000 -1.568 0.000) 1.568 15.959 ( 0.000 1.730 0.000) 1.730 15.962 ( 0.000 -1.347 0.000) 1.347 16.036 ( 0.000 -3.197 0.000) 3.197 16.336 ( 0.000 4.679 0.000) 4.679 16.363 ( 0.000 -2.178 0.000) 2.178 16.807 ( 0.000 -1.932 0.000) 1.932 17.640 ( 0.000 1.542 0.000) 1.542 17.884 ( 0.000 -0.794 0.000) 0.794 17.972 ( 0.000 1.486 0.000) 1.486 18.177 ( 0.000 -0.905 0.000) 0.905 27.712 ( 0.000 1.113 0.000) 1.113 27.795 ( 0.000 -0.257 0.000) 0.257 27.884 ( 0.000 -0.771 0.000) 0.771 28.108 ( 0.000 -2.513 0.000) 2.513 29.025 ( 0.000 1.108 0.000) 1.108 29.032 ( 0.000 -0.609 0.000) 0.609 29.866 ( 0.000 2.013 0.000) 2.013 29.918 ( 0.000 2.536 0.000) 2.536 30.093 ( 0.000 7.712 0.000) 7.712 30.226 ( 0.000 3.869 0.000) 3.869 30.957 ( 0.000 -3.755 0.000) 3.755 31.098 ( 0.000 -9.398 0.000) 9.398 31.289 ( 0.000 0.327 0.000) 0.327 31.434 ( 0.000 -2.185 0.000) 2.185 31.674 ( 0.000 7.412 0.000) 7.412 32.478 ( 0.000 -4.293 0.000) 4.293 ======================= Grid point 12 (8/168) ======================= q-point: ( 0.10 0.14 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.942 ( 12.074 21.741 23.890) 34.485 1.096 ( 23.904 25.272 13.966) 37.485 1.588 ( 35.030 42.123 6.351) 55.152 2.518 ( 6.978 -0.085 -17.410) 18.757 2.776 ( 7.533 0.292 1.204) 7.634 2.931 ( 12.636 1.532 6.365) 14.232 3.266 ( 14.737 0.508 4.855) 15.524 3.526 ( 0.024 -1.556 -3.775) 4.083 3.772 ( 0.892 -2.744 3.623) 4.631 3.823 ( 1.936 -1.850 -0.276) 2.692 4.029 ( 5.152 1.431 1.565) 5.571 4.318 ( 2.411 -4.283 8.327) 9.670 4.443 ( -2.863 -1.188 -0.602) 3.157 4.586 ( 5.573 -5.898 4.388) 9.225 4.743 ( -5.093 4.039 3.276) 7.278 4.989 ( 4.791 -1.428 -0.135) 5.002 5.234 ( 0.752 3.472 2.631) 4.421 5.373 ( 4.557 -9.607 5.605) 12.020 5.730 ( -4.547 6.442 4.176) 8.923 5.805 ( 2.127 0.066 0.291) 2.147 5.917 ( 4.232 -6.271 -1.182) 7.657 6.138 ( 2.470 3.083 -0.387) 3.969 6.467 ( -1.283 -2.192 2.310) 3.433 6.590 ( -4.225 -0.973 -2.077) 4.807 6.809 ( 1.632 2.146 3.179) 4.169 6.937 ( -0.999 2.308 -2.382) 3.464 7.045 ( 3.159 5.423 -6.406) 8.968 7.297 ( -1.054 -0.576 0.038) 1.202 7.482 ( -0.485 -2.631 -5.056) 5.720 7.902 ( 0.007 0.026 -0.105) 0.108 7.908 ( -2.622 4.455 3.060) 6.007 8.239 ( -7.339 -6.116 -0.353) 9.560 8.526 ( 5.155 0.909 -6.260) 8.160 8.659 ( 4.341 -0.448 0.138) 4.366 8.841 ( 9.419 -0.596 -5.050) 10.704 9.233 ( 3.593 -13.293 3.003) 14.093 11.178 ( 0.676 -3.102 0.751) 3.262 11.382 ( -2.492 5.221 -0.521) 5.808 11.491 ( 1.656 -3.639 1.376) 4.229 11.849 ( -1.597 0.376 0.446) 1.700 13.637 ( -3.302 2.496 -0.948) 4.247 14.164 ( -4.175 4.262 -2.765) 6.576 14.338 ( -8.549 -3.813 -1.422) 9.468 14.798 ( -8.234 -2.838 -2.361) 9.023 15.312 ( -1.362 4.126 -2.075) 4.815 15.477 ( -6.986 14.162 -13.073) 20.500 15.918 ( -2.505 -2.932 -0.516) 3.890 16.032 ( -9.517 -1.350 14.035) 17.011 16.054 ( 0.500 -3.343 2.407) 4.150 16.307 ( 2.215 4.365 -8.351) 9.680 16.375 ( -11.379 -2.751 14.374) 18.538 16.799 ( -0.656 -1.017 -2.473) 2.753 17.919 ( 8.120 -2.902 -0.737) 8.654 17.996 ( 12.329 -3.319 -4.339) 13.485 18.111 ( 28.599 -11.565 -8.011) 31.872 18.253 ( 7.346 -1.069 2.509) 7.836 27.683 ( -0.951 1.411 -1.308) 2.147 27.796 ( 0.229 0.230 -0.579) 0.663 27.887 ( 1.299 -0.876 -1.350) 2.068 28.088 ( -0.730 -2.291 -2.482) 3.456 29.000 ( -2.719 1.282 -0.499) 3.048 29.030 ( 1.171 0.801 -1.257) 1.895 29.608 ( -6.676 20.205 -39.443) 44.817 29.838 ( -7.987 4.717 0.969) 9.327 29.971 ( -9.854 4.734 0.446) 10.941 30.211 ( -8.455 8.758 9.211) 15.266 30.292 ( -14.646 14.266 12.127) 23.772 31.118 ( 6.223 1.691 5.125) 8.237 31.143 ( -2.355 -1.647 1.952) 3.474 31.413 ( -4.651 -2.657 2.108) 5.757 32.016 ( 11.141 -1.523 -2.455) 11.509 33.400 ( 40.871 -40.083 8.476) 57.870 ======================= Grid point 13 (9/168) ======================= q-point: ( 0.20 0.14 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.428 ( 15.710 16.675 20.079) 30.464 1.532 ( 13.963 28.296 17.734) 36.196 2.327 ( 39.478 9.996 0.689) 40.730 2.494 ( 16.310 6.067 -12.234) 21.272 2.904 ( 9.712 -1.190 -1.393) 9.883 3.213 ( 11.037 0.766 2.960) 11.453 3.442 ( 5.705 4.732 -1.908) 7.654 3.716 ( 21.503 -1.056 7.073) 22.660 3.774 ( -2.670 1.258 0.952) 3.101 3.901 ( 4.948 -1.169 2.427) 5.633 4.088 ( -0.275 3.260 3.965) 5.141 4.324 ( -5.200 1.265 -1.730) 5.624 4.542 ( 7.122 -6.881 8.674) 13.164 4.704 ( -2.818 2.493 9.542) 10.256 4.779 ( 5.462 -6.929 2.439) 9.154 5.069 ( 5.553 -7.042 -1.035) 9.027 5.330 ( 5.624 5.075 6.383) 9.906 5.479 ( 7.476 -4.911 -2.411) 9.264 5.730 ( -1.275 3.081 4.315) 5.454 5.862 ( 4.359 0.364 0.697) 4.429 5.921 ( -0.960 -9.089 -0.423) 9.149 6.196 ( 4.222 3.828 -1.137) 5.811 6.502 ( 0.816 -6.132 3.792) 7.256 6.541 ( 0.415 -0.367 -0.539) 0.773 6.813 ( -4.670 1.610 -3.588) 6.105 6.896 ( -3.030 2.379 2.726) 4.719 7.032 ( 6.384 6.094 -7.874) 11.828 7.235 ( -4.574 0.693 -6.768) 8.198 7.416 ( 1.050 1.692 -2.396) 3.116 7.898 ( -1.629 -1.956 1.721) 3.073 7.931 ( -0.227 -0.484 5.288) 5.315 8.164 ( -2.515 -0.917 2.032) 3.361 8.488 ( -0.334 8.237 -7.015) 10.824 8.673 ( 5.747 -1.710 -6.635) 8.943 8.954 ( 6.629 -0.696 1.139) 6.762 9.241 ( -5.723 -8.679 2.371) 10.663 11.192 ( 0.923 -1.880 -0.880) 2.272 11.321 ( -3.774 4.107 -1.068) 5.679 11.542 ( 1.756 -3.555 2.162) 4.516 11.835 ( -2.054 -0.437 2.364) 3.162 13.572 ( -2.312 0.180 -2.733) 3.584 14.030 ( -8.403 1.434 -4.586) 9.680 14.145 ( -12.712 -1.939 -1.710) 12.973 14.599 ( -12.208 -2.659 -3.091) 12.871 15.229 ( -0.792 6.025 -5.292) 8.058 15.378 ( -2.014 6.629 0.805) 6.975 15.860 ( -0.652 -3.177 -4.687) 5.700 16.036 ( -2.930 -1.086 4.288) 5.306 16.084 ( 0.693 -3.096 -0.922) 3.304 16.241 ( -1.328 3.388 -1.553) 3.956 16.357 ( -9.477 -1.264 11.062) 14.621 16.737 ( -1.897 -0.489 -4.350) 4.771 18.045 ( 8.801 -1.853 -0.124) 8.995 18.129 ( 10.027 0.403 -1.522) 10.150 18.352 ( 17.241 -8.354 -11.236) 22.210 18.432 ( 9.873 -1.462 3.436) 10.555 27.675 ( 0.999 -0.578 -0.409) 1.224 27.790 ( 0.155 0.872 -0.796) 1.191 27.892 ( 1.939 -1.185 -2.259) 3.204 28.034 ( -1.066 -1.627 -4.222) 4.649 28.960 ( -0.047 0.923 -2.185) 2.373 29.032 ( -0.198 0.497 0.190) 0.568 29.249 ( -2.387 14.672 -13.392) 20.008 29.749 ( -5.935 1.060 1.429) 6.196 29.837 ( -4.829 1.988 -4.136) 6.662 30.198 ( -5.918 3.638 2.580) 7.410 30.307 ( -2.357 11.505 10.811) 15.962 31.089 ( -4.744 -2.738 -0.998) 5.568 31.333 ( 4.792 4.366 5.897) 8.764 31.374 ( -0.247 -0.624 7.015) 7.047 32.169 ( 13.130 -2.120 -3.513) 13.756 33.806 ( 13.865 -23.633 -1.029) 27.419 ======================= Grid point 14 (10/168) ======================= q-point: ( 0.30 0.14 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.845 ( 17.235 20.946 9.049) 28.595 1.977 ( 10.956 13.193 23.688) 29.244 2.530 ( 14.636 4.303 -8.696) 17.560 2.841 ( 14.239 3.456 -2.693) 14.898 3.085 ( 13.441 0.296 -5.370) 14.477 3.289 ( 7.026 -5.515 2.774) 9.352 3.617 ( -0.834 8.874 -1.853) 9.103 3.639 ( 4.654 1.914 -5.727) 7.624 3.964 ( 3.084 4.383 0.381) 5.373 4.063 ( 4.391 11.923 3.804) 13.263 4.188 ( -0.718 -1.194 6.301) 6.453 4.337 ( 12.841 -5.181 6.985) 15.509 4.690 ( 0.349 -3.161 6.711) 7.426 4.768 ( 0.094 1.077 4.175) 4.313 4.871 ( 3.633 -11.766 0.650) 12.331 5.135 ( 6.154 -2.652 -3.344) 7.490 5.528 ( 6.075 -2.137 8.265) 10.478 5.555 ( 7.410 2.877 -4.114) 8.950 5.776 ( 4.044 0.904 -1.639) 4.456 5.904 ( 0.643 -4.107 0.526) 4.190 5.960 ( 1.314 -4.493 5.976) 7.591 6.203 ( 0.119 -3.592 -3.669) 5.135 6.515 ( -1.175 -4.034 1.839) 4.587 6.636 ( 5.627 -0.789 5.068) 7.614 6.684 ( -1.083 3.222 -2.611) 4.286 6.866 ( -4.307 0.339 -2.473) 4.978 7.017 ( 1.383 4.562 -6.191) 7.814 7.132 ( 3.878 6.779 -2.508) 8.203 7.437 ( 1.781 2.521 0.177) 3.092 7.876 ( -3.204 1.538 0.207) 3.560 7.978 ( -0.729 -4.821 2.366) 5.420 8.237 ( 2.292 1.508 9.654) 10.037 8.372 ( -1.095 9.729 -10.126) 14.085 8.703 ( 6.116 -4.151 -5.062) 8.959 9.065 ( 5.521 1.673 0.866) 5.833 9.150 ( -10.041 -4.612 5.524) 12.353 11.174 ( 0.243 -0.394 -4.357) 4.382 11.257 ( -3.405 3.449 0.814) 4.915 11.584 ( 0.313 -4.092 1.916) 4.529 11.841 ( -1.639 -1.664 3.459) 4.173 13.506 ( -1.197 -1.266 -3.841) 4.217 13.804 ( -12.076 -1.920 -5.073) 13.238 13.931 ( -11.466 1.596 -1.942) 11.738 14.381 ( -10.841 -2.317 -2.338) 11.330 15.201 ( 2.134 3.108 -2.241) 4.386 15.360 ( -1.771 5.627 0.899) 5.967 15.801 ( 0.414 -3.334 -5.151) 6.150 16.030 ( 2.179 -1.774 -7.382) 7.899 16.056 ( -1.793 0.181 2.963) 3.468 16.260 ( -1.343 0.486 6.771) 6.920 16.330 ( -6.901 -0.554 6.697) 9.633 16.649 ( -1.841 -0.485 -5.738) 6.045 18.177 ( 7.518 -1.889 0.352) 7.760 18.263 ( 8.907 0.753 -1.644) 9.089 18.442 ( 8.652 -2.947 -7.292) 11.693 18.613 ( 8.218 -1.400 2.869) 8.816 27.696 ( 1.551 -2.036 0.226) 2.569 27.787 ( 0.278 0.851 -0.275) 0.936 27.895 ( 1.735 -1.611 -2.397) 3.369 27.966 ( -0.784 -0.569 -4.738) 4.836 28.936 ( 0.642 -1.082 -3.522) 3.740 29.028 ( -0.994 0.272 0.909) 1.374 29.147 ( 0.859 9.396 -4.324) 10.379 29.677 ( -3.094 -2.004 -1.899) 4.147 29.738 ( -3.613 3.541 -1.238) 5.208 30.115 ( -7.034 1.772 1.841) 7.484 30.400 ( 0.874 11.041 6.370) 12.777 30.976 ( -5.981 -1.438 -3.194) 6.932 31.323 ( -4.350 -4.116 4.224) 7.328 31.619 ( 9.463 10.933 9.177) 17.126 32.331 ( 11.810 -5.152 -2.996) 13.229 33.934 ( 5.742 -14.606 -1.147) 15.736 ======================= Grid point 15 (11/168) ======================= q-point: ( 0.40 0.14 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.181 ( 14.423 16.988 5.805) 23.029 2.361 ( 7.618 8.520 16.565) 20.126 2.656 ( 5.850 8.209 -1.476) 10.188 2.920 ( 4.796 -2.116 -4.280) 6.768 3.081 ( -1.248 0.442 -3.777) 4.002 3.431 ( 0.002 5.306 -5.813) 7.871 3.529 ( 6.427 -4.915 -2.344) 8.424 3.708 ( 3.447 5.374 -0.396) 6.397 3.939 ( -3.873 5.249 -0.128) 6.525 4.119 ( -0.613 0.624 3.509) 3.616 4.309 ( 7.405 16.464 4.276) 18.552 4.576 ( 5.686 -10.053 2.372) 11.791 4.737 ( -1.460 1.060 3.181) 3.657 4.758 ( -2.382 0.680 -1.256) 2.777 4.936 ( 3.407 -17.429 0.985) 17.786 5.181 ( 4.640 0.772 -3.344) 5.771 5.575 ( 1.176 1.085 -1.334) 2.083 5.642 ( 0.684 6.527 -2.045) 6.874 5.834 ( 6.477 -5.883 -0.459) 8.762 5.944 ( -0.067 -2.774 4.210) 5.042 6.011 ( 0.316 -2.488 0.255) 2.521 6.164 ( -0.316 -15.635 -0.016) 15.638 6.583 ( 4.275 0.444 3.841) 5.765 6.667 ( -0.575 -2.470 -4.164) 4.875 6.781 ( 3.402 6.716 4.749) 8.901 6.800 ( 3.417 5.781 1.496) 6.880 7.006 ( 0.751 4.699 -0.602) 4.797 7.232 ( 8.100 3.270 0.431) 8.746 7.458 ( 0.403 2.579 0.505) 2.658 7.805 ( -4.533 4.459 -0.764) 6.405 7.974 ( -1.484 -0.514 1.247) 2.006 8.181 ( -4.426 6.044 -10.883) 13.212 8.429 ( 2.738 -2.893 9.713) 10.498 8.733 ( 4.288 -3.461 -4.296) 6.987 9.060 ( -5.267 1.012 3.215) 6.253 9.164 ( 2.444 0.517 2.343) 3.425 11.114 ( -0.945 0.384 -3.828) 3.961 11.238 ( -1.014 3.413 1.182) 3.752 11.593 ( -0.983 -4.215 0.943) 4.429 11.857 ( -0.819 -3.239 2.449) 4.142 13.454 ( 0.029 -1.957 -3.294) 3.832 13.585 ( -8.910 -2.966 -3.037) 9.869 13.764 ( -6.893 3.425 -1.215) 7.792 14.226 ( -6.165 -2.059 -1.156) 6.601 15.218 ( 1.289 0.983 -0.370) 1.663 15.347 ( -0.385 5.702 -0.011) 5.715 15.760 ( 0.632 -3.597 -3.315) 4.932 15.978 ( 0.134 0.245 -3.436) 3.448 16.084 ( 2.253 -1.004 0.030) 2.466 16.283 ( -5.690 -1.392 4.990) 7.696 16.337 ( -0.173 0.580 5.717) 5.749 16.556 ( -1.125 -0.490 -6.057) 6.180 18.276 ( 4.198 -1.913 0.555) 4.647 18.360 ( 5.636 -0.178 -1.363) 5.801 18.470 ( 3.073 0.871 -3.455) 4.706 18.740 ( 4.548 -1.587 1.538) 5.057 27.725 ( 1.342 -2.520 0.919) 3.000 27.787 ( -0.184 -0.054 -0.386) 0.431 27.888 ( 0.145 -0.985 -1.584) 1.871 27.915 ( 0.619 -0.139 -3.274) 3.335 28.903 ( 0.015 -0.699 -2.587) 2.680 29.023 ( -0.799 -0.341 0.622) 1.069 29.145 ( 1.718 6.417 -0.900) 6.704 29.614 ( -1.655 -3.295 -2.125) 4.256 29.694 ( -1.670 4.539 0.210) 4.842 30.038 ( -4.435 0.851 0.998) 4.625 30.468 ( 0.795 11.069 3.061) 11.512 30.857 ( -4.185 -0.718 -2.513) 4.934 31.310 ( -2.253 -5.153 2.449) 6.134 31.828 ( 5.568 15.229 5.848) 17.237 32.452 ( 6.901 -9.042 -1.847) 11.523 33.985 ( 2.254 -10.676 -0.452) 10.920 ======================= Grid point 16 (12/168) ======================= q-point: (-0.50 0.14 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 147 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.360 ( 0.000 12.624 0.000) 12.624 2.548 ( 0.000 10.107 0.000) 10.107 2.637 ( 0.000 9.240 0.000) 9.240 2.948 ( -0.000 -1.384 0.000) 1.384 3.033 ( 0.000 -1.482 0.000) 1.482 3.429 ( -0.000 3.118 0.000) 3.118 3.492 ( 0.000 4.700 0.000) 4.700 3.768 ( 0.000 -0.277 -0.000) 0.277 3.900 ( -0.000 5.084 0.000) 5.084 4.138 ( 0.000 -2.509 0.000) 2.509 4.412 ( 0.000 19.248 0.000) 19.248 4.606 ( 0.000 -12.503 0.000) 12.503 4.725 ( 0.000 0.596 -0.000) 0.596 4.740 ( -0.000 6.895 0.000) 6.895 4.967 ( 0.000 -20.088 0.000) 20.088 5.202 ( 0.000 -0.954 0.000) 0.954 5.572 ( 0.000 0.276 0.000) 0.276 5.617 ( 0.000 10.783 -0.000) 10.783 5.897 ( 0.000 -8.311 -0.000) 8.311 5.965 ( 0.000 -7.134 0.000) 7.134 6.013 ( 0.000 0.910 -0.000) 0.910 6.172 ( 0.000 -18.173 0.000) 18.173 6.622 ( 0.000 -2.601 0.000) 2.601 6.652 ( 0.000 2.839 0.000) 2.839 6.837 ( 0.000 11.012 -0.000) 11.012 6.877 ( 0.000 9.410 0.000) 9.410 7.010 ( 0.000 0.934 0.000) 0.934 7.311 ( 0.000 -0.721 0.000) 0.721 7.466 ( 0.000 2.637 0.000) 2.637 7.762 ( 0.000 6.271 0.000) 6.271 7.993 ( -0.000 4.644 0.000) 4.644 8.026 ( 0.000 2.256 0.000) 2.256 8.515 ( 0.000 -7.474 0.000) 7.474 8.739 ( 0.000 -1.293 0.000) 1.293 9.040 ( 0.000 1.813 0.000) 1.813 9.199 ( 0.000 1.369 -0.000) 1.369 11.082 ( 0.000 0.473 0.000) 0.473 11.239 ( 0.000 3.564 0.000) 3.564 11.588 ( 0.000 -4.111 0.000) 4.111 11.865 ( 0.000 -4.017 0.000) 4.017 13.440 ( 0.000 -1.461 0.000) 1.461 13.488 ( 0.000 -3.801 0.000) 3.801 13.703 ( 0.000 3.983 0.000) 3.983 14.170 ( 0.000 -1.974 0.000) 1.974 15.225 ( 0.000 0.530 0.000) 0.530 15.346 ( 0.000 5.541 0.000) 5.541 15.746 ( 0.000 -3.768 0.000) 3.768 15.960 ( 0.000 0.677 0.000) 0.677 16.107 ( 0.000 -1.545 0.000) 1.545 16.260 ( 0.000 -0.663 0.000) 0.663 16.383 ( 0.000 -0.176 0.000) 0.176 16.500 ( 0.000 -0.341 -0.000) 0.341 18.313 ( 0.000 -1.852 0.000) 1.852 18.399 ( 0.000 -1.957 0.000) 1.957 18.471 ( 0.000 3.472 0.000) 3.472 18.785 ( 0.000 -1.677 0.000) 1.677 27.750 ( 0.000 -3.410 0.000) 3.410 27.774 ( 0.000 0.078 0.000) 0.078 27.877 ( 0.000 0.633 0.000) 0.633 27.905 ( 0.000 -1.082 0.000) 1.082 28.887 ( 0.000 -0.380 0.000) 0.380 29.019 ( 0.000 -0.537 0.000) 0.537 29.156 ( 0.000 5.392 0.000) 5.392 29.587 ( 0.000 -3.345 0.000) 3.345 29.683 ( -0.000 4.610 0.000) 4.610 30.008 ( 0.000 0.583 0.000) 0.583 30.492 ( 0.000 11.118 0.000) 11.118 30.807 ( 0.000 -0.488 0.000) 0.488 31.307 ( 0.000 -5.499 0.000) 5.499 31.907 ( 0.000 17.166 0.000) 17.166 32.497 ( 0.000 -10.994 0.000) 10.994 33.999 ( 0.000 -9.525 0.000) 9.525 ======================= Grid point 22 (13/168) ======================= q-point: ( 0.00 0.29 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.066 ( 0.000 25.373 0.000) 25.373 1.407 ( 0.000 31.755 0.000) 31.755 2.326 ( 0.000 7.881 0.000) 7.881 2.582 ( 0.000 22.452 0.000) 22.452 2.714 ( 0.000 0.052 0.000) 0.052 2.723 ( 0.000 5.511 0.000) 5.511 3.152 ( 0.000 -3.295 0.000) 3.295 3.516 ( 0.000 1.226 0.000) 1.226 3.706 ( 0.000 0.821 0.000) 0.821 3.796 ( 0.000 0.096 0.000) 0.096 3.937 ( 0.000 -1.515 0.000) 1.515 4.154 ( 0.000 -5.715 0.000) 5.715 4.317 ( 0.000 -8.259 0.000) 8.259 4.469 ( 0.000 -3.414 0.000) 3.414 4.918 ( 0.000 5.420 0.000) 5.420 4.944 ( 0.000 -1.044 0.000) 1.044 5.211 ( 0.000 1.451 0.000) 1.451 5.253 ( 0.000 1.588 0.000) 1.588 5.734 ( 0.000 -5.940 0.000) 5.940 5.808 ( 0.000 -6.789 0.000) 6.789 5.848 ( 0.000 2.834 0.000) 2.834 6.121 ( 0.000 0.025 0.000) 0.025 6.536 ( 0.000 6.716 0.000) 6.716 6.753 ( 0.000 0.608 0.000) 0.608 6.768 ( 0.000 8.315 0.000) 8.315 7.017 ( 0.000 2.042 0.000) 2.042 7.118 ( 0.000 1.810 0.000) 1.810 7.324 ( 0.000 3.008 0.000) 3.008 7.371 ( 0.000 -6.435 0.000) 6.435 7.913 ( 0.000 1.587 0.000) 1.587 8.057 ( 0.000 4.102 0.000) 4.102 8.219 ( 0.000 -11.969 0.000) 11.969 8.349 ( 0.000 -1.636 0.000) 1.636 8.509 ( 0.000 -2.709 0.000) 2.709 8.832 ( 0.000 1.029 0.000) 1.029 9.010 ( 0.000 -6.069 0.000) 6.069 11.117 ( 0.000 -1.064 0.000) 1.064 11.345 ( 0.000 -6.952 0.000) 6.952 11.547 ( 0.000 7.455 0.000) 7.455 11.862 ( 0.000 -1.193 0.000) 1.193 13.783 ( 0.000 6.573 0.000) 6.573 14.295 ( 0.000 -7.456 0.000) 7.456 14.340 ( 0.000 7.052 0.000) 7.052 14.795 ( 0.000 -5.410 0.000) 5.410 15.427 ( 0.000 6.463 0.000) 6.463 15.801 ( 0.000 -1.507 0.000) 1.507 15.905 ( 0.000 -4.344 0.000) 4.344 15.922 ( 0.000 -3.867 0.000) 3.867 16.062 ( 0.000 4.358 0.000) 4.358 16.308 ( 0.000 -3.032 0.000) 3.032 16.439 ( 0.000 5.262 0.000) 5.262 16.748 ( 0.000 -3.801 0.000) 3.801 17.685 ( 0.000 2.753 0.000) 2.753 17.857 ( 0.000 -1.808 0.000) 1.808 18.012 ( 0.000 2.356 0.000) 2.356 18.150 ( 0.000 -1.628 0.000) 1.628 27.751 ( 0.000 2.685 0.000) 2.685 27.791 ( 0.000 -0.073 0.000) 0.073 27.861 ( 0.000 -1.331 0.000) 1.331 28.037 ( 0.000 -4.334 0.000) 4.334 29.026 ( 0.000 0.095 0.000) 0.095 29.044 ( 0.000 0.600 0.000) 0.600 29.937 ( 0.000 4.791 0.000) 4.791 29.990 ( 0.000 4.004 0.000) 4.004 30.285 ( 0.000 10.444 0.000) 10.444 30.324 ( 0.000 5.404 0.000) 5.404 30.850 ( 0.000 -6.508 0.000) 6.508 30.874 ( 0.000 -11.796 0.000) 11.796 31.295 ( 0.000 0.348 0.000) 0.348 31.387 ( 0.000 -2.413 0.000) 2.413 31.835 ( 0.000 8.260 0.000) 8.260 32.356 ( 0.000 -7.344 0.000) 7.344 ======================= Grid point 23 (14/168) ======================= q-point: ( 0.10 0.29 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.376 ( 16.145 19.897 15.567) 29.981 1.592 ( 17.925 25.844 9.224) 32.776 2.349 ( 10.617 2.894 -10.204) 15.007 2.622 ( 8.472 21.445 -2.384) 23.180 2.762 ( 6.952 5.678 3.702) 9.709 2.972 ( 16.453 5.440 7.026) 18.699 3.255 ( 12.600 -2.753 3.460) 13.353 3.533 ( 2.232 1.406 -1.758) 3.170 3.719 ( 0.860 -1.538 2.504) 3.062 3.840 ( 3.544 3.816 3.365) 6.200 3.997 ( 6.676 -2.919 -0.629) 7.313 4.217 ( 1.897 -5.431 8.206) 10.022 4.335 ( -1.316 -7.496 3.407) 8.338 4.503 ( 4.433 -4.444 0.528) 6.299 4.889 ( -3.893 7.178 0.780) 8.203 4.940 ( 2.406 -0.750 -2.746) 3.727 5.246 ( 1.138 -2.314 3.278) 4.171 5.284 ( 4.297 0.376 -0.296) 4.324 5.717 ( -2.386 -6.834 0.665) 7.269 5.798 ( -1.619 -6.350 0.446) 6.568 5.865 ( 2.144 3.923 0.600) 4.510 6.125 ( -0.279 -3.142 1.202) 3.375 6.540 ( -0.862 8.011 2.146) 8.338 6.657 ( -3.024 6.875 -4.219) 8.615 6.845 ( 2.799 2.284 3.367) 4.938 6.994 ( -2.728 3.303 -1.690) 4.605 7.142 ( 4.354 4.879 -3.448) 7.393 7.256 ( -1.987 -3.480 -0.558) 4.046 7.428 ( 1.955 -1.937 -0.725) 2.846 7.901 ( -2.346 1.839 1.003) 3.145 7.993 ( -6.771 -0.369 -0.321) 6.789 8.141 ( -2.937 -3.523 1.834) 4.940 8.505 ( 11.167 -2.385 -6.682) 13.231 8.609 ( 7.738 -4.754 7.796) 11.969 8.831 ( 3.052 0.059 -5.001) 5.859 9.007 ( -0.874 -8.013 2.454) 8.425 11.133 ( 0.569 -1.046 1.740) 2.109 11.344 ( -1.967 -6.329 2.464) 7.070 11.547 ( 0.860 6.828 -1.453) 7.034 11.845 ( -1.517 -1.153 -0.421) 1.951 13.728 ( -5.671 6.062 -1.040) 8.366 14.207 ( -8.169 -5.611 -3.161) 10.402 14.294 ( -5.213 5.188 -0.879) 7.407 14.715 ( -7.740 -5.238 -2.685) 9.724 15.420 ( -0.841 6.640 -0.681) 6.727 15.679 ( -1.163 5.910 -15.536) 16.662 15.848 ( -2.768 -3.814 -1.731) 5.021 15.953 ( 1.678 -5.221 0.187) 5.487 16.047 ( -8.246 2.009 11.063) 13.944 16.293 ( -8.138 -3.711 7.340) 11.571 16.423 ( -0.098 5.377 -2.228) 5.821 16.749 ( 0.961 -3.792 -2.828) 4.827 17.836 ( 16.302 -2.406 -3.164) 16.780 17.919 ( 9.965 -2.284 -2.827) 10.607 18.088 ( 8.448 1.963 1.356) 8.779 18.223 ( 7.277 -1.815 2.007) 7.764 27.722 ( -1.318 2.347 -1.780) 3.227 27.800 ( 0.555 0.313 -0.137) 0.652 27.862 ( 0.923 -1.368 -1.167) 2.021 28.023 ( -0.591 -3.933 -1.554) 4.270 29.010 ( -0.452 0.456 -1.929) 2.033 29.044 ( 0.080 0.374 -0.326) 0.503 29.786 ( -3.647 4.610 -17.522) 18.482 29.916 ( -0.476 1.963 -14.557) 14.697 30.169 ( -13.978 11.961 0.253) 18.399 30.348 ( -4.471 6.394 4.883) 9.204 30.551 ( -18.817 7.017 10.480) 22.652 30.974 ( 0.719 -9.801 6.714) 11.901 31.264 ( 1.422 5.957 5.726) 8.384 31.358 ( -3.804 -2.310 0.701) 4.506 32.018 ( 13.067 2.956 -2.869) 13.701 32.783 ( 32.010 -22.173 10.037) 40.212 ======================= Grid point 24 (15/168) ======================= q-point: ( 0.20 0.29 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.763 ( 10.143 16.753 18.938) 27.244 2.051 ( 20.669 19.831 9.966) 30.328 2.434 ( 14.828 -1.251 -9.440) 17.623 2.781 ( 11.610 6.611 -1.964) 13.504 2.935 ( 16.609 14.372 -2.714) 22.131 3.269 ( 6.886 6.767 1.956) 9.850 3.511 ( 12.569 -0.236 -0.642) 12.588 3.664 ( 16.721 -0.581 7.132) 18.188 3.812 ( 4.915 0.835 5.033) 7.084 3.941 ( 0.663 2.475 6.179) 6.689 4.105 ( 9.720 1.502 -0.947) 9.880 4.313 ( -4.611 -2.641 1.613) 5.553 4.405 ( 6.229 -5.843 12.230) 14.917 4.605 ( 6.979 -7.737 -1.788) 10.572 4.850 ( -4.086 7.807 5.430) 10.350 4.975 ( 5.208 -1.584 -1.010) 5.536 5.305 ( 3.546 -5.809 0.640) 6.836 5.375 ( 8.452 -2.789 -2.190) 9.165 5.697 ( -2.718 -7.879 4.181) 9.324 5.780 ( -0.905 -5.480 1.015) 5.646 5.932 ( 4.066 5.474 2.038) 7.117 6.153 ( 1.393 -5.149 2.866) 6.055 6.556 ( -0.801 5.561 2.616) 6.197 6.584 ( -0.165 7.956 -5.082) 9.442 6.866 ( -6.245 3.056 -5.223) 8.696 6.921 ( -0.872 1.032 2.531) 2.869 7.144 ( 4.324 4.320 -6.547) 8.957 7.219 ( -2.639 -2.710 -2.821) 4.719 7.451 ( 3.383 2.431 0.996) 4.283 7.857 ( -4.449 -0.678 3.471) 5.684 7.949 ( -0.915 1.482 3.089) 3.546 8.172 ( 1.383 -0.031 4.219) 4.440 8.557 ( 6.829 -1.384 -7.249) 10.055 8.706 ( -1.469 5.590 -3.627) 6.824 8.869 ( 7.708 -9.676 0.032) 12.371 9.051 ( -0.340 -6.969 5.314) 8.770 11.164 ( 0.887 -0.649 1.131) 1.577 11.335 ( -4.201 -3.812 4.319) 7.130 11.538 ( 1.239 4.360 -3.061) 5.469 11.815 ( -2.338 -1.788 0.614) 3.007 13.610 ( -6.412 3.685 -2.009) 7.663 13.994 ( -13.100 -5.293 -4.169) 14.731 14.167 ( -8.444 4.471 -2.169) 9.798 14.522 ( -11.374 -4.713 -3.425) 12.779 15.366 ( -1.587 7.400 -4.965) 9.051 15.539 ( -0.999 8.084 -4.852) 9.481 15.779 ( -0.673 -4.569 -5.329) 7.052 15.968 ( 1.777 -5.422 -2.504) 6.231 16.060 ( -4.113 0.725 7.251) 8.367 16.242 ( -8.778 -2.849 8.657) 12.653 16.393 ( -0.983 4.612 -1.436) 4.929 16.703 ( -1.246 -3.015 -4.374) 5.457 18.011 ( 9.959 -1.394 -0.615) 10.075 18.084 ( 15.049 -3.958 -5.588) 16.533 18.269 ( 12.498 0.202 -0.933) 12.534 18.394 ( 9.815 -2.186 3.079) 10.517 27.688 ( -0.311 1.658 -1.526) 2.275 27.800 ( 0.329 0.069 -1.019) 1.073 27.862 ( 1.156 -1.339 -1.665) 2.430 27.987 ( -0.688 -2.862 -2.691) 3.988 28.973 ( -0.177 0.817 -3.384) 3.486 29.038 ( -0.520 -0.123 -0.135) 0.551 29.500 ( -3.800 8.666 -16.592) 19.100 29.744 ( -3.130 -1.187 -8.913) 9.521 29.974 ( -12.121 10.212 3.986) 16.343 30.275 ( -8.604 3.048 1.140) 9.199 30.559 ( -2.163 12.166 11.925) 17.173 31.015 ( -4.025 -4.374 3.601) 6.950 31.291 ( -4.996 -2.903 1.156) 5.893 31.465 ( 9.956 1.942 10.723) 14.760 32.179 ( 13.305 5.481 -4.669) 15.129 33.285 ( 20.123 -25.195 5.134) 32.651 ======================= Grid point 25 (16/168) ======================= q-point: ( 0.30 0.29 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.130 ( 9.800 11.686 17.113) 22.922 2.416 ( 13.109 20.346 8.487) 25.648 2.599 ( 15.629 1.178 -3.499) 16.060 2.886 ( 4.755 0.407 -1.096) 4.896 3.200 ( 16.941 11.183 -7.564) 21.662 3.261 ( 2.312 2.878 -1.547) 4.002 3.639 ( 3.396 -1.925 -5.566) 6.798 3.823 ( 1.301 9.370 2.329) 9.742 3.995 ( 2.736 -3.551 5.754) 7.294 4.114 ( 10.915 -3.741 4.883) 12.529 4.199 ( -0.576 -0.312 1.401) 1.546 4.367 ( 10.527 8.631 5.517) 14.688 4.549 ( -1.527 -7.606 0.546) 7.777 4.716 ( 9.862 -2.903 4.582) 11.255 4.884 ( -2.449 8.196 5.964) 10.428 5.081 ( 9.837 -3.620 -2.398) 10.753 5.362 ( 5.640 -10.177 -3.403) 12.122 5.461 ( 4.554 -5.791 -2.195) 7.688 5.742 ( -0.276 -8.104 7.307) 10.915 5.820 ( 3.190 -4.443 2.761) 6.127 6.013 ( 3.522 9.296 0.987) 9.989 6.218 ( 1.093 0.507 0.647) 1.368 6.468 ( -4.416 0.487 -3.073) 5.402 6.631 ( 4.096 2.754 6.490) 8.153 6.727 ( -1.946 0.038 -6.287) 6.582 6.864 ( -4.801 -0.461 -1.712) 5.118 7.125 ( 2.015 4.815 -2.854) 5.949 7.228 ( 5.746 2.165 -0.433) 6.156 7.524 ( 2.520 6.433 1.600) 7.092 7.889 ( 0.534 -0.267 6.334) 6.362 7.965 ( -1.672 3.190 1.274) 3.820 8.255 ( 1.471 -0.104 5.122) 5.330 8.534 ( -0.027 3.309 -10.407) 10.920 8.623 ( 2.560 -1.381 -5.281) 6.029 8.983 ( 0.127 -8.147 7.283) 10.928 9.102 ( 2.046 -0.923 2.172) 3.123 11.173 ( 0.335 0.474 -1.620) 1.721 11.318 ( -4.716 0.611 5.605) 7.350 11.518 ( 0.883 -0.269 -3.264) 3.392 11.788 ( -2.656 -3.466 1.429) 4.594 13.496 ( -4.515 0.672 -2.748) 5.328 13.733 ( -13.313 -4.684 -4.061) 14.686 13.996 ( -9.211 4.484 -2.553) 10.557 14.314 ( -10.185 -4.174 -2.525) 11.293 15.301 ( 0.442 6.499 -4.044) 7.667 15.498 ( -0.728 7.471 -1.234) 7.607 15.714 ( 0.579 -5.054 -5.803) 7.717 15.954 ( 1.369 -5.453 -3.974) 6.885 16.072 ( -2.630 1.352 4.604) 5.472 16.234 ( -5.421 -2.718 8.672) 10.583 16.365 ( -0.865 3.655 -0.675) 3.816 16.621 ( -1.823 -2.382 -5.360) 6.142 18.149 ( 7.890 -0.874 0.025) 7.938 18.231 ( 11.112 -3.223 -4.562) 12.437 18.424 ( 8.935 1.217 -1.485) 9.139 18.572 ( 8.138 -2.494 2.635) 8.910 27.678 ( 0.656 0.341 -0.815) 1.101 27.790 ( 0.109 -0.763 -1.335) 1.542 27.862 ( 0.935 -1.042 -1.127) 1.797 27.945 ( -0.298 -1.509 -3.193) 3.544 28.933 ( 0.115 0.718 -3.419) 3.495 29.025 ( -0.998 -0.706 -0.051) 1.224 29.331 ( -0.705 7.827 -7.559) 10.904 29.618 ( -2.203 -3.152 -5.924) 7.063 29.870 ( -6.363 8.415 2.485) 10.839 30.150 ( -7.953 1.145 0.698) 8.065 30.667 ( 0.317 13.936 8.226) 16.186 30.946 ( -5.771 -1.161 -0.923) 5.958 31.237 ( -3.861 -3.483 1.725) 5.479 31.768 ( 10.357 -2.100 12.688) 16.512 32.311 ( 10.610 8.448 -5.859) 14.774 33.556 ( 10.375 -21.132 2.247) 23.648 ======================= Grid point 26 (17/168) ======================= q-point: ( 0.40 0.29 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.430 ( 7.110 8.782 10.958) 15.740 2.671 ( 8.859 16.609 6.526) 19.923 2.816 ( 11.915 3.282 2.181) 12.549 2.909 ( 0.213 3.065 -1.772) 3.547 3.144 ( -1.900 7.082 -6.572) 9.846 3.440 ( 9.796 1.198 -1.621) 10.001 3.547 ( -2.039 1.873 -6.201) 6.791 3.901 ( 5.260 7.088 0.472) 8.839 4.034 ( -4.362 2.186 4.557) 6.677 4.123 ( -3.729 3.298 1.351) 5.159 4.306 ( 5.041 -11.926 0.108) 12.948 4.472 ( -2.265 -15.542 -0.466) 15.713 4.631 ( 9.581 9.612 2.287) 13.762 4.864 ( 0.026 6.568 -0.659) 6.601 4.903 ( -0.112 8.103 7.935) 11.342 5.173 ( 7.785 -4.028 -6.639) 10.996 5.414 ( 4.635 -12.277 -1.852) 13.253 5.470 ( 0.084 -11.311 -0.857) 11.344 5.822 ( 2.537 -7.597 2.112) 8.283 5.884 ( 0.744 0.437 1.246) 1.515 6.050 ( -3.438 8.070 0.166) 8.774 6.135 ( 0.475 7.189 -3.397) 7.965 6.549 ( 5.960 -3.768 6.738) 9.753 6.611 ( -2.902 -3.175 -4.761) 6.417 6.818 ( 7.457 -0.687 7.097) 10.317 6.866 ( 3.915 0.794 2.204) 4.563 7.131 ( 0.627 7.169 -1.042) 7.272 7.326 ( 5.838 4.155 -0.016) 7.165 7.559 ( 0.359 7.613 1.054) 7.694 7.917 ( -3.825 5.413 0.107) 6.629 7.983 ( 1.800 1.310 5.323) 5.770 8.286 ( -1.943 2.207 -4.579) 5.442 8.364 ( -4.021 -1.648 -5.294) 6.850 8.663 ( 4.287 -3.497 -0.214) 5.537 9.035 ( -2.792 -2.706 6.482) 7.558 9.167 ( 3.850 -0.958 -0.096) 3.968 11.144 ( -0.728 2.643 -1.943) 3.360 11.321 ( -2.206 3.952 4.005) 6.043 11.493 ( 0.082 -4.449 -2.075) 4.910 11.763 ( -2.115 -5.721 0.895) 6.165 13.416 ( -1.567 -1.311 -2.390) 3.144 13.516 ( -9.042 -3.565 -2.363) 10.003 13.851 ( -5.735 4.908 -1.541) 7.704 14.164 ( -5.860 -3.890 -1.243) 7.143 15.281 ( 0.707 5.013 -1.627) 5.318 15.480 ( -0.110 7.136 -0.835) 7.186 15.668 ( 0.553 -5.227 -3.563) 6.350 15.931 ( 0.503 -5.015 -2.315) 5.546 16.090 ( -0.257 1.627 2.199) 2.748 16.244 ( -3.537 -2.342 4.595) 6.254 16.363 ( -0.010 2.047 1.883) 2.781 16.534 ( -1.282 -1.779 -5.226) 5.667 18.248 ( 4.321 -0.802 0.339) 4.408 18.322 ( 5.951 -2.734 -2.910) 7.166 18.514 ( 4.324 2.912 -0.665) 5.256 18.694 ( 4.420 -2.715 1.404) 5.374 27.686 ( 0.830 -0.982 -0.155) 1.295 27.774 ( -0.246 -1.395 -1.092) 1.789 27.868 ( 0.466 -0.543 0.276) 0.767 27.909 ( 0.131 -0.574 -2.900) 2.959 28.902 ( 0.091 0.749 -2.134) 2.263 29.009 ( -0.808 -1.153 -0.043) 1.409 29.279 ( 0.695 6.140 -2.670) 6.731 29.541 ( -1.237 -3.617 -2.997) 4.858 29.823 ( -2.610 7.527 1.204) 8.057 30.056 ( -4.605 0.568 0.361) 4.654 30.744 ( -0.146 14.083 4.729) 14.856 30.847 ( -3.823 0.294 -1.931) 4.293 31.209 ( -1.685 -3.455 0.905) 3.950 32.044 ( 6.681 -7.580 11.279) 15.143 32.362 ( 5.248 13.231 -7.000) 15.862 33.686 ( 4.474 -17.924 0.959) 18.499 ======================= Grid point 27 (18/168) ======================= q-point: (-0.50 0.29 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 147 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.558 ( -0.000 7.679 0.000) 7.679 2.817 ( -0.000 11.525 0.000) 11.525 2.860 ( 0.000 9.899 0.000) 9.899 2.980 ( -0.000 -2.704 -0.000) 2.704 3.039 ( 0.000 11.573 0.000) 11.573 3.491 ( 0.000 2.254 0.000) 2.254 3.501 ( 0.000 0.658 0.000) 0.658 3.967 ( -0.000 9.720 0.000) 9.720 4.002 ( 0.000 1.781 -0.000) 1.781 4.102 ( 0.000 3.537 0.000) 3.537 4.337 ( 0.000 -12.070 -0.000) 12.070 4.448 ( 0.000 -20.170 0.000) 20.170 4.716 ( 0.000 8.920 0.000) 8.920 4.855 ( 0.000 5.552 -0.000) 5.552 4.948 ( 0.000 12.209 -0.000) 12.209 5.190 ( 0.000 -3.513 0.000) 3.513 5.443 ( 0.000 -12.057 0.000) 12.057 5.467 ( 0.000 -14.598 0.000) 14.598 5.851 ( 0.000 -7.072 -0.000) 7.072 5.893 ( -0.000 3.971 0.000) 3.971 5.990 ( 0.000 5.309 0.000) 5.309 6.155 ( 0.000 7.401 0.000) 7.401 6.561 ( 0.000 -3.651 0.000) 3.651 6.644 ( 0.000 -4.450 0.000) 4.450 6.938 ( 0.000 -0.952 0.000) 0.952 6.941 ( 0.000 0.367 -0.000) 0.367 7.122 ( 0.000 9.430 0.000) 9.430 7.371 ( 0.000 4.999 0.000) 4.999 7.569 ( 0.000 7.786 0.000) 7.786 7.885 ( 0.000 4.414 0.000) 4.414 8.070 ( 0.000 1.626 0.000) 1.626 8.135 ( 0.000 8.942 0.000) 8.942 8.340 ( 0.000 -8.728 0.000) 8.728 8.703 ( 0.000 -2.973 0.000) 2.973 9.052 ( 0.000 -0.468 0.000) 0.468 9.199 ( 0.000 -1.804 0.000) 1.804 11.125 ( 0.000 3.844 0.000) 3.844 11.329 ( 0.000 5.121 0.000) 5.121 11.481 ( 0.000 -5.954 0.000) 5.954 11.750 ( 0.000 -6.982 0.000) 6.982 13.404 ( -0.000 -1.845 0.000) 1.845 13.414 ( 0.000 -3.024 0.000) 3.024 13.796 ( 0.000 5.070 0.000) 5.070 14.110 ( 0.000 -3.812 0.000) 3.812 15.278 ( 0.000 4.507 0.000) 4.507 15.475 ( 0.000 6.993 0.000) 6.993 15.652 ( 0.000 -5.310 0.000) 5.310 15.921 ( 0.000 -4.793 0.000) 4.793 16.103 ( 0.000 1.475 0.000) 1.475 16.238 ( 0.000 -1.524 0.000) 1.524 16.386 ( 0.000 0.586 0.000) 0.586 16.484 ( 0.000 -1.262 0.000) 1.262 18.285 ( 0.000 -0.845 0.000) 0.845 18.352 ( 0.000 -2.492 0.000) 2.492 18.544 ( 0.000 3.566 0.000) 3.566 18.737 ( 0.000 -2.810 0.000) 2.810 27.693 ( 0.000 -1.721 0.000) 1.721 27.764 ( 0.000 -1.310 0.000) 1.310 27.882 ( 0.000 0.024 0.000) 0.024 27.884 ( 0.000 -0.685 -0.000) 0.685 28.890 ( 0.000 0.835 0.000) 0.835 29.002 ( 0.000 -1.309 0.000) 1.309 29.273 ( 0.000 5.412 0.000) 5.412 29.513 ( 0.000 -3.610 0.000) 3.610 29.811 ( -0.000 7.269 0.000) 7.269 30.021 ( 0.000 0.457 0.000) 0.457 30.770 ( 0.000 14.208 0.000) 14.208 30.803 ( 0.000 0.327 0.000) 0.327 31.202 ( 0.000 -3.164 0.000) 3.164 32.185 ( 0.000 -18.804 0.000) 18.804 32.342 ( 0.000 24.128 0.000) 24.128 33.726 ( -0.000 -16.830 0.000) 16.830 ======================= Grid point 33 (19/168) ======================= q-point: ( 0.00 0.43 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( 0.000 23.845 0.000) 23.845 2.002 ( 0.000 26.014 0.000) 26.014 2.028 ( 0.000 -20.548 0.000) 20.548 2.448 ( 0.000 -17.162 0.000) 17.162 2.852 ( 0.000 7.230 0.000) 7.230 3.014 ( 0.000 -8.252 0.000) 8.252 3.437 ( 0.000 34.313 0.000) 34.313 3.569 ( 0.000 3.874 0.000) 3.874 3.667 ( 0.000 -4.460 0.000) 4.460 3.876 ( 0.000 -8.150 0.000) 8.150 3.889 ( 0.000 7.190 0.000) 7.190 4.028 ( 0.000 -6.029 0.000) 6.029 4.217 ( 0.000 -1.032 0.000) 1.032 4.312 ( 0.000 -9.961 0.000) 9.961 4.946 ( 0.000 1.553 0.000) 1.553 4.978 ( 0.000 -0.131 0.000) 0.131 5.271 ( 0.000 3.949 0.000) 3.949 5.295 ( 0.000 2.046 0.000) 2.046 5.596 ( 0.000 -5.544 0.000) 5.544 5.622 ( 0.000 -8.131 0.000) 8.131 5.943 ( 0.000 5.878 0.000) 5.878 6.064 ( 0.000 -5.216 0.000) 5.216 6.677 ( 0.000 5.672 0.000) 5.672 6.749 ( 0.000 -1.537 0.000) 1.537 6.978 ( 0.000 9.406 0.000) 9.406 7.089 ( 0.000 5.822 0.000) 5.822 7.112 ( 0.000 -3.492 0.000) 3.492 7.225 ( 0.000 -6.914 0.000) 6.914 7.511 ( 0.000 14.923 0.000) 14.923 7.868 ( 0.000 -16.413 0.000) 16.413 7.983 ( 0.000 0.573 0.000) 0.573 8.048 ( 0.000 -3.541 0.000) 3.541 8.381 ( 0.000 3.612 0.000) 3.612 8.452 ( 0.000 -3.047 0.000) 3.047 8.859 ( 0.000 1.770 0.000) 1.770 8.912 ( 0.000 -3.559 0.000) 3.559 11.129 ( 0.000 2.345 0.000) 2.345 11.212 ( 0.000 -5.616 0.000) 5.616 11.694 ( 0.000 6.634 0.000) 6.634 11.807 ( 0.000 -4.190 0.000) 4.190 13.940 ( 0.000 8.608 0.000) 8.608 14.124 ( 0.000 -9.040 0.000) 9.040 14.500 ( 0.000 8.209 0.000) 8.209 14.662 ( 0.000 -7.434 0.000) 7.434 15.581 ( 0.000 8.212 0.000) 8.212 15.739 ( 0.000 -6.262 0.000) 6.262 15.830 ( 0.000 -0.863 0.000) 0.863 15.854 ( 0.000 -2.557 0.000) 2.557 16.157 ( 0.000 4.586 0.000) 4.586 16.241 ( 0.000 -3.611 0.000) 3.611 16.548 ( 0.000 5.384 0.000) 5.384 16.656 ( 0.000 -5.065 0.000) 5.065 17.747 ( 0.000 3.216 0.000) 3.216 17.810 ( 0.000 -2.792 0.000) 2.792 18.063 ( 0.000 2.505 0.000) 2.505 18.111 ( 0.000 -2.180 0.000) 2.180 27.795 ( 0.000 0.515 0.000) 0.515 27.802 ( 0.000 0.800 0.000) 0.800 27.854 ( 0.000 2.260 0.000) 2.260 27.940 ( 0.000 -4.925 0.000) 4.925 29.034 ( 0.000 0.647 0.000) 0.647 29.046 ( 0.000 -0.370 0.000) 0.370 30.033 ( 0.000 3.607 0.000) 3.607 30.054 ( 0.000 1.565 0.000) 1.565 30.449 ( 0.000 7.259 0.000) 7.259 30.498 ( 0.000 9.796 0.000) 9.796 30.640 ( 0.000 -10.381 0.000) 10.381 30.695 ( 0.000 -8.544 0.000) 8.544 31.308 ( 0.000 1.015 0.000) 1.015 31.339 ( 0.000 -2.054 0.000) 2.054 32.010 ( 0.000 8.768 0.000) 8.768 32.190 ( 0.000 -8.714 0.000) 8.714 ======================= Grid point 34 (20/168) ======================= q-point: ( 0.10 0.43 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.772 ( 15.455 18.935 6.986) 25.421 2.099 ( 10.045 17.086 5.468) 20.560 2.141 ( 11.152 -9.838 -0.642) 14.885 2.503 ( 5.333 -15.141 3.801) 16.497 3.001 ( 13.828 6.631 2.425) 15.526 3.145 ( 14.340 -6.801 2.442) 16.058 3.503 ( 6.612 28.176 0.376) 28.944 3.574 ( 2.738 2.865 -2.175) 4.521 3.671 ( 2.677 -1.596 0.475) 3.153 3.911 ( 2.953 -6.835 1.131) 7.531 3.973 ( 8.248 6.593 3.140) 11.017 4.106 ( 3.537 -5.667 7.897) 10.344 4.234 ( -0.453 -0.576 3.633) 3.706 4.344 ( 2.353 -10.056 2.343) 10.590 4.933 ( 0.575 3.271 -1.901) 3.827 5.013 ( 1.553 -0.961 2.287) 2.927 5.227 ( -0.264 3.578 -5.067) 6.209 5.307 ( 0.315 -0.433 0.498) 0.731 5.580 ( -2.226 -4.183 1.082) 4.861 5.628 ( -2.392 -7.692 4.025) 9.005 5.951 ( 1.791 4.664 -0.083) 4.997 6.050 ( -0.558 -4.491 -0.379) 4.542 6.684 ( -0.354 5.357 1.003) 5.461 6.744 ( 0.210 -0.166 -1.485) 1.509 6.967 ( 0.243 8.548 -0.820) 8.591 7.087 ( -1.806 6.205 -0.416) 6.476 7.133 ( -0.265 -7.383 -0.985) 7.453 7.199 ( 1.729 -2.619 -3.375) 4.608 7.518 ( -0.041 12.775 2.211) 12.965 7.832 ( -3.910 -14.160 1.539) 14.771 7.969 ( -1.174 4.489 1.567) 4.897 8.070 ( 0.949 -4.754 0.921) 4.934 8.470 ( 9.337 0.466 -1.751) 9.511 8.518 ( 6.553 -3.518 1.914) 7.680 8.849 ( -0.519 1.662 -1.509) 2.304 8.899 ( -0.729 -3.374 0.936) 3.576 11.143 ( -0.021 2.118 2.290) 3.119 11.219 ( -0.852 -5.269 2.451) 5.873 11.686 ( -0.286 6.334 -1.229) 6.459 11.793 ( -1.015 -3.993 -0.944) 4.227 13.875 ( -6.878 8.183 -1.403) 10.781 14.050 ( -7.760 -8.595 -1.843) 11.726 14.436 ( -6.001 7.627 -2.194) 9.950 14.588 ( -7.003 -7.003 -2.615) 10.243 15.575 ( -0.761 8.090 -0.625) 8.150 15.720 ( 0.031 -4.178 -4.047) 5.817 15.787 ( 0.558 0.662 -7.684) 7.733 15.847 ( 2.795 -4.442 -4.556) 6.950 16.120 ( -9.369 4.527 8.879) 13.678 16.211 ( -8.847 -4.267 7.713) 12.488 16.537 ( 0.768 5.705 -3.052) 6.515 16.653 ( 1.276 -5.401 -3.089) 6.352 17.833 ( 11.286 1.439 -2.248) 11.598 17.874 ( 9.067 -2.216 -2.046) 9.555 18.134 ( 7.526 2.360 1.408) 8.012 18.182 ( 7.294 -2.238 1.570) 7.790 27.769 ( -0.937 1.965 -1.946) 2.920 27.800 ( 0.002 -0.953 -1.177) 1.514 27.860 ( 0.611 2.185 -0.101) 2.272 27.935 ( -0.156 -4.397 -0.590) 4.439 29.025 ( -0.066 0.883 -1.611) 1.838 29.041 ( -0.078 -0.584 -0.833) 1.021 29.873 ( -4.078 3.786 -15.539) 16.505 29.926 ( -2.867 -1.115 -15.764) 16.061 30.395 ( -13.910 8.913 -0.179) 16.521 30.456 ( -8.725 2.952 2.142) 9.456 30.627 ( -4.612 2.767 14.460) 15.428 30.762 ( 3.113 -10.052 10.672) 14.987 31.325 ( -1.235 0.439 1.975) 2.370 31.330 ( -1.770 -0.422 2.617) 3.187 32.157 ( 15.275 10.261 -0.062) 18.401 32.416 ( 21.261 -14.927 4.836) 26.424 ======================= Grid point 35 (21/168) ======================= q-point: ( 0.20 0.43 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.078 ( 10.910 13.704 9.999) 20.169 2.315 ( 12.226 -8.712 0.003) 15.013 2.413 ( 18.190 15.190 6.478) 24.568 2.680 ( 10.465 -10.033 3.256) 14.859 3.236 ( 14.015 10.235 -1.619) 17.429 3.419 ( 13.782 -7.176 0.678) 15.553 3.508 ( 0.166 10.655 -4.238) 11.468 3.674 ( 6.272 -5.843 1.110) 8.644 3.842 ( 13.419 9.679 4.719) 17.205 3.976 ( 4.488 -1.024 -0.210) 4.608 4.195 ( 13.977 5.944 3.929) 15.688 4.268 ( -1.097 0.539 6.304) 6.422 4.308 ( 5.506 -3.523 12.951) 14.507 4.431 ( 5.412 -9.889 1.005) 11.318 4.934 ( 1.767 5.023 0.368) 5.337 5.063 ( 1.617 -0.038 1.892) 2.489 5.184 ( 3.421 0.923 -5.446) 6.497 5.325 ( 2.498 -5.308 -0.932) 5.940 5.578 ( -1.651 -1.010 5.270) 5.614 5.646 ( -1.486 -6.194 5.275) 8.271 6.012 ( 4.675 2.442 1.907) 5.608 6.067 ( 2.382 -3.299 1.533) 4.348 6.659 ( -1.531 4.955 -3.396) 6.199 6.714 ( 0.468 0.909 -4.515) 4.629 6.950 ( -7.331 4.973 -4.833) 10.091 6.977 ( -6.118 4.006 0.007) 7.313 7.127 ( 3.303 -3.896 -0.966) 5.198 7.158 ( -0.257 -3.775 -3.260) 4.994 7.598 ( 4.557 11.858 4.656) 13.530 7.811 ( -2.441 -6.309 4.403) 8.072 8.007 ( 1.440 4.897 4.013) 6.493 8.123 ( 3.005 -5.024 3.560) 6.851 8.535 ( 5.340 0.781 -6.638) 8.555 8.634 ( 4.572 -9.514 -2.931) 10.955 8.834 ( 1.098 6.160 1.893) 6.538 8.947 ( 2.639 -4.862 4.077) 6.873 11.174 ( -0.009 1.791 2.878) 3.390 11.239 ( -1.603 -4.435 4.192) 6.309 11.654 ( -1.217 5.846 -2.532) 6.486 11.756 ( -2.160 -4.003 -1.141) 4.690 13.716 ( -9.830 6.421 -2.454) 11.995 13.859 ( -12.163 -7.228 -3.173) 14.500 14.283 ( -9.180 6.298 -3.038) 11.540 14.411 ( -10.354 -6.015 -3.418) 12.452 15.525 ( -1.433 7.796 -4.886) 9.311 15.662 ( 0.286 -3.419 -5.623) 6.587 15.702 ( -0.167 4.354 -6.260) 7.627 15.837 ( 2.155 -6.951 -4.189) 8.397 16.099 ( -6.520 2.987 9.099) 11.586 16.171 ( -8.452 -3.746 9.735) 13.425 16.503 ( 0.072 5.726 -4.013) 6.993 16.617 ( -0.229 -5.203 -4.470) 6.863 17.997 ( 11.759 0.242 -1.947) 11.922 18.021 ( 13.051 -2.056 -3.620) 13.699 18.299 ( 10.613 2.120 1.218) 10.891 18.346 ( 10.069 -2.392 2.161) 10.573 27.732 ( -0.602 2.391 -2.159) 3.277 27.779 ( -0.101 -2.035 -2.131) 2.949 27.866 ( 0.573 1.889 -0.511) 2.039 27.923 ( -0.066 -3.258 -1.206) 3.475 28.997 ( -0.230 1.402 -2.697) 3.048 29.024 ( -0.418 -1.132 -1.376) 1.830 29.629 ( -3.486 4.732 -14.518) 15.662 29.705 ( -3.282 -2.753 -12.612) 13.320 30.179 ( -13.480 8.534 2.548) 16.157 30.291 ( -11.849 -2.098 1.022) 12.077 30.778 ( 0.364 8.729 13.190) 15.822 30.916 ( -1.368 -5.373 10.180) 11.592 31.281 ( -2.148 2.759 -1.046) 3.650 31.395 ( 3.856 -6.844 4.410) 9.009 32.419 ( 16.521 16.613 0.567) 23.436 32.810 ( 19.589 -21.276 4.787) 29.314 ======================= Grid point 36 (22/168) ======================= q-point: ( 0.30 0.43 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.355 ( 9.014 10.072 11.394) 17.679 2.527 ( 11.450 -6.151 4.247) 13.674 2.738 ( 13.957 10.132 4.952) 17.944 2.867 ( 9.159 -2.856 1.908) 9.782 3.391 ( 7.582 8.962 -1.812) 11.878 3.444 ( 4.781 9.644 -9.592) 14.417 3.574 ( 5.092 -3.171 -1.199) 6.117 3.729 ( -1.049 -13.352 2.534) 13.630 4.017 ( 2.905 2.398 0.396) 3.788 4.049 ( 7.255 -2.142 -2.853) 8.085 4.296 ( -0.196 8.884 2.672) 9.280 4.432 ( -2.255 -3.177 0.630) 3.947 4.502 ( 13.302 3.528 8.254) 16.048 4.626 ( 12.251 -7.085 9.521) 17.056 5.016 ( 4.376 4.863 2.387) 6.964 5.099 ( 1.603 2.033 0.194) 2.596 5.199 ( 6.088 -0.963 -6.711) 9.112 5.344 ( 1.291 -7.886 -2.005) 8.239 5.667 ( 2.545 1.155 7.986) 8.461 5.724 ( 4.192 -3.938 5.144) 7.716 6.125 ( 5.483 1.928 2.684) 6.402 6.168 ( 5.965 -3.319 4.119) 7.973 6.541 ( -6.100 5.686 -7.404) 11.152 6.651 ( -1.482 -4.023 -7.003) 8.211 6.768 ( -5.202 5.446 0.260) 7.536 6.846 ( -5.189 -1.846 -0.796) 5.565 7.189 ( 4.631 1.948 0.727) 5.077 7.227 ( 7.126 -1.637 1.209) 7.411 7.706 ( 2.365 10.178 3.431) 10.998 7.861 ( 0.877 -3.968 5.430) 6.782 8.073 ( 0.048 7.429 4.052) 8.463 8.215 ( 1.921 -4.570 3.639) 6.150 8.514 ( 2.184 -0.560 -6.408) 6.793 8.579 ( -1.237 -5.996 -6.971) 9.278 8.928 ( 3.174 4.168 5.492) 7.590 9.041 ( 3.564 -5.020 2.730) 6.735 11.201 ( -0.094 2.368 1.924) 3.052 11.268 ( -1.554 -3.853 5.455) 6.857 11.589 ( -2.346 5.535 -3.701) 7.059 11.701 ( -3.244 -5.007 -1.138) 6.074 13.539 ( -8.366 3.486 -2.748) 9.471 13.629 ( -11.559 -5.073 -3.336) 13.057 14.102 ( -9.131 5.581 -2.697) 11.036 14.215 ( -9.570 -5.342 -2.658) 11.278 15.450 ( -0.017 7.584 -5.343) 9.277 15.596 ( 0.264 -6.495 -6.024) 8.863 15.657 ( -0.001 7.921 -2.322) 8.254 15.817 ( 0.576 -7.592 -2.826) 8.122 16.112 ( -3.448 2.524 6.491) 7.771 16.172 ( -4.633 -3.155 7.799) 9.605 16.455 ( -0.365 4.854 -3.592) 6.049 16.551 ( -1.046 -4.317 -4.852) 6.578 18.144 ( 9.084 0.482 -1.193) 9.174 18.171 ( 10.653 -2.233 -3.214) 11.349 18.465 ( 8.737 2.430 0.591) 9.088 18.518 ( 8.397 -2.680 1.762) 8.989 27.704 ( -0.083 2.016 -1.717) 2.649 27.753 ( -0.127 -2.476 -2.053) 3.219 27.868 ( 0.508 1.448 -0.504) 1.615 27.907 ( 0.131 -2.074 -1.573) 2.606 28.961 ( -0.279 1.815 -2.692) 3.258 28.999 ( -0.683 -1.716 -1.426) 2.333 29.461 ( -1.400 5.115 -8.245) 9.804 29.550 ( -1.863 -3.712 -7.639) 8.695 30.040 ( -8.019 7.199 1.987) 10.958 30.140 ( -8.486 -2.519 0.772) 8.885 30.887 ( -3.192 5.409 8.269) 10.383 30.935 ( -5.465 -0.451 4.748) 7.254 31.265 ( 1.799 8.951 -0.512) 9.145 31.547 ( 7.152 -15.379 5.444) 17.813 32.653 ( 12.095 21.251 0.566) 24.459 33.106 ( 12.481 -22.484 3.080) 25.899 ======================= Grid point 37 (23/168) ======================= q-point: ( 0.40 0.43 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.598 ( 6.222 7.743 8.649) 13.171 2.742 ( 7.428 -5.874 5.795) 11.103 2.943 ( 6.842 7.890 2.500) 10.738 3.001 ( 5.455 2.256 1.363) 6.059 3.365 ( 0.785 12.907 -6.603) 14.519 3.501 ( 7.425 1.953 -5.302) 9.330 3.564 ( -1.469 1.514 -2.210) 3.055 3.760 ( -0.410 -15.421 4.776) 16.149 4.024 ( -0.740 -0.191 -1.273) 1.485 4.091 ( 1.842 -7.198 -0.582) 7.453 4.315 ( 0.463 8.854 0.225) 8.869 4.371 ( -3.081 1.383 -1.443) 3.673 4.749 ( 7.324 4.084 5.086) 9.808 4.884 ( 6.700 -8.544 7.806) 13.373 5.032 ( -2.263 7.066 -0.133) 7.421 5.135 ( 3.397 1.258 -3.196) 4.830 5.205 ( 2.975 -4.186 -4.349) 6.730 5.313 ( -0.755 -7.204 -3.324) 7.970 5.788 ( 4.088 3.574 2.903) 6.157 5.861 ( 5.075 -2.201 3.513) 6.553 6.199 ( 0.131 4.900 -1.493) 5.124 6.234 ( -0.014 1.814 -0.481) 1.877 6.460 ( 2.326 -2.207 0.924) 3.337 6.521 ( -4.100 -5.630 -3.019) 7.591 6.833 ( 5.462 2.048 5.173) 7.796 6.866 ( 4.240 -0.781 2.866) 5.177 7.269 ( 4.148 5.994 0.869) 7.341 7.354 ( 6.292 -1.690 1.723) 6.739 7.752 ( 0.183 10.069 1.681) 10.210 7.916 ( -0.455 -5.083 1.859) 5.432 8.088 ( -2.545 7.655 3.149) 8.660 8.228 ( -2.961 -5.412 -0.270) 6.175 8.419 ( -2.096 5.136 -7.116) 9.022 8.556 ( 2.780 -7.246 -0.502) 7.777 9.023 ( 1.599 2.528 4.004) 4.998 9.108 ( 2.468 -4.483 0.643) 5.158 11.218 ( 0.055 4.471 1.349) 4.671 11.315 ( -0.359 -4.403 5.287) 6.890 11.504 ( -2.375 5.363 -4.192) 7.209 11.634 ( -3.164 -6.674 -1.272) 7.495 13.410 ( -4.256 0.854 -1.934) 4.753 13.449 ( -7.061 -2.768 -2.032) 7.852 13.959 ( -5.536 5.559 -1.502) 7.988 14.070 ( -5.625 -5.173 -1.369) 7.763 15.408 ( 0.488 6.913 -2.854) 7.495 15.547 ( 0.684 -6.385 -3.705) 7.414 15.636 ( -0.294 7.807 -0.951) 7.871 15.797 ( 0.055 -7.593 -1.448) 7.730 16.135 ( -1.277 2.587 3.687) 4.681 16.190 ( -2.190 -2.763 4.381) 5.624 16.418 ( -0.202 3.169 -1.735) 3.618 16.484 ( -0.823 -3.029 -3.982) 5.070 18.245 ( 4.927 0.555 -0.515) 4.985 18.271 ( 5.739 -1.995 -1.825) 6.344 18.575 ( 4.648 2.959 0.243) 5.515 18.635 ( 4.531 -2.954 0.920) 5.487 27.690 ( 0.142 1.319 -0.919) 1.614 27.731 ( -0.120 -2.428 -1.231) 2.725 27.872 ( 0.349 0.809 0.021) 0.881 27.892 ( 0.168 -0.991 -1.424) 1.743 28.932 ( -0.149 1.997 -1.635) 2.585 28.975 ( -0.514 -2.046 -0.884) 2.287 29.387 ( -0.086 4.448 -3.427) 5.616 29.467 ( -0.735 -3.628 -3.490) 5.087 29.968 ( -3.582 5.860 1.017) 6.942 30.047 ( -4.362 -1.888 0.375) 4.767 30.863 ( -4.205 2.397 1.256) 5.000 30.914 ( -3.512 -0.567 3.364) 4.897 31.310 ( 2.811 15.453 0.638) 15.719 31.700 ( 4.808 -20.199 3.681) 21.087 32.800 ( 6.110 23.836 0.225) 24.607 33.274 ( 5.914 -22.059 1.474) 22.886 ======================= Grid point 38 (24/168) ======================= q-point: (-0.50 0.43 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 147 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.704 ( -0.000 6.923 0.000) 6.923 2.842 ( 0.000 -6.299 0.000) 6.299 3.012 ( 0.000 7.485 0.000) 7.485 3.058 ( 0.000 3.669 0.000) 3.669 3.323 ( 0.000 13.985 0.000) 13.985 3.499 ( 0.000 -2.250 0.000) 2.250 3.560 ( 0.000 4.943 0.000) 4.943 3.791 ( 0.000 -17.610 0.000) 17.610 4.001 ( 0.000 1.169 0.000) 1.169 4.104 ( 0.000 -8.976 0.000) 8.976 4.318 ( 0.000 8.144 -0.000) 8.144 4.335 ( -0.000 3.635 0.000) 3.635 4.834 ( 0.000 4.572 0.000) 4.572 4.977 ( 0.000 -3.851 0.000) 3.851 5.021 ( 0.000 0.723 -0.000) 0.723 5.126 ( -0.000 5.234 0.000) 5.234 5.204 ( 0.000 -9.149 0.000) 9.149 5.280 ( 0.000 -6.872 0.000) 6.872 5.841 ( 0.000 5.200 0.000) 5.200 5.924 ( 0.000 -0.977 0.000) 0.977 6.161 ( 0.000 8.431 0.000) 8.431 6.241 ( 0.000 0.959 0.000) 0.959 6.468 ( 0.000 -4.324 0.000) 4.324 6.500 ( 0.000 -7.305 0.000) 7.305 6.928 ( 0.000 0.349 0.000) 0.349 6.940 ( 0.000 -0.396 0.000) 0.396 7.318 ( 0.000 8.687 0.000) 8.687 7.424 ( 0.000 -0.974 0.000) 0.974 7.761 ( 0.000 9.658 0.000) 9.658 7.904 ( 0.000 -3.157 0.000) 3.157 8.096 ( 0.000 1.567 0.000) 1.567 8.167 ( 0.000 -5.744 0.000) 5.744 8.364 ( 0.000 11.237 0.000) 11.237 8.583 ( 0.000 -9.015 0.000) 9.015 9.059 ( 0.000 2.069 0.000) 2.069 9.131 ( 0.000 -4.206 0.000) 4.206 11.229 ( 0.000 5.959 0.000) 5.959 11.355 ( 0.000 -6.237 0.000) 6.237 11.448 ( 0.000 6.593 0.000) 6.593 11.596 ( 0.000 -7.692 0.000) 7.692 13.373 ( -0.000 -0.969 0.000) 0.969 13.373 ( 0.000 -0.918 0.000) 0.918 13.906 ( 0.000 5.596 0.000) 5.596 14.018 ( 0.000 -5.156 0.000) 5.156 15.396 ( 0.000 6.593 0.000) 6.593 15.531 ( 0.000 -6.430 0.000) 6.430 15.628 ( 0.000 7.886 0.000) 7.886 15.789 ( 0.000 -7.585 0.000) 7.585 16.148 ( 0.000 2.522 0.000) 2.522 16.198 ( 0.000 -2.294 0.000) 2.294 16.410 ( 0.000 1.719 0.000) 1.719 16.450 ( 0.000 -2.001 0.000) 2.001 18.281 ( 0.000 0.538 0.000) 0.538 18.306 ( 0.000 -1.829 0.000) 1.829 18.613 ( 0.000 3.179 0.000) 3.179 18.676 ( 0.000 -3.060 0.000) 3.060 27.686 ( 0.000 0.957 0.000) 0.957 27.723 ( 0.000 -2.309 0.000) 2.309 27.879 ( 0.000 0.066 0.000) 0.066 27.881 ( 0.000 -0.104 -0.000) 0.104 28.921 ( 0.000 2.045 0.000) 2.045 28.966 ( 0.000 -2.130 0.000) 2.130 29.368 ( 0.000 4.018 0.000) 4.018 29.442 ( 0.000 -3.413 0.000) 3.413 29.946 ( 0.000 5.294 0.000) 5.294 30.014 ( 0.000 -1.500 0.000) 1.500 30.834 ( 0.000 2.900 0.000) 2.900 30.903 ( 0.000 -2.114 0.000) 2.114 31.339 ( 0.000 17.463 0.000) 17.463 31.761 ( 0.000 -21.838 0.000) 21.838 32.849 ( 0.000 24.728 0.000) 24.728 33.328 ( 0.000 -21.792 0.000) 21.792 ======================= Grid point 77 (25/168) ======================= q-point: ( 0.00 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.572 ( -7.610 0.000 29.601) 30.564 0.583 ( 12.668 0.000 28.157) 30.876 1.175 ( -13.982 0.000 59.675) 61.291 2.331 ( -4.928 0.000 -18.684) 19.323 2.693 ( -0.515 0.000 1.201) 1.307 2.915 ( -2.648 0.000 8.833) 9.222 3.094 ( 7.676 0.000 -0.710) 7.709 3.511 ( -2.125 0.000 -5.450) 5.850 3.727 ( 4.910 0.000 -8.073) 9.449 3.784 ( 6.211 0.000 3.048) 6.919 3.963 ( -1.395 0.000 4.644) 4.849 4.374 ( 0.038 0.000 2.143) 2.144 4.428 ( 2.752 0.000 1.868) 3.326 4.659 ( 4.340 0.000 2.199) 4.866 4.892 ( 3.143 0.000 5.791) 6.589 5.043 ( -1.533 0.000 1.853) 2.404 5.177 ( -2.389 0.000 0.642) 2.473 5.415 ( 1.773 0.000 -4.268) 4.621 5.804 ( 1.620 0.000 2.073) 2.631 5.904 ( -9.244 0.000 5.420) 10.716 5.988 ( 43.939 0.000 1.867) 43.979 6.141 ( 0.021 0.000 -4.205) 4.205 6.305 ( -14.834 0.000 -0.196) 14.835 6.676 ( 0.443 0.000 -0.799) 0.914 6.832 ( -1.362 0.000 7.596) 7.717 6.946 ( 1.172 0.000 -0.994) 1.537 7.081 ( -51.472 0.000 -0.079) 51.472 7.253 ( 1.424 0.000 -2.040) 2.488 7.548 ( -4.569 0.000 -7.135) 8.473 7.790 ( 39.375 0.000 -9.380) 40.477 7.883 ( -0.646 0.000 8.600) 8.624 7.946 ( 0.628 0.000 1.243) 1.392 8.435 ( 7.540 0.000 -1.492) 7.687 8.557 ( 10.700 0.000 -0.417) 10.708 8.688 ( -12.458 0.000 3.430) 12.922 9.536 ( -12.932 0.000 -4.649) 13.742 11.185 ( 2.208 0.000 -5.488) 5.915 11.278 ( 1.194 0.000 -2.882) 3.120 11.558 ( 0.179 0.000 4.092) 4.096 11.873 ( -0.324 0.000 1.793) 1.822 13.648 ( -1.136 0.000 0.692) 1.331 14.103 ( 0.417 0.000 -3.040) 3.069 14.461 ( -2.377 0.000 0.212) 2.387 14.857 ( 1.835 0.000 -4.992) 5.319 15.213 ( -3.011 0.000 -0.955) 3.159 15.287 ( 1.706 0.000 -0.515) 1.782 15.926 ( 0.338 0.000 -4.033) 4.047 16.063 ( 4.402 0.000 -12.625) 13.370 16.140 ( 0.004 0.000 4.736) 4.736 16.467 ( -10.421 0.000 5.740) 11.897 16.797 ( -0.713 0.000 -2.951) 3.036 16.883 ( 24.071 0.000 -2.004) 24.154 17.662 ( -22.707 0.000 1.448) 22.753 17.937 ( -6.462 0.000 4.322) 7.775 17.957 ( 0.143 0.000 0.055) 0.153 18.194 ( 2.901 0.000 0.717) 2.988 27.648 ( 0.475 0.000 -0.094) 0.485 27.714 ( 3.615 0.000 -0.926) 3.731 27.876 ( -0.362 0.000 -1.561) 1.602 28.102 ( -1.346 0.000 -3.324) 3.586 28.853 ( 0.701 0.000 0.463) 0.840 28.958 ( 1.065 0.000 -2.982) 3.166 29.101 ( -3.887 0.000 4.017) 5.590 29.895 ( 1.039 0.000 -8.501) 8.564 29.899 ( 0.957 0.000 5.016) 5.107 30.273 ( -1.212 0.000 6.100) 6.220 31.003 ( -1.940 0.000 0.804) 2.100 31.155 ( -80.683 0.000 2.238) 80.714 31.212 ( 1.487 0.000 0.276) 1.512 31.425 ( 5.648 0.000 -4.144) 7.005 32.052 ( -8.754 0.000 7.484) 11.517 32.948 ( 80.860 0.000 -1.819) 80.880 ======================= Grid point 78 (26/168) ======================= q-point: ( 0.10 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.918 ( 9.583 0.000 23.783) 25.641 1.316 ( 30.923 0.000 21.979) 37.938 1.752 ( 12.832 0.000 39.581) 41.609 2.123 ( 7.843 0.000 -20.459) 21.911 2.764 ( 6.307 0.000 0.629) 6.339 3.037 ( 8.211 0.000 5.883) 10.101 3.304 ( 12.777 0.000 -2.792) 13.078 3.498 ( 8.857 0.000 2.602) 9.232 3.715 ( 3.918 0.000 -6.154) 7.296 3.944 ( 7.972 0.000 3.914) 8.881 3.992 ( -3.385 0.000 0.775) 3.472 4.323 ( -0.502 0.000 -1.572) 1.650 4.587 ( 4.936 0.000 7.826) 9.253 4.790 ( 4.489 0.000 6.476) 7.880 5.003 ( -8.109 0.000 6.862) 10.622 5.052 ( 8.732 0.000 5.346) 10.239 5.196 ( 2.772 0.000 0.970) 2.936 5.408 ( 0.852 0.000 0.189) 0.873 5.809 ( -5.080 0.000 -1.959) 5.445 5.891 ( 0.083 0.000 8.334) 8.335 6.073 ( -1.900 0.000 -3.716) 4.173 6.079 ( -5.907 0.000 4.099) 7.190 6.376 ( 13.568 0.000 -5.353) 14.586 6.669 ( -0.349 0.000 -0.758) 0.834 6.788 ( -2.781 0.000 0.868) 2.913 6.899 ( -2.120 0.000 8.164) 8.435 6.929 ( -3.445 0.000 -1.855) 3.913 7.224 ( -2.554 0.000 -6.769) 7.235 7.376 ( -3.122 0.000 -6.082) 6.837 7.918 ( 1.919 0.000 -5.010) 5.365 7.994 ( 1.100 0.000 11.772) 11.823 8.025 ( 13.104 0.000 -15.615) 20.385 8.486 ( -12.757 0.000 4.584) 13.556 8.540 ( 5.711 0.000 -5.520) 7.942 8.805 ( 14.834 0.000 -0.493) 14.842 9.378 ( -1.976 0.000 -5.689) 6.022 11.160 ( 2.452 0.000 -5.662) 6.170 11.255 ( 0.495 0.000 -3.380) 3.416 11.617 ( 0.134 0.000 5.397) 5.398 11.884 ( -1.079 0.000 2.373) 2.607 13.603 ( -4.338 0.000 0.328) 4.350 14.049 ( -2.464 0.000 -4.333) 4.984 14.355 ( -10.301 0.000 -0.695) 10.324 14.757 ( -6.814 0.000 -5.050) 8.482 15.144 ( -2.508 0.000 -2.265) 3.380 15.322 ( 2.156 0.000 0.015) 2.156 15.870 ( -0.666 0.000 -4.998) 5.043 15.981 ( 3.674 0.000 -12.311) 12.847 16.206 ( 0.607 0.000 6.089) 6.120 16.286 ( -15.353 0.000 4.916) 16.120 16.732 ( -1.966 0.000 -4.590) 4.993 16.733 ( -18.466 0.000 10.924) 21.455 17.947 ( 16.962 0.000 -5.214) 17.746 17.998 ( 17.547 0.000 -4.509) 18.117 18.004 ( 5.418 0.000 0.195) 5.421 18.311 ( 9.050 0.000 2.262) 9.328 27.668 ( 1.769 0.000 0.376) 1.809 27.740 ( 2.265 0.000 -2.428) 3.320 27.860 ( 1.079 0.000 -2.145) 2.401 28.030 ( -1.349 0.000 -5.345) 5.513 28.887 ( 2.424 0.000 1.018) 2.629 28.953 ( 2.715 0.000 -5.185) 5.853 29.092 ( -3.232 0.000 3.859) 5.033 29.804 ( -0.318 0.000 -8.032) 8.038 29.937 ( -6.953 0.000 7.518) 10.240 30.283 ( -4.690 0.000 3.751) 6.005 30.426 ( -29.215 0.000 15.871) 33.248 31.158 ( 8.580 0.000 5.016) 9.939 31.185 ( -4.646 0.000 -0.720) 4.702 31.482 ( 2.842 0.000 1.059) 3.033 32.055 ( 1.654 0.000 3.865) 4.204 33.661 ( 35.527 0.000 -18.143) 39.892 ======================= Grid point 79 (27/168) ======================= q-point: ( 0.20 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.355 ( 14.677 0.000 18.160) 23.349 1.944 ( 12.931 0.000 28.541) 31.334 2.134 ( 18.281 0.000 -12.971) 22.415 2.383 ( 28.522 0.000 9.050) 29.924 2.881 ( 9.617 0.000 -1.679) 9.762 3.289 ( 15.365 0.000 4.024) 15.884 3.339 ( 4.298 0.000 -3.004) 5.244 3.622 ( -7.574 0.000 -9.191) 11.910 3.806 ( 12.273 0.000 3.463) 12.752 3.928 ( 0.233 0.000 -1.671) 1.687 4.168 ( 16.365 0.000 6.894) 17.758 4.301 ( -4.457 0.000 1.902) 4.845 4.734 ( 5.709 0.000 2.309) 6.158 4.862 ( -7.332 0.000 6.571) 9.846 5.003 ( 1.139 0.000 6.105) 6.211 5.210 ( 6.212 0.000 -2.625) 6.744 5.275 ( 4.296 0.000 2.189) 4.822 5.483 ( 3.222 0.000 8.868) 9.435 5.723 ( 2.037 0.000 -8.431) 8.674 5.952 ( -2.327 0.000 7.583) 7.932 6.025 ( -0.209 0.000 -0.875) 0.900 6.191 ( 9.890 0.000 5.414) 11.275 6.486 ( 8.256 0.000 -3.673) 9.037 6.647 ( -1.334 0.000 -0.706) 1.509 6.762 ( -12.263 0.000 -3.235) 12.682 6.821 ( 5.447 0.000 -0.491) 5.469 6.955 ( -0.757 0.000 6.389) 6.434 6.999 ( -7.632 0.000 -12.475) 14.624 7.376 ( 3.492 0.000 0.528) 3.532 7.864 ( 0.778 0.000 -7.166) 7.208 8.039 ( 6.819 0.000 -8.660) 11.022 8.189 ( 1.283 0.000 12.734) 12.798 8.308 ( -7.725 0.000 2.183) 8.028 8.615 ( 6.337 0.000 -1.689) 6.558 8.951 ( 6.222 0.000 -1.843) 6.490 9.302 ( -0.854 0.000 -4.170) 4.257 11.125 ( 1.371 0.000 -5.686) 5.849 11.219 ( 0.149 0.000 -3.636) 3.639 11.675 ( -0.840 0.000 5.135) 5.203 11.898 ( -0.757 0.000 2.486) 2.599 13.537 ( -4.097 0.000 0.118) 4.099 13.912 ( -7.543 0.000 -5.880) 9.564 14.147 ( -14.777 0.000 -0.246) 14.779 14.561 ( -10.832 0.000 -3.672) 11.438 15.114 ( 1.783 0.000 -1.131) 2.111 15.335 ( -0.426 0.000 -0.503) 0.659 15.804 ( -0.278 0.000 -4.734) 4.742 15.911 ( 3.736 0.000 -9.382) 10.098 16.150 ( -8.119 0.000 2.964) 8.643 16.294 ( 1.054 0.000 6.761) 6.843 16.602 ( -13.439 0.000 8.279) 15.784 16.637 ( -2.443 0.000 -5.664) 6.168 18.090 ( 8.274 0.000 1.473) 8.404 18.113 ( 7.630 0.000 0.168) 7.632 18.216 ( 16.982 0.000 -9.037) 19.237 18.496 ( 10.442 0.000 2.250) 10.682 27.708 ( 2.516 0.000 0.633) 2.595 27.745 ( 1.379 0.000 -1.334) 1.919 27.862 ( 1.991 0.000 -1.742) 2.646 27.946 ( -1.147 0.000 -5.694) 5.808 28.921 ( 1.027 0.000 -4.932) 5.038 28.947 ( 3.554 0.000 1.063) 3.709 29.089 ( -3.158 0.000 4.192) 5.248 29.712 ( -0.575 0.000 -6.480) 6.505 29.857 ( -13.216 0.000 8.865) 15.914 30.220 ( -6.659 0.000 1.419) 6.808 30.334 ( -4.929 0.000 7.716) 9.156 31.069 ( -6.828 0.000 -2.980) 7.450 31.370 ( 10.080 0.000 5.310) 11.393 31.503 ( -4.487 0.000 4.670) 6.477 32.197 ( 11.410 0.000 1.932) 11.573 33.876 ( 17.632 0.000 -12.816) 21.797 ======================= Grid point 80 (28/168) ======================= q-point: ( 0.30 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.769 ( 15.132 0.000 13.533) 20.301 2.367 ( 2.929 0.000 22.865) 23.052 2.369 ( 19.369 0.000 -0.774) 19.385 2.747 ( 15.760 0.000 -4.801) 16.475 3.009 ( 8.217 0.000 -2.776) 8.673 3.331 ( -9.571 0.000 -13.289) 16.377 3.499 ( 17.519 0.000 2.359) 17.677 3.533 ( 8.909 0.000 1.198) 8.989 3.895 ( 0.061 0.000 0.582) 0.585 3.946 ( 1.175 0.000 1.464) 1.877 4.239 ( -4.155 0.000 0.549) 4.191 4.525 ( 16.655 0.000 2.092) 16.786 4.777 ( -7.594 0.000 1.657) 7.773 4.787 ( 1.938 0.000 -3.331) 3.854 5.126 ( 4.256 0.000 6.151) 7.479 5.203 ( -0.089 0.000 -3.661) 3.662 5.358 ( 2.552 0.000 2.739) 3.743 5.625 ( -1.788 0.000 3.910) 4.299 5.686 ( 9.319 0.000 -7.926) 12.233 6.007 ( 2.002 0.000 2.084) 2.890 6.050 ( 4.097 0.000 -1.040) 4.227 6.425 ( 8.429 0.000 6.227) 10.480 6.564 ( 6.616 0.000 -1.212) 6.726 6.585 ( -3.565 0.000 -1.467) 3.855 6.624 ( -3.366 0.000 2.530) 4.211 6.771 ( -5.096 0.000 -8.508) 9.917 6.911 ( 3.255 0.000 2.772) 4.276 7.061 ( 7.912 0.000 3.984) 8.859 7.437 ( 1.510 0.000 2.289) 2.742 7.786 ( -1.047 0.000 -6.562) 6.645 8.026 ( 2.037 0.000 -6.007) 6.343 8.096 ( -8.797 0.000 -0.973) 8.850 8.486 ( 6.164 0.000 9.524) 11.345 8.694 ( 3.367 0.000 3.760) 5.048 8.973 ( 3.241 0.000 -6.720) 7.460 9.260 ( -2.645 0.000 1.711) 3.150 11.084 ( 0.685 0.000 -3.760) 3.822 11.183 ( 0.899 0.000 -3.869) 3.971 11.697 ( -2.855 0.000 3.491) 4.510 11.911 ( -0.368 0.000 1.107) 1.166 13.485 ( -3.097 0.000 0.848) 3.211 13.708 ( -8.720 0.000 -5.576) 10.350 13.918 ( -14.441 0.000 1.327) 14.502 14.363 ( -9.683 0.000 -2.013) 9.890 15.167 ( 4.437 0.000 0.740) 4.499 15.301 ( -1.944 0.000 -1.716) 2.593 15.764 ( 1.108 0.000 -3.034) 3.230 15.891 ( 4.113 0.000 -5.095) 6.548 16.092 ( -2.806 0.000 1.685) 3.273 16.379 ( 0.339 0.000 5.151) 5.163 16.489 ( -10.960 0.000 5.063) 12.073 16.539 ( -1.881 0.000 -4.480) 4.859 18.230 ( 6.646 0.000 0.291) 6.652 18.238 ( 8.192 0.000 1.666) 8.359 18.334 ( 9.345 0.000 -5.628) 10.909 18.666 ( 8.196 0.000 1.362) 8.308 27.754 ( 2.475 0.000 0.222) 2.485 27.755 ( 1.184 0.000 -0.564) 1.311 27.875 ( -0.473 0.000 -3.803) 3.833 27.882 ( 1.947 0.000 -0.028) 1.947 28.886 ( 0.619 0.000 -3.023) 3.086 29.015 ( 3.754 0.000 0.594) 3.800 29.085 ( -3.502 0.000 4.003) 5.319 29.643 ( -0.134 0.000 -4.442) 4.444 29.767 ( -10.171 0.000 7.780) 12.806 30.122 ( -6.402 0.000 -0.300) 6.409 30.363 ( -0.722 0.000 3.598) 3.670 30.927 ( -6.205 0.000 -2.951) 6.871 31.462 ( -5.399 0.000 2.395) 5.906 31.566 ( 8.067 0.000 3.308) 8.719 32.412 ( 11.351 0.000 2.934) 11.724 33.964 ( 10.832 0.000 -9.681) 14.528 ======================= Grid point 81 (29/168) ======================= q-point: ( 0.40 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.120 ( 10.880 0.000 10.214) 14.923 2.512 ( -4.878 0.000 4.036) 6.331 2.576 ( 0.352 0.000 2.635) 2.659 2.864 ( 9.711 0.000 -6.583) 11.732 3.090 ( 1.366 0.000 5.687) 5.849 3.161 ( 8.990 0.000 -8.319) 12.248 3.551 ( -5.896 0.000 0.776) 5.947 3.797 ( 11.925 0.000 0.514) 11.936 3.910 ( 2.228 0.000 2.926) 3.678 3.994 ( 2.549 0.000 0.273) 2.564 4.183 ( -1.157 0.000 -4.374) 4.525 4.614 ( 0.823 0.000 -7.436) 7.482 4.753 ( -0.393 0.000 4.976) 4.992 4.770 ( 0.247 0.000 0.294) 0.384 5.176 ( 1.571 0.000 -1.683) 2.302 5.236 ( 5.280 0.000 -2.341) 5.776 5.419 ( 0.369 0.000 4.049) 4.066 5.568 ( -1.700 0.000 -1.801) 2.477 5.779 ( 6.023 0.000 -1.101) 6.123 6.058 ( 1.878 0.000 1.197) 2.227 6.097 ( 6.433 0.000 -6.632) 9.239 6.495 ( 3.539 0.000 -7.446) 8.244 6.573 ( 0.098 0.000 -0.475) 0.485 6.635 ( -0.610 0.000 5.356) 5.391 6.668 ( -1.352 0.000 -0.436) 1.420 6.689 ( 0.735 0.000 7.462) 7.498 6.993 ( 2.497 0.000 3.171) 4.036 7.254 ( 10.272 0.000 1.522) 10.384 7.464 ( -1.255 0.000 2.137) 2.478 7.683 ( -1.993 0.000 -6.346) 6.651 7.983 ( -4.454 0.000 -0.016) 4.454 7.993 ( 0.518 0.000 -0.214) 0.561 8.549 ( 1.596 0.000 -7.476) 7.644 8.838 ( -1.150 0.000 14.780) 14.825 8.919 ( 3.221 0.000 -10.490) 10.973 9.246 ( -3.561 0.000 3.308) 4.860 11.076 ( 1.216 0.000 0.231) 1.238 11.160 ( 2.140 0.000 -4.404) 4.897 11.671 ( -3.642 0.000 1.583) 3.971 11.903 ( -0.376 0.000 -1.799) 1.838 13.468 ( -1.288 0.000 2.691) 2.983 13.560 ( -3.560 0.000 -2.078) 4.122 13.751 ( -9.929 0.000 3.248) 10.447 14.229 ( -5.169 0.000 -0.774) 5.226 15.240 ( 2.586 0.000 1.330) 2.908 15.253 ( -0.949 0.000 -1.987) 2.202 15.772 ( 2.103 0.000 -0.135) 2.107 15.914 ( 3.353 0.000 -1.547) 3.693 16.094 ( 0.828 0.000 0.893) 1.218 16.367 ( -1.124 0.000 -5.646) 5.757 16.376 ( -9.020 0.000 2.593) 9.385 16.531 ( -0.213 0.000 5.579) 5.583 18.318 ( 3.602 0.000 0.897) 3.712 18.375 ( 6.312 0.000 1.576) 6.506 18.387 ( 3.758 0.000 -2.111) 4.310 18.771 ( 4.016 0.000 0.056) 4.016 27.757 ( 0.761 0.000 -2.002) 2.142 27.784 ( 1.532 0.000 -0.553) 1.629 27.861 ( 0.778 0.000 1.141) 1.381 27.919 ( 0.931 0.000 2.215) 2.403 28.878 ( 1.225 0.000 -0.668) 1.395 29.069 ( 2.489 0.000 -0.215) 2.498 29.073 ( -3.549 0.000 3.688) 5.118 29.611 ( 1.016 0.000 -2.138) 2.367 29.718 ( -7.076 0.000 7.102) 10.025 30.027 ( -3.811 0.000 -1.766) 4.201 30.378 ( -0.793 0.000 0.813) 1.136 30.832 ( -2.668 0.000 -0.619) 2.739 31.399 ( -3.189 0.000 -1.398) 3.482 31.679 ( 3.667 0.000 -0.077) 3.668 32.585 ( 5.239 0.000 3.674) 6.399 34.006 ( 7.830 0.000 -8.201) 11.339 ======================= Grid point 82 (30/168) ======================= q-point: (-0.50 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.191 ( -13.207 0.000 0.385) 13.213 2.334 ( -11.930 0.000 -10.057) 15.603 2.586 ( 2.401 0.000 5.620) 6.112 2.933 ( 8.070 0.000 -5.405) 9.713 3.164 ( -4.230 0.000 9.861) 10.730 3.344 ( 14.159 0.000 -4.020) 14.719 3.492 ( -3.081 0.000 9.250) 9.750 3.879 ( 1.143 0.000 2.745) 2.973 3.945 ( -4.310 0.000 -2.335) 4.902 3.994 ( -2.263 0.000 -1.413) 2.668 4.103 ( 1.303 0.000 -8.255) 8.357 4.553 ( 2.082 0.000 -6.653) 6.971 4.786 ( -0.643 0.000 2.446) 2.529 4.827 ( 1.800 0.000 5.837) 6.108 5.195 ( -3.355 0.000 -8.627) 9.256 5.215 ( 2.959 0.000 1.356) 3.255 5.454 ( -2.251 0.000 4.716) 5.225 5.570 ( 2.642 0.000 -0.374) 2.668 5.852 ( 3.306 0.000 1.556) 3.653 6.070 ( -2.281 0.000 -0.222) 2.292 6.074 ( 2.560 0.000 -9.357) 9.701 6.417 ( 1.263 0.000 -11.495) 11.564 6.559 ( -0.539 0.000 -1.207) 1.322 6.657 ( -3.341 0.000 5.927) 6.804 6.719 ( -4.414 0.000 4.199) 6.092 6.739 ( 3.871 0.000 6.538) 7.598 7.003 ( -3.976 0.000 0.415) 3.998 7.320 ( -3.746 0.000 -1.908) 4.204 7.455 ( -2.005 0.000 1.355) 2.420 7.651 ( 6.743 0.000 -2.214) 7.097 7.961 ( 0.308 0.000 1.322) 1.357 8.096 ( 6.713 0.000 7.604) 10.143 8.416 ( -3.371 0.000 -12.361) 12.812 8.857 ( 6.943 0.000 -13.379) 15.074 8.928 ( -6.144 0.000 10.625) 12.273 9.206 ( -4.695 0.000 0.712) 4.749 11.128 ( 1.898 0.000 4.176) 4.587 11.147 ( 2.986 0.000 -4.782) 5.637 11.639 ( -1.769 0.000 0.626) 1.876 11.858 ( -0.174 0.000 -4.980) 4.983 13.516 ( 1.013 0.000 6.028) 6.112 13.563 ( 3.637 0.000 2.320) 4.314 13.686 ( -3.262 0.000 3.489) 4.777 14.192 ( 1.118 0.000 0.117) 1.124 15.232 ( 0.893 0.000 -1.618) 1.848 15.266 ( -0.924 0.000 1.068) 1.412 15.817 ( 1.425 0.000 2.714) 3.065 15.957 ( 3.274 0.000 -0.136) 3.277 16.123 ( 1.401 0.000 0.130) 1.407 16.273 ( -0.277 0.000 -7.904) 7.909 16.277 ( -6.288 0.000 1.827) 6.548 16.604 ( 0.038 0.000 6.634) 6.634 18.357 ( -0.592 0.000 1.487) 1.600 18.383 ( -1.078 0.000 -0.939) 1.430 18.492 ( 3.772 0.000 4.026) 5.517 18.788 ( -0.821 0.000 -1.443) 1.660 27.745 ( 0.801 0.000 -1.659) 1.842 27.788 ( -0.046 0.000 -0.819) 0.821 27.912 ( 1.465 0.000 4.048) 4.305 27.955 ( -0.633 0.000 3.398) 3.456 28.912 ( 2.197 0.000 1.887) 2.897 29.061 ( -2.995 0.000 3.253) 4.422 29.079 ( -0.325 0.000 -1.026) 1.076 29.631 ( 2.953 0.000 0.206) 2.960 29.704 ( -5.277 0.000 7.152) 8.888 29.973 ( 0.504 0.000 -2.852) 2.897 30.353 ( -1.938 0.000 -1.592) 2.508 30.839 ( 1.879 0.000 2.688) 3.280 31.335 ( -0.444 0.000 -4.749) 4.770 31.673 ( -1.677 0.000 -3.643) 4.010 32.647 ( -2.774 0.000 3.699) 4.624 34.028 ( 6.573 0.000 -7.427) 9.918 ======================= Grid point 83 (31/168) ======================= q-point: (-0.40 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.864 ( -23.403 0.000 -3.116) 23.610 1.953 ( -18.331 0.000 -14.026) 23.082 2.681 ( -3.131 0.000 9.470) 9.974 2.973 ( 0.220 0.000 -1.504) 1.520 3.190 ( -3.171 0.000 7.040) 7.721 3.434 ( 5.804 0.000 -1.405) 5.972 3.658 ( 3.335 0.000 6.256) 7.090 3.708 ( -20.013 0.000 -4.250) 20.459 3.909 ( -4.790 0.000 0.072) 4.790 3.921 ( 0.974 0.000 0.405) 1.055 4.078 ( 5.766 0.000 -3.977) 7.005 4.467 ( -3.255 0.000 -10.482) 10.976 4.739 ( -8.197 0.000 -3.889) 9.072 4.895 ( -2.716 0.000 3.515) 4.442 4.984 ( -5.889 0.000 -7.239) 9.332 5.287 ( 3.024 0.000 3.189) 4.395 5.463 ( -4.406 0.000 5.447) 7.006 5.537 ( -3.693 0.000 -9.393) 10.093 5.939 ( 3.105 0.000 6.018) 6.772 5.955 ( -6.654 0.000 -6.543) 9.332 6.018 ( 0.088 0.000 -2.039) 2.041 6.305 ( -1.239 0.000 -8.217) 8.310 6.536 ( -0.294 0.000 0.549) 0.623 6.671 ( -5.173 0.000 1.204) 5.311 6.691 ( -0.960 0.000 6.297) 6.370 6.922 ( -6.242 0.000 0.645) 6.275 6.930 ( 8.106 0.000 10.327) 13.128 7.187 ( -8.617 0.000 0.521) 8.632 7.441 ( -1.684 0.000 1.180) 2.056 7.776 ( 7.959 0.000 0.339) 7.966 7.992 ( 2.512 0.000 -2.080) 3.261 8.194 ( -5.567 0.000 -11.415) 12.700 8.300 ( 4.275 0.000 9.799) 10.691 8.857 ( 15.280 0.000 -15.782) 21.966 8.908 ( -7.681 0.000 6.321) 9.947 9.124 ( -4.442 0.000 -1.575) 4.713 11.152 ( 4.170 0.000 -3.689) 5.568 11.211 ( 1.281 0.000 5.023) 5.184 11.622 ( -0.947 0.000 -0.480) 1.062 11.798 ( 1.165 0.000 -6.061) 6.172 13.600 ( -2.473 0.000 8.515) 8.867 13.708 ( 8.851 0.000 4.644) 9.995 13.753 ( 8.510 0.000 2.473) 8.862 14.266 ( 7.633 0.000 0.712) 7.666 15.239 ( 1.893 0.000 -1.471) 2.398 15.242 ( -3.450 0.000 1.222) 3.660 15.871 ( 0.308 0.000 4.265) 4.276 15.996 ( 3.494 0.000 -3.998) 5.310 16.128 ( -0.068 0.000 0.455) 0.460 16.187 ( 0.656 0.000 -7.718) 7.745 16.247 ( -2.145 0.000 4.556) 5.035 16.678 ( 0.676 0.000 5.272) 5.316 18.330 ( -4.941 0.000 1.358) 5.124 18.332 ( -5.427 0.000 0.800) 5.486 18.589 ( 1.195 0.000 6.377) 6.488 18.714 ( -5.386 0.000 -2.881) 6.108 27.747 ( 0.983 0.000 -0.460) 1.085 27.766 ( -1.504 0.000 -0.782) 1.695 27.972 ( -2.117 0.000 3.291) 3.913 27.988 ( 1.645 0.000 4.785) 5.060 28.989 ( 2.998 0.000 4.326) 5.263 29.038 ( -2.871 0.000 -1.475) 3.228 29.054 ( -2.169 0.000 2.673) 3.443 29.705 ( 4.651 0.000 2.106) 5.105 29.716 ( -4.207 0.000 7.972) 9.014 29.978 ( 4.509 0.000 -3.335) 5.608 30.280 ( -3.489 0.000 -3.605) 5.016 30.939 ( 4.812 0.000 4.850) 6.832 31.281 ( 2.259 0.000 -6.899) 7.260 31.551 ( -6.281 0.000 -6.231) 8.848 32.589 ( -9.778 0.000 3.887) 10.523 34.045 ( 6.223 0.000 -7.027) 9.387 ======================= Grid point 84 (32/168) ======================= q-point: (-0.30 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.429 ( -27.734 0.000 -2.346) 27.833 1.470 ( -24.895 0.000 -10.265) 26.928 2.729 ( -7.609 0.000 15.168) 16.970 2.796 ( -26.448 0.000 -1.246) 26.478 3.252 ( -16.345 0.000 9.151) 18.732 3.297 ( -2.753 0.000 -8.252) 8.699 3.408 ( -8.927 0.000 -5.588) 10.532 3.651 ( 0.296 0.000 -2.177) 2.197 3.908 ( -0.155 0.000 -3.934) 3.937 3.946 ( 4.129 0.000 3.934) 5.703 4.118 ( -21.548 0.000 -14.014) 25.704 4.205 ( 8.589 0.000 4.318) 9.613 4.558 ( -1.381 0.000 -8.528) 8.639 4.774 ( -12.791 0.000 -3.317) 13.214 4.899 ( -1.610 0.000 -1.849) 2.452 5.264 ( -11.377 0.000 -12.983) 17.263 5.375 ( 3.794 0.000 1.606) 4.120 5.417 ( -8.108 0.000 3.170) 8.705 5.778 ( -4.892 0.000 -6.647) 8.253 6.014 ( -1.619 0.000 2.486) 2.966 6.041 ( -2.339 0.000 8.716) 9.024 6.166 ( -5.687 0.000 -7.403) 9.335 6.596 ( -5.107 0.000 0.026) 5.107 6.602 ( 5.701 0.000 1.448) 5.882 6.780 ( 3.961 0.000 5.929) 7.131 6.838 ( -4.974 0.000 0.544) 5.003 7.105 ( -6.906 0.000 6.011) 9.155 7.190 ( 8.427 0.000 9.942) 13.033 7.428 ( -1.691 0.000 1.346) 2.161 7.878 ( 4.575 0.000 0.217) 4.580 7.900 ( -3.205 0.000 -9.151) 9.696 8.113 ( 4.500 0.000 -2.639) 5.217 8.422 ( 0.174 0.000 6.470) 6.473 8.859 ( -7.120 0.000 5.967) 9.290 8.915 ( 8.935 0.000 -15.251) 17.676 9.115 ( 9.077 0.000 0.707) 9.104 11.192 ( 4.782 0.000 -1.892) 5.142 11.258 ( -0.244 0.000 1.238) 1.262 11.590 ( -1.619 0.000 -1.566) 2.252 11.775 ( 2.918 0.000 -3.265) 4.379 13.639 ( -2.501 0.000 5.837) 6.350 13.907 ( 9.422 0.000 3.611) 10.090 13.973 ( 13.593 0.000 3.720) 14.093 14.437 ( 12.607 0.000 0.785) 12.632 15.204 ( -3.139 0.000 2.039) 3.743 15.252 ( 1.744 0.000 -1.171) 2.100 15.924 ( 0.183 0.000 4.335) 4.339 15.955 ( 1.258 0.000 -8.173) 8.269 16.117 ( 0.730 0.000 -6.475) 6.515 16.157 ( 4.839 0.000 -3.747) 6.120 16.299 ( -2.525 0.000 10.947) 11.235 16.745 ( 1.443 0.000 3.386) 3.681 18.235 ( -9.016 0.000 2.166) 9.272 18.238 ( -8.042 0.000 0.666) 8.070 18.563 ( -8.700 0.000 -3.826) 9.504 18.682 ( -0.572 0.000 9.412) 9.430 27.727 ( -2.209 0.000 -0.732) 2.327 27.762 ( 0.996 0.000 0.009) 0.996 27.964 ( -2.914 0.000 2.344) 3.740 28.065 ( 1.429 0.000 4.070) 4.313 28.967 ( -3.674 0.000 -1.513) 3.973 29.043 ( -1.922 0.000 2.296) 2.994 29.108 ( 3.896 0.000 5.337) 6.608 29.758 ( -3.259 0.000 10.039) 10.555 29.814 ( 5.422 0.000 2.724) 6.067 30.029 ( 6.196 0.000 -2.916) 6.848 30.167 ( -5.275 0.000 -3.561) 6.364 31.067 ( 4.545 0.000 2.915) 5.400 31.262 ( 5.307 0.000 -5.818) 7.875 31.354 ( -8.627 0.000 -7.053) 11.143 32.448 ( -14.080 0.000 4.957) 14.927 34.060 ( 6.534 0.000 -8.086) 10.396 ======================= Grid point 85 (33/168) ======================= q-point: (-0.20 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.969 ( -30.636 0.000 2.864) 30.769 0.986 ( -31.408 0.000 5.590) 31.902 2.061 ( -56.923 0.000 -5.034) 57.145 2.798 ( -8.148 0.000 17.925) 19.690 2.988 ( -15.234 0.000 3.596) 15.653 3.084 ( -19.851 0.000 -7.280) 21.144 3.396 ( 0.859 0.000 -2.523) 2.665 3.637 ( -15.796 0.000 -4.106) 16.321 3.667 ( 7.410 0.000 -7.253) 10.368 3.847 ( 1.327 0.000 -9.006) 9.104 4.060 ( 1.035 0.000 7.160) 7.235 4.377 ( 4.819 0.000 4.518) 6.606 4.469 ( -13.959 0.000 -8.817) 16.511 4.487 ( 3.962 0.000 -7.628) 8.595 4.856 ( -3.188 0.000 0.683) 3.261 4.964 ( -9.278 0.000 -8.399) 12.515 5.313 ( -7.724 0.000 2.198) 8.030 5.430 ( 2.842 0.000 -1.328) 3.137 5.637 ( -3.983 0.000 -8.387) 9.284 5.969 ( -7.745 0.000 -6.961) 10.413 6.003 ( -8.473 0.000 9.604) 12.807 6.096 ( 1.744 0.000 2.636) 3.161 6.524 ( -3.425 0.000 -0.759) 3.508 6.671 ( 2.242 0.000 -0.637) 2.331 6.786 ( -3.087 0.000 1.553) 3.455 6.914 ( 4.524 0.000 2.175) 5.020 7.099 ( -5.373 0.000 10.273) 11.593 7.317 ( -1.246 0.000 -0.439) 1.321 7.479 ( 5.918 0.000 5.097) 7.810 7.815 ( -1.215 0.000 -0.052) 1.217 7.924 ( 1.259 0.000 0.267) 1.287 8.190 ( 9.049 0.000 -2.977) 9.526 8.479 ( 3.360 0.000 -1.455) 3.662 8.792 ( 1.616 0.000 -19.357) 19.424 8.829 ( -6.872 0.000 7.598) 10.245 9.378 ( 14.273 0.000 9.686) 17.249 11.239 ( -0.222 0.000 -2.868) 2.876 11.247 ( 3.820 0.000 -0.874) 3.919 11.545 ( -1.545 0.000 -1.304) 2.021 11.806 ( 2.826 0.000 0.029) 2.826 13.655 ( -1.267 0.000 1.735) 2.148 14.055 ( 5.853 0.000 0.792) 5.906 14.226 ( 12.619 0.000 3.378) 13.064 14.649 ( 13.488 0.000 -0.731) 13.508 15.205 ( -0.330 0.000 2.860) 2.879 15.269 ( 0.995 0.000 0.633) 1.180 15.877 ( 0.319 0.000 -6.479) 6.487 15.966 ( 0.153 0.000 1.521) 1.529 16.071 ( 0.870 0.000 -2.651) 2.790 16.165 ( 5.144 0.000 -8.589) 10.012 16.408 ( -1.944 0.000 13.144) 13.287 16.796 ( 1.602 0.000 1.298) 2.062 18.106 ( -10.847 0.000 2.919) 11.233 18.109 ( -8.409 0.000 0.125) 8.410 18.374 ( -9.270 0.000 -3.704) 9.982 18.793 ( 0.410 0.000 9.986) 9.994 27.685 ( -1.967 0.000 -0.661) 2.075 27.770 ( 0.593 0.000 -1.268) 1.400 27.938 ( -2.771 0.000 1.000) 2.946 28.119 ( 0.756 0.000 2.265) 2.388 28.899 ( -2.916 0.000 -1.122) 3.124 29.035 ( -1.794 0.000 1.650) 2.437 29.219 ( 3.892 0.000 1.263) 4.092 29.839 ( -1.036 0.000 7.314) 7.387 29.918 ( 5.398 0.000 -0.487) 5.420 30.093 ( -6.709 0.000 15.171) 16.588 30.100 ( 4.840 0.000 0.486) 4.865 31.128 ( 4.411 0.000 -3.213) 5.457 31.147 ( -7.636 0.000 -5.819) 9.600 31.321 ( 6.118 0.000 -1.165) 6.227 32.282 ( -15.270 0.000 6.758) 16.699 34.035 ( 6.757 0.000 -18.192) 19.406 ======================= Grid point 86 (34/168) ======================= q-point: (-0.10 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.593 ( -29.127 0.000 17.361) 33.908 0.695 ( -31.997 0.000 24.910) 40.550 1.134 ( -60.138 0.000 22.047) 64.052 2.678 ( -16.630 0.000 -11.413) 20.169 2.804 ( -13.228 0.000 2.082) 13.391 2.870 ( -6.598 0.000 13.465) 14.995 3.144 ( -9.125 0.000 -6.624) 11.276 3.677 ( 5.807 0.000 -2.261) 6.232 3.708 ( 7.531 0.000 -6.351) 9.851 3.738 ( -1.606 0.000 -10.750) 10.870 4.048 ( -11.912 0.000 2.438) 12.159 4.273 ( 2.431 0.000 -0.437) 2.470 4.455 ( 0.483 0.000 -0.691) 0.843 4.555 ( 10.024 0.000 2.399) 10.307 4.833 ( -1.621 0.000 0.750) 1.786 4.847 ( 1.537 0.000 9.172) 9.300 5.256 ( -4.806 0.000 4.820) 6.807 5.436 ( 2.101 0.000 -4.076) 4.586 5.438 ( -4.862 0.000 -5.995) 7.719 5.821 ( -4.264 0.000 -1.262) 4.446 5.969 ( -10.127 0.000 9.693) 14.018 6.147 ( 2.969 0.000 -1.168) 3.190 6.458 ( -2.695 0.000 -3.594) 4.492 6.678 ( 0.837 0.000 -1.322) 1.564 6.783 ( -1.773 0.000 4.689) 5.013 6.949 ( 0.300 0.000 -0.906) 0.954 7.228 ( 6.618 0.000 16.044) 17.356 7.269 ( -0.572 0.000 -2.549) 2.612 7.609 ( 3.249 0.000 0.341) 3.267 7.817 ( -1.754 0.000 4.850) 5.157 7.933 ( -0.482 0.000 0.254) 0.545 8.316 ( 10.077 0.000 -2.116) 10.297 8.324 ( -16.152 0.000 -45.001) 47.812 8.536 ( -0.621 0.000 -7.882) 7.906 8.796 ( -9.102 0.000 7.171) 11.588 9.698 ( 7.765 0.000 4.548) 8.999 11.209 ( 1.743 0.000 -3.947) 4.315 11.280 ( 2.093 0.000 -1.698) 2.695 11.528 ( -0.403 0.000 1.238) 1.302 11.847 ( 1.353 0.000 1.156) 1.780 13.638 ( -0.182 0.000 -1.372) 1.384 14.110 ( 2.226 0.000 -1.570) 2.724 14.414 ( 6.745 0.000 1.938) 7.018 14.812 ( 9.645 0.000 -3.305) 10.195 15.236 ( -0.308 0.000 1.747) 1.774 15.294 ( -0.102 0.000 0.507) 0.517 15.956 ( 12.152 0.000 22.839) 25.871 15.957 ( 0.469 0.000 -2.859) 2.897 16.092 ( 0.695 0.000 2.811) 2.896 16.128 ( 4.914 0.000 -11.241) 12.268 16.511 ( -3.225 0.000 10.943) 11.409 16.818 ( 0.763 0.000 -0.899) 1.179 17.978 ( -9.057 0.000 2.520) 9.401 17.998 ( -5.304 0.000 0.027) 5.304 18.220 ( -5.167 0.000 -1.993) 5.538 18.763 ( -12.236 0.000 -26.154) 28.875 27.655 ( -0.938 0.000 -0.468) 1.049 27.731 ( -2.238 0.000 -3.701) 4.326 27.905 ( -1.805 0.000 -0.402) 1.849 28.136 ( -0.244 0.000 -0.148) 0.285 28.857 ( -1.248 0.000 -0.370) 1.302 29.019 ( -1.585 0.000 -1.437) 2.139 29.183 ( -4.740 0.000 -6.547) 8.083 29.847 ( 0.319 0.000 0.501) 0.594 29.949 ( 3.565 0.000 -6.447) 7.367 30.193 ( 2.121 0.000 5.704) 6.085 30.697 ( 35.252 0.000 74.554) 82.468 31.010 ( -2.932 0.000 -2.588) 3.911 31.165 ( 5.414 0.000 -3.160) 6.269 31.389 ( 4.599 0.000 -2.185) 5.091 32.139 ( -13.631 0.000 8.202) 15.908 33.529 ( -31.698 0.000 -72.816) 79.416 ======================= Grid point 87 (35/168) ======================= q-point: ( 0.00 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.822 ( 12.615 19.601 18.822) 29.961 1.082 ( -2.358 26.779 26.227) 37.557 1.612 ( -13.474 41.744 32.131) 54.374 2.356 ( -4.481 1.793 -16.824) 17.503 2.732 ( -1.640 2.412 2.465) 3.819 2.894 ( 0.748 -2.087 9.366) 9.624 3.130 ( 4.598 3.336 -0.573) 5.709 3.470 ( 1.081 -2.162 -5.587) 6.087 3.708 ( 6.512 -2.628 -6.900) 9.844 3.745 ( 4.003 -1.919 0.427) 4.459 4.011 ( 0.346 1.353 4.351) 4.570 4.335 ( 3.940 -4.741 6.543) 8.989 4.456 ( -0.538 2.997 -2.045) 3.668 4.510 ( 4.763 -9.716 2.961) 11.219 4.906 ( -0.491 0.709 1.731) 1.934 4.933 ( -1.686 -3.269 4.456) 5.778 5.200 ( 0.645 2.149 -0.141) 2.249 5.432 ( 0.352 -6.409 8.328) 10.515 5.727 ( 6.282 2.470 2.166) 7.089 5.848 ( 2.723 2.602 3.082) 4.867 5.907 ( -8.926 -0.316 3.884) 9.739 6.149 ( -1.674 -2.594 1.706) 3.527 6.474 ( 2.595 4.255 -0.219) 4.989 6.658 ( -1.118 -0.749 -2.149) 2.535 6.815 ( -0.239 -1.366 5.170) 5.353 6.975 ( -4.709 1.530 -0.259) 4.958 7.024 ( -7.162 2.112 -2.336) 7.824 7.364 ( -7.064 -0.059 -0.656) 7.095 7.427 ( 2.055 -3.521 -2.655) 4.865 7.894 ( 1.120 -0.059 0.319) 1.166 7.974 ( -1.805 5.404 4.301) 7.138 8.061 ( 15.631 7.721 -20.715) 27.075 8.411 ( 4.091 -2.597 -0.991) 4.946 8.553 ( 8.636 -0.634 0.361) 8.667 8.741 ( -7.689 4.192 -0.468) 8.770 9.308 ( -7.209 -14.718 4.149) 16.906 11.147 ( 2.324 -2.459 -2.629) 4.285 11.367 ( 2.026 6.368 -3.481) 7.536 11.508 ( -0.713 -4.575 3.505) 5.807 11.863 ( 0.089 -0.496 0.532) 0.733 13.684 ( -1.261 3.521 0.657) 3.797 14.169 ( 0.095 4.866 -4.625) 6.714 14.421 ( -2.284 -3.810 0.396) 4.460 14.838 ( 0.442 -2.611 -4.599) 5.307 15.316 ( -0.767 3.833 -1.636) 4.238 15.389 ( 1.570 9.970 -12.894) 16.374 15.896 ( 0.498 -2.781 -5.864) 6.510 16.003 ( 2.750 -4.102 -5.214) 7.181 16.190 ( 1.250 2.636 0.590) 2.977 16.404 ( -4.477 -5.472 8.095) 10.748 16.629 ( 6.377 -9.790 13.419) 17.793 16.779 ( -2.006 -1.851 -2.760) 3.882 17.669 ( -11.402 1.169 2.442) 11.719 17.901 ( -2.722 -1.626 2.792) 4.225 17.983 ( -0.034 1.721 0.669) 1.847 18.183 ( 2.840 -0.989 0.694) 3.086 27.694 ( -1.714 1.413 -1.611) 2.744 27.766 ( 2.032 2.314 -2.132) 3.746 27.868 ( -0.281 -0.801 -1.606) 1.816 28.080 ( -0.998 -2.117 -2.875) 3.707 28.964 ( 1.391 0.697 -2.864) 3.259 29.099 ( -4.542 0.218 3.447) 5.706 29.325 ( 4.047 24.392 -27.445) 36.940 29.837 ( -0.156 -1.065 -4.615) 4.739 30.036 ( 1.201 8.337 -0.576) 8.442 30.331 ( -1.389 5.494 6.754) 8.817 30.981 ( -14.869 -3.261 1.464) 15.292 31.082 ( -0.801 -3.325 1.331) 3.670 31.345 ( -32.997 5.785 1.268) 33.524 31.425 ( -8.074 1.068 -3.712) 8.950 31.899 ( 14.901 -10.290 13.810) 22.774 32.671 ( 41.340 -14.896 10.027) 45.071 ======================= Grid point 88 (36/168) ======================= q-point: ( 0.10 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.362 ( 10.112 25.884 17.716) 32.955 1.462 ( 27.708 15.238 17.622) 36.200 1.916 ( 7.908 16.665 23.615) 29.965 2.202 ( 6.887 9.309 -10.729) 15.786 2.803 ( 4.168 2.488 1.998) 5.249 3.054 ( 9.788 1.546 6.044) 11.607 3.311 ( 11.733 1.222 -3.383) 12.272 3.481 ( 10.596 -1.142 3.269) 11.147 3.745 ( 7.234 2.756 -4.754) 9.085 3.831 ( 2.973 -4.850 1.259) 5.827 4.103 ( 2.268 2.285 4.287) 5.361 4.368 ( -2.623 3.954 -2.181) 5.222 4.506 ( 5.557 -6.947 6.416) 10.968 4.674 ( 7.828 -9.878 5.428) 13.723 4.913 ( -6.920 -0.859 9.314) 11.635 4.993 ( 3.960 -5.313 1.329) 6.758 5.244 ( 5.908 2.230 -1.002) 6.394 5.460 ( -2.568 -2.548 5.137) 6.282 5.811 ( -5.599 1.731 -0.232) 5.865 5.824 ( 2.347 -2.181 3.986) 5.114 5.939 ( 0.586 -3.662 4.636) 5.937 6.147 ( 0.652 4.081 0.781) 4.206 6.511 ( 2.205 3.966 0.784) 4.605 6.574 ( -5.259 -5.154 1.027) 7.435 6.838 ( -2.904 2.222 -3.205) 4.863 6.878 ( 3.907 1.855 -1.859) 4.707 7.002 ( -4.044 3.813 2.587) 6.131 7.257 ( -4.627 1.970 -4.803) 6.954 7.380 ( 0.070 0.575 -4.216) 4.256 7.918 ( 0.134 -1.384 1.459) 2.016 7.959 ( 0.672 0.873 -4.752) 4.878 8.109 ( 8.229 4.032 -3.568) 9.834 8.475 ( 1.979 -2.750 1.401) 3.666 8.585 ( -5.330 5.349 -6.103) 9.709 8.789 ( 14.977 -1.951 0.491) 15.112 9.259 ( -0.264 -9.858 -2.703) 10.225 11.149 ( 2.218 -0.751 -3.513) 4.221 11.335 ( -0.195 6.611 -4.155) 7.811 11.555 ( 0.124 -5.479 5.116) 7.497 11.870 ( -0.598 -1.240 1.440) 1.993 13.630 ( -5.464 2.812 0.497) 6.166 14.087 ( -3.605 3.324 -4.995) 6.999 14.320 ( -9.991 -3.166 -0.438) 10.489 14.726 ( -7.113 -3.044 -5.021) 9.223 15.215 ( -2.759 5.987 -5.359) 8.495 15.370 ( 2.539 4.350 -1.695) 5.314 15.825 ( -0.104 -3.777 -6.760) 7.744 15.973 ( 2.988 -1.504 -8.121) 8.783 16.220 ( -2.602 0.861 5.889) 6.496 16.284 ( -10.497 0.759 3.380) 11.054 16.638 ( -11.657 -5.611 7.498) 14.953 16.744 ( -3.054 -1.528 -1.283) 3.647 17.864 ( 21.917 -5.810 -4.867) 23.190 17.944 ( 4.082 -2.094 2.533) 5.240 18.051 ( 8.579 2.446 -0.755) 8.953 18.302 ( 9.117 -1.089 2.354) 9.479 27.663 ( -0.056 0.364 -0.770) 0.854 27.768 ( 1.278 1.323 -1.937) 2.671 27.853 ( 0.996 -0.682 -1.945) 2.289 28.018 ( -1.270 -1.269 -4.625) 4.961 28.937 ( -0.024 0.561 -3.187) 3.236 29.066 ( -1.704 4.001 0.011) 4.348 29.154 ( 0.409 11.774 -8.380) 14.458 29.758 ( -0.795 -2.882 -7.093) 7.697 30.019 ( -8.066 6.748 5.024) 11.655 30.320 ( -6.850 3.926 3.524) 8.646 30.570 ( -24.072 10.714 11.800) 28.870 31.166 ( -5.512 -1.304 0.711) 5.709 31.237 ( 10.036 7.107 6.729) 14.018 31.439 ( 1.834 -3.818 0.551) 4.272 32.018 ( 2.581 -3.089 2.817) 4.913 33.381 ( 35.664 -22.618 -6.327) 42.703 ======================= Grid point 89 (37/168) ======================= q-point: ( 0.20 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.701 ( 11.303 26.236 14.054) 31.837 2.042 ( 13.198 9.196 24.812) 29.570 2.181 ( 19.732 4.262 -9.876) 22.473 2.474 ( 23.804 9.592 6.537) 26.483 2.887 ( 6.455 0.558 -0.634) 6.510 3.231 ( 4.197 -2.904 -1.707) 5.381 3.412 ( 14.249 4.482 -0.357) 14.942 3.696 ( -7.262 6.582 -6.441) 11.728 3.827 ( 13.901 2.929 1.818) 14.322 3.956 ( 14.510 -0.159 5.059) 15.367 4.172 ( 3.660 0.932 3.287) 5.007 4.324 ( -2.848 1.372 1.340) 3.434 4.660 ( 6.385 -4.980 1.787) 8.293 4.833 ( 3.838 -11.553 5.352) 13.298 4.902 ( -6.866 0.976 7.531) 10.237 5.044 ( 2.126 -6.294 -0.314) 6.651 5.362 ( 11.299 -1.856 -3.337) 11.926 5.529 ( 1.745 -1.687 8.371) 8.716 5.737 ( -1.210 5.946 -3.511) 7.010 5.892 ( 1.253 -4.319 2.559) 5.174 5.998 ( -0.396 -1.345 6.980) 7.120 6.180 ( 1.811 0.723 0.289) 1.971 6.530 ( 1.212 -1.709 -0.137) 2.099 6.603 ( 2.851 -0.465 5.054) 5.821 6.738 ( -7.097 -0.497 -3.059) 7.744 6.885 ( 5.821 5.196 -6.596) 10.217 6.928 ( -6.263 0.085 -2.150) 6.622 7.118 ( -2.959 6.339 -3.008) 7.615 7.399 ( 3.537 2.381 0.373) 4.280 7.898 ( 0.103 3.062 -4.841) 5.729 7.959 ( 3.123 -4.348 -0.955) 5.438 8.250 ( 5.934 1.704 8.175) 10.245 8.369 ( -8.232 6.291 -5.235) 11.608 8.579 ( 6.059 -3.148 -1.794) 7.060 8.968 ( 7.659 0.920 0.064) 7.715 9.227 ( 0.669 -6.895 -3.549) 7.784 11.130 ( 1.124 0.557 -4.369) 4.545 11.279 ( -0.843 5.521 -3.697) 6.697 11.613 ( -0.527 -5.569 4.959) 7.475 11.878 ( -0.685 -1.953 1.564) 2.594 13.547 ( -5.525 1.203 0.500) 5.677 13.930 ( -8.715 1.228 -5.760) 10.518 14.125 ( -13.649 -1.666 -0.211) 13.752 14.530 ( -10.514 -2.888 -3.753) 11.531 15.156 ( 0.930 3.931 -2.235) 4.617 15.378 ( 0.190 3.908 -1.246) 4.106 15.755 ( 0.396 -3.966 -5.338) 6.661 15.923 ( 3.055 -0.030 -8.103) 8.660 16.152 ( -7.718 0.509 3.327) 8.420 16.303 ( 0.765 1.001 5.840) 5.974 16.538 ( -9.725 -4.329 4.353) 11.501 16.657 ( -4.855 0.042 -2.260) 5.355 18.056 ( 8.923 -2.199 -0.183) 9.192 18.090 ( 11.505 -3.738 -1.125) 12.149 18.209 ( 13.098 1.184 -3.449) 13.596 18.487 ( 10.297 -1.080 2.315) 10.609 27.672 ( 1.504 -1.529 0.109) 2.147 27.768 ( 1.306 0.750 -1.461) 2.099 27.855 ( 1.546 -0.626 -1.168) 2.036 27.943 ( -1.031 -0.362 -5.005) 5.123 28.904 ( 0.178 -0.153 -2.772) 2.782 29.053 ( 0.973 5.041 -1.117) 5.254 29.109 ( -1.431 4.076 0.500) 4.349 29.668 ( -0.694 -3.540 -6.209) 7.181 29.912 ( -13.037 5.232 7.563) 15.954 30.237 ( -7.009 2.091 0.974) 7.379 30.477 ( -5.436 11.580 6.951) 14.559 31.057 ( -6.942 -0.883 -2.178) 7.329 31.414 ( -1.238 -0.826 3.079) 3.420 31.532 ( 8.583 7.146 8.257) 13.889 32.136 ( 10.198 -5.286 0.054) 11.486 33.702 ( 19.336 -15.629 -8.556) 26.294 ======================= Grid point 90 (38/168) ======================= q-point: ( 0.30 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.027 ( 12.220 21.060 10.830) 26.648 2.429 ( 6.609 5.966 16.003) 18.312 2.448 ( 16.408 6.941 4.793) 18.450 2.779 ( 11.129 3.611 -4.232) 12.442 3.002 ( 8.437 0.104 -2.966) 8.944 3.315 ( 11.945 -8.856 0.332) 14.873 3.436 ( -6.623 7.339 -11.488) 15.155 3.634 ( 7.027 5.524 1.030) 8.998 3.968 ( 4.117 7.388 0.787) 8.494 4.125 ( 2.489 10.271 2.272) 10.810 4.249 ( 0.079 2.660 -0.125) 2.664 4.452 ( 13.800 -8.724 4.824) 17.024 4.705 ( 1.934 -1.029 -4.697) 5.183 4.854 ( -4.761 4.308 1.281) 6.547 4.927 ( 0.033 -18.286 4.438) 18.817 5.076 ( 3.886 -2.848 -1.348) 5.003 5.492 ( 9.107 -4.548 -2.329) 10.443 5.642 ( -1.174 3.752 2.915) 4.894 5.705 ( 5.331 2.814 -2.393) 6.485 5.947 ( 2.743 -3.855 2.084) 5.170 6.011 ( -2.396 1.246 -2.436) 3.637 6.218 ( -1.832 -12.062 6.404) 13.779 6.589 ( 0.799 -0.709 4.959) 5.073 6.613 ( 1.760 0.541 -4.018) 4.420 6.730 ( 5.113 5.245 3.145) 7.971 6.798 ( -2.703 3.446 -2.555) 5.070 6.962 ( 6.808 2.895 -0.402) 7.408 7.118 ( 3.855 5.652 0.667) 6.874 7.457 ( 1.570 2.444 1.817) 3.426 7.830 ( -1.069 4.196 -5.848) 7.277 7.991 ( 0.972 -1.338 0.309) 1.682 8.181 ( -6.379 5.791 -7.227) 11.245 8.430 ( 4.907 -4.541 5.080) 8.397 8.665 ( 3.925 -2.480 3.739) 5.960 9.030 ( 3.407 4.090 -4.521) 6.984 9.216 ( -0.538 -4.410 2.256) 4.983 11.092 ( 0.093 1.203 -3.336) 3.548 11.233 ( 0.342 4.509 -3.547) 5.747 11.641 ( -2.384 -5.132 3.671) 6.745 11.879 ( -0.648 -3.108 0.272) 3.186 13.478 ( -4.323 -0.426 1.040) 4.467 13.713 ( -10.170 -0.130 -4.380) 11.074 13.916 ( -12.598 0.332 0.602) 12.617 14.338 ( -9.334 -2.449 -2.077) 9.871 15.182 ( 2.973 1.919 0.312) 3.553 15.351 ( -0.711 4.447 -1.890) 4.884 15.722 ( 1.231 -3.564 -2.545) 4.550 15.899 ( 4.076 -0.068 -5.707) 7.014 16.098 ( -3.060 0.772 1.892) 3.679 16.377 ( -0.217 -0.299 4.392) 4.408 16.438 ( -7.599 -3.443 2.937) 8.845 16.557 ( -4.123 0.498 -2.093) 4.651 18.187 ( 7.622 -2.291 -0.179) 7.960 18.240 ( 8.669 -1.959 0.064) 8.887 18.349 ( 8.962 2.081 -2.496) 9.533 18.654 ( 7.897 -1.241 1.453) 8.125 27.705 ( 1.957 -2.487 0.684) 3.238 27.773 ( 1.076 0.050 -1.469) 1.822 27.873 ( 0.874 -0.472 0.052) 0.995 27.883 ( 0.387 0.203 -2.980) 3.012 28.880 ( 0.350 -0.111 -1.911) 1.945 29.064 ( -0.756 1.367 1.668) 2.286 29.108 ( 0.525 4.404 0.811) 4.509 29.601 ( -0.103 -3.557 -4.292) 5.576 29.815 ( -9.876 4.626 7.028) 12.975 30.130 ( -6.618 0.994 -0.354) 6.701 30.493 ( -1.116 11.453 3.340) 11.982 30.921 ( -6.249 -0.453 -2.500) 6.746 31.380 ( -4.671 -5.281 1.611) 7.232 31.755 ( 8.410 15.166 4.509) 17.918 32.313 ( 10.501 -9.367 1.451) 14.146 33.844 ( 11.778 -11.259 -7.820) 18.073 ======================= Grid point 91 (39/168) ======================= q-point: ( 0.40 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.314 ( 8.625 15.474 8.489) 19.644 2.579 ( -2.952 6.767 4.029) 8.411 2.673 ( 0.835 8.920 2.130) 9.209 2.841 ( 8.911 0.145 -4.570) 10.016 3.063 ( 1.094 -2.302 4.002) 4.745 3.294 ( 5.486 9.615 -7.543) 13.396 3.502 ( 6.672 -6.980 -0.503) 9.668 3.710 ( 3.582 3.447 0.919) 5.056 3.973 ( -4.508 6.791 3.559) 8.894 4.134 ( -1.472 -1.551 -2.570) 3.344 4.320 ( 9.124 17.193 -3.069) 19.704 4.617 ( 1.700 -12.266 3.347) 12.828 4.664 ( 1.808 4.360 -6.443) 7.987 4.785 ( -2.571 1.016 -1.921) 3.367 4.965 ( 0.943 -18.317 1.967) 18.447 5.148 ( 5.582 -0.224 0.607) 5.619 5.573 ( 2.149 -2.448 -0.825) 3.360 5.612 ( 0.252 9.489 0.573) 9.510 5.799 ( 7.012 -4.611 -2.944) 8.894 5.927 ( 0.799 -2.087 -5.312) 5.763 6.026 ( 0.845 -4.336 3.379) 5.562 6.233 ( -3.925 -13.314 3.876) 14.412 6.596 ( 1.667 -3.062 0.033) 3.486 6.675 ( 0.298 4.007 3.163) 5.114 6.768 ( 3.959 9.230 -5.120) 11.273 6.887 ( 3.068 7.331 5.506) 9.668 7.012 ( 0.359 2.028 1.265) 2.417 7.242 ( 8.242 0.184 0.283) 8.249 7.482 ( -0.831 2.387 1.915) 3.171 7.741 ( -0.520 5.279 -6.328) 8.257 8.017 ( 1.506 2.246 1.925) 3.319 8.022 ( -4.609 3.707 -2.844) 6.563 8.476 ( 1.678 -6.616 -5.375) 8.688 8.772 ( 0.748 -3.086 6.418) 7.161 8.997 ( 0.497 3.714 -5.010) 6.256 9.242 ( -1.477 -0.838 3.362) 3.766 11.074 ( 0.761 0.801 -0.379) 1.168 11.208 ( 1.665 3.864 -3.826) 5.687 11.625 ( -3.309 -4.158 2.059) 5.699 11.861 ( -0.418 -4.073 -2.115) 4.608 13.447 ( -1.663 -1.612 2.421) 3.351 13.554 ( -6.079 -1.062 -0.121) 6.173 13.768 ( -7.670 1.962 1.815) 8.123 14.207 ( -4.971 -2.126 -0.820) 5.469 15.221 ( 0.779 0.741 0.569) 1.216 15.335 ( 0.905 5.375 -0.925) 5.529 15.735 ( 1.736 -3.304 0.657) 3.789 15.914 ( 3.974 -0.486 -2.948) 4.972 16.095 ( 0.026 0.192 1.151) 1.167 16.319 ( -4.354 -3.094 -2.950) 6.102 16.398 ( -4.486 0.851 0.507) 4.594 16.530 ( -0.739 -0.242 5.041) 5.101 18.278 ( 4.312 -2.360 -0.423) 4.933 18.362 ( 5.452 -1.850 1.680) 5.998 18.434 ( 4.371 3.678 -0.508) 5.736 18.756 ( 3.773 -1.444 0.196) 4.044 27.742 ( 1.309 -3.079 0.436) 3.374 27.762 ( 0.490 0.305 -1.730) 1.823 27.866 ( 1.014 0.134 -0.223) 1.047 27.911 ( 0.661 -0.731 2.491) 2.679 28.878 ( 0.890 0.169 0.007) 0.906 29.059 ( -2.832 -0.469 2.810) 4.017 29.138 ( 1.864 5.117 0.360) 5.458 29.570 ( 0.961 -3.301 -1.990) 3.973 29.763 ( -6.772 4.179 6.393) 10.208 30.036 ( -3.935 0.827 -1.300) 4.226 30.500 ( -0.892 10.955 0.236) 10.994 30.829 ( -2.838 -0.235 -0.422) 2.879 31.323 ( -2.754 -5.631 -1.213) 6.385 31.870 ( 3.828 16.229 -1.642) 16.755 32.471 ( 5.195 -10.722 3.972) 12.559 33.909 ( 7.892 -9.265 -7.325) 14.205 ======================= Grid point 92 (40/168) ======================= q-point: (-0.50 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.343 ( -10.367 7.573 -3.674) 13.354 2.439 ( -12.515 14.512 -6.123) 20.117 2.687 ( 2.528 9.478 4.887) 10.960 2.935 ( 6.314 0.547 -2.336) 6.754 3.123 ( -2.971 -2.862 7.609) 8.655 3.404 ( 11.048 5.079 -2.502) 12.414 3.544 ( -0.073 -0.198 4.726) 4.731 3.762 ( -0.167 1.303 0.444) 1.387 3.941 ( -3.322 4.517 2.324) 6.069 4.065 ( 0.642 -2.268 -6.252) 6.682 4.344 ( -0.845 17.458 -5.420) 18.299 4.600 ( -0.874 1.082 -6.523) 6.669 4.695 ( 2.672 -7.309 4.370) 8.925 4.745 ( 0.363 -5.602 -1.148) 5.730 4.986 ( -1.875 -12.719 0.991) 12.895 5.234 ( 1.582 2.688 3.334) 4.565 5.581 ( 1.374 2.667 -0.391) 3.026 5.653 ( 1.502 3.842 0.494) 4.154 5.833 ( 3.230 -5.649 -3.380) 7.333 5.911 ( 1.623 -0.872 -2.444) 3.060 6.021 ( -3.201 -6.123 -2.230) 7.260 6.217 ( -3.122 -10.727 5.081) 12.273 6.645 ( -3.500 -3.458 0.837) 4.991 6.675 ( 1.011 -0.315 3.580) 3.733 6.738 ( 2.099 11.570 -6.853) 13.610 6.871 ( -6.006 5.000 -1.641) 7.985 7.035 ( -1.438 2.277 2.172) 3.460 7.303 ( -0.888 0.278 -0.713) 1.173 7.480 ( -1.918 2.465 1.336) 3.397 7.713 ( 5.483 5.355 -3.292) 8.342 7.957 ( -0.673 0.207 -0.856) 1.109 8.160 ( 7.681 5.252 8.423) 12.551 8.384 ( -1.417 -3.200 -9.922) 10.521 8.813 ( 1.552 -3.324 -1.224) 3.867 8.939 ( -2.222 0.514 -3.184) 3.916 9.225 ( -3.815 0.981 0.601) 3.985 11.110 ( 2.734 -0.010 1.658) 3.198 11.193 ( 1.629 2.954 -3.239) 4.677 11.603 ( -1.830 -3.219 1.399) 3.958 11.820 ( 0.340 -3.685 -4.611) 5.912 13.496 ( 2.282 -1.796 5.361) 6.097 13.524 ( -0.778 -3.058 3.988) 5.085 13.724 ( -0.685 3.230 2.073) 3.899 14.172 ( 1.175 -1.989 0.096) 2.312 15.229 ( -0.030 1.439 0.534) 1.535 15.343 ( 0.300 5.623 -0.012) 5.631 15.784 ( 1.173 -3.088 3.505) 4.816 15.951 ( 3.825 -0.909 -1.485) 4.203 16.109 ( 0.033 -1.208 0.327) 1.252 16.223 ( -1.565 -2.507 -5.215) 5.995 16.327 ( -3.618 2.639 -0.312) 4.489 16.597 ( 0.033 -0.786 6.443) 6.491 18.308 ( -0.134 -2.288 0.003) 2.292 18.427 ( -0.864 0.690 2.405) 2.647 18.492 ( 2.678 1.214 2.125) 3.627 18.773 ( -0.955 -1.478 -1.217) 2.140 27.733 ( -0.547 -1.552 -1.002) 1.927 27.775 ( 1.198 -0.456 -0.231) 1.303 27.898 ( 0.991 -1.274 2.524) 2.996 27.949 ( -0.279 -0.601 3.574) 3.635 28.910 ( 1.458 0.066 2.352) 2.768 29.046 ( -2.565 -0.421 2.344) 3.500 29.161 ( 0.233 6.013 0.703) 6.059 29.588 ( 2.516 -3.055 0.286) 3.968 29.746 ( -4.658 3.571 6.251) 8.575 29.988 ( 0.382 1.310 -1.838) 2.289 30.467 ( -1.671 10.228 -2.591) 10.683 30.831 ( 1.570 -0.570 2.488) 2.997 31.271 ( -0.190 -4.843 -3.719) 6.109 31.836 ( -1.691 13.529 -6.930) 15.295 32.551 ( -2.074 -8.540 5.289) 10.257 33.930 ( 5.568 -9.335 -7.223) 13.050 ======================= Grid point 93 (41/168) ======================= q-point: (-0.40 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.023 ( -16.898 6.786 -12.217) 21.929 2.125 ( -19.107 21.590 -4.152) 29.128 2.748 ( -4.966 5.930 7.919) 11.069 2.979 ( -0.174 -0.272 0.452) 0.555 3.167 ( -0.228 -0.785 5.800) 5.857 3.475 ( -5.348 -0.807 -0.224) 5.414 3.573 ( -0.516 1.432 -0.100) 1.526 3.736 ( -1.794 4.034 2.433) 5.041 3.940 ( 1.705 2.205 -1.420) 3.129 4.057 ( 4.901 -0.412 -1.601) 5.172 4.188 ( -9.434 16.525 -7.348) 20.398 4.464 ( -7.169 -3.468 -7.731) 11.099 4.683 ( -5.358 -4.558 -3.035) 7.661 4.770 ( -0.436 -3.629 0.181) 3.660 4.934 ( -4.014 -8.197 0.932) 9.175 5.255 ( -4.464 2.275 3.893) 6.345 5.533 ( -2.296 -4.157 -10.062) 11.127 5.657 ( -2.463 8.754 3.291) 9.671 5.842 ( 0.767 -6.355 -5.340) 8.336 5.885 ( -4.847 -1.592 -1.531) 5.326 5.959 ( 1.749 -3.876 3.263) 5.360 6.256 ( -1.552 -5.176 6.786) 8.674 6.518 ( -4.661 -2.559 -2.721) 5.973 6.704 ( -0.741 6.462 -0.368) 6.515 6.704 ( -7.858 -2.288 -4.475) 9.328 6.828 ( 4.730 -3.002 6.621) 8.673 7.041 ( 0.338 4.755 3.319) 5.808 7.239 ( -5.525 4.414 1.273) 7.185 7.464 ( -1.684 2.346 1.076) 3.082 7.800 ( 6.234 2.268 -1.129) 6.729 7.941 ( 0.331 -3.221 -2.763) 4.257 8.211 ( -3.486 1.198 -9.192) 9.903 8.401 ( 5.927 7.811 8.785) 13.165 8.833 ( 0.975 -4.897 1.122) 5.118 8.873 ( 6.162 -0.795 -10.186) 11.931 9.140 ( -5.426 0.919 -2.198) 5.926 11.169 ( 4.906 1.409 -4.398) 6.738 11.203 ( 0.576 -0.703 3.774) 3.881 11.593 ( -1.384 -2.372 0.653) 2.823 11.778 ( 1.953 -1.994 -5.250) 5.946 13.561 ( -2.254 -3.261 7.150) 8.176 13.665 ( 9.631 -2.955 5.390) 11.426 13.800 ( 7.268 3.404 2.169) 8.313 14.246 ( 7.567 -1.994 0.766) 7.863 15.239 ( -0.465 2.533 1.800) 3.142 15.340 ( -0.274 6.604 -0.323) 6.618 15.841 ( 0.136 -2.823 4.436) 5.260 15.990 ( 4.015 -0.687 -3.518) 5.382 16.094 ( -1.494 -2.945 0.508) 3.341 16.157 ( 1.566 -1.968 -7.011) 7.449 16.300 ( -1.924 3.907 3.461) 5.563 16.670 ( 0.849 -0.826 5.184) 5.318 18.275 ( -4.583 -2.074 0.754) 5.087 18.396 ( -6.097 2.750 2.222) 7.047 18.556 ( -0.144 -2.720 4.951) 5.651 18.701 ( -5.503 -1.271 -2.408) 6.140 27.715 ( -0.995 -1.701 -0.154) 1.977 27.784 ( 0.515 0.686 -0.295) 0.907 27.938 ( -0.729 -2.529 3.240) 4.174 27.989 ( 0.358 -0.532 3.881) 3.934 28.967 ( 0.573 -0.724 3.771) 3.882 29.035 ( -1.461 0.392 1.801) 2.351 29.173 ( 0.147 8.531 1.925) 8.747 29.647 ( 2.858 -2.563 1.905) 4.285 29.767 ( -2.079 2.598 7.337) 8.056 30.006 ( 4.435 2.229 -1.985) 5.345 30.388 ( -2.805 9.605 -5.119) 11.239 30.921 ( 4.453 -1.627 4.059) 6.241 31.235 ( 2.295 -3.427 -5.158) 6.605 31.672 ( -6.472 9.687 -9.868) 15.268 32.527 ( -8.764 -5.071 5.644) 11.592 33.919 ( 3.691 -11.707 -7.479) 14.374 ======================= Grid point 94 (42/168) ======================= q-point: (-0.30 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.582 ( -21.626 10.795 -10.766) 26.460 1.765 ( -21.625 26.381 -2.738) 34.221 2.745 ( -10.417 1.248 12.915) 16.639 2.883 ( -17.395 6.466 1.581) 18.625 3.175 ( -24.654 -2.576 0.810) 24.802 3.247 ( 3.007 -0.545 2.198) 3.764 3.560 ( -2.313 8.394 -6.903) 11.111 3.720 ( -3.291 3.074 0.941) 4.601 3.901 ( -2.650 -0.165 -11.599) 11.899 3.942 ( -7.822 -1.466 -5.493) 9.669 4.092 ( -5.682 3.239 -1.392) 6.687 4.273 ( -0.552 1.761 1.508) 2.383 4.556 ( -2.068 -0.821 -6.180) 6.569 4.688 ( -7.108 -2.893 -4.071) 8.687 4.865 ( -6.319 -4.285 -0.991) 7.699 5.186 ( -7.656 -6.344 1.199) 10.015 5.359 ( -4.438 2.665 -7.519) 9.128 5.614 ( -5.906 6.264 0.230) 8.612 5.715 ( -4.415 -2.121 -4.902) 6.929 5.872 ( 2.184 -6.972 -1.460) 7.451 5.993 ( -6.269 -3.543 7.049) 10.077 6.279 ( -4.194 1.982 3.685) 5.924 6.498 ( 0.598 -4.953 -1.234) 5.139 6.555 ( -2.936 -3.400 -2.237) 5.018 6.750 ( 5.057 1.466 4.455) 6.897 6.889 ( -2.414 2.900 1.417) 4.031 7.177 ( -2.196 3.003 7.831) 8.670 7.200 ( 4.261 1.826 4.810) 6.680 7.450 ( -1.734 1.937 1.196) 2.861 7.844 ( 2.820 -3.105 -2.760) 5.021 7.890 ( -0.214 -1.457 -5.505) 5.699 8.107 ( 0.808 1.910 -3.550) 4.111 8.517 ( 1.163 6.970 2.099) 7.371 8.817 ( -5.614 -3.530 6.512) 9.294 8.951 ( 9.704 1.747 -13.678) 16.861 9.064 ( 4.214 -4.845 0.972) 6.494 11.176 ( 2.226 -1.379 -3.493) 4.366 11.266 ( 3.201 0.149 0.899) 3.328 11.566 ( -2.246 -1.448 -0.478) 2.715 11.773 ( 3.276 -0.362 -2.671) 4.242 13.599 ( -1.567 -2.802 4.804) 5.778 13.902 ( 11.716 -1.715 5.219) 12.940 13.973 ( 10.861 1.280 2.125) 11.141 14.417 ( 12.462 -2.051 1.111) 12.679 15.263 ( -0.163 4.471 3.844) 5.898 15.335 ( 0.973 8.070 -0.996) 8.189 15.880 ( 0.007 -3.199 1.179) 3.410 15.976 ( 1.090 0.828 -4.051) 4.276 16.089 ( 0.068 -2.376 -3.980) 4.636 16.124 ( 4.812 -3.064 -4.071) 7.008 16.340 ( -1.726 3.555 8.235) 9.134 16.740 ( 1.661 -0.633 3.383) 3.822 18.187 ( -8.046 -1.849 1.442) 8.381 18.296 ( -9.532 2.777 1.940) 10.116 18.545 ( -7.746 -2.382 -3.653) 8.890 18.601 ( -5.671 -5.995 7.737) 11.312 27.697 ( -1.318 -1.108 0.264) 1.742 27.790 ( 0.420 1.211 -0.043) 1.283 27.944 ( -2.315 -1.886 2.367) 3.810 28.046 ( 1.153 -1.794 3.373) 3.991 28.978 ( -1.589 0.920 0.481) 1.898 29.060 ( -0.887 0.426 4.559) 4.664 29.241 ( 5.332 12.256 3.559) 13.831 29.708 ( 1.253 -1.502 3.611) 4.106 29.861 ( 1.239 1.527 10.423) 10.607 30.071 ( 6.725 3.620 -2.676) 8.093 30.266 ( -4.021 8.884 -6.470) 11.703 31.028 ( 4.199 -3.519 1.185) 5.605 31.238 ( 4.996 -1.648 -3.393) 6.260 31.432 ( -8.975 6.217 -10.057) 14.844 32.418 ( -13.266 -2.233 6.090) 14.767 33.863 ( 0.538 -17.421 -9.246) 19.730 ======================= Grid point 95 (43/168) ======================= q-point: (-0.20 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.149 ( -24.337 16.534 0.601) 29.428 1.394 ( -23.495 28.075 -1.174) 36.628 2.293 ( -48.453 23.076 0.737) 53.672 2.778 ( -9.220 -2.089 14.651) 17.436 2.921 ( -11.762 -3.009 -0.732) 12.163 3.165 ( -17.386 2.249 -0.967) 17.557 3.435 ( -5.312 4.805 -3.971) 8.189 3.588 ( -14.068 -2.887 -4.143) 14.947 3.696 ( 4.822 1.357 -6.895) 8.523 3.775 ( 0.380 -4.861 -10.816) 11.865 4.094 ( 0.768 2.348 4.249) 4.915 4.321 ( -1.984 -5.027 -3.813) 6.614 4.424 ( -6.616 -4.072 -3.037) 8.341 4.572 ( 1.336 5.116 -3.759) 6.487 4.753 ( -3.785 -1.158 0.728) 4.025 5.069 ( -6.063 -0.716 -1.845) 6.378 5.251 ( -4.230 -0.059 0.051) 4.231 5.478 ( -9.551 -1.615 -3.195) 10.200 5.640 ( 1.778 4.742 -4.426) 6.726 5.868 ( -2.807 -1.639 0.945) 3.385 5.988 ( -3.386 -7.396 6.509) 10.418 6.212 ( -6.156 6.014 0.351) 8.613 6.444 ( -0.956 -6.367 -2.300) 6.837 6.577 ( 1.331 -2.140 2.731) 3.716 6.839 ( -3.725 3.622 1.037) 5.298 6.901 ( 5.090 0.602 2.169) 5.566 7.163 ( -4.233 3.225 5.551) 7.690 7.306 ( -1.495 -1.101 0.010) 1.857 7.485 ( 3.597 0.221 4.057) 5.426 7.849 ( 2.462 -0.950 -1.549) 3.060 7.886 ( 2.647 -0.468 0.676) 2.772 8.121 ( 4.242 -2.902 -2.161) 5.576 8.519 ( 2.735 2.747 -6.346) 7.436 8.788 ( -6.891 -2.123 -0.730) 7.248 8.853 ( 0.524 2.437 -6.266) 6.744 9.249 ( 7.085 -11.134 6.906) 14.895 11.159 ( 0.905 -3.553 -3.384) 4.989 11.323 ( 4.220 2.075 -1.166) 4.846 11.519 ( -2.390 -1.042 -0.762) 2.716 11.810 ( 2.946 0.231 -0.061) 2.955 13.623 ( 0.087 -0.912 1.750) 1.976 14.090 ( 7.099 3.121 1.272) 7.859 14.188 ( 12.113 -3.468 3.028) 12.958 14.634 ( 13.371 -1.978 0.270) 13.519 15.305 ( 0.898 3.516 0.560) 3.672 15.389 ( 6.663 13.812 2.622) 15.558 15.856 ( -0.162 -1.782 -3.285) 3.741 15.967 ( 0.101 -0.337 -0.439) 0.563 16.038 ( 0.082 -2.746 -3.679) 4.592 16.158 ( 6.165 -1.150 -6.072) 8.729 16.426 ( -1.994 1.902 11.212) 11.546 16.795 ( 1.698 -0.438 1.425) 2.260 18.068 ( -9.343 -1.668 1.990) 9.697 18.155 ( -10.490 2.349 1.492) 10.853 18.360 ( -9.126 -1.577 -3.863) 10.035 18.559 ( -13.624 -16.231 7.615) 22.517 27.687 ( -0.371 0.696 0.728) 1.074 27.793 ( 0.259 1.090 -0.674) 1.307 27.926 ( -2.385 -1.236 1.026) 2.875 28.092 ( 0.798 -2.535 1.838) 3.232 28.962 ( 0.209 2.663 -0.873) 2.810 29.092 ( -2.100 1.595 5.264) 5.888 29.418 ( 15.837 19.540 -3.247) 25.360 29.792 ( 2.354 -0.591 7.483) 7.866 30.043 ( -0.011 -0.889 15.074) 15.100 30.087 ( 3.990 10.781 -7.644) 13.805 30.193 ( 0.448 5.334 5.942) 7.997 31.068 ( 3.895 -5.518 -4.161) 7.933 31.192 ( -7.891 4.090 -7.328) 11.519 31.309 ( 5.480 -0.973 -0.181) 5.568 32.267 ( -15.082 -0.998 6.781) 16.566 33.666 ( -10.215 -28.475 -17.332) 34.865 ======================= Grid point 96 (44/168) ======================= q-point: (-0.10 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.892 ( -26.798 16.778 15.050) 35.016 0.984 ( -23.297 26.137 7.586) 35.825 1.684 ( -34.833 45.611 17.361) 59.959 2.668 ( -12.334 -1.255 -10.820) 16.455 2.812 ( -6.112 -5.239 12.070) 14.508 2.868 ( -16.519 3.405 0.285) 16.868 3.186 ( -8.851 3.904 -3.193) 10.187 3.539 ( -1.009 -5.116 -3.282) 6.161 3.678 ( 2.885 -3.766 -5.001) 6.894 3.726 ( 6.844 -0.979 -8.006) 10.577 4.063 ( -10.521 -0.105 1.915) 10.694 4.227 ( 2.984 -3.707 0.620) 4.799 4.408 ( 3.761 -4.473 -1.248) 5.976 4.522 ( -2.388 -0.478 -1.883) 3.078 4.846 ( 5.827 2.219 6.725) 9.171 4.957 ( -4.193 2.729 -3.525) 6.119 5.229 ( -3.788 -0.605 5.151) 6.423 5.301 ( -5.093 -0.989 1.494) 5.399 5.649 ( 4.683 8.562 -3.506) 10.370 5.831 ( -2.932 1.800 1.733) 3.852 5.987 ( -7.576 -3.596 6.074) 10.355 6.151 ( -1.159 0.021 0.323) 1.203 6.437 ( 2.465 0.062 -1.301) 2.788 6.633 ( 2.625 -0.948 1.497) 3.167 6.799 ( -3.370 0.608 2.817) 4.434 6.963 ( 1.394 2.180 1.007) 2.776 7.164 ( -5.230 -1.368 3.321) 6.345 7.277 ( 4.122 -1.650 -0.399) 4.458 7.544 ( -3.001 -4.409 0.992) 5.425 7.882 ( 1.676 0.719 0.090) 1.826 7.937 ( 0.227 4.612 3.758) 5.954 8.154 ( 4.934 -5.058 -10.478) 12.637 8.443 ( 2.466 1.105 -14.774) 15.019 8.584 ( -6.194 1.217 -8.382) 10.493 8.824 ( -5.065 2.279 3.237) 6.429 9.358 ( -6.683 -19.089 9.801) 22.475 11.142 ( 1.644 -3.631 -2.542) 4.728 11.360 ( 3.028 4.426 -2.549) 5.938 11.493 ( -0.979 -2.639 1.317) 3.107 11.849 ( 1.580 0.181 0.186) 1.601 13.654 ( 2.411 2.844 0.764) 3.806 14.173 ( 4.293 4.590 -2.011) 6.599 14.372 ( 6.637 -4.060 2.018) 8.038 14.805 ( 8.804 -2.151 -2.234) 9.334 15.316 ( 0.934 3.450 -0.646) 3.632 15.510 ( 10.004 13.362 -14.889) 22.367 15.940 ( 1.271 -1.599 -1.018) 2.282 15.961 ( 9.400 0.845 17.741) 20.095 16.017 ( 1.138 -4.656 -2.549) 5.428 16.184 ( 5.555 2.547 -4.669) 7.691 16.510 ( -3.518 0.237 10.242) 10.831 16.817 ( 0.281 -0.685 -0.621) 0.966 17.957 ( -7.965 -1.705 2.844) 8.628 18.022 ( -7.044 1.759 -0.241) 7.265 18.189 ( -16.748 -10.945 -1.891) 20.096 18.244 ( -25.494 -13.372 -0.553) 28.794 27.705 ( 1.115 1.591 0.758) 2.085 27.776 ( 0.072 1.849 -2.507) 3.116 27.896 ( -1.682 -0.907 -0.489) 1.973 28.107 ( -0.073 -2.646 -0.355) 2.670 28.964 ( 1.804 2.057 -1.912) 3.337 29.112 ( -3.092 0.722 4.913) 5.850 29.525 ( 15.752 24.357 -27.225) 39.782 29.877 ( -0.732 3.088 -1.527) 3.522 30.008 ( 5.627 5.558 -4.057) 8.889 30.240 ( 1.991 4.329 6.207) 7.825 30.747 ( 34.512 1.543 51.148) 61.722 31.037 ( -1.369 0.399 -3.388) 3.676 31.104 ( 5.891 -2.901 -0.964) 6.637 31.377 ( 3.816 -1.039 -1.175) 4.126 32.087 ( -19.794 -3.496 3.847) 20.465 32.976 ( -44.744 -27.973 -29.567) 60.487 ======================= Grid point 97 (45/168) ======================= q-point: ( 0.00 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.246 ( 6.809 20.891 13.174) 25.619 1.606 ( -1.273 25.678 20.337) 32.781 2.206 ( -3.471 -1.239 -11.010) 11.610 2.653 ( -10.054 25.975 8.396) 29.091 2.752 ( -0.634 8.662 5.261) 10.155 2.859 ( 5.481 1.463 10.441) 11.883 3.159 ( 1.162 -2.722 1.015) 3.129 3.472 ( 2.461 2.226 -5.759) 6.646 3.668 ( 5.792 0.159 -3.830) 6.946 3.729 ( 6.107 0.561 -2.127) 6.491 3.999 ( -1.837 -0.898 5.165) 5.555 4.212 ( 4.724 -6.518 3.874) 8.934 4.327 ( 3.674 -7.550 1.412) 8.514 4.483 ( -0.789 -2.247 1.437) 2.781 4.895 ( 0.976 -0.756 -2.310) 2.619 4.980 ( -2.355 4.364 4.424) 6.646 5.215 ( -2.726 0.214 0.785) 2.845 5.371 ( -3.855 0.659 8.987) 9.801 5.720 ( 1.323 -4.754 0.123) 4.936 5.852 ( -1.820 -1.138 2.758) 3.495 5.902 ( -3.902 -3.137 5.942) 7.770 6.129 ( 0.925 0.152 0.760) 1.206 6.559 ( 1.035 5.732 2.367) 6.288 6.694 ( -4.746 4.301 -4.437) 7.792 6.817 ( 3.760 2.442 2.547) 5.156 7.018 ( -3.007 2.689 -1.912) 4.464 7.090 ( -0.121 3.478 -0.764) 3.563 7.320 ( -5.305 -4.205 0.825) 6.820 7.371 ( 4.319 -0.499 -0.705) 4.405 7.915 ( 0.123 2.225 0.307) 2.249 8.060 ( 11.467 -6.351 -13.010) 18.468 8.075 ( -3.629 2.539 0.429) 4.450 8.347 ( 2.417 -2.238 -0.694) 3.366 8.523 ( 4.032 -2.358 1.792) 5.003 8.816 ( -3.788 2.783 -1.690) 4.996 9.053 ( -2.469 -9.720 2.561) 10.350 11.115 ( 2.231 -0.281 -0.252) 2.262 11.373 ( 1.071 -6.649 2.621) 7.227 11.521 ( 0.269 7.053 -2.571) 7.512 11.843 ( 0.608 -1.836 -1.562) 2.486 13.788 ( -1.540 6.494 0.528) 6.695 14.257 ( -1.267 -0.703 -3.928) 4.186 14.340 ( -0.975 0.555 0.145) 1.131 14.754 ( -0.280 -5.374 -4.221) 6.839 15.420 ( 0.395 6.391 -0.867) 6.461 15.547 ( 1.789 5.601 -14.732) 15.862 15.823 ( 0.504 -4.069 -7.765) 8.781 15.902 ( 2.062 -5.951 -2.340) 6.719 16.220 ( 0.262 1.062 5.862) 5.963 16.340 ( 4.047 -0.891 4.454) 6.084 16.542 ( -4.980 -0.887 7.868) 9.354 16.724 ( -2.472 -3.465 -2.394) 4.884 17.708 ( -6.265 2.539 2.332) 7.151 17.869 ( -2.828 -1.756 1.697) 3.736 18.024 ( 0.782 2.199 0.828) 2.476 18.155 ( 2.417 -1.709 0.518) 3.005 27.730 ( -1.364 2.171 -1.828) 3.149 27.789 ( 0.497 0.536 -0.599) 0.946 27.846 ( -0.159 -1.055 -1.335) 1.709 28.018 ( -0.513 -3.841 -1.930) 4.330 28.988 ( -0.128 1.626 -1.835) 2.455 29.095 ( -3.496 -0.714 3.187) 4.784 29.656 ( -0.292 10.217 -23.470) 25.599 29.843 ( -1.248 1.125 -9.120) 9.273 30.224 ( 1.529 9.825 -0.455) 9.954 30.481 ( -2.722 8.629 7.997) 12.076 30.865 ( -4.691 -7.599 2.648) 9.315 31.007 ( 0.473 -4.779 6.827) 8.347 31.360 ( 1.051 -1.419 -1.626) 2.401 31.432 ( -11.519 -3.274 10.347) 15.826 31.835 ( 9.449 5.000 1.649) 10.817 32.425 ( 12.975 -10.576 5.313) 17.562 ======================= Grid point 98 (46/168) ======================= q-point: ( 0.10 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.680 ( 24.632 12.483 11.140) 29.777 1.887 ( 5.771 20.713 21.912) 30.699 2.142 ( 11.240 2.772 -10.743) 15.794 2.645 ( -0.047 20.743 5.322) 21.415 2.832 ( 1.625 4.294 3.768) 5.940 3.124 ( 12.780 7.725 7.223) 16.588 3.339 ( 11.290 0.155 1.685) 11.416 3.461 ( 9.713 0.171 -1.172) 9.785 3.760 ( 8.222 -1.121 0.413) 8.308 3.858 ( 9.338 6.421 1.522) 11.434 4.049 ( -0.265 -4.845 4.376) 6.535 4.360 ( 8.470 -6.769 3.733) 11.467 4.376 ( -1.576 -4.173 2.063) 4.915 4.527 ( 3.866 -3.551 3.334) 6.218 4.911 ( 2.451 -2.504 -0.333) 3.520 4.993 ( -4.753 6.473 8.118) 11.419 5.192 ( 1.924 -5.022 -4.040) 6.727 5.400 ( -3.263 -1.110 7.555) 8.304 5.747 ( 0.052 -5.727 3.396) 6.659 5.851 ( -4.594 -2.124 3.915) 6.399 5.924 ( -0.131 2.170 5.344) 5.769 6.162 ( 1.004 -3.474 2.682) 4.502 6.564 ( -3.205 3.446 -5.185) 7.002 6.593 ( -0.990 6.665 3.374) 7.536 6.874 ( -0.934 2.139 -3.041) 3.833 6.938 ( 3.040 4.089 -3.572) 6.223 7.084 ( -3.127 3.661 -0.799) 4.881 7.256 ( -4.197 -2.750 0.023) 5.018 7.403 ( 2.943 2.506 -1.208) 4.050 7.919 ( -1.511 1.962 0.047) 2.477 7.975 ( -0.740 -1.017 -3.155) 3.397 8.139 ( 6.507 -1.198 -0.498) 6.635 8.408 ( 5.706 -2.680 -2.106) 6.646 8.679 ( 3.965 -3.198 -7.151) 8.780 8.726 ( 4.728 1.787 2.998) 5.877 9.058 ( 0.934 -8.238 0.558) 8.310 11.145 ( 1.720 0.671 -0.408) 1.891 11.419 ( -1.215 -6.856 5.064) 8.609 11.488 ( 0.909 7.399 -4.525) 8.720 11.832 ( -0.129 -2.616 -0.859) 2.757 13.718 ( -7.209 5.704 0.260) 9.196 14.134 ( -7.948 -1.649 -4.539) 9.300 14.271 ( -6.643 1.268 -1.098) 6.851 14.638 ( -7.003 -5.344 -5.073) 10.166 15.355 ( -2.543 7.362 -6.654) 10.244 15.479 ( 3.396 5.823 -4.437) 8.070 15.736 ( -0.001 -4.681 -7.810) 9.105 15.903 ( 2.573 -5.313 -4.381) 7.351 16.237 ( -7.483 1.485 7.814) 10.920 16.332 ( -2.603 3.029 -0.236) 4.000 16.532 ( -9.293 -4.286 7.383) 12.619 16.683 ( 0.254 -4.182 -3.318) 5.344 17.797 ( 12.823 -0.705 -0.554) 12.854 17.903 ( 4.639 -2.005 1.281) 5.214 18.103 ( 8.056 2.637 0.235) 8.480 18.267 ( 8.836 -2.249 2.298) 9.403 27.687 ( -1.066 1.816 -1.726) 2.722 27.781 ( 0.526 -0.042 -1.961) 2.031 27.838 ( 0.678 -0.428 -1.000) 1.282 27.977 ( -0.859 -2.653 -3.089) 4.162 28.956 ( -0.736 1.546 -2.340) 2.900 29.078 ( -2.875 -0.762 2.677) 4.002 29.407 ( -1.075 9.968 -16.224) 19.072 29.707 ( -1.690 -2.265 -9.488) 9.900 30.192 ( -8.096 9.760 2.283) 12.885 30.420 ( -9.243 4.864 1.953) 10.626 30.755 ( -11.983 6.750 8.663) 16.255 31.120 ( -3.230 -3.511 7.729) 9.083 31.327 ( 2.099 -2.545 -0.033) 3.300 31.431 ( 2.082 5.341 7.539) 9.471 31.982 ( 7.038 1.882 -0.606) 7.310 32.905 ( 30.611 -22.209 2.591) 37.908 ======================= Grid point 99 (47/168) ======================= q-point: ( 0.20 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.114 ( 12.030 11.788 13.767) 21.753 2.285 ( 15.350 13.220 14.722) 25.043 2.298 ( 18.907 6.439 -3.420) 20.265 2.768 ( 9.111 12.954 1.909) 15.952 2.912 ( 7.665 5.177 -0.235) 9.252 3.228 ( 0.581 3.788 -5.583) 6.772 3.470 ( 11.934 0.347 -3.205) 12.362 3.796 ( 12.246 -1.234 4.538) 13.118 3.884 ( 5.283 5.709 3.345) 8.468 4.018 ( 11.877 4.418 1.381) 12.747 4.123 ( 5.819 -4.541 2.963) 7.954 4.351 ( -2.317 1.444 2.100) 3.444 4.545 ( 8.751 -7.728 -1.576) 11.780 4.627 ( 1.668 -3.220 8.208) 8.973 4.949 ( 4.429 -2.534 -2.764) 5.803 5.018 ( -5.791 6.977 10.434) 13.823 5.192 ( 6.771 -10.014 -6.963) 13.950 5.464 ( 0.074 -3.146 7.354) 7.999 5.796 ( -2.515 -3.072 2.360) 4.619 5.841 ( 0.721 -5.119 7.735) 9.303 5.994 ( 0.525 5.495 4.106) 6.880 6.213 ( 0.810 -1.254 2.034) 2.523 6.489 ( -0.998 0.569 -2.232) 2.511 6.626 ( 1.249 1.980 4.004) 4.638 6.747 ( -5.227 2.102 -7.446) 9.337 6.936 ( -5.423 1.753 -0.648) 5.736 7.021 ( 4.557 5.613 -6.267) 9.568 7.190 ( -1.058 0.519 -0.103) 1.183 7.480 ( 4.872 5.978 1.787) 7.916 7.909 ( 1.761 -0.806 0.932) 2.150 7.975 ( 0.416 4.161 -0.362) 4.197 8.244 ( 4.495 -1.963 2.350) 5.439 8.454 ( 1.644 -1.353 -3.572) 4.159 8.548 ( 0.595 2.173 -7.916) 8.231 8.934 ( 9.383 -5.085 4.195) 11.467 9.080 ( 2.430 -5.336 -2.161) 6.249 11.154 ( 0.662 1.926 -1.310) 2.421 11.413 ( -3.295 5.265 -0.063) 6.212 11.482 ( 1.268 -4.893 0.712) 5.104 11.818 ( -0.791 -3.849 -0.567) 3.970 13.595 ( -8.593 3.554 0.667) 9.323 13.919 ( -12.928 -3.253 -3.726) 13.842 14.125 ( -9.435 2.684 -1.822) 9.977 14.449 ( -9.731 -4.860 -3.906) 11.557 15.267 ( -0.183 6.636 -4.032) 7.767 15.482 ( 1.287 6.045 -2.525) 6.676 15.661 ( 0.621 -5.064 -5.422) 7.444 15.882 ( 2.581 -4.095 -5.934) 7.657 16.180 ( -7.037 2.218 3.975) 8.381 16.334 ( -0.558 1.670 3.758) 4.150 16.451 ( -7.904 -3.565 3.181) 9.236 16.625 ( -3.066 -3.093 -2.627) 5.086 18.000 ( 13.820 -2.771 -2.673) 14.346 18.023 ( 8.232 -2.051 1.761) 8.665 18.256 ( 10.774 2.892 -0.361) 11.162 18.449 ( 10.072 -2.593 2.421) 10.679 27.665 ( 0.188 0.733 -0.827) 1.121 27.767 ( 0.879 -0.818 -2.160) 2.471 27.843 ( 0.868 -0.189 -0.143) 0.900 27.927 ( -0.637 -1.237 -3.434) 3.705 28.918 ( -0.842 1.588 -1.811) 2.551 29.066 ( -2.673 -1.244 2.599) 3.930 29.269 ( 0.682 8.010 -7.884) 11.260 29.591 ( -0.911 -3.855 -7.027) 8.067 30.057 ( -12.321 8.309 4.706) 15.588 30.287 ( -8.903 2.133 -0.053) 9.155 30.742 ( -2.785 13.530 7.262) 15.606 31.050 ( -8.189 0.773 0.184) 8.228 31.326 ( -4.610 -5.855 2.129) 7.750 31.680 ( 12.090 -0.708 11.589) 16.762 32.095 ( 10.805 7.298 -4.385) 13.757 33.309 ( 21.047 -21.445 -2.209) 30.129 ======================= Grid point 100 (48/168) ======================= q-point: ( 0.30 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.408 ( 7.682 12.371 11.078) 18.297 2.595 ( 18.550 7.658 2.489) 20.222 2.622 ( 7.287 10.861 12.296) 17.952 2.884 ( 2.587 4.431 1.433) 5.327 3.056 ( 8.583 6.983 -7.128) 13.162 3.216 ( 11.014 0.301 -3.308) 11.504 3.513 ( 0.961 0.824 -6.264) 6.391 3.826 ( 2.440 9.836 -1.999) 10.330 4.069 ( 5.429 -1.978 1.036) 5.871 4.166 ( 1.042 -3.018 2.125) 3.835 4.251 ( 3.584 -5.375 3.924) 7.558 4.439 ( 12.750 10.065 0.512) 16.252 4.544 ( -4.281 -13.153 1.174) 13.881 4.769 ( 7.326 5.378 -2.699) 9.480 4.964 ( 4.647 0.406 -7.690) 8.994 5.058 ( -2.807 3.944 10.428) 11.497 5.254 ( 8.982 -13.011 -4.423) 16.417 5.539 ( -2.042 -6.875 7.512) 10.386 5.773 ( 0.545 -2.302 -2.264) 3.274 5.960 ( -2.883 -5.873 7.989) 10.326 6.038 ( 3.928 8.493 2.206) 9.614 6.156 ( -5.277 5.295 -4.800) 8.883 6.532 ( 1.293 -4.626 6.001) 7.686 6.607 ( 0.355 -0.739 -3.140) 3.245 6.756 ( 6.565 -0.781 4.639) 8.076 6.856 ( -1.846 1.570 1.514) 2.858 7.061 ( 6.653 6.376 -4.072) 10.075 7.227 ( 4.625 3.761 -0.163) 5.964 7.556 ( 1.947 7.450 1.759) 7.898 7.931 ( 0.410 3.672 -5.112) 6.308 7.995 ( 1.460 2.824 4.586) 5.580 8.273 ( -1.754 0.984 -6.015) 6.342 8.347 ( -0.432 -1.423 -5.568) 5.763 8.608 ( 4.939 -3.089 3.972) 7.051 9.073 ( 0.926 -3.387 -3.485) 4.947 9.100 ( 5.874 -3.139 3.659) 7.599 11.140 ( -0.374 3.515 -1.041) 3.685 11.353 ( -1.236 7.001 -3.526) 7.935 11.508 ( -1.319 -7.331 3.452) 8.210 11.789 ( -1.421 -5.524 -1.556) 5.912 13.481 ( -7.085 1.041 1.420) 7.301 13.679 ( -12.809 -3.181 -1.523) 13.285 13.956 ( -9.092 3.698 -1.322) 9.904 14.267 ( -8.628 -4.320 -2.206) 9.898 15.255 ( 1.465 5.086 -0.659) 5.333 15.463 ( 0.640 6.120 -2.521) 6.650 15.635 ( 1.077 -4.672 -1.783) 5.115 15.863 ( 3.512 -3.584 -5.221) 7.242 16.130 ( -3.201 2.302 1.460) 4.204 16.338 ( -4.791 -3.717 0.495) 6.084 16.404 ( -1.794 0.533 4.687) 5.047 16.544 ( -3.681 -1.711 -1.331) 4.272 18.146 ( 8.666 -1.564 -1.285) 8.899 18.186 ( 9.194 -2.616 0.785) 9.592 18.408 ( 8.615 3.333 -0.204) 9.239 18.613 ( 7.593 -2.694 1.642) 8.222 27.671 ( 0.968 -0.622 0.063) 1.152 27.760 ( 0.746 -1.335 -1.464) 2.117 27.862 ( 0.884 -0.330 1.075) 1.430 27.885 ( 0.021 -0.100 -2.776) 2.778 28.894 ( -0.480 1.580 -0.517) 1.731 29.052 ( -2.997 -1.651 2.854) 4.456 29.233 ( 2.139 6.259 -2.988) 7.258 29.520 ( 0.093 -4.048 -4.191) 5.827 29.943 ( -9.222 7.279 4.893) 12.727 30.154 ( -7.490 0.916 -0.373) 7.555 30.784 ( -1.111 16.142 3.724) 16.603 30.919 ( -6.630 0.667 -1.359) 6.800 31.262 ( -4.715 -5.858 0.590) 7.543 31.990 ( 10.317 -10.899 9.687) 17.862 32.198 ( 9.414 16.384 -5.431) 19.661 33.534 ( 13.300 -18.333 -4.230) 23.041 ======================= Grid point 101 (49/168) ======================= q-point: ( 0.40 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.574 ( 0.220 8.659 4.334) 9.686 2.781 ( 4.700 10.995 2.906) 12.306 2.884 ( 1.688 10.068 1.187) 10.278 2.930 ( 9.104 4.962 6.284) 12.124 3.019 ( -1.250 2.235 -4.060) 4.801 3.405 ( 11.721 -1.000 -2.013) 11.935 3.456 ( 1.497 5.610 -3.189) 6.624 3.863 ( 5.149 7.307 -2.860) 9.385 4.056 ( -2.118 -3.994 -4.490) 6.372 4.150 ( -4.893 6.022 2.500) 8.152 4.351 ( 1.801 -11.419 4.481) 12.398 4.490 ( -4.226 -15.903 2.311) 16.617 4.617 ( 10.461 10.201 -3.474) 15.019 4.787 ( 3.879 6.327 -6.757) 10.036 4.927 ( 2.056 4.209 -6.248) 7.809 5.171 ( 2.818 1.617 7.068) 7.779 5.345 ( 6.988 -14.759 -2.847) 16.576 5.570 ( -4.390 -8.226 7.305) 11.845 5.776 ( 3.551 -1.205 -2.316) 4.407 5.935 ( -2.305 1.678 -0.067) 2.852 6.055 ( -5.405 4.115 2.430) 7.214 6.138 ( 2.987 4.419 2.342) 5.825 6.523 ( 1.442 -4.041 -2.482) 4.957 6.694 ( -1.614 -3.172 5.718) 6.735 6.879 ( 7.147 1.746 -0.366) 7.367 6.935 ( 2.355 -0.892 3.835) 4.588 7.094 ( 2.495 6.988 -2.805) 7.932 7.310 ( 6.248 4.776 -1.409) 7.989 7.582 ( -0.647 7.499 1.428) 7.661 7.857 ( 0.246 4.781 -6.600) 8.154 8.057 ( 0.518 1.429 -1.991) 2.505 8.144 ( -1.450 8.075 -0.367) 8.212 8.315 ( 0.845 -8.194 -3.904) 9.115 8.717 ( 1.248 -3.374 4.902) 6.080 9.025 ( 0.105 -0.570 -6.138) 6.165 9.200 ( 1.830 -3.333 2.752) 4.693 11.127 ( -0.313 4.370 0.076) 4.382 11.300 ( 0.592 4.985 -4.904) 7.018 11.518 ( -2.288 -5.792 3.554) 7.170 11.745 ( -0.684 -6.929 -2.760) 7.490 13.420 ( -3.371 -0.754 2.728) 4.402 13.513 ( -8.412 -2.700 2.070) 9.074 13.834 ( -5.051 4.393 0.005) 6.694 14.144 ( -4.584 -3.968 -0.893) 6.128 15.277 ( 0.700 4.500 1.043) 4.672 15.459 ( 1.398 6.633 -0.970) 6.848 15.650 ( 1.098 -4.820 1.386) 5.134 15.873 ( 3.785 -3.815 -3.344) 6.329 16.109 ( -0.923 1.261 0.011) 1.563 16.253 ( -2.932 -3.204 -3.588) 5.634 16.415 ( -3.197 0.967 2.116) 3.954 16.516 ( -1.332 -1.241 4.355) 4.720 18.242 ( 4.919 -1.057 -0.775) 5.091 18.315 ( 5.407 -2.486 1.833) 6.227 18.511 ( 4.383 3.760 0.363) 5.786 18.714 ( 3.459 -2.650 0.578) 4.396 27.690 ( 0.713 -1.562 0.517) 1.793 27.757 ( 0.508 -1.075 -0.476) 1.281 27.866 ( 0.584 0.078 -1.243) 1.375 27.894 ( 0.592 -0.729 2.308) 2.492 28.894 ( -0.025 1.573 1.337) 2.065 29.039 ( -2.953 -1.549 3.119) 4.566 29.252 ( 2.282 5.405 -0.334) 5.876 29.498 ( 1.132 -3.583 -1.384) 4.004 29.878 ( -6.134 6.536 4.375) 9.974 30.055 ( -4.308 0.798 -0.494) 4.409 30.765 ( -1.592 11.299 -2.643) 11.713 30.845 ( -3.396 4.230 1.833) 5.726 31.209 ( -1.624 -4.273 -1.042) 4.688 32.129 ( 3.680 -13.346 -6.399) 15.251 32.320 ( 6.178 17.969 6.501) 20.082 33.643 ( 7.892 -16.393 -5.384) 18.974 ======================= Grid point 102 (50/168) ======================= q-point: (-0.50 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.485 ( -8.578 7.566 -6.665) 13.238 2.774 ( -7.109 14.246 -2.062) 16.054 2.905 ( 1.538 8.473 2.387) 8.936 2.947 ( -5.034 -1.337 -0.077) 5.209 3.127 ( 5.254 7.420 4.677) 10.224 3.497 ( 4.200 2.456 0.496) 4.891 3.527 ( 4.368 2.365 2.506) 5.563 3.903 ( 3.717 5.752 -4.552) 8.223 3.961 ( -0.830 -5.273 -5.904) 7.959 4.092 ( -2.512 5.493 -0.494) 6.060 4.389 ( -3.432 -8.822 3.858) 10.222 4.478 ( -1.214 -11.811 2.747) 12.187 4.671 ( 1.201 7.552 -5.511) 9.425 4.784 ( 4.798 7.568 -2.116) 9.207 4.896 ( -0.046 1.410 -3.883) 4.131 5.286 ( 0.693 0.875 7.560) 7.642 5.378 ( 2.158 -14.946 -4.411) 15.732 5.584 ( -3.506 -6.589 6.351) 9.800 5.793 ( 0.108 -3.886 -2.310) 4.522 5.948 ( 0.901 2.198 1.692) 2.916 6.011 ( -2.811 6.846 2.813) 7.917 6.176 ( -0.794 4.134 2.303) 4.799 6.545 ( 1.739 -4.167 -0.450) 4.538 6.659 ( -5.157 -3.605 0.917) 6.359 6.884 ( -6.804 -1.518 -5.560) 8.917 6.899 ( -1.904 3.112 -3.539) 5.083 7.118 ( 2.310 6.917 -0.013) 7.292 7.362 ( 1.215 3.770 -1.073) 4.103 7.571 ( -1.900 6.810 0.417) 7.083 7.827 ( 5.028 4.882 -4.714) 8.446 7.974 ( -2.064 1.160 -4.825) 5.375 8.272 ( 2.316 0.898 0.273) 2.499 8.291 ( 8.078 -1.150 2.484) 8.529 8.743 ( -3.435 -4.190 3.148) 6.267 8.939 ( 0.426 0.332 -9.407) 9.422 9.214 ( -2.023 -2.516 -0.086) 3.230 11.139 ( 1.500 2.767 0.583) 3.201 11.253 ( 0.867 2.633 -5.648) 6.292 11.529 ( -1.347 -3.347 3.588) 5.088 11.716 ( 1.605 -6.103 -3.282) 7.113 13.451 ( 2.132 -2.329 4.184) 5.242 13.465 ( -3.388 -2.426 5.694) 7.056 13.806 ( 0.852 4.735 0.974) 4.908 14.112 ( 1.281 -3.796 0.083) 4.008 15.301 ( 0.098 5.323 2.280) 5.791 15.475 ( 0.923 7.134 0.275) 7.199 15.699 ( 0.835 -5.112 4.234) 6.690 15.902 ( 3.623 -4.195 -1.766) 5.818 16.088 ( -1.254 -0.441 -1.244) 1.820 16.174 ( 0.125 -2.313 -6.157) 6.578 16.386 ( -2.764 3.127 2.229) 4.731 16.570 ( -0.110 -1.891 5.983) 6.276 18.278 ( 0.276 -0.592 -0.011) 0.653 18.393 ( 0.447 -2.925 3.556) 4.626 18.551 ( 0.031 3.480 0.606) 3.533 18.732 ( -1.191 -2.416 -0.515) 2.742 27.698 ( -0.389 -1.141 0.579) 1.337 27.769 ( 0.985 -0.757 0.372) 1.297 27.871 ( 0.291 -0.840 0.677) 1.117 27.931 ( 0.172 -1.157 2.886) 3.114 28.923 ( 0.163 1.322 3.401) 3.652 29.033 ( -2.317 -0.975 3.110) 3.999 29.289 ( 1.550 5.853 1.618) 6.268 29.526 ( 2.531 -3.012 1.250) 4.128 29.846 ( -3.858 5.936 3.603) 7.944 30.016 ( 0.040 1.106 -0.284) 1.142 30.707 ( -0.432 10.423 -5.111) 11.617 30.834 ( -0.198 1.952 1.726) 2.613 31.185 ( 0.383 -1.757 -1.631) 2.428 32.025 ( -2.267 -4.398 -12.143) 13.112 32.461 ( 0.046 8.715 8.093) 11.893 33.663 ( 3.501 -16.308 -6.449) 17.883 ======================= Grid point 103 (51/168) ======================= q-point: (-0.40 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.207 ( -13.474 10.749 -10.224) 20.040 2.577 ( -13.151 19.706 -3.856) 24.003 2.835 ( -10.874 -1.779 3.909) 11.692 2.941 ( -0.584 -0.216 0.973) 1.156 3.229 ( 3.192 7.102 2.748) 8.258 3.495 ( -8.345 4.446 4.206) 10.349 3.644 ( 5.425 1.732 2.679) 6.294 3.821 ( -1.853 0.722 -7.626) 7.881 3.936 ( 2.394 -1.329 -5.874) 6.481 4.096 ( 3.322 4.797 -0.672) 5.874 4.312 ( -9.752 -7.047 -0.318) 12.036 4.454 ( -4.800 4.187 -3.738) 7.385 4.592 ( -5.090 -0.704 0.408) 5.155 4.805 ( -4.673 -2.386 -0.240) 5.252 4.840 ( 0.466 7.135 -2.506) 7.577 5.248 ( -9.092 -6.514 -2.503) 11.462 5.394 ( 0.665 -3.448 2.214) 4.151 5.606 ( -3.224 -6.970 6.385) 9.987 5.708 ( -4.427 -7.589 -4.678) 9.954 5.892 ( -6.606 -1.549 -0.911) 6.846 6.054 ( -0.569 10.293 1.435) 10.408 6.227 ( 1.840 1.649 4.936) 5.520 6.456 ( -3.952 -2.056 -1.495) 4.699 6.653 ( -5.118 -0.179 -5.980) 7.873 6.759 ( 3.511 -4.008 6.425) 8.347 6.826 ( -2.031 3.001 -1.381) 3.878 7.140 ( 0.713 5.145 0.047) 5.194 7.319 ( -4.278 2.307 -0.437) 4.880 7.545 ( -1.714 5.985 -0.174) 6.228 7.849 ( 0.095 2.021 -6.598) 6.901 7.906 ( 2.696 0.231 -3.017) 4.053 8.223 ( 0.138 -0.450 -6.387) 6.405 8.545 ( 9.505 4.155 8.913) 13.676 8.717 ( -4.046 -5.345 4.438) 8.040 8.841 ( 4.115 -1.238 -12.767) 13.470 9.139 ( -4.573 -1.585 -3.626) 6.047 11.184 ( 2.436 -0.474 0.976) 2.667 11.200 ( 1.872 0.627 -6.885) 7.162 11.554 ( -0.726 -0.682 3.307) 3.454 11.721 ( 3.465 -3.413 -2.947) 5.687 13.500 ( -0.491 -2.072 5.835) 6.212 13.598 ( 8.142 -3.551 6.097) 10.774 13.883 ( 6.904 4.694 1.619) 8.504 14.186 ( 7.398 -3.793 0.844) 8.356 15.334 ( 0.012 6.496 3.574) 7.414 15.493 ( 0.641 8.068 0.890) 8.142 15.761 ( 0.074 -4.981 4.871) 6.967 15.947 ( 4.154 -4.394 -0.854) 6.107 16.040 ( -2.049 -1.268 -2.142) 3.224 16.114 ( 1.725 -2.142 -7.270) 7.773 16.389 ( -1.344 4.694 3.964) 6.289 16.640 ( 0.947 -2.255 5.027) 5.590 18.250 ( -4.431 -0.286 0.912) 4.533 18.402 ( -5.770 -2.860 4.993) 8.149 18.530 ( -3.466 1.185 0.501) 3.697 18.666 ( -5.783 -1.966 -1.188) 6.222 27.696 ( -0.777 0.055 0.931) 1.214 27.790 ( 0.872 -0.269 0.516) 1.048 27.886 ( -0.490 -1.995 2.016) 2.878 27.964 ( 0.113 -1.819 2.654) 3.220 28.970 ( -0.463 0.885 4.669) 4.775 29.039 ( -1.345 -0.154 3.015) 3.305 29.349 ( 2.672 7.766 4.183) 9.217 29.604 ( 3.969 -2.004 3.341) 5.561 29.843 ( -1.534 5.241 3.747) 6.623 30.047 ( 4.121 1.380 -0.174) 4.349 30.620 ( -1.344 11.521 -7.938) 14.056 30.882 ( 3.486 -2.050 1.169) 4.209 31.183 ( 1.760 -0.288 -1.420) 2.279 31.803 ( -6.828 -1.394 -13.538) 15.226 32.495 ( -6.544 6.099 6.877) 11.284 33.604 ( -1.034 -18.276 -7.663) 19.844 ======================= Grid point 104 (52/168) ======================= q-point: (-0.30 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.863 ( -16.091 15.776 -8.308) 24.017 2.286 ( -17.548 21.959 -5.251) 28.596 2.717 ( -12.595 -5.966 8.162) 16.151 2.908 ( -5.068 -2.415 0.752) 5.664 3.272 ( -4.383 4.177 0.836) 6.112 3.356 ( -15.469 15.047 7.845) 22.962 3.662 ( -4.407 -5.737 -3.949) 8.242 3.722 ( 0.039 7.687 -9.003) 11.838 3.871 ( -2.123 -4.253 -6.020) 7.671 3.978 ( -14.576 6.160 -8.304) 17.871 4.211 ( -1.922 1.064 2.471) 3.306 4.278 ( -7.017 4.695 -4.233) 9.444 4.458 ( -9.139 -7.048 -4.322) 12.324 4.740 ( -8.018 -3.566 0.208) 8.777 4.790 ( 0.237 5.644 -0.972) 5.732 5.077 ( -6.937 -3.935 -1.469) 8.110 5.360 ( -5.801 0.115 -0.229) 5.807 5.586 ( -9.857 -7.512 2.092) 12.568 5.626 ( 0.968 -6.358 0.608) 6.460 5.798 ( -2.718 -5.202 0.168) 5.871 6.007 ( -5.784 5.206 1.248) 7.881 6.186 ( -5.415 -5.482 -1.326) 7.818 6.533 ( -0.644 4.026 -2.668) 4.873 6.579 ( 6.815 7.878 4.988) 11.549 6.810 ( 1.971 2.633 2.855) 4.355 6.914 ( 1.737 -0.497 3.063) 3.556 7.187 ( 4.390 -0.960 3.734) 5.843 7.256 ( -4.348 1.895 2.179) 5.220 7.500 ( -3.780 3.198 -0.836) 5.022 7.760 ( 1.781 -2.711 -6.803) 7.537 7.903 ( 1.390 1.806 -4.418) 4.971 8.155 ( -0.321 1.343 -4.442) 4.651 8.664 ( -1.074 6.756 -2.650) 7.336 8.732 ( -2.829 -4.052 6.492) 8.159 8.863 ( 10.936 -9.889 -2.148) 14.899 9.004 ( -4.534 -1.025 -6.600) 8.072 11.147 ( 0.497 -1.200 -4.916) 5.085 11.238 ( 4.566 -2.913 -1.967) 5.762 11.572 ( -0.913 2.323 1.736) 3.041 11.756 ( 3.940 -1.409 -1.288) 4.378 13.569 ( 1.833 0.406 4.362) 4.749 13.828 ( 11.934 -4.997 5.740) 14.154 14.038 ( 9.680 4.540 1.496) 10.796 14.354 ( 11.975 -4.030 1.390) 12.711 15.380 ( 0.631 6.975 3.054) 7.641 15.529 ( 2.513 9.920 2.396) 10.510 15.802 ( -0.010 -4.459 2.036) 4.902 15.982 ( -0.393 -0.235 -3.334) 3.365 16.015 ( 2.093 -5.147 2.297) 6.012 16.057 ( 3.054 -2.714 -8.611) 9.531 16.429 ( -0.760 4.994 5.708) 7.622 16.710 ( 1.668 -2.397 3.529) 4.581 18.165 ( -8.238 -0.254 1.737) 8.423 18.325 ( -10.958 -1.391 4.792) 12.041 18.447 ( -7.758 -3.299 -0.613) 8.452 18.535 ( -9.896 -1.905 0.264) 10.081 27.700 ( -0.345 1.305 1.332) 1.896 27.805 ( 0.353 0.327 0.309) 0.572 27.897 ( -1.311 -2.322 2.087) 3.386 27.996 ( 0.526 -2.990 1.943) 3.604 29.002 ( -1.124 1.390 2.898) 3.405 29.064 ( -1.056 -0.059 4.548) 4.670 29.498 ( 8.751 10.758 7.816) 15.918 29.715 ( 4.816 1.400 3.332) 6.021 29.896 ( 0.724 3.082 7.306) 7.962 30.133 ( 7.415 1.748 -0.888) 7.670 30.485 ( -2.465 11.443 -10.202) 15.527 30.935 ( 3.411 -5.300 -2.674) 6.846 31.217 ( 3.569 0.227 0.358) 3.594 31.528 ( -8.779 0.887 -12.205) 15.060 32.422 ( -11.874 4.625 5.985) 14.079 33.443 ( -7.743 -21.969 -9.648) 25.212 ======================= Grid point 105 (53/168) ======================= q-point: (-0.20 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.547 ( -16.813 20.832 -1.045) 26.790 1.900 ( -24.073 21.617 -5.563) 32.829 2.628 ( -13.003 -7.645 10.182) 18.199 2.794 ( -9.051 -1.797 -1.274) 9.315 3.026 ( -25.895 27.255 6.519) 38.156 3.186 ( -13.914 3.367 -4.753) 15.083 3.466 ( -15.025 -2.827 -3.160) 15.612 3.591 ( -4.616 2.282 -2.584) 5.761 3.687 ( -2.081 0.231 -7.700) 7.980 3.791 ( -0.791 5.227 -9.534) 10.901 4.129 ( -1.656 0.774 -1.051) 2.109 4.212 ( -7.660 -4.681 -3.428) 9.609 4.294 ( -3.094 -7.157 -1.681) 7.976 4.588 ( -7.018 -4.707 -2.125) 8.714 4.836 ( 3.866 7.071 2.192) 8.351 5.005 ( -3.485 -2.342 0.751) 4.266 5.275 ( -5.099 2.558 2.305) 6.153 5.440 ( -10.550 -3.420 1.386) 11.177 5.663 ( 2.600 -3.978 0.365) 4.767 5.804 ( -0.180 -7.588 3.366) 8.303 5.937 ( -5.618 2.936 2.792) 6.927 6.118 ( -1.274 -5.917 -0.945) 6.126 6.508 ( 0.717 7.291 -2.250) 7.664 6.661 ( 0.743 9.546 2.666) 9.939 6.872 ( -3.028 -0.001 -1.806) 3.525 6.953 ( 4.573 3.760 4.039) 7.167 7.226 ( -1.759 3.058 1.488) 3.829 7.271 ( -2.828 -2.000 1.563) 3.800 7.451 ( -0.755 -3.769 0.946) 3.958 7.785 ( 8.606 -1.813 -3.763) 9.566 7.908 ( 3.886 0.046 -0.042) 3.886 8.109 ( -0.645 0.232 -2.273) 2.374 8.567 ( -0.311 1.446 -10.673) 10.775 8.718 ( -8.251 -4.449 2.522) 9.707 8.883 ( -0.453 0.298 -4.781) 4.812 9.000 ( 1.986 -11.035 5.982) 12.708 11.106 ( 1.022 -1.464 -4.099) 4.471 11.283 ( 3.848 -4.979 -1.430) 6.453 11.565 ( -0.890 4.908 -0.331) 4.999 11.806 ( 3.270 -0.916 -0.269) 3.406 13.657 ( 4.360 4.043 2.506) 6.452 14.074 ( 11.541 -6.262 4.197) 13.785 14.192 ( 8.270 5.465 0.148) 9.913 14.566 ( 12.545 -4.541 0.856) 13.369 15.409 ( 0.794 6.532 0.094) 6.581 15.648 ( 9.489 10.487 0.366) 14.147 15.813 ( -0.233 -2.353 2.290) 3.292 15.938 ( -1.603 -2.544 -1.307) 3.279 15.981 ( 0.101 -2.320 -6.136) 6.561 16.111 ( 7.009 -3.311 -1.241) 7.851 16.488 ( -1.419 4.061 7.096) 8.299 16.765 ( 1.129 -2.629 1.890) 3.429 18.043 ( -10.152 -0.671 2.460) 10.468 18.186 ( -13.174 -1.288 4.570) 14.004 18.266 ( -12.922 -4.768 -2.348) 13.973 18.364 ( -13.042 -2.861 0.992) 13.388 27.718 ( 0.655 2.298 1.489) 2.815 27.806 ( -0.234 0.455 -0.258) 0.573 27.891 ( -1.663 -1.893 1.023) 2.719 28.022 ( 0.666 -4.087 0.961) 4.251 29.008 ( -0.538 2.087 0.719) 2.272 29.097 ( -2.209 -0.472 5.163) 5.636 29.803 ( 15.946 13.787 -7.035) 22.223 29.830 ( 9.611 5.794 14.002) 17.944 30.033 ( 0.438 -0.085 11.970) 11.979 30.258 ( 10.996 3.300 0.082) 11.480 30.337 ( -2.060 9.783 -6.213) 11.771 30.917 ( 1.568 -8.760 -6.331) 10.921 31.282 ( -3.609 2.462 -6.526) 7.854 31.294 ( 1.142 0.775 -0.470) 1.458 32.275 ( -14.886 2.801 5.375) 16.072 33.109 ( -19.530 -24.024 -12.872) 33.530 ======================= Grid point 106 (54/168) ======================= q-point: (-0.10 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.289 ( -21.647 21.208 6.292) 30.951 1.539 ( -13.559 27.111 5.901) 30.882 2.458 ( -15.526 -2.336 -2.581) 15.911 2.703 ( -2.724 -6.176 5.910) 8.971 2.749 ( -16.143 36.383 6.604) 40.348 2.902 ( -15.918 1.193 -0.185) 15.964 3.235 ( -10.578 -1.851 0.857) 10.773 3.504 ( -0.588 1.613 -4.230) 4.565 3.658 ( 2.550 2.210 -3.961) 5.203 3.710 ( 4.767 0.572 -9.054) 10.248 4.040 ( -9.588 -0.876 2.483) 9.943 4.132 ( 2.468 -5.772 -0.297) 6.285 4.279 ( 2.226 -6.634 -1.299) 7.117 4.499 ( -3.367 -3.850 0.621) 5.153 4.916 ( 2.261 3.493 -0.769) 4.232 4.962 ( -1.629 -0.520 0.912) 1.938 5.257 ( -5.380 3.396 5.568) 8.455 5.331 ( -5.051 1.709 4.871) 7.223 5.699 ( 2.169 -3.393 -0.767) 4.099 5.844 ( -0.912 -6.133 3.880) 7.315 5.900 ( -4.158 -0.358 4.266) 5.968 6.112 ( 0.820 -1.061 -0.288) 1.371 6.516 ( 2.335 6.262 -0.224) 6.687 6.718 ( 3.555 8.761 1.542) 9.579 6.798 ( -3.647 0.055 -0.840) 3.743 7.020 ( 0.438 2.669 1.532) 3.108 7.170 ( -5.882 1.083 -0.662) 6.018 7.267 ( 4.004 2.378 0.246) 4.664 7.425 ( -4.069 -7.196 -0.619) 8.290 7.888 ( 5.317 1.442 -0.627) 5.545 7.995 ( 7.013 -4.880 -2.083) 8.794 8.095 ( 1.527 1.130 -1.492) 2.416 8.419 ( -2.193 -2.582 -10.603) 11.131 8.564 ( -8.034 -2.226 -1.532) 8.476 8.859 ( -2.400 1.008 1.745) 3.134 9.056 ( -2.478 -10.566 4.874) 11.897 11.093 ( 1.884 -0.971 -1.955) 2.884 11.328 ( 2.524 -6.140 0.494) 6.657 11.543 ( -0.287 6.414 -1.594) 6.615 11.841 ( 1.913 -1.324 -1.023) 2.541 13.751 ( 4.150 6.374 1.373) 7.729 14.249 ( 5.896 -6.244 0.330) 8.594 14.296 ( 5.423 5.840 -0.046) 7.970 14.729 ( 7.725 -5.096 -1.512) 9.377 15.416 ( 0.899 6.306 -0.855) 6.427 15.676 ( 5.185 3.984 -15.059) 16.417 15.890 ( 0.282 -3.145 -3.727) 4.884 15.910 ( 0.064 -5.476 -2.387) 5.974 16.012 ( 9.125 3.721 12.091) 15.598 16.207 ( 6.800 -0.334 -0.650) 6.839 16.534 ( -3.553 2.269 7.134) 8.287 16.777 ( -1.456 -3.202 0.080) 3.518 17.905 ( -14.366 -2.606 3.821) 15.092 17.977 ( -17.104 -4.009 1.602) 17.640 18.066 ( -7.127 2.284 0.348) 7.492 18.194 ( -6.748 -1.472 -1.188) 7.008 27.746 ( 0.785 2.592 0.464) 2.748 27.793 ( -0.518 0.296 -0.724) 0.938 27.870 ( -1.320 -1.462 -0.455) 2.022 28.034 ( 0.209 -4.405 -0.385) 4.426 29.003 ( -0.064 2.013 -0.727) 2.141 29.108 ( -3.274 -0.779 4.214) 5.393 29.846 ( 7.379 9.649 -13.655) 18.276 29.967 ( -3.603 4.958 -8.645) 10.598 30.163 ( 10.666 8.900 -1.548) 13.977 30.354 ( 2.160 6.615 7.565) 10.279 30.698 ( 21.785 -5.852 22.861) 32.116 30.891 ( 2.448 -9.755 -0.089) 10.058 31.179 ( 4.663 4.920 -2.258) 7.144 31.350 ( 2.665 -1.565 -0.211) 3.097 32.062 ( -19.461 1.750 0.631) 19.550 32.578 ( -25.718 -13.954 -9.032) 30.622 ======================= Grid point 107 (55/168) ======================= q-point: ( 0.00 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.658 ( 2.744 19.116 6.746) 20.456 2.009 ( -0.151 -14.519 -2.539) 14.740 2.109 ( 0.733 22.620 11.677) 25.467 2.505 ( -0.208 -15.470 6.399) 16.742 2.903 ( 2.027 5.037 4.785) 7.238 3.032 ( 0.771 -7.049 1.703) 7.292 3.465 ( -0.960 22.330 0.933) 22.370 3.544 ( -1.179 9.385 -1.463) 9.571 3.622 ( 2.770 -3.450 -2.371) 5.020 3.801 ( 5.695 1.308 -2.657) 6.419 3.995 ( -1.742 0.765 6.194) 6.479 4.086 ( 4.451 -5.232 4.344) 8.128 4.248 ( 1.837 -0.075 3.769) 4.194 4.347 ( 0.403 -9.395 3.429) 10.009 4.906 ( 0.312 2.862 -2.619) 3.892 4.995 ( 1.643 -3.730 -0.117) 4.077 5.277 ( -6.701 6.064 3.178) 9.580 5.382 ( -5.142 -1.909 6.267) 8.328 5.627 ( -0.734 -1.427 4.302) 4.592 5.709 ( -2.090 -7.871 7.190) 10.863 5.951 ( -1.310 5.177 1.314) 5.499 6.071 ( -1.747 -5.447 0.826) 5.780 6.680 ( 1.769 4.913 0.216) 5.226 6.738 ( -0.792 -0.693 -1.801) 2.086 6.956 ( 0.074 9.492 -2.335) 9.775 7.087 ( 0.055 3.206 -1.640) 3.601 7.143 ( 1.745 0.613 0.085) 1.852 7.162 ( -2.601 -8.490 -0.296) 8.885 7.501 ( 3.113 12.045 -1.456) 12.526 7.807 ( 5.560 -15.558 -6.564) 17.778 7.983 ( 0.692 3.361 0.564) 3.477 8.060 ( -0.624 -3.491 1.050) 3.698 8.370 ( 1.765 3.901 -1.232) 4.455 8.458 ( 1.219 -3.984 0.685) 4.222 8.860 ( -1.743 1.890 -0.730) 2.673 8.915 ( -0.781 -4.150 0.454) 4.248 11.143 ( 1.667 3.066 1.439) 3.775 11.238 ( 0.968 -6.012 2.549) 6.601 11.665 ( 0.881 6.627 -2.945) 7.306 11.780 ( 0.876 -4.462 -2.647) 5.262 13.942 ( -1.790 8.444 0.244) 8.635 14.121 ( -1.965 -8.663 -0.339) 8.889 14.466 ( -0.320 7.845 -3.302) 8.518 14.624 ( -0.443 -7.260 -3.913) 8.259 15.566 ( 1.207 7.416 -1.564) 7.674 15.632 ( 1.956 2.507 -10.733) 11.194 15.744 ( 0.327 -3.272 -8.560) 9.170 15.767 ( 1.201 -6.496 -2.635) 7.112 16.260 ( 1.303 2.670 6.379) 7.037 16.313 ( 3.565 -2.154 4.913) 6.441 16.567 ( -5.185 2.956 1.917) 6.269 16.644 ( -3.497 -4.159 -1.200) 5.565 17.767 ( -4.329 3.016 2.052) 5.661 17.825 ( -3.401 -2.567 1.746) 4.605 18.070 ( 1.277 2.295 0.597) 2.693 18.116 ( 1.817 -2.116 0.426) 2.822 27.770 ( -1.136 1.454 -2.012) 2.730 27.792 ( -0.290 -0.608 -1.475) 1.622 27.852 ( 0.261 2.499 -0.219) 2.522 27.930 ( -0.028 -4.461 -0.978) 4.567 29.027 ( -1.473 2.135 -0.090) 2.596 29.069 ( -2.543 -1.785 1.756) 3.568 29.801 ( -2.970 4.620 -18.435) 19.236 29.854 ( -2.673 -0.659 -14.434) 14.694 30.433 ( 2.702 10.472 0.011) 10.815 30.613 ( -4.254 -2.497 0.109) 4.933 30.736 ( 4.009 1.704 13.370) 14.062 30.879 ( -4.247 -7.576 12.885) 15.539 31.337 ( 3.131 -0.303 0.261) 3.156 31.359 ( 4.546 -2.580 6.134) 8.059 32.003 ( 1.132 9.854 -0.460) 9.929 32.212 ( 3.913 -10.392 1.825) 11.253 ======================= Grid point 108 (56/168) ======================= q-point: ( 0.10 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.918 ( 17.846 10.626 6.226) 21.683 2.094 ( 13.886 -5.832 -2.314) 15.238 2.298 ( 4.371 17.949 13.719) 23.011 2.605 ( 3.265 -11.335 7.262) 13.852 3.043 ( 8.267 8.064 1.316) 11.624 3.191 ( 13.749 -5.839 1.694) 15.033 3.491 ( -0.273 6.682 -4.363) 7.985 3.542 ( 8.099 7.943 1.560) 11.450 3.723 ( 8.352 2.835 4.493) 9.899 3.892 ( 5.913 -5.466 0.150) 8.054 4.082 ( 4.767 8.678 4.878) 11.038 4.233 ( 7.763 -5.150 4.153) 10.200 4.341 ( 1.401 0.497 7.632) 7.775 4.419 ( 2.325 -6.984 5.837) 9.394 4.896 ( 1.606 2.766 -1.814) 3.677 5.016 ( 2.968 -6.391 -2.966) 7.645 5.215 ( -6.497 8.265 5.176) 11.718 5.366 ( -4.388 -4.586 5.241) 8.231 5.664 ( -2.507 0.119 7.055) 7.488 5.746 ( -4.074 -6.133 7.356) 10.408 5.977 ( 1.810 2.910 3.069) 4.600 6.063 ( -0.234 -5.177 1.893) 5.517 6.650 ( -2.109 4.089 -5.949) 7.520 6.691 ( -1.028 0.889 -2.751) 3.068 6.948 ( 0.662 5.336 -2.126) 5.782 7.045 ( 3.556 1.411 -4.056) 5.576 7.106 ( -6.981 0.746 0.266) 7.026 7.183 ( -2.543 -3.157 1.177) 4.221 7.543 ( 5.139 12.111 0.599) 13.169 7.827 ( 3.699 -12.497 -2.286) 13.232 8.001 ( 1.255 4.328 1.595) 4.780 8.086 ( 3.165 -3.572 0.835) 4.845 8.406 ( 4.938 2.969 -3.627) 6.808 8.521 ( 5.430 -7.798 -2.430) 9.808 8.827 ( 0.306 5.160 -0.415) 5.186 8.930 ( 1.860 -5.139 1.110) 5.577 11.185 ( 0.894 3.370 2.088) 4.064 11.282 ( -0.047 -5.999 3.806) 7.105 11.637 ( 0.294 6.802 -3.641) 7.721 11.757 ( 0.140 -4.815 -2.664) 5.504 13.857 ( -8.559 7.634 -0.412) 11.476 14.018 ( -9.467 -7.691 -1.525) 12.292 14.374 ( -5.582 6.763 -4.021) 9.647 14.514 ( -6.422 -6.674 -4.866) 10.462 15.503 ( -1.511 6.709 -7.599) 10.249 15.591 ( 3.211 2.689 -4.554) 6.188 15.650 ( 0.057 -1.067 -7.503) 7.579 15.768 ( 2.618 -7.455 -3.259) 8.547 16.289 ( -7.129 3.395 7.539) 10.917 16.354 ( -4.632 -1.920 4.731) 6.894 16.502 ( -4.110 2.280 0.041) 4.700 16.586 ( -0.294 -4.933 -3.413) 6.006 17.815 ( 7.666 1.924 0.448) 7.917 17.860 ( 5.530 -2.265 0.762) 6.024 18.158 ( 8.134 2.766 0.989) 8.648 18.215 ( 8.440 -2.744 1.747) 9.045 27.728 ( -0.991 1.987 -2.241) 3.155 27.764 ( -0.219 -1.490 -2.375) 2.812 27.855 ( 0.452 2.145 -0.493) 2.247 27.914 ( -0.153 -3.316 -1.561) 3.668 28.998 ( -1.624 2.416 -0.668) 2.987 29.047 ( -2.361 -2.139 1.191) 3.401 29.562 ( -2.412 5.725 -14.683) 15.943 29.653 ( -2.489 -3.322 -12.434) 13.109 30.383 ( -8.955 7.855 -0.390) 11.918 30.474 ( -10.952 -0.590 -0.441) 10.977 30.872 ( -0.773 5.737 10.037) 11.587 31.007 ( 1.816 -7.019 12.403) 14.367 31.329 ( -5.046 3.550 0.452) 6.186 31.431 ( -3.214 -4.629 6.803) 8.834 32.156 ( 15.801 13.976 -0.100) 21.095 32.492 ( 23.211 -18.359 2.707) 29.718 ======================= Grid point 109 (57/168) ======================= q-point: ( 0.20 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.275 ( 15.561 5.684 8.644) 18.686 2.352 ( 16.664 -1.165 3.784) 17.128 2.559 ( 11.533 12.190 9.401) 19.235 2.757 ( 6.555 -6.865 5.089) 10.770 3.174 ( 10.674 12.300 -4.156) 16.808 3.334 ( 5.411 -0.635 -6.985) 8.858 3.479 ( 4.805 6.547 -0.923) 8.173 3.701 ( 7.551 -10.104 1.450) 12.697 3.920 ( 8.176 -1.304 2.606) 8.680 3.944 ( 3.028 -2.826 -2.215) 4.697 4.249 ( 9.824 10.825 1.754) 14.723 4.396 ( 7.361 1.251 3.459) 8.229 4.463 ( 2.440 -1.101 5.581) 6.190 4.551 ( 4.127 -5.463 9.758) 11.920 4.925 ( 5.167 1.847 -1.617) 5.721 5.017 ( 4.092 -5.890 -6.188) 9.472 5.207 ( -4.560 9.198 7.960) 12.991 5.380 ( -2.509 -6.626 6.259) 9.454 5.729 ( -1.345 -0.678 8.956) 9.081 5.758 ( -2.540 -2.693 5.827) 6.903 6.070 ( 4.164 1.587 3.794) 5.852 6.127 ( 3.487 -4.772 4.884) 7.667 6.545 ( -1.866 4.004 -6.577) 7.922 6.619 ( -1.283 -2.627 -5.544) 6.268 6.860 ( -6.536 6.865 -4.581) 10.528 6.952 ( -8.933 -1.389 -2.315) 9.332 7.106 ( 5.432 2.834 -1.009) 6.209 7.159 ( 1.707 -2.621 2.222) 3.837 7.666 ( 5.997 11.723 2.448) 13.394 7.866 ( 2.567 -5.623 0.840) 6.238 8.065 ( 3.277 4.983 2.080) 6.316 8.173 ( 5.305 -4.874 1.078) 7.285 8.425 ( 3.421 0.946 -4.209) 5.506 8.512 ( 1.901 -6.105 -7.837) 10.114 8.893 ( 5.084 3.176 2.915) 6.666 8.990 ( 4.263 -4.793 0.160) 6.417 11.215 ( 0.111 4.132 1.786) 4.503 11.322 ( -0.674 -6.284 4.303) 7.646 11.586 ( -1.048 7.286 -4.341) 8.546 11.721 ( -1.054 -5.722 -2.695) 6.412 13.691 ( -11.516 5.651 -0.013) 12.828 13.815 ( -13.444 -6.124 -1.370) 14.837 14.218 ( -8.374 5.681 -3.438) 10.687 14.339 ( -8.923 -5.848 -3.892) 11.356 15.411 ( -0.315 7.141 -5.247) 8.867 15.547 ( 0.096 -6.022 -5.791) 8.356 15.619 ( 2.284 7.084 -2.897) 7.987 15.766 ( 2.423 -6.878 -4.057) 8.345 16.240 ( -6.999 3.543 4.479) 9.033 16.316 ( -6.501 -3.486 4.551) 8.668 16.451 ( -1.686 3.520 -0.742) 3.973 16.541 ( -1.463 -4.704 -2.361) 5.463 17.973 ( 11.530 -0.010 -0.681) 11.550 17.989 ( 9.337 -1.366 0.478) 9.448 18.320 ( 10.296 3.280 0.944) 10.847 18.387 ( 10.054 -3.279 1.945) 10.753 27.694 ( -0.324 1.928 -1.665) 2.568 27.736 ( 0.093 -2.020 -2.109) 2.922 27.857 ( 0.561 1.444 -0.403) 1.601 27.893 ( 0.012 -1.917 -1.724) 2.578 28.965 ( -1.712 2.808 -0.347) 3.307 29.024 ( -2.395 -2.673 1.299) 3.817 29.408 ( -0.326 5.707 -8.676) 10.390 29.508 ( -0.868 -4.333 -8.140) 9.263 30.215 ( -11.569 6.371 1.592) 13.303 30.298 ( -10.650 -1.568 -0.140) 10.766 30.982 ( -0.019 8.546 7.671) 11.484 31.089 ( -7.668 -0.248 7.788) 10.932 31.254 ( -2.065 3.841 -1.696) 4.679 31.486 ( 3.805 -13.778 4.918) 15.116 32.424 ( 16.999 20.534 -0.209) 26.659 32.862 ( 20.153 -21.933 0.569) 29.791 ======================= Grid point 110 (58/168) ======================= q-point: ( 0.30 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.574 ( 7.876 5.818 10.344) 14.243 2.657 ( 11.937 -1.486 8.913) 14.971 2.825 ( 11.341 7.247 3.970) 14.032 2.908 ( 7.102 -1.237 2.302) 7.568 3.261 ( 5.681 9.167 -8.784) 13.909 3.309 ( 7.910 5.161 -6.171) 11.282 3.544 ( 2.972 4.985 -0.747) 5.851 3.785 ( 1.567 -14.233 1.878) 14.442 3.964 ( 4.202 -2.288 -4.606) 6.642 4.007 ( 4.414 -6.733 -2.667) 8.481 4.351 ( 0.185 9.942 3.494) 10.539 4.468 ( -5.387 -0.282 4.377) 6.947 4.603 ( 12.393 6.319 0.857) 13.938 4.754 ( 11.514 -7.901 0.325) 13.968 4.961 ( 3.218 3.106 -7.119) 8.407 5.042 ( 7.626 -6.069 -3.947) 10.515 5.226 ( -5.481 8.688 8.445) 13.298 5.403 ( -5.200 -7.641 7.463) 11.879 5.770 ( 0.794 3.477 3.153) 4.761 5.860 ( 1.313 -4.089 8.810) 9.801 6.153 ( 3.075 3.293 -1.074) 4.632 6.214 ( 1.562 -1.523 -1.117) 2.451 6.471 ( -1.946 0.918 1.098) 2.415 6.547 ( -0.948 -4.674 -1.300) 4.943 6.795 ( 2.731 3.758 1.435) 4.862 6.854 ( -1.057 -1.638 1.367) 2.382 7.183 ( 6.141 5.096 -1.208) 8.071 7.253 ( 6.433 -1.306 0.676) 6.599 7.747 ( 2.149 10.116 0.769) 10.370 7.911 ( 2.053 -4.911 -0.901) 5.398 8.118 ( 0.458 6.873 0.312) 6.896 8.222 ( 1.670 -3.554 -2.796) 4.821 8.384 ( -0.654 3.560 -6.858) 7.755 8.507 ( 4.115 -7.191 0.918) 8.336 8.999 ( 4.149 0.194 1.181) 4.318 9.054 ( 4.410 -3.475 -0.522) 5.639 11.232 ( -0.333 5.408 1.690) 5.676 11.359 ( -0.670 -6.885 3.633) 7.813 11.508 ( -2.160 7.711 -4.472) 9.172 11.660 ( -2.204 -7.014 -3.317) 8.066 13.524 ( -10.112 3.057 1.296) 10.643 13.600 ( -12.406 -4.143 0.360) 13.085 14.053 ( -8.007 5.452 -2.161) 9.925 14.166 ( -8.091 -5.418 -2.288) 10.003 15.378 ( 0.938 6.584 -1.695) 6.863 15.506 ( 1.149 -5.166 -2.766) 5.972 15.620 ( 1.269 6.236 -1.804) 6.614 15.758 ( 2.391 -6.412 -3.537) 7.703 16.188 ( -3.433 3.221 0.678) 4.756 16.259 ( -4.224 -3.747 0.192) 5.650 16.436 ( -1.588 2.413 2.409) 3.761 16.494 ( -2.500 -2.964 0.030) 3.878 18.129 ( 9.158 -0.040 -0.713) 9.186 18.144 ( 9.012 -1.439 0.611) 9.147 18.478 ( 8.233 3.527 0.846) 8.997 18.550 ( 7.748 -3.409 1.494) 8.596 27.681 ( 0.247 1.432 -0.667) 1.599 27.721 ( 0.283 -2.235 -1.107) 2.510 27.865 ( 0.681 0.532 0.236) 0.896 27.878 ( 0.281 -0.582 -1.308) 1.459 28.942 ( -1.507 2.936 0.844) 3.406 29.004 ( -2.456 -2.907 2.035) 4.316 29.347 ( 1.352 4.901 -3.925) 6.422 29.438 ( 0.591 -4.134 -4.177) 5.907 30.080 ( -8.572 5.434 2.316) 10.410 30.151 ( -8.146 -1.575 0.382) 8.306 30.961 ( -7.418 3.527 0.655) 8.240 31.030 ( -7.651 0.639 3.870) 8.598 31.258 ( 3.811 12.716 -0.179) 13.276 31.631 ( 6.971 -19.745 2.911) 21.141 32.651 ( 12.492 23.535 -0.789) 26.656 33.119 ( 13.657 -21.939 -1.626) 25.894 ======================= Grid point 111 (59/168) ======================= q-point: ( 0.40 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.718 ( -0.120 6.523 3.280) 7.302 2.853 ( 1.087 -6.476 4.473) 7.945 2.984 ( 4.667 7.800 1.593) 9.228 3.035 ( 4.784 3.271 2.114) 6.169 3.246 ( 6.337 12.201 -3.959) 14.307 3.402 ( 9.629 -2.084 -3.799) 10.559 3.566 ( 0.241 6.915 1.056) 7.000 3.801 ( -1.022 -15.307 -0.979) 15.372 3.946 ( 2.992 0.575 -5.728) 6.488 4.042 ( 4.350 -8.690 -4.039) 10.524 4.376 ( -3.097 7.059 5.785) 9.638 4.430 ( -6.500 2.950 6.169) 9.435 4.744 ( 8.403 3.828 -5.703) 10.853 4.870 ( 7.984 -7.813 -7.735) 13.588 4.929 ( 4.249 7.772 -5.624) 10.492 5.100 ( 5.527 -9.241 -4.211) 11.562 5.246 ( -4.609 5.866 9.872) 12.374 5.400 ( -5.985 -8.266 8.789) 13.468 5.836 ( 1.746 6.916 3.056) 7.760 5.946 ( -0.551 -2.055 4.628) 5.093 6.146 ( 1.163 4.710 -2.841) 5.622 6.213 ( 2.182 0.081 -1.696) 2.765 6.458 ( -0.762 0.002 0.768) 1.082 6.563 ( -2.874 -7.964 4.692) 9.680 6.905 ( 5.131 0.933 1.822) 5.524 6.917 ( 2.532 -0.540 1.798) 3.152 7.258 ( 5.678 7.725 -2.348) 9.871 7.357 ( 6.798 -1.118 -1.627) 7.079 7.761 ( 0.031 8.804 -0.682) 8.830 7.889 ( 0.017 -2.544 -4.833) 5.462 8.084 ( -0.668 1.955 -4.177) 4.660 8.160 ( -1.783 -5.665 -5.313) 7.968 8.356 ( 1.578 11.441 1.162) 11.608 8.586 ( 1.493 -9.787 3.035) 10.355 9.031 ( 1.979 2.303 -3.269) 4.462 9.112 ( 2.518 -4.812 0.185) 5.435 11.238 ( -0.893 6.071 0.551) 6.161 11.353 ( -1.332 -3.646 -3.393) 5.156 11.459 ( -0.502 3.977 1.673) 4.343 11.593 ( -0.935 -7.556 -2.812) 8.117 13.422 ( -5.800 0.985 3.105) 6.653 13.458 ( -7.844 -2.418 2.968) 8.729 13.938 ( -4.316 5.471 -0.678) 7.002 14.049 ( -4.308 -5.214 -0.880) 6.821 15.392 ( 0.992 6.427 1.219) 6.616 15.520 ( 1.798 -5.168 0.941) 5.552 15.621 ( 0.789 6.374 -0.664) 6.457 15.763 ( 2.288 -6.610 -1.976) 7.269 16.144 ( -1.078 2.102 -2.382) 3.355 16.193 ( -1.546 -2.662 -3.719) 4.828 16.442 ( -2.242 1.710 3.411) 4.426 16.481 ( -1.663 -1.972 3.998) 4.758 18.238 ( 5.226 0.694 -0.066) 5.272 18.267 ( 5.320 -2.041 1.114) 5.806 18.585 ( 4.038 3.468 0.796) 5.382 18.653 ( 3.573 -3.194 0.881) 4.872 27.684 ( 0.377 0.982 0.367) 1.114 27.720 ( 0.371 -2.194 0.141) 2.230 27.873 ( 0.355 0.459 -0.515) 0.775 27.882 ( 0.549 -0.492 1.037) 1.272 28.940 ( -1.183 2.701 2.476) 3.851 28.996 ( -2.249 -2.593 3.031) 4.579 29.349 ( 1.987 4.154 -0.621) 4.646 29.426 ( 1.509 -3.529 -0.889) 3.940 29.999 ( -5.304 4.643 2.260) 7.402 30.056 ( -4.722 -1.059 0.607) 4.877 30.858 ( -4.016 3.650 -1.638) 5.668 30.940 ( -5.137 -2.619 -0.713) 5.810 31.317 ( 2.762 16.921 -0.001) 17.145 31.731 ( 3.571 -21.368 -0.659) 21.674 32.791 ( 6.775 23.867 -1.135) 24.836 33.255 ( 7.546 -21.202 -3.336) 22.751 ======================= Grid point 112 (60/168) ======================= q-point: (-0.50 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.649 ( -6.751 8.354 -4.644) 11.702 2.818 ( -5.925 -7.797 -1.635) 9.928 3.003 ( -2.258 7.873 -0.928) 8.243 3.054 ( -2.418 3.417 -0.489) 4.214 3.362 ( 5.808 12.409 1.702) 13.806 3.523 ( 6.770 -0.997 1.345) 6.974 3.586 ( -0.015 2.646 2.959) 3.969 3.733 ( -2.317 -13.632 -4.739) 14.617 3.959 ( 5.128 2.050 -3.967) 6.800 4.055 ( 3.207 -6.751 -2.972) 8.043 4.394 ( -4.573 4.602 6.717) 9.338 4.408 ( -3.419 2.254 4.466) 6.059 4.742 ( 1.548 2.476 -7.753) 8.285 4.844 ( 1.441 -5.385 -8.167) 9.888 4.971 ( 4.801 7.875 -1.061) 9.284 5.138 ( 3.506 -8.807 -1.814) 9.651 5.299 ( -3.248 3.129 9.380) 10.407 5.427 ( -4.398 -7.907 9.306) 12.979 5.844 ( -4.063 6.525 0.049) 7.687 5.945 ( -5.181 -2.326 1.719) 5.934 6.164 ( 3.779 6.700 0.374) 7.701 6.232 ( 1.074 0.139 -0.612) 1.244 6.479 ( 1.038 -1.556 2.157) 2.855 6.541 ( -4.665 -6.503 2.707) 8.448 6.881 ( -4.911 1.441 -4.638) 6.907 6.912 ( -3.408 -0.958 -2.244) 4.192 7.281 ( 1.147 7.743 -3.329) 8.506 7.388 ( 0.205 -1.985 -3.404) 3.946 7.741 ( -0.487 8.597 -1.925) 8.824 7.868 ( 3.647 -2.435 -3.350) 5.519 8.015 ( 0.735 4.137 -6.700) 7.908 8.139 ( 5.415 -7.117 -4.017) 9.804 8.424 ( 2.786 8.203 4.663) 9.838 8.607 ( -2.197 -8.841 2.204) 9.372 8.996 ( 0.143 5.289 -5.518) 7.645 9.122 ( -0.420 -6.057 -1.628) 6.286 11.212 ( -0.745 3.899 -2.279) 4.577 11.274 ( -0.901 -1.325 -6.267) 6.468 11.504 ( 1.374 1.754 3.907) 4.498 11.590 ( 2.674 -5.813 -0.408) 6.412 13.419 ( -0.697 -0.580 4.708) 4.794 13.427 ( -1.911 -1.259 5.391) 5.857 13.912 ( 1.275 5.426 0.472) 5.594 14.021 ( 1.341 -5.065 0.195) 5.243 15.432 ( 0.567 7.115 3.478) 7.940 15.573 ( 1.194 -5.944 3.940) 7.231 15.633 ( 0.838 6.997 0.587) 7.071 15.784 ( 2.058 -6.980 -0.351) 7.286 16.096 ( -0.331 1.144 -4.108) 4.278 16.130 ( 0.412 -1.997 -5.772) 6.122 16.453 ( -1.600 3.410 4.134) 5.592 16.520 ( -0.634 -2.968 5.295) 6.103 18.286 ( 0.344 1.364 0.784) 1.611 18.331 ( 0.304 -2.845 2.197) 3.608 18.619 ( -0.764 3.111 0.572) 3.254 18.678 ( -1.173 -2.767 0.248) 3.016 27.698 ( 0.160 1.103 1.193) 1.633 27.735 ( 0.522 -2.199 1.201) 2.560 27.875 ( 0.087 1.067 0.278) 1.106 27.903 ( 0.193 -1.469 1.476) 2.091 28.961 ( -0.995 2.162 4.049) 4.696 29.004 ( -1.802 -1.889 3.838) 4.642 29.390 ( 2.190 4.124 2.168) 5.148 29.463 ( 2.438 -3.192 2.084) 4.525 29.961 ( -2.356 4.682 1.622) 5.486 30.020 ( -0.830 -1.071 0.765) 1.556 30.809 ( 0.749 2.821 -2.827) 4.064 30.869 ( -0.899 -1.927 -3.410) 4.019 31.330 ( -0.408 16.145 -0.855) 16.173 31.719 ( -1.345 -19.664 -4.385) 20.192 32.836 ( 0.721 22.182 -1.165) 22.224 33.282 ( 1.755 -20.707 -4.736) 21.315 ======================= Grid point 113 (61/168) ======================= q-point: (-0.40 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.440 ( -10.744 11.697 -6.517) 17.168 2.670 ( -9.835 -10.321 -1.489) 14.334 2.890 ( -9.477 9.588 -3.039) 13.819 2.978 ( -5.978 0.478 -1.036) 6.085 3.412 ( 1.132 10.194 -1.298) 10.339 3.588 ( -0.375 1.551 0.583) 1.699 3.624 ( -1.935 -3.321 -0.366) 3.861 3.678 ( 2.235 -8.081 0.833) 8.426 3.994 ( 3.623 4.504 -2.819) 6.431 4.092 ( 2.715 -4.869 1.385) 5.745 4.343 ( -6.278 7.028 -0.416) 9.433 4.432 ( -1.678 -2.256 2.016) 3.460 4.617 ( -7.460 2.220 -5.693) 9.643 4.732 ( -7.214 -6.347 -2.790) 10.005 5.016 ( 0.782 8.114 -1.530) 8.294 5.133 ( -1.774 -3.570 -1.955) 4.440 5.345 ( -4.355 0.457 8.097) 9.205 5.458 ( -5.145 -7.729 8.828) 12.812 5.706 ( -8.848 5.217 -4.972) 11.411 5.813 ( -10.168 -4.790 -2.409) 11.495 6.185 ( -3.926 2.632 -1.366) 4.920 6.230 ( -3.170 -1.908 -1.181) 3.884 6.487 ( 4.213 5.609 4.344) 8.251 6.628 ( 7.713 -6.739 6.866) 12.331 6.743 ( -3.510 5.575 -3.666) 7.539 6.833 ( -2.826 -2.282 -0.009) 3.632 7.236 ( -2.335 4.226 -2.618) 5.492 7.312 ( -4.506 -2.711 -2.202) 5.701 7.703 ( -1.015 8.283 -3.243) 8.953 7.834 ( -1.783 -3.926 -6.334) 7.662 7.993 ( 5.057 8.173 -6.582) 11.648 8.164 ( 3.925 -6.255 -6.646) 9.934 8.549 ( 5.043 -0.410 5.489) 7.466 8.604 ( -1.340 -5.413 4.044) 6.888 8.916 ( -1.491 7.381 -6.349) 9.850 9.062 ( -2.739 -5.902 -4.323) 7.812 11.181 ( 0.563 0.363 -2.972) 3.047 11.196 ( 0.976 -0.858 -6.858) 6.980 11.578 ( 2.318 2.684 3.342) 4.873 11.646 ( 4.045 -3.718 0.361) 5.506 13.487 ( 2.335 0.858 5.761) 6.275 13.529 ( 5.443 -2.961 6.078) 8.680 13.988 ( 6.999 5.352 1.248) 8.899 14.095 ( 7.193 -5.006 0.990) 8.819 15.486 ( 0.351 7.870 4.504) 9.075 15.639 ( 0.415 -6.303 4.951) 8.026 15.661 ( 1.143 7.582 1.775) 7.871 15.821 ( 2.048 -7.356 1.332) 7.751 16.041 ( 0.027 0.985 -4.988) 5.085 16.072 ( 1.147 -1.903 -6.604) 6.968 16.487 ( -0.462 4.761 4.499) 6.567 16.577 ( 0.453 -3.873 4.844) 6.218 18.266 ( -4.734 1.852 1.748) 5.376 18.325 ( -5.209 -3.750 3.394) 7.260 18.574 ( -5.413 2.486 0.027) 5.956 18.623 ( -5.890 -2.282 -0.220) 6.320 27.716 ( 0.073 1.796 1.739) 2.501 27.762 ( 0.582 -2.303 1.772) 2.963 27.880 ( -0.312 1.286 0.710) 1.502 27.920 ( -0.099 -2.323 1.331) 2.679 28.997 ( -1.104 1.549 4.922) 5.276 29.026 ( -1.335 -1.121 4.207) 4.554 29.476 ( 3.651 4.811 5.637) 8.261 29.554 ( 4.034 -3.003 5.319) 7.320 29.964 ( 0.890 5.650 0.833) 5.780 30.045 ( 3.034 -1.979 0.405) 3.644 30.785 ( 2.001 4.206 -7.189) 8.566 30.840 ( 2.697 -2.086 -3.915) 5.191 31.298 ( -2.039 12.061 -0.558) 12.245 31.601 ( -5.161 -15.146 -6.492) 17.268 32.785 ( -5.637 19.267 -1.136) 20.107 33.202 ( -4.306 -20.606 -5.939) 21.873 ======================= Grid point 114 (62/168) ======================= q-point: (-0.30 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.193 ( -12.207 16.031 -4.510) 20.648 2.501 ( -11.218 -13.489 1.387) 17.599 2.646 ( -16.012 13.259 -4.383) 21.246 2.839 ( -10.635 -5.569 -0.983) 12.045 3.379 ( -3.409 6.496 -2.501) 7.751 3.518 ( -3.350 -5.215 -5.971) 8.606 3.603 ( -3.661 5.041 5.040) 8.014 3.712 ( 0.036 -6.040 -0.979) 6.119 3.972 ( -4.070 10.524 -2.626) 11.585 4.112 ( -11.483 0.155 1.532) 11.586 4.193 ( -0.091 3.934 -6.404) 7.517 4.296 ( -7.665 -4.653 -10.972) 14.170 4.422 ( -13.954 4.885 0.952) 14.815 4.586 ( -12.353 -9.550 2.475) 15.809 4.947 ( -2.287 8.203 -2.809) 8.967 5.074 ( -1.973 -0.472 -2.584) 3.285 5.332 ( -7.859 -0.362 7.298) 10.730 5.453 ( -8.372 -7.096 6.906) 12.967 5.550 ( -2.087 1.608 -2.223) 3.447 5.645 ( -5.446 -7.038 -2.279) 9.186 6.086 ( -5.988 1.682 -1.004) 6.300 6.113 ( -5.256 -1.965 -1.477) 5.802 6.659 ( 1.417 7.272 2.689) 7.881 6.754 ( 3.497 3.960 5.235) 7.437 6.813 ( 7.140 0.499 3.302) 7.883 6.894 ( 9.333 -1.972 4.338) 10.479 7.164 ( -2.661 0.346 -0.998) 2.863 7.227 ( -4.423 -4.277 0.754) 6.198 7.620 ( -3.627 7.876 -5.584) 10.313 7.731 ( 0.946 -2.173 -7.658) 8.016 7.969 ( 1.593 5.601 -6.251) 8.543 8.114 ( 0.200 -6.041 -6.474) 8.857 8.645 ( -1.762 -2.492 6.981) 7.619 8.667 ( 1.830 -5.542 -0.065) 5.837 8.831 ( -0.625 6.781 -2.464) 7.242 8.950 ( -3.041 -4.428 -6.268) 8.255 11.137 ( 0.921 0.503 -5.055) 5.163 11.172 ( 2.627 -2.842 -4.009) 5.573 11.642 ( 2.052 3.885 1.612) 4.679 11.713 ( 3.746 -2.841 0.307) 4.711 13.616 ( 5.999 3.932 4.910) 8.692 13.716 ( 9.526 -5.546 5.473) 12.306 14.144 ( 10.398 5.592 1.463) 11.897 14.257 ( 11.261 -5.294 1.463) 12.529 15.537 ( 0.677 8.023 2.593) 8.458 15.690 ( 0.621 -6.431 2.210) 6.829 15.720 ( 2.489 8.389 4.459) 9.821 15.880 ( 1.507 -7.190 3.723) 8.235 15.989 ( 1.128 0.561 -5.038) 5.193 16.012 ( 1.526 -1.717 -7.429) 7.776 16.537 ( 0.055 5.366 4.531) 7.023 16.640 ( 0.968 -4.449 3.920) 6.008 18.181 ( -9.085 1.932 2.503) 9.620 18.245 ( -10.321 -4.280 4.044) 11.882 18.452 ( -9.472 1.935 -0.771) 9.699 18.495 ( -9.959 -2.078 -0.215) 10.176 27.741 ( 0.333 2.457 1.961) 3.161 27.790 ( 0.416 -2.010 1.638) 2.626 27.880 ( -0.651 1.234 0.683) 1.553 27.930 ( -0.093 -3.159 0.740) 3.246 29.031 ( -1.328 1.414 4.160) 4.590 29.055 ( -1.327 -0.851 4.448) 4.719 29.652 ( 7.174 4.898 10.989) 14.008 29.718 ( 6.582 -1.622 9.161) 11.396 30.009 ( 4.698 6.948 -0.417) 8.398 30.121 ( 7.305 -3.215 -1.198) 8.071 30.692 ( -0.531 8.178 -11.068) 13.772 30.824 ( 1.907 -5.490 -7.105) 9.179 31.277 ( -0.468 6.018 0.800) 6.089 31.439 ( -5.638 -8.167 -5.686) 11.437 32.637 ( -11.742 15.481 -0.904) 19.451 33.008 ( -11.283 -20.167 -6.934) 24.127 ======================= Grid point 115 (63/168) ======================= q-point: (-0.20 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.967 ( -13.531 20.048 -0.294) 24.189 2.301 ( -19.285 14.779 -5.144) 24.835 2.359 ( -12.733 -13.799 4.750) 19.368 2.625 ( -13.223 -12.532 -2.683) 18.415 3.218 ( -12.781 5.156 -3.287) 14.169 3.339 ( -11.318 -5.251 -5.481) 13.628 3.614 ( -2.666 5.241 3.424) 6.804 3.655 ( -4.028 1.795 -0.571) 4.446 3.768 ( -15.167 16.860 -2.482) 22.814 3.893 ( -3.957 3.257 -7.630) 9.192 4.085 ( -3.242 -1.800 -8.452) 9.229 4.165 ( -7.482 -5.620 0.383) 9.366 4.224 ( -7.967 4.721 1.056) 9.321 4.410 ( -8.585 -11.686 -0.596) 14.513 4.943 ( 0.856 4.012 1.405) 4.336 5.011 ( -1.450 -0.266 -3.643) 3.930 5.321 ( -4.630 2.450 8.900) 10.328 5.386 ( -6.241 -0.860 3.533) 7.223 5.565 ( -0.117 -3.857 3.737) 5.372 5.599 ( -0.557 -8.707 1.677) 8.884 6.003 ( -4.187 3.094 0.900) 5.283 6.060 ( -1.329 -2.153 0.744) 2.637 6.664 ( 0.418 7.159 -2.102) 7.473 6.769 ( -1.976 -2.313 0.507) 3.084 6.968 ( 1.798 10.521 0.002) 10.674 7.037 ( 5.387 4.598 3.956) 8.113 7.165 ( -1.295 -5.372 2.410) 6.029 7.226 ( 1.004 -7.749 2.478) 8.198 7.494 ( -1.798 10.676 -5.960) 12.359 7.713 ( 6.255 -7.626 -5.795) 11.439 7.938 ( 1.392 4.138 -2.221) 4.898 8.056 ( 0.515 -5.805 -3.145) 6.622 8.577 ( -5.110 0.887 -6.855) 8.596 8.631 ( -7.477 -3.715 1.509) 8.485 8.867 ( -0.190 -1.325 3.152) 3.425 8.875 ( 1.582 -1.493 -0.892) 2.351 11.107 ( 1.602 1.716 -3.577) 4.278 11.175 ( 2.473 -4.784 -2.341) 5.872 11.675 ( 1.345 5.256 -0.384) 5.439 11.764 ( 2.746 -3.262 -0.400) 4.283 13.773 ( 7.635 6.965 3.221) 10.825 13.927 ( 9.926 -7.749 3.680) 13.119 14.321 ( 9.914 6.733 0.668) 12.003 14.455 ( 11.412 -6.194 0.899) 13.016 15.561 ( 0.924 7.904 -0.452) 7.971 15.707 ( 1.725 -5.476 -2.225) 6.157 15.835 ( 4.023 4.432 3.340) 6.855 15.887 ( -2.152 -1.924 -1.854) 3.431 15.962 ( 2.591 1.251 -3.402) 4.456 16.032 ( 7.070 -4.260 0.879) 8.301 16.584 ( -0.742 5.159 4.295) 6.754 16.688 ( 0.052 -4.730 2.786) 5.490 18.047 ( -11.735 1.291 2.945) 12.168 18.099 ( -13.884 -3.902 3.785) 14.911 18.274 ( -11.224 2.135 -1.047) 11.473 18.319 ( -11.486 -2.133 -0.455) 11.692 27.770 ( 0.690 2.447 1.733) 3.077 27.807 ( 0.024 -0.898 0.634) 1.099 27.874 ( -0.926 1.139 0.220) 1.484 27.935 ( 0.128 -4.151 0.102) 4.154 29.048 ( -1.427 1.793 2.518) 3.405 29.079 ( -1.967 -1.239 4.013) 4.638 29.910 ( 5.138 4.358 11.540) 13.363 29.977 ( 8.841 -1.220 13.340) 16.050 30.111 ( 12.488 9.096 -2.987) 15.736 30.252 ( 13.162 -3.804 -2.337) 13.898 30.537 ( -2.601 9.564 -9.493) 13.724 30.729 ( -1.452 -9.367 -8.379) 12.652 31.293 ( 1.018 1.064 0.088) 1.475 31.318 ( -2.716 -0.582 -3.591) 4.540 32.410 ( -15.915 10.526 -0.150) 19.082 32.694 ( -18.312 -17.014 -6.899) 25.931 ======================= Grid point 116 (64/168) ======================= q-point: (-0.10 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( -17.262 21.657 3.149) 27.873 2.049 ( -6.869 19.222 1.956) 20.506 2.169 ( -15.521 -15.178 1.107) 21.737 2.470 ( -3.239 -16.259 1.607) 16.657 2.972 ( -12.645 5.739 -0.694) 13.904 3.112 ( -10.582 -7.078 -0.830) 12.758 3.539 ( -10.256 24.640 2.492) 26.806 3.578 ( -2.782 9.619 -0.566) 10.029 3.645 ( 0.694 -3.052 -3.574) 4.751 3.796 ( 1.547 3.898 -6.370) 7.627 4.006 ( -1.270 -5.025 -0.634) 5.222 4.027 ( -7.096 -2.128 4.123) 8.478 4.203 ( 0.823 0.202 0.550) 1.011 4.332 ( -2.551 -11.348 1.429) 11.719 4.946 ( -1.177 1.255 -2.779) 3.268 4.973 ( 0.830 -0.281 0.312) 0.930 5.336 ( -5.735 3.632 3.501) 7.637 5.365 ( -3.457 1.599 8.310) 9.141 5.593 ( 0.333 -4.046 1.973) 4.513 5.651 ( -0.572 -8.670 6.580) 10.899 5.968 ( -2.506 5.137 1.473) 5.903 6.071 ( -0.058 -3.974 1.688) 4.318 6.653 ( 1.945 6.228 -1.877) 6.789 6.746 ( 0.031 -2.899 -0.617) 2.965 6.976 ( 0.036 11.812 -0.428) 11.820 7.087 ( -0.189 4.806 -0.178) 4.813 7.148 ( -3.332 -4.261 1.327) 5.570 7.227 ( -1.012 -8.207 -1.705) 8.443 7.464 ( 3.582 13.014 -3.019) 13.832 7.769 ( 8.055 -14.347 -5.372) 17.308 7.958 ( 1.439 3.907 0.742) 4.229 8.058 ( 0.728 -5.030 -0.002) 5.083 8.422 ( -4.906 3.352 -4.051) 7.191 8.504 ( -6.317 -3.755 -1.187) 7.444 8.874 ( -1.010 0.902 1.680) 2.158 8.916 ( 0.056 -3.764 1.548) 4.071 11.109 ( 1.949 2.646 -0.859) 3.397 11.198 ( 1.925 -5.800 0.268) 6.117 11.678 ( 0.963 6.290 -1.957) 6.657 11.786 ( 1.654 -4.052 -1.730) 4.706 13.905 ( 4.947 8.404 1.566) 9.877 14.084 ( 5.614 -8.808 1.549) 10.559 14.447 ( 6.001 7.884 -1.183) 9.978 14.603 ( 6.898 -7.105 -1.285) 9.986 15.564 ( 1.255 7.723 -1.674) 8.001 15.695 ( 2.585 -3.179 -6.183) 7.418 15.810 ( -0.653 -2.190 -5.411) 5.874 15.829 ( -0.219 -2.601 -6.197) 6.725 16.099 ( 8.029 4.306 6.849) 11.398 16.174 ( 7.245 -2.796 3.180) 8.391 16.602 ( -2.965 4.204 3.485) 6.214 16.695 ( -2.447 -4.597 1.291) 5.365 17.889 ( -13.066 0.824 3.250) 13.489 17.922 ( -11.754 -2.124 2.565) 12.217 18.115 ( -7.040 2.347 -0.304) 7.427 18.159 ( -6.840 -1.978 -0.765) 7.161 27.795 ( 0.379 1.092 0.656) 1.329 27.802 ( -0.451 0.687 -0.937) 1.246 27.859 ( -0.711 1.619 -0.311) 1.796 27.937 ( 0.195 -4.825 -0.375) 4.844 29.045 ( -1.473 2.038 1.057) 2.728 29.083 ( -2.502 -1.597 2.836) 4.105 29.993 ( 2.309 4.999 -8.261) 9.927 30.036 ( -2.261 0.957 -9.636) 9.944 30.346 ( 10.483 9.011 -0.318) 13.827 30.507 ( 4.575 6.703 8.103) 11.467 30.539 ( 12.237 -7.424 7.553) 16.184 30.695 ( 4.596 -9.335 6.275) 12.151 31.258 ( 1.920 3.024 -3.060) 4.711 31.311 ( 1.404 -2.261 -1.329) 2.975 32.156 ( -15.617 7.104 -0.355) 17.160 32.337 ( -16.868 -10.290 -2.743) 19.949 ======================= Grid point 147 (65/168) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.021 ( 8.522 0.000 17.120) 19.124 1.108 ( -7.528 0.000 26.195) 27.255 1.970 ( -9.024 0.000 -17.714) 19.880 2.211 ( -16.822 0.000 47.496) 50.387 2.710 ( 0.759 0.000 -0.794) 1.098 3.043 ( -2.420 0.000 5.112) 5.656 3.063 ( 12.999 0.000 -1.083) 13.044 3.444 ( 0.966 0.000 0.238) 0.995 3.579 ( 4.505 0.000 -7.440) 8.698 3.843 ( 7.600 0.000 2.844) 8.115 4.053 ( -1.796 0.000 3.009) 3.504 4.310 ( -0.595 0.000 -3.925) 3.969 4.556 ( 5.644 0.000 6.685) 8.749 4.730 ( 8.621 0.000 5.034) 9.983 4.961 ( 6.092 0.000 1.274) 6.224 5.001 ( 4.884 0.000 -4.684) 6.767 5.269 ( -3.812 0.000 7.098) 8.057 5.451 ( -2.679 0.000 8.738) 9.139 5.887 ( 3.701 0.000 6.787) 7.731 5.923 ( -10.671 0.000 -6.338) 12.412 6.023 ( 18.753 0.000 1.574) 18.819 6.067 ( -0.879 0.000 -0.886) 1.248 6.304 ( -6.588 0.000 0.199) 6.591 6.661 ( 0.847 0.000 -0.924) 1.254 6.924 ( 1.637 0.000 -1.047) 1.943 6.980 ( -3.350 0.000 5.848) 6.740 7.082 ( -26.011 0.000 0.366) 26.014 7.199 ( 0.022 0.000 -4.242) 4.242 7.410 ( -6.563 0.000 -6.194) 9.024 7.567 ( 18.814 0.000 -12.829) 22.772 7.977 ( -1.794 0.000 2.222) 2.856 8.067 ( 0.405 0.000 9.421) 9.430 8.414 ( 5.921 0.000 0.247) 5.926 8.551 ( 15.166 0.000 -0.044) 15.166 8.745 ( -15.286 0.000 1.962) 15.411 9.398 ( -8.211 0.000 -9.962) 12.909 11.072 ( 3.197 0.000 -5.466) 6.333 11.202 ( 1.758 0.000 -4.822) 5.132 11.661 ( 0.116 0.000 6.287) 6.288 11.906 ( 0.145 0.000 1.354) 1.362 13.672 ( -1.882 0.000 2.038) 2.774 14.024 ( 0.873 0.000 -5.001) 5.076 14.469 ( -4.026 0.000 0.714) 4.089 14.742 ( 2.931 0.000 -6.616) 7.236 15.188 ( -4.332 0.000 -1.530) 4.594 15.267 ( 2.927 0.000 -1.799) 3.436 15.837 ( 0.088 0.000 -5.080) 5.081 15.844 ( 2.750 0.000 -9.671) 10.054 16.241 ( 0.664 0.000 5.567) 5.607 16.512 ( -9.018 0.000 -0.660) 9.042 16.730 ( -1.606 0.000 -3.511) 3.861 16.835 ( 13.060 0.000 -2.899) 13.378 17.714 ( -7.296 0.000 4.006) 8.324 17.954 ( 0.507 0.000 -0.427) 0.663 18.034 ( -7.923 0.000 5.428) 9.604 18.208 ( 5.091 0.000 0.689) 5.138 27.649 ( 0.848 0.000 0.312) 0.904 27.693 ( 1.247 0.000 -1.114) 1.672 27.840 ( -0.508 0.000 -1.967) 2.032 28.017 ( -2.153 0.000 -5.288) 5.710 28.863 ( 1.350 0.000 0.557) 1.460 28.913 ( -0.463 0.000 -1.760) 1.820 29.186 ( -4.075 0.000 4.928) 6.395 29.727 ( 1.872 0.000 -8.926) 9.120 30.020 ( 1.231 0.000 7.302) 7.405 30.363 ( -2.427 0.000 2.846) 3.740 31.032 ( -2.171 0.000 2.298) 3.161 31.204 ( -36.602 0.000 2.580) 36.692 31.219 ( 6.716 0.000 0.491) 6.734 31.336 ( 4.779 0.000 -4.788) 6.765 32.231 ( -14.310 0.000 10.812) 17.935 32.893 ( 43.387 0.000 -4.033) 43.574 ======================= Grid point 148 (66/168) ======================= q-point: ( 0.10 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.373 ( 4.799 0.000 22.970) 23.465 1.565 ( 37.414 0.000 7.076) 38.078 1.784 ( 9.392 0.000 -13.538) 16.477 2.477 ( -7.628 0.000 31.394) 32.307 2.749 ( 6.068 0.000 -2.788) 6.677 3.135 ( 7.452 0.000 4.501) 8.705 3.217 ( 7.176 0.000 -3.189) 7.853 3.594 ( 4.306 0.000 -6.270) 7.606 3.634 ( 13.935 0.000 9.977) 17.139 3.932 ( -6.006 0.000 -7.076) 9.281 4.006 ( 9.665 0.000 2.711) 10.038 4.345 ( 1.624 0.000 2.831) 3.264 4.668 ( 3.638 0.000 -0.374) 3.657 4.931 ( 4.481 0.000 7.761) 8.962 4.992 ( 3.362 0.000 -5.091) 6.101 5.078 ( 7.732 0.000 -0.383) 7.741 5.307 ( -2.509 0.000 8.121) 8.500 5.543 ( -1.122 0.000 11.088) 11.145 5.688 ( -5.899 0.000 -9.340) 11.047 6.036 ( -1.815 0.000 -0.317) 1.842 6.084 ( 9.070 0.000 7.474) 11.753 6.120 ( -9.414 0.000 5.521) 10.914 6.289 ( 10.143 0.000 -4.694) 11.177 6.648 ( -0.327 0.000 -2.179) 2.203 6.816 ( -6.010 0.000 1.702) 6.246 6.904 ( -5.059 0.000 -0.717) 5.109 7.029 ( -1.820 0.000 4.084) 4.471 7.046 ( -9.678 0.000 -9.463) 13.536 7.319 ( 2.515 0.000 -0.952) 2.689 7.664 ( 12.201 0.000 -12.068) 17.161 7.978 ( -0.705 0.000 1.558) 1.710 8.218 ( 5.665 0.000 9.025) 10.656 8.436 ( -6.650 0.000 -3.518) 7.523 8.588 ( -3.336 0.000 6.440) 7.253 8.793 ( 13.029 0.000 -0.930) 13.062 9.224 ( 1.083 0.000 -9.876) 9.935 11.058 ( 2.078 0.000 -4.258) 4.739 11.169 ( 1.401 0.000 -5.362) 5.542 11.729 ( -0.570 0.000 5.914) 5.941 11.918 ( -0.179 0.000 0.803) 0.823 13.635 ( -5.772 0.000 3.010) 6.509 13.952 ( -2.997 0.000 -5.629) 6.377 14.356 ( -11.070 0.000 0.898) 11.106 14.657 ( -4.833 0.000 -5.028) 6.974 15.112 ( -2.508 0.000 -0.910) 2.668 15.297 ( 3.237 0.000 -2.536) 4.113 15.774 ( -0.464 0.000 -4.856) 4.879 15.794 ( 3.151 0.000 -6.854) 7.544 16.323 ( 1.351 0.000 5.985) 6.135 16.330 ( -11.580 0.000 0.475) 11.589 16.647 ( -3.529 0.000 -3.809) 5.192 16.818 ( -7.216 0.000 -0.386) 7.226 17.869 ( 15.637 0.000 -0.023) 15.637 18.003 ( 5.955 0.000 -0.442) 5.972 18.047 ( 1.812 0.000 3.921) 4.319 18.345 ( 10.168 0.000 1.128) 10.231 27.677 ( 1.903 0.000 0.489) 1.965 27.705 ( 1.946 0.000 -1.321) 2.352 27.827 ( 1.116 0.000 -0.884) 1.424 27.925 ( -1.628 0.000 -5.359) 5.600 28.887 ( -0.171 0.000 -2.143) 2.150 28.904 ( 2.757 0.000 0.722) 2.850 29.184 ( -3.906 0.000 5.577) 6.809 29.654 ( 1.131 0.000 -7.609) 7.693 30.089 ( -4.736 0.000 8.378) 9.624 30.316 ( -4.987 0.000 -0.338) 4.999 30.642 ( -27.545 0.000 7.855) 28.643 31.157 ( -7.087 0.000 -2.276) 7.444 31.253 ( 9.345 0.000 4.749) 10.482 31.502 ( 10.513 0.000 1.453) 10.613 32.162 ( -5.653 0.000 6.775) 8.824 33.378 ( 31.367 0.000 -13.041) 33.969 ======================= Grid point 149 (67/168) ======================= q-point: ( 0.20 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.723 ( 6.698 0.000 20.203) 21.285 1.981 ( 27.043 0.000 -2.895) 27.198 2.216 ( 35.189 0.000 2.746) 35.296 2.646 ( -3.154 0.000 12.799) 13.182 2.829 ( 7.997 0.000 -3.264) 8.637 3.303 ( 5.788 0.000 -7.053) 9.123 3.326 ( 8.972 0.000 4.063) 9.850 3.478 ( -4.539 0.000 -0.998) 4.648 3.878 ( 6.032 0.000 -3.932) 7.200 3.883 ( 4.495 0.000 4.804) 6.580 4.253 ( 17.763 0.000 2.365) 17.920 4.330 ( -6.084 0.000 0.503) 6.105 4.678 ( 5.642 0.000 -9.216) 10.806 4.883 ( -4.967 0.000 -3.857) 6.288 5.108 ( 3.498 0.000 3.208) 4.746 5.172 ( 3.683 0.000 -0.058) 3.683 5.380 ( -0.275 0.000 8.617) 8.621 5.492 ( 2.213 0.000 -12.155) 12.355 5.699 ( -0.882 0.000 9.483) 9.524 6.011 ( -0.320 0.000 -1.244) 1.284 6.027 ( -3.704 0.000 0.960) 3.826 6.317 ( 8.639 0.000 0.305) 8.645 6.423 ( 11.107 0.000 3.961) 11.792 6.594 ( -1.295 0.000 -5.179) 5.339 6.770 ( -10.492 0.000 2.941) 10.897 6.802 ( -7.077 0.000 -5.441) 8.927 6.849 ( 4.871 0.000 2.726) 5.582 7.052 ( -0.077 0.000 3.146) 3.146 7.406 ( 5.176 0.000 2.379) 5.697 7.683 ( 5.575 0.000 -8.760) 10.383 7.989 ( -0.010 0.000 0.857) 0.857 8.236 ( -10.304 0.000 -3.278) 10.813 8.403 ( 7.827 0.000 1.311) 7.936 8.729 ( 3.024 0.000 15.368) 15.663 8.868 ( 3.294 0.000 -7.342) 8.047 9.218 ( 6.624 0.000 -3.565) 7.522 11.043 ( 1.201 0.000 -2.414) 2.696 11.126 ( 1.312 0.000 -5.834) 5.980 11.768 ( -2.220 0.000 4.297) 4.837 11.917 ( -0.133 0.000 -0.707) 0.719 13.581 ( -6.084 0.000 4.316) 7.460 13.796 ( -7.764 0.000 -6.041) 9.838 14.166 ( -14.792 0.000 2.252) 14.963 14.498 ( -9.085 0.000 -2.853) 9.523 15.115 ( 2.698 0.000 1.283) 2.987 15.294 ( 0.469 0.000 -3.151) 3.185 15.726 ( 0.648 0.000 -3.201) 3.266 15.791 ( 4.017 0.000 -3.526) 5.345 16.193 ( -7.537 0.000 1.993) 7.796 16.404 ( 0.454 0.000 3.370) 3.401 16.552 ( -2.899 0.000 -1.666) 3.344 16.682 ( -9.811 0.000 0.739) 9.839 18.088 ( 12.993 0.000 -1.414) 13.070 18.114 ( 8.137 0.000 0.011) 8.137 18.157 ( 7.477 0.000 1.612) 7.648 18.524 ( 10.785 0.000 0.674) 10.806 27.714 ( 2.468 0.000 -0.173) 2.474 27.722 ( 1.898 0.000 -1.331) 2.318 27.856 ( -0.458 0.000 -3.192) 3.225 27.857 ( 2.093 0.000 1.566) 2.614 28.862 ( -0.001 0.000 -1.637) 1.637 28.961 ( 3.547 0.000 0.362) 3.566 29.186 ( -4.353 0.000 5.913) 7.343 29.595 ( 1.272 0.000 -5.851) 5.988 30.048 ( -13.896 0.000 11.062) 17.761 30.212 ( -6.140 0.000 -2.254) 6.541 30.445 ( -8.148 0.000 3.971) 9.064 31.009 ( -7.187 0.000 -3.204) 7.869 31.452 ( 9.432 0.000 3.173) 9.951 31.571 ( -4.698 0.000 2.365) 5.259 32.264 ( 9.695 0.000 4.990) 10.903 33.621 ( 20.932 0.000 -14.119) 25.248 ======================= Grid point 150 (68/168) ======================= q-point: ( 0.30 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.059 ( 9.200 0.000 16.956) 19.291 2.429 ( 23.505 0.000 5.658) 24.177 2.591 ( 16.732 0.000 -8.496) 18.766 2.664 ( -8.724 0.000 4.143) 9.657 3.002 ( 17.016 0.000 2.374) 17.180 3.064 ( -7.367 0.000 -13.933) 15.761 3.572 ( 3.839 0.000 2.328) 4.490 3.583 ( 13.124 0.000 7.839) 15.287 3.931 ( 4.898 0.000 -3.363) 5.941 3.945 ( -1.141 0.000 4.449) 4.593 4.205 ( -6.598 0.000 -3.868) 7.648 4.493 ( 10.098 0.000 -4.680) 11.130 4.682 ( 9.209 0.000 -7.817) 12.080 4.781 ( -1.482 0.000 -1.106) 1.849 5.131 ( 2.997 0.000 -5.935) 6.648 5.180 ( -2.697 0.000 1.833) 3.261 5.443 ( 9.840 0.000 -14.506) 17.528 5.475 ( -1.317 0.000 9.128) 9.223 5.742 ( -1.913 0.000 3.589) 4.067 5.989 ( 1.459 0.000 -4.032) 4.288 6.035 ( 2.134 0.000 1.923) 2.873 6.356 ( 5.656 0.000 -10.120) 11.594 6.535 ( 1.724 0.000 -4.438) 4.761 6.689 ( 8.148 0.000 9.987) 12.889 6.715 ( -3.750 0.000 7.035) 7.972 6.724 ( -3.494 0.000 4.554) 5.740 6.967 ( 4.980 0.000 2.627) 5.630 7.119 ( 5.703 0.000 1.695) 5.949 7.490 ( 1.061 0.000 2.996) 3.178 7.641 ( 0.781 0.000 -7.221) 7.263 7.994 ( -0.481 0.000 1.343) 1.426 8.072 ( -7.026 0.000 -1.105) 7.112 8.456 ( 3.300 0.000 -6.603) 7.381 8.790 ( 2.047 0.000 -12.073) 12.245 8.976 ( 0.702 0.000 19.137) 19.149 9.278 ( 2.020 0.000 0.184) 2.029 11.054 ( 1.794 0.000 0.757) 1.947 11.082 ( 2.090 0.000 -6.219) 6.561 11.751 ( -4.427 0.000 2.092) 4.897 11.890 ( -0.487 0.000 -3.414) 3.449 13.550 ( -4.959 0.000 5.701) 7.556 13.617 ( -6.405 0.000 -3.792) 7.443 13.973 ( -14.026 0.000 4.372) 14.692 14.330 ( -8.532 0.000 -1.526) 8.668 15.200 ( 4.145 0.000 2.568) 4.876 15.253 ( -1.079 0.000 -2.425) 2.654 15.731 ( 2.678 0.000 -0.341) 2.700 15.831 ( 4.632 0.000 -1.878) 4.998 16.137 ( -3.630 0.000 2.919) 4.658 16.354 ( -3.038 0.000 -5.790) 6.539 16.539 ( -9.473 0.000 0.825) 9.509 16.576 ( 0.452 0.000 6.262) 6.278 18.243 ( 7.060 0.000 1.322) 7.183 18.251 ( 9.649 0.000 -0.927) 9.693 18.291 ( 7.408 0.000 1.210) 7.506 18.677 ( 7.985 0.000 -0.206) 7.988 27.723 ( 1.178 0.000 -2.431) 2.702 27.748 ( 2.384 0.000 -0.538) 2.444 27.852 ( 1.442 0.000 1.141) 1.839 27.920 ( 1.820 0.000 3.657) 4.085 28.857 ( 0.885 0.000 -0.298) 0.934 29.018 ( 3.518 0.000 -0.280) 3.530 29.180 ( -5.137 0.000 5.937) 7.851 29.564 ( 2.041 0.000 -3.965) 4.460 29.955 ( -13.643 0.000 11.760) 18.012 30.084 ( -5.685 0.000 -3.552) 6.704 30.406 ( -2.056 0.000 0.874) 2.234 30.884 ( -4.746 0.000 -1.401) 4.949 31.465 ( -7.238 0.000 -2.248) 7.579 31.598 ( 6.448 0.000 0.073) 6.448 32.503 ( 10.197 0.000 6.650) 12.174 33.738 ( 15.297 0.000 -13.961) 20.710 ======================= Grid point 151 (69/168) ======================= q-point: ( 0.40 0.00 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.334 ( 0.386 0.000 11.217) 11.224 2.485 ( -13.441 0.000 -3.531) 13.897 2.645 ( -4.015 0.000 5.253) 6.612 2.695 ( 13.681 0.000 -11.171) 17.663 3.012 ( 19.577 0.000 -7.922) 21.119 3.263 ( 4.430 0.000 10.107) 11.035 3.611 ( -2.090 0.000 5.302) 5.699 3.826 ( 7.687 0.000 3.126) 8.299 3.945 ( 4.289 0.000 -7.854) 8.949 3.974 ( -1.118 0.000 2.514) 2.751 4.066 ( -3.504 0.000 -3.451) 4.918 4.471 ( 1.383 0.000 -7.670) 7.794 4.791 ( 0.804 0.000 -1.089) 1.354 4.795 ( 8.811 0.000 0.848) 8.851 5.119 ( 5.073 0.000 -7.525) 9.075 5.182 ( 1.253 0.000 1.563) 2.003 5.441 ( 9.077 0.000 -11.586) 14.718 5.541 ( -2.775 0.000 8.151) 8.611 5.770 ( 4.608 0.000 -1.701) 4.912 5.978 ( 2.277 0.000 -2.715) 3.544 6.100 ( 0.166 0.000 3.471) 3.475 6.278 ( 3.416 0.000 -14.565) 14.961 6.537 ( 2.511 0.000 -1.379) 2.865 6.758 ( -1.966 0.000 8.393) 8.620 6.778 ( -1.978 0.000 9.259) 9.467 6.818 ( -2.693 0.000 5.428) 6.059 7.051 ( 0.257 0.000 2.789) 2.801 7.253 ( 9.732 0.000 -1.528) 9.851 7.506 ( -2.258 0.000 2.170) 3.132 7.563 ( 0.224 0.000 -5.156) 5.161 7.998 ( -3.260 0.000 1.740) 3.695 8.040 ( 4.324 0.000 3.074) 5.305 8.370 ( -1.529 0.000 -10.214) 10.328 8.675 ( 2.856 0.000 -14.463) 14.742 9.122 ( -6.563 0.000 13.333) 14.860 9.268 ( -2.729 0.000 -1.002) 2.907 11.052 ( 3.184 0.000 -6.166) 6.939 11.120 ( 2.930 0.000 3.985) 4.946 11.696 ( -4.290 0.000 1.091) 4.427 11.822 ( -0.817 0.000 -6.479) 6.530 13.545 ( 0.018 0.000 0.441) 0.441 13.565 ( -1.985 0.000 6.988) 7.264 13.840 ( -10.503 0.000 5.916) 12.055 14.214 ( -4.173 0.000 -0.951) 4.280 15.220 ( -0.473 0.000 -0.840) 0.964 15.273 ( 1.484 0.000 1.966) 2.463 15.797 ( 3.630 0.000 2.529) 4.424 15.880 ( 4.279 0.000 -2.253) 4.836 16.133 ( -1.258 0.000 2.409) 2.718 16.232 ( -2.210 0.000 -7.478) 7.798 16.416 ( -8.184 0.000 2.658) 8.605 16.653 ( 0.004 0.000 5.910) 5.910 18.352 ( 3.393 0.000 2.732) 4.357 18.353 ( 4.408 0.000 -0.351) 4.422 18.427 ( 7.221 0.000 2.485) 7.636 18.758 ( 3.381 0.000 -1.397) 3.658 27.716 ( 1.196 0.000 -1.629) 2.021 27.772 ( 1.325 0.000 -0.462) 1.403 27.911 ( 2.285 0.000 3.387) 4.086 27.986 ( 0.472 0.000 4.330) 4.355 28.887 ( 2.292 0.000 1.463) 2.719 29.057 ( 2.098 0.000 -0.789) 2.242 29.163 ( -5.467 0.000 5.662) 7.870 29.571 ( 3.533 0.000 -2.291) 4.211 29.901 ( -10.455 0.000 11.584) 15.604 29.969 ( -3.008 0.000 -4.047) 5.043 30.376 ( -2.082 0.000 -0.795) 2.229 30.847 ( -0.421 0.000 2.247) 2.286 31.325 ( -3.919 0.000 -6.439) 7.538 31.645 ( 1.776 0.000 -3.444) 3.875 32.690 ( 2.772 0.000 7.444) 7.944 33.794 ( 12.560 0.000 -13.801) 18.661 ======================= Grid point 152 (70/168) ======================= q-point: (-0.50 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.191 ( -19.090 0.000 -2.587) 19.264 2.205 ( -20.370 0.000 1.609) 20.434 2.749 ( 2.667 0.000 10.905) 11.226 2.793 ( 13.854 0.000 -9.098) 16.575 3.224 ( 15.716 0.000 -8.481) 17.858 3.357 ( -6.184 0.000 9.288) 11.158 3.686 ( 0.667 0.000 10.000) 10.022 3.886 ( -2.578 0.000 -1.542) 3.004 3.896 ( 4.554 0.000 -9.961) 10.952 3.916 ( -4.849 0.000 -2.065) 5.271 4.041 ( -1.763 0.000 4.140) 4.500 4.405 ( 1.184 0.000 -9.002) 9.080 4.782 ( -0.641 0.000 -2.262) 2.351 4.926 ( 3.740 0.000 2.973) 4.778 5.048 ( -5.760 0.000 -4.992) 7.622 5.242 ( 4.208 0.000 0.120) 4.210 5.439 ( 5.547 0.000 -11.321) 12.607 5.577 ( -3.991 0.000 7.350) 8.363 5.848 ( 8.008 0.000 -1.458) 8.140 6.010 ( 2.443 0.000 2.894) 3.787 6.013 ( -6.776 0.000 -8.284) 10.702 6.224 ( 3.365 0.000 -5.376) 6.342 6.567 ( -0.257 0.000 2.782) 2.794 6.779 ( -6.511 0.000 1.953) 6.798 6.798 ( -5.118 0.000 8.224) 9.686 6.902 ( 4.250 0.000 10.233) 11.080 7.035 ( -5.356 0.000 3.116) 6.196 7.277 ( -2.935 0.000 -2.519) 3.868 7.487 ( -2.675 0.000 1.970) 3.322 7.622 ( 10.682 0.000 -1.156) 10.745 7.977 ( -1.969 0.000 -0.686) 2.085 8.201 ( -4.644 0.000 -8.873) 10.015 8.208 ( 12.850 0.000 2.293) 13.053 8.556 ( 4.945 0.000 -16.651) 17.370 9.092 ( -9.862 0.000 6.188) 11.643 9.182 ( -4.694 0.000 -2.773) 5.451 11.049 ( 4.499 0.000 -4.424) 6.310 11.216 ( 2.483 0.000 3.966) 4.679 11.653 ( -2.747 0.000 0.727) 2.842 11.734 ( 0.429 0.000 -7.193) 7.206 13.621 ( 6.118 0.000 3.487) 7.042 13.657 ( 3.185 0.000 7.583) 8.225 13.771 ( -7.137 0.000 5.463) 8.988 14.187 ( 2.243 0.000 -0.916) 2.423 15.220 ( 0.331 0.000 0.818) 0.882 15.291 ( -1.429 0.000 1.355) 1.970 15.883 ( 2.411 0.000 3.649) 4.373 15.901 ( 3.185 0.000 -4.798) 5.759 16.125 ( -0.515 0.000 -7.355) 7.373 16.133 ( -0.900 0.000 0.038) 0.900 16.367 ( -5.115 0.000 7.664) 9.214 16.708 ( 0.014 0.000 3.801) 3.802 18.388 ( -0.547 0.000 1.362) 1.467 18.399 ( -1.699 0.000 2.885) 3.348 18.565 ( 6.064 0.000 3.379) 6.942 18.748 ( -1.619 0.000 -2.776) 3.214 27.726 ( 1.349 0.000 -0.337) 1.390 27.775 ( -0.304 0.000 -0.533) 0.614 27.991 ( 2.342 0.000 3.958) 4.599 28.026 ( -1.317 0.000 3.627) 3.859 28.962 ( 3.781 0.000 3.088) 4.882 29.058 ( -0.802 0.000 -1.044) 1.317 29.141 ( -5.133 0.000 5.087) 7.226 29.622 ( 5.774 0.000 -1.712) 6.022 29.888 ( -7.819 0.000 11.018) 13.511 29.913 ( 1.100 0.000 -2.718) 2.932 30.320 ( -3.690 0.000 -0.860) 3.789 30.916 ( 3.164 0.000 5.210) 6.096 31.206 ( -0.105 0.000 -8.470) 8.470 31.577 ( -3.082 0.000 -6.347) 7.056 32.752 ( -5.547 0.000 7.447) 9.286 33.822 ( 11.383 0.000 -13.925) 17.985 ======================= Grid point 153 (71/168) ======================= q-point: (-0.40 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.855 ( -26.156 0.000 2.448) 26.270 1.856 ( -24.959 0.000 5.437) 25.545 2.899 ( -0.813 0.000 12.490) 12.516 2.907 ( 9.810 0.000 -5.272) 11.137 3.293 ( -10.743 0.000 2.659) 11.067 3.306 ( 9.473 0.000 -9.817) 13.642 3.675 ( -20.491 0.000 1.122) 20.521 3.742 ( -7.346 0.000 -0.985) 7.411 3.831 ( 0.637 0.000 -10.299) 10.319 3.898 ( 5.781 0.000 2.182) 6.179 4.130 ( 4.973 0.000 7.288) 8.823 4.282 ( -7.534 0.000 -6.771) 10.130 4.603 ( -11.806 0.000 -9.145) 14.933 4.924 ( -6.461 0.000 -1.616) 6.660 4.937 ( -4.176 0.000 1.425) 4.413 5.247 ( 0.005 0.000 -11.519) 11.519 5.372 ( -0.886 0.000 0.405) 0.974 5.561 ( -6.790 0.000 3.071) 7.453 5.818 ( -5.649 0.000 -6.233) 8.412 5.951 ( 5.486 0.000 -1.315) 5.641 6.151 ( 4.870 0.000 11.096) 12.118 6.168 ( -2.499 0.000 -6.553) 7.013 6.583 ( -2.448 0.000 3.991) 4.682 6.690 ( -6.439 0.000 0.759) 6.484 6.817 ( -2.507 0.000 6.582) 7.043 6.964 ( -8.216 0.000 3.382) 8.885 7.121 ( 8.565 0.000 8.764) 12.254 7.217 ( -3.172 0.000 2.212) 3.867 7.471 ( -2.449 0.000 1.264) 2.756 7.772 ( 8.831 0.000 -0.663) 8.856 7.884 ( -2.590 0.000 -6.704) 7.187 8.087 ( -2.442 0.000 -0.943) 2.618 8.421 ( 1.977 0.000 -1.532) 2.501 8.492 ( 21.803 0.000 -18.221) 28.414 9.009 ( -7.275 0.000 4.293) 8.447 9.099 ( -1.767 0.000 0.311) 1.794 11.095 ( 5.512 0.000 -1.497) 5.712 11.253 ( 0.368 0.000 -2.044) 2.077 11.615 ( -2.526 0.000 -0.528) 2.580 11.704 ( 3.245 0.000 -2.525) 4.112 13.729 ( -4.034 0.000 2.132) 4.563 13.786 ( 9.022 0.000 3.278) 9.599 13.834 ( 7.977 0.000 7.669) 11.066 14.263 ( 8.978 0.000 -1.292) 9.070 15.243 ( 0.274 0.000 2.292) 2.308 15.268 ( -3.052 0.000 1.344) 3.335 15.868 ( 1.585 0.000 -6.863) 7.044 15.947 ( 1.050 0.000 2.599) 2.803 16.054 ( 0.859 0.000 -5.286) 5.356 16.115 ( -0.322 0.000 -1.156) 1.200 16.421 ( -2.258 0.000 10.727) 10.962 16.744 ( 0.937 0.000 1.433) 1.713 18.362 ( -6.393 0.000 1.867) 6.660 18.368 ( -5.134 0.000 2.939) 5.916 18.649 ( -5.934 0.000 -3.905) 7.103 18.691 ( 4.742 0.000 3.828) 6.094 27.746 ( 1.110 0.000 0.270) 1.142 27.752 ( -1.625 0.000 -0.791) 1.807 28.026 ( -2.743 0.000 2.136) 3.476 28.067 ( 1.912 0.000 3.380) 3.884 29.011 ( -3.207 0.000 -1.267) 3.448 29.067 ( 4.588 0.000 2.672) 5.309 29.121 ( -4.389 0.000 5.216) 6.817 29.703 ( 7.873 0.000 -3.314) 8.542 29.899 ( -4.968 0.000 7.556) 9.043 29.943 ( 4.032 0.000 0.847) 4.120 30.259 ( -5.665 0.000 4.710) 7.367 31.015 ( 3.473 0.000 -1.072) 3.635 31.159 ( 3.873 0.000 -1.800) 4.271 31.416 ( -6.535 0.000 -7.884) 10.240 32.700 ( -11.788 0.000 7.925) 14.204 33.829 ( 10.510 0.000 -15.460) 18.695 ======================= Grid point 154 (72/168) ======================= q-point: (-0.30 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.476 ( -28.650 0.000 7.421) 29.596 1.567 ( -28.899 0.000 18.541) 34.336 2.785 ( -32.327 0.000 1.677) 32.371 2.998 ( -3.138 0.000 9.179) 9.700 3.133 ( -0.275 0.000 -8.140) 8.145 3.303 ( -5.513 0.000 -1.934) 5.842 3.415 ( -11.478 0.000 4.572) 12.355 3.536 ( -4.556 0.000 -8.165) 9.350 3.727 ( 0.879 0.000 -9.427) 9.468 3.938 ( -23.171 0.000 -7.524) 24.362 4.050 ( 5.641 0.000 6.257) 8.425 4.306 ( 7.337 0.000 4.271) 8.489 4.408 ( -0.723 0.000 -6.566) 6.606 4.685 ( -17.274 0.000 -6.087) 18.315 4.912 ( -2.785 0.000 2.997) 4.092 5.041 ( -8.072 0.000 -8.475) 11.704 5.403 ( 0.536 0.000 2.211) 2.276 5.452 ( -7.817 0.000 0.359) 7.825 5.674 ( -6.592 0.000 -5.287) 8.450 6.000 ( 3.954 0.000 -1.951) 4.410 6.019 ( -5.385 0.000 -6.743) 8.630 6.304 ( -8.093 0.000 16.208) 18.116 6.592 ( -5.996 0.000 -0.987) 6.076 6.599 ( 3.708 0.000 -2.715) 4.596 6.879 ( 2.159 0.000 4.218) 4.738 6.889 ( -6.472 0.000 4.682) 7.988 7.214 ( -2.559 0.000 4.370) 5.064 7.308 ( 3.666 0.000 1.372) 3.914 7.431 ( 1.148 0.000 -0.483) 1.245 7.848 ( 0.089 0.000 3.729) 3.730 7.879 ( 5.200 0.000 0.208) 5.204 8.081 ( 2.508 0.000 -0.167) 2.513 8.344 ( 5.818 0.000 -16.322) 17.327 8.585 ( 7.164 0.000 -14.218) 15.921 8.976 ( -4.992 0.000 6.293) 8.033 9.239 ( 12.004 0.000 10.823) 16.163 11.174 ( 4.834 0.000 0.386) 4.849 11.199 ( 0.360 0.000 -6.884) 6.893 11.565 ( -2.167 0.000 -1.137) 2.447 11.759 ( 3.792 0.000 1.131) 3.957 13.684 ( -2.364 0.000 -1.555) 2.829 13.946 ( 8.169 0.000 0.317) 8.176 14.066 ( 11.251 0.000 5.881) 12.695 14.422 ( 13.376 0.000 -2.570) 13.621 15.243 ( -2.003 0.000 1.814) 2.702 15.278 ( 0.057 0.000 3.250) 3.250 15.823 ( 1.661 0.000 -3.615) 3.978 15.959 ( 0.662 0.000 -3.076) 3.147 16.046 ( 1.152 0.000 1.468) 1.866 16.089 ( -0.160 0.000 -3.117) 3.121 16.522 ( -1.023 0.000 10.771) 10.819 16.771 ( 1.917 0.000 -0.679) 2.034 18.252 ( -9.122 0.000 0.767) 9.155 18.295 ( -9.199 0.000 3.919) 9.999 18.486 ( -8.583 0.000 -4.179) 9.546 18.789 ( 3.490 0.000 0.940) 3.614 27.711 ( -2.085 0.000 -0.968) 2.299 27.759 ( 0.243 0.000 -0.259) 0.355 27.993 ( -3.357 0.000 0.522) 3.397 28.122 ( 1.035 0.000 1.907) 2.169 28.941 ( -3.582 0.000 -1.260) 3.797 29.083 ( -2.241 0.000 0.357) 2.269 29.184 ( 1.994 0.000 4.485) 4.909 29.778 ( 8.310 0.000 -6.233) 10.388 29.880 ( -2.460 0.000 -0.840) 2.599 30.049 ( 4.943 0.000 4.889) 6.953 30.321 ( -3.069 0.000 21.575) 21.793 31.000 ( 5.040 0.000 -9.538) 10.788 31.214 ( -7.307 0.000 -7.591) 10.536 31.265 ( 3.812 0.000 5.501) 6.693 32.585 ( -15.217 0.000 9.508) 17.943 33.768 ( 7.073 0.000 -21.893) 23.007 ======================= Grid point 155 (73/168) ======================= q-point: (-0.20 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.165 ( -27.523 0.000 16.548) 32.114 1.367 ( -30.428 0.000 23.181) 38.252 2.173 ( -50.461 0.000 20.971) 54.645 2.898 ( -18.070 0.000 -9.669) 20.495 3.018 ( -8.647 0.000 -1.779) 8.828 3.090 ( -10.589 0.000 7.056) 12.725 3.271 ( -13.261 0.000 -9.052) 16.056 3.554 ( 7.074 0.000 -0.332) 7.082 3.592 ( -2.944 0.000 -5.813) 6.516 3.672 ( 0.807 0.000 -3.640) 3.729 4.203 ( 5.751 0.000 4.495) 7.299 4.312 ( -19.927 0.000 -4.280) 20.381 4.415 ( 7.582 0.000 -1.209) 7.678 4.418 ( 3.735 0.000 -0.902) 3.842 4.874 ( -3.980 0.000 -2.085) 4.493 4.905 ( -2.842 0.000 3.390) 4.424 5.365 ( -5.059 0.000 1.736) 5.349 5.422 ( -1.544 0.000 2.565) 2.994 5.488 ( -6.280 0.000 -3.914) 7.400 5.886 ( -5.111 0.000 -1.600) 5.356 6.040 ( 4.421 0.000 -2.570) 5.113 6.274 ( -14.064 0.000 10.778) 17.719 6.487 ( -4.297 0.000 -2.920) 5.195 6.624 ( 3.926 0.000 -3.516) 5.270 6.873 ( -3.947 0.000 6.611) 7.700 6.938 ( 0.850 0.000 0.600) 1.040 7.244 ( 1.290 0.000 3.674) 3.894 7.260 ( -1.495 0.000 -3.874) 4.152 7.541 ( 5.844 0.000 0.958) 5.922 7.901 ( -2.253 0.000 7.473) 7.805 7.929 ( 1.204 0.000 -1.413) 1.857 8.168 ( 7.564 0.000 0.880) 7.616 8.199 ( -0.410 0.000 -20.561) 20.566 8.463 ( 0.335 0.000 -11.785) 11.789 8.976 ( -6.210 0.000 7.539) 9.767 9.582 ( 12.519 0.000 7.716) 14.706 11.133 ( 2.070 0.000 -7.527) 7.807 11.230 ( 2.386 0.000 -1.186) 2.665 11.543 ( -0.245 0.000 1.493) 1.513 11.826 ( 2.709 0.000 1.408) 3.053 13.628 ( -0.668 0.000 -2.750) 2.830 14.036 ( 5.138 0.000 -2.753) 5.829 14.296 ( 10.363 0.000 3.795) 11.036 14.594 ( 13.439 0.000 -4.946) 14.320 15.250 ( -0.032 0.000 1.638) 1.638 15.303 ( -0.575 0.000 0.651) 0.868 15.893 ( 7.989 0.000 4.189) 9.021 15.921 ( 0.507 0.000 -4.390) 4.420 16.044 ( -0.065 0.000 -1.842) 1.843 16.101 ( 1.398 0.000 3.924) 4.166 16.618 ( -1.230 0.000 8.517) 8.606 16.785 ( 1.974 0.000 -2.321) 3.046 18.113 ( -8.843 0.000 0.200) 8.845 18.174 ( -11.750 0.000 3.637) 12.299 18.307 ( -8.077 0.000 -3.215) 8.693 18.750 ( -4.647 0.000 -11.914) 12.788 27.671 ( -1.622 0.000 -0.836) 1.825 27.741 ( -1.426 0.000 -1.349) 1.963 27.939 ( -3.088 0.000 -0.853) 3.204 28.138 ( -0.191 0.000 -0.395) 0.439 28.881 ( -2.372 0.000 -0.794) 2.502 29.036 ( -2.477 0.000 -2.614) 3.601 29.222 ( -2.313 0.000 2.480) 3.391 29.811 ( 6.509 0.000 -8.426) 10.647 29.847 ( 0.134 0.000 0.560) 0.576 30.193 ( 4.222 0.000 7.070) 8.235 30.724 ( 14.897 0.000 35.720) 38.701 30.992 ( 8.717 0.000 -9.835) 13.142 31.042 ( -4.619 0.000 -4.974) 6.788 31.358 ( 0.957 0.000 3.676) 3.799 32.456 ( -16.415 0.000 11.547) 20.070 33.445 ( -10.620 0.000 -36.346) 37.866 ======================= Grid point 156 (74/168) ======================= q-point: (-0.10 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.027 ( -20.258 0.000 25.405) 32.493 1.046 ( -33.947 0.000 17.795) 38.328 1.974 ( -30.243 0.000 52.253) 60.374 2.411 ( -21.287 0.000 -15.166) 26.137 2.812 ( -12.859 0.000 -1.677) 12.968 3.009 ( -1.402 0.000 -7.493) 7.623 3.055 ( -4.911 0.000 4.507) 6.666 3.499 ( -0.891 0.000 -7.270) 7.325 3.621 ( 0.708 0.000 -2.140) 2.254 3.717 ( 4.565 0.000 1.989) 4.980 4.043 ( -6.083 0.000 -0.388) 6.095 4.365 ( 4.105 0.000 5.637) 6.973 4.408 ( -0.013 0.000 -1.815) 1.815 4.567 ( 9.573 0.000 0.142) 9.574 4.872 ( 2.877 0.000 1.417) 3.207 4.940 ( 4.890 0.000 0.584) 4.925 5.281 ( -5.290 0.000 2.053) 5.675 5.423 ( -3.078 0.000 4.689) 5.609 5.616 ( 15.192 0.000 12.858) 19.903 5.829 ( -2.228 0.000 2.200) 3.131 6.070 ( 3.535 0.000 -3.751) 5.155 6.136 ( -13.489 0.000 3.228) 13.870 6.395 ( -3.529 0.000 -2.659) 4.418 6.646 ( 2.530 0.000 -1.449) 2.915 6.915 ( -1.344 0.000 7.801) 7.916 6.928 ( -0.553 0.000 -1.167) 1.291 7.220 ( 0.562 0.000 -2.317) 2.384 7.355 ( 10.322 0.000 -1.417) 10.419 7.551 ( -1.639 0.000 -5.037) 5.297 7.682 ( -22.425 0.000 -18.311) 28.951 7.968 ( -1.207 0.000 9.306) 9.384 7.993 ( -4.366 0.000 1.765) 4.710 8.302 ( 7.654 0.000 0.722) 7.688 8.412 ( 6.166 0.000 -5.394) 8.192 8.918 ( -11.270 0.000 5.246) 12.432 9.644 ( -5.780 0.000 -7.045) 9.113 11.092 ( 3.152 0.000 -7.005) 7.681 11.227 ( 1.504 0.000 -3.857) 4.140 11.588 ( 0.595 0.000 5.061) 5.096 11.877 ( 1.573 0.000 1.572) 2.224 13.637 ( 2.666 0.000 1.192) 2.920 14.052 ( 2.543 0.000 -4.446) 5.122 14.451 ( 4.562 0.000 1.905) 4.943 14.714 ( 9.950 0.000 -6.550) 11.913 15.251 ( -1.782 0.000 -0.208) 1.794 15.273 ( -1.040 0.000 -1.911) 2.175 15.882 ( 0.919 0.000 -4.515) 4.608 15.921 ( 2.480 0.000 -10.236) 10.532 16.171 ( 0.925 0.000 4.876) 4.963 16.340 ( 24.104 0.000 12.179) 27.006 16.663 ( -2.382 0.000 4.745) 5.309 16.775 ( 0.681 0.000 -3.227) 3.298 17.998 ( -5.396 0.000 -0.154) 5.398 18.001 ( -14.420 0.000 -1.747) 14.525 18.191 ( -2.745 0.000 -1.121) 2.965 18.300 ( -27.813 0.000 -11.488) 30.092 27.647 ( -0.490 0.000 -0.336) 0.594 27.700 ( -1.250 0.000 -0.744) 1.454 27.883 ( -2.053 0.000 -1.779) 2.716 28.101 ( -1.708 0.000 -3.483) 3.879 28.853 ( -0.496 0.000 -0.056) 0.499 28.957 ( -2.427 0.000 -2.764) 3.678 29.200 ( -4.391 0.000 4.071) 5.988 29.789 ( 3.814 0.000 -9.328) 10.077 29.910 ( 2.545 0.000 5.594) 6.146 30.319 ( 1.320 0.000 6.332) 6.468 30.977 ( 1.021 0.000 -0.812) 1.305 31.064 ( 13.109 0.000 -6.962) 14.843 31.373 ( -1.748 0.000 0.147) 1.754 31.509 ( 27.325 0.000 15.873) 31.600 32.338 ( -16.251 0.000 12.442) 20.466 32.643 ( -29.596 0.000 -19.931) 35.682 ======================= Grid point 157 (75/168) ======================= q-point: ( 0.00 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.147 ( 9.500 12.424 13.957) 20.962 1.504 ( -4.444 28.441 18.313) 34.118 1.985 ( -8.294 1.557 -10.283) 13.303 2.418 ( -17.233 19.776 35.811) 44.390 2.798 ( -0.870 6.413 3.664) 7.437 3.036 ( 0.107 -0.625 5.286) 5.324 3.089 ( 9.891 3.437 -3.344) 10.992 3.396 ( 3.382 -4.167 0.531) 5.393 3.569 ( 6.810 -1.033 -6.843) 9.709 3.789 ( 4.546 -2.339 2.654) 5.760 4.104 ( 1.821 1.496 4.905) 5.442 4.369 ( -0.128 3.419 -4.799) 5.894 4.463 ( 3.546 -5.699 4.074) 7.852 4.599 ( 7.996 -10.793 5.844) 14.649 4.901 ( 4.336 -2.519 -0.739) 5.069 4.999 ( 3.219 -0.522 0.373) 3.282 5.274 ( -5.388 1.756 7.827) 9.663 5.540 ( -1.763 1.279 6.027) 6.408 5.780 ( 3.450 -3.490 0.925) 4.994 5.925 ( -1.356 0.366 4.630) 4.838 5.972 ( -4.096 3.652 4.263) 6.949 6.174 ( -0.349 -0.344 0.667) 0.828 6.443 ( 4.467 9.968 -2.866) 11.293 6.623 ( -0.663 -3.026 -1.293) 3.357 6.863 ( -0.521 -3.022 -0.264) 3.077 6.954 ( -12.781 -5.208 -1.291) 13.862 7.062 ( -0.352 4.732 4.229) 6.356 7.320 ( -5.847 1.879 -5.479) 8.230 7.370 ( -4.161 1.087 -1.219) 4.470 7.688 ( 14.173 7.496 -16.331) 22.886 7.934 ( -0.551 -2.458 2.689) 3.685 8.086 ( 0.172 1.188 5.730) 5.854 8.389 ( 6.607 -2.590 -0.634) 7.125 8.575 ( 11.322 2.007 2.171) 11.702 8.744 ( -13.350 -0.122 -0.391) 13.356 9.273 ( -5.933 -10.317 -6.442) 13.533 11.078 ( 3.019 0.777 -3.634) 4.788 11.279 ( 2.026 6.248 -5.480) 8.554 11.602 ( -0.245 -5.169 6.048) 7.959 11.879 ( 0.490 -2.490 0.616) 2.611 13.707 ( -2.080 3.384 1.929) 4.416 14.070 ( 0.521 4.026 -5.712) 7.007 14.432 ( -3.788 -3.481 0.821) 5.209 14.721 ( 2.117 -2.329 -6.983) 7.660 15.233 ( -3.691 4.203 -3.610) 6.658 15.304 ( 3.057 3.435 -2.053) 5.036 15.760 ( 1.154 -4.369 -7.179) 8.483 15.878 ( 1.736 0.026 -6.841) 7.058 16.254 ( 1.079 1.237 4.783) 5.057 16.475 ( -6.042 -3.169 0.554) 6.845 16.711 ( -0.760 -1.895 -3.309) 3.889 16.755 ( 6.716 -5.685 1.100) 8.868 17.728 ( -7.463 1.323 3.863) 8.507 17.961 ( -0.336 -0.278 1.041) 1.128 18.012 ( -5.865 -0.677 4.017) 7.141 18.198 ( 5.144 -1.029 0.689) 5.291 27.666 ( -1.263 1.049 -1.078) 1.965 27.729 ( 1.552 2.505 -1.765) 3.435 27.833 ( -0.213 -0.582 -1.737) 1.844 28.007 ( -1.844 -1.116 -4.553) 5.038 28.923 ( -0.566 1.247 -1.417) 1.970 29.016 ( 1.108 11.849 -7.156) 13.886 29.192 ( -3.696 0.839 4.278) 5.715 29.700 ( 0.630 -2.031 -8.424) 8.688 30.095 ( 1.202 6.399 5.416) 8.469 30.425 ( -3.538 5.681 2.520) 7.151 31.016 ( -8.387 -2.371 2.374) 9.034 31.135 ( 9.242 -1.560 3.924) 10.161 31.324 ( 3.194 -1.000 -4.622) 5.707 31.370 ( -25.621 9.666 -0.132) 27.384 32.140 ( -6.283 -8.294 12.245) 16.069 32.753 ( 33.634 -11.574 -0.153) 35.570 ======================= Grid point 158 (76/168) ======================= q-point: ( 0.10 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.631 ( 29.828 7.801 7.382) 31.703 1.704 ( 12.709 22.117 8.393) 26.853 1.890 ( 6.973 11.512 -2.740) 13.735 2.575 ( -8.960 9.383 27.165) 30.104 2.821 ( 2.032 5.657 -1.936) 6.315 3.146 ( 5.123 -0.036 2.504) 5.702 3.205 ( 10.441 0.781 -2.904) 10.865 3.613 ( 12.097 0.618 0.924) 12.148 3.673 ( 13.381 3.932 4.955) 14.801 3.828 ( -0.370 -3.288 -1.375) 3.584 4.141 ( 1.445 5.149 -1.000) 5.441 4.348 ( 1.403 1.124 0.237) 1.814 4.562 ( 5.315 -8.734 -0.405) 10.232 4.806 ( 6.879 -10.494 7.315) 14.524 4.925 ( 1.343 -2.670 -4.234) 5.183 5.076 ( 4.985 -1.663 1.779) 5.548 5.274 ( -4.595 -2.107 5.825) 7.713 5.590 ( -0.855 -0.709 6.760) 6.850 5.745 ( -2.566 6.012 -2.716) 7.078 5.919 ( -1.606 -2.229 3.870) 4.746 6.096 ( -1.488 -2.112 10.785) 11.090 6.151 ( 0.691 3.985 0.219) 4.050 6.462 ( 3.975 8.885 -5.618) 11.239 6.614 ( 0.600 -3.016 1.534) 3.437 6.787 ( -4.016 -2.529 -0.857) 4.823 6.844 ( -2.707 -1.439 -0.992) 3.222 7.037 ( -9.583 0.837 -3.286) 10.165 7.150 ( -3.034 6.523 -2.475) 7.607 7.344 ( 2.109 2.347 -0.556) 3.203 7.726 ( 10.592 4.834 -12.042) 16.750 7.956 ( -0.596 -1.274 2.578) 2.937 8.206 ( 6.261 -1.272 5.595) 8.493 8.464 ( -2.065 1.681 -3.201) 4.164 8.537 ( -4.904 -3.751 2.415) 6.630 8.814 ( 12.625 0.939 2.137) 12.839 9.146 ( 1.208 -6.672 -8.411) 10.804 11.079 ( 1.710 1.933 -2.940) 3.912 11.237 ( 1.107 6.031 -5.901) 8.510 11.666 ( -0.669 -5.674 6.055) 8.325 11.887 ( 0.170 -2.868 -0.013) 2.873 13.662 ( -6.438 2.722 2.949) 7.586 13.983 ( -3.670 2.750 -5.822) 7.411 14.324 ( -10.708 -2.865 1.014) 11.131 14.624 ( -5.035 -3.115 -5.175) 7.864 15.150 ( -2.286 3.679 -1.646) 4.634 15.332 ( 3.271 3.257 -2.662) 5.329 15.707 ( 0.835 -4.194 -4.579) 6.266 15.824 ( 1.975 0.446 -7.070) 7.354 16.323 ( -9.024 -0.257 0.871) 9.069 16.333 ( -0.495 0.847 5.592) 5.678 16.621 ( -4.264 -2.422 -3.484) 6.015 16.775 ( -4.903 -3.922 0.242) 6.283 17.836 ( 11.953 -2.017 1.359) 12.198 18.009 ( 3.044 -2.008 3.185) 4.842 18.044 ( 6.195 2.082 0.319) 6.543 18.336 ( 10.285 -0.980 1.113) 10.391 27.655 ( 0.576 -0.583 0.027) 0.820 27.731 ( 1.560 0.947 -1.998) 2.706 27.829 ( 1.153 0.135 -0.210) 1.179 27.925 ( -1.541 -0.105 -4.765) 5.009 28.893 ( -0.853 0.960 -1.421) 1.915 28.994 ( 2.746 7.384 -2.938) 8.408 29.187 ( -3.821 0.233 5.082) 6.362 29.618 ( 0.501 -3.042 -7.213) 7.845 30.138 ( -5.730 4.444 7.247) 10.252 30.348 ( -6.705 3.052 -0.607) 7.392 30.732 ( -21.525 7.246 5.908) 23.468 31.161 ( -8.446 0.865 -1.368) 8.599 31.348 ( 9.443 8.469 3.611) 13.188 31.461 ( 11.520 -3.511 3.113) 12.439 32.106 ( -6.054 -5.170 5.751) 9.821 33.230 ( 30.612 -13.333 -9.129) 34.615 ======================= Grid point 159 (77/168) ======================= q-point: ( 0.20 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.984 ( 6.315 20.449 15.048) 26.162 2.063 ( 26.660 7.671 -1.816) 27.801 2.286 ( 32.116 7.436 3.343) 33.134 2.715 ( -4.968 6.022 13.848) 15.897 2.847 ( 6.798 2.276 -4.549) 8.490 3.206 ( 4.469 -6.766 2.185) 8.398 3.379 ( 7.009 2.911 -6.245) 9.828 3.590 ( -2.736 9.143 -1.668) 9.688 3.831 ( 10.589 3.545 -1.065) 11.218 4.062 ( 10.379 7.170 5.184) 13.639 4.208 ( 9.071 -3.244 1.294) 9.720 4.342 ( -1.437 0.170 -0.212) 1.463 4.606 ( 5.561 -5.561 -6.850) 10.429 4.851 ( -0.058 -1.696 -8.965) 9.124 4.928 ( 1.507 -12.758 1.797) 12.971 5.153 ( -4.230 -1.138 7.611) 8.781 5.301 ( 7.612 -6.968 -3.035) 10.756 5.651 ( 2.121 6.013 0.941) 6.445 5.721 ( -3.629 4.838 6.570) 8.930 5.931 ( -0.151 -3.137 0.645) 3.207 6.049 ( -4.548 2.084 -1.072) 5.116 6.287 ( 0.827 -5.416 9.127) 10.645 6.475 ( 7.770 4.448 -4.855) 10.185 6.661 ( 2.847 5.888 -4.085) 7.711 6.720 ( -8.024 -4.358 3.870) 9.918 6.817 ( 2.842 0.208 -1.347) 3.152 6.863 ( -1.910 2.359 0.902) 3.167 7.116 ( -1.045 4.845 0.636) 4.997 7.421 ( 5.084 2.102 1.712) 5.761 7.734 ( 5.188 4.489 -8.953) 11.279 7.984 ( 0.351 -0.154 2.505) 2.534 8.259 ( -7.563 1.296 -6.338) 9.952 8.362 ( 4.812 -2.974 1.374) 5.822 8.657 ( 4.200 -4.813 8.989) 11.028 8.942 ( 4.010 4.463 -2.448) 6.480 9.154 ( 7.757 -6.063 -2.591) 10.181 11.067 ( 0.411 2.506 -1.783) 3.103 11.184 ( 0.996 5.220 -5.876) 7.922 11.709 ( -1.993 -5.439 4.668) 7.439 11.880 ( -0.095 -3.504 -1.554) 3.834 13.594 ( -7.277 1.367 4.287) 8.555 13.820 ( -8.133 2.034 -5.492) 10.022 14.143 ( -14.121 -1.951 2.180) 14.421 14.466 ( -8.756 -3.001 -2.912) 9.703 15.144 ( 2.008 2.913 0.995) 3.676 15.332 ( 0.917 3.473 -3.078) 4.730 15.686 ( 1.137 -3.276 -1.759) 3.889 15.795 ( 3.593 -0.322 -5.140) 6.279 16.196 ( -7.174 0.380 1.698) 7.382 16.405 ( -0.143 0.040 2.646) 2.650 16.521 ( -3.575 -2.694 -0.496) 4.504 16.669 ( -8.085 -1.387 0.536) 8.221 18.028 ( 11.353 -3.214 -0.770) 11.825 18.123 ( 6.948 -2.104 2.530) 7.688 18.181 ( 10.346 3.272 -0.255) 10.854 18.516 ( 10.723 -0.961 0.661) 10.787 27.679 ( 1.794 -1.732 0.548) 2.553 27.736 ( 1.805 0.256 -1.742) 2.522 27.860 ( -0.400 0.440 -3.128) 3.184 27.862 ( 1.519 0.059 1.667) 2.256 28.870 ( -0.405 0.981 -0.759) 1.304 29.021 ( 3.467 5.115 -1.209) 6.297 29.186 ( -4.247 -0.089 5.702) 7.110 29.557 ( 0.967 -3.255 -5.336) 6.325 30.076 ( -13.429 2.803 9.568) 16.725 30.228 ( -6.643 1.720 -1.887) 7.117 30.571 ( -7.110 10.878 3.079) 13.356 31.009 ( -7.532 0.175 -2.709) 8.006 31.449 ( -0.551 -2.407 0.647) 2.552 31.660 ( 6.993 10.487 4.684) 13.447 32.171 ( 8.319 -8.850 3.602) 12.668 33.508 ( 21.204 -10.592 -11.722) 26.443 ======================= Grid point 160 (78/168) ======================= q-point: ( 0.30 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.264 ( 8.026 17.285 14.249) 23.795 2.490 ( 23.882 5.276 2.748) 24.612 2.638 ( 10.995 4.929 -3.700) 12.604 2.712 ( -6.119 4.795 1.073) 7.848 2.989 ( 13.250 0.822 1.258) 13.335 3.211 ( -2.984 10.369 -11.728) 15.936 3.357 ( 7.521 -11.199 5.578) 14.598 3.676 ( 4.051 3.467 3.235) 6.237 3.994 ( 7.808 7.621 1.149) 10.971 4.147 ( 4.306 12.289 -1.088) 13.067 4.189 ( -5.958 -1.007 -4.064) 7.282 4.506 ( 12.781 -1.878 -0.989) 12.956 4.598 ( 3.456 -5.326 -5.239) 8.232 4.755 ( 1.794 -1.671 -7.669) 8.051 4.933 ( 2.639 -14.760 -3.973) 15.511 5.149 ( -4.225 1.142 6.507) 7.842 5.397 ( 11.908 -6.589 -9.270) 16.467 5.653 ( -3.434 9.140 2.176) 10.004 5.758 ( -0.324 0.661 3.746) 3.817 5.894 ( -1.496 0.424 -3.940) 4.236 6.028 ( 1.451 -3.513 2.596) 4.603 6.310 ( -2.705 -6.382 0.825) 6.980 6.584 ( 2.690 4.401 -5.996) 7.909 6.599 ( 5.223 -0.827 3.095) 6.128 6.755 ( -2.280 2.641 4.259) 5.505 6.864 ( 5.942 5.796 6.685) 10.658 6.978 ( 5.895 -0.351 1.103) 6.007 7.137 ( 3.232 2.691 1.106) 4.349 7.499 ( 1.445 1.893 2.324) 3.327 7.684 ( 0.943 3.965 -7.607) 8.630 8.011 ( -0.034 1.454 1.036) 1.785 8.093 ( -5.817 2.022 -1.996) 6.474 8.399 ( 2.582 -5.167 -5.495) 7.973 8.760 ( 2.281 -1.914 -3.334) 4.470 8.997 ( 1.217 0.476 7.384) 7.499 9.248 ( 3.547 -2.939 1.170) 4.753 11.056 ( 0.532 1.875 -1.398) 2.398 11.147 ( 1.891 4.556 -3.950) 6.320 11.703 ( -3.931 -4.474 2.503) 6.461 11.846 ( -0.489 -4.248 -3.752) 5.688 13.539 ( -6.274 -0.444 4.693) 7.847 13.649 ( -6.918 2.173 -1.836) 7.480 13.959 ( -13.156 -0.980 3.921) 13.763 14.304 ( -8.187 -2.539 -1.575) 8.716 15.208 ( 2.299 1.542 2.058) 3.449 15.310 ( 0.785 4.658 -1.657) 5.006 15.705 ( 2.447 -2.485 0.344) 3.505 15.819 ( 4.764 -1.217 -2.593) 5.559 16.137 ( -3.506 0.042 2.086) 4.080 16.333 ( -3.652 -2.081 -5.845) 7.199 16.518 ( -6.197 -1.206 3.479) 7.209 16.585 ( -1.841 0.232 4.272) 4.658 18.175 ( 8.333 -3.056 -0.223) 8.878 18.267 ( 7.906 -1.696 2.010) 8.332 18.333 ( 8.332 3.963 0.479) 9.239 18.667 ( 7.800 -1.047 -0.109) 7.871 27.717 ( 2.128 -2.032 0.467) 2.979 27.738 ( 0.838 0.653 -1.860) 2.142 27.846 ( 1.383 -0.301 0.096) 1.418 27.918 ( 1.412 -0.473 3.453) 3.760 28.868 ( 0.479 1.286 0.594) 1.495 29.065 ( 3.147 3.905 -0.591) 5.050 29.183 ( -4.502 0.328 5.847) 7.387 29.529 ( 1.785 -2.925 -3.234) 4.712 29.979 ( -12.415 2.472 9.728) 15.965 30.102 ( -6.113 1.587 -2.207) 6.690 30.525 ( -2.368 10.688 -0.037) 10.948 30.885 ( -4.941 0.298 -1.068) 5.064 31.378 ( -5.785 -5.795 -2.027) 8.435 31.775 ( 5.768 13.851 -2.345) 15.186 32.393 ( 10.129 -10.213 6.770) 15.897 33.650 ( 15.282 -8.435 -12.377) 21.398 ======================= Grid point 161 (79/168) ======================= q-point: ( 0.40 0.14 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.472 ( -5.149 7.071 4.885) 10.019 2.567 ( -5.932 11.102 -0.250) 12.590 2.697 ( 4.195 6.553 -1.512) 7.926 2.761 ( 7.198 5.848 -1.379) 9.377 3.083 ( 13.163 3.738 -7.106) 15.419 3.268 ( 4.142 3.097 7.798) 9.357 3.527 ( 6.953 -9.372 3.538) 12.194 3.741 ( 2.031 2.556 0.659) 3.330 4.001 ( -2.818 0.065 -4.238) 5.090 4.064 ( -5.299 4.187 -0.979) 6.824 4.248 ( 8.164 15.823 -2.779) 18.021 4.522 ( 2.350 3.984 -8.750) 9.897 4.663 ( 5.988 -10.615 0.011) 12.187 4.740 ( 0.554 -5.621 0.127) 5.649 4.972 ( 5.068 -10.685 -1.300) 11.897 5.206 ( 3.325 4.293 4.107) 6.808 5.444 ( 9.886 -3.079 -12.084) 15.914 5.640 ( -0.141 0.324 1.524) 1.565 5.780 ( 0.959 5.703 0.247) 5.788 5.874 ( 1.357 -2.126 -0.292) 2.539 6.060 ( -2.083 -3.617 0.678) 4.229 6.290 ( -1.058 -4.485 2.652) 5.316 6.585 ( 6.017 6.411 -7.902) 11.822 6.686 ( 0.631 -3.725 5.521) 6.690 6.762 ( -4.138 1.748 5.604) 7.182 6.951 ( -4.382 4.212 0.545) 6.102 7.059 ( 2.633 0.553 3.550) 4.454 7.240 ( 7.498 0.002 -0.515) 7.516 7.522 ( -1.093 2.561 1.910) 3.377 7.617 ( 1.332 4.210 -5.234) 6.848 7.977 ( -2.041 -0.843 -0.630) 2.296 8.104 ( 4.063 4.770 4.071) 7.472 8.327 ( -0.545 -4.212 -9.163) 10.099 8.697 ( 2.432 2.278 -11.765) 12.228 9.066 ( -6.006 -5.251 8.366) 11.560 9.271 ( -1.557 -0.380 0.054) 1.604 11.050 ( 2.841 0.809 -4.229) 5.158 11.162 ( 1.751 3.105 1.360) 3.815 11.660 ( -3.687 -3.204 1.454) 5.096 11.781 ( -0.571 -3.991 -5.928) 7.169 13.519 ( -1.552 -1.300 3.867) 4.365 13.591 ( -2.692 1.098 4.642) 5.478 13.833 ( -9.417 -0.254 4.853) 10.597 14.191 ( -3.956 -2.209 -1.019) 4.644 15.235 ( -0.093 2.133 0.995) 2.355 15.332 ( 1.590 4.956 0.816) 5.268 15.770 ( 3.483 -2.543 2.524) 4.997 15.868 ( 4.277 -1.231 -1.854) 4.821 16.122 ( -1.251 -0.977 1.251) 2.021 16.207 ( -2.771 -2.280 -6.773) 7.665 16.433 ( -6.971 1.481 3.012) 7.737 16.645 ( -0.154 -0.779 5.705) 5.760 18.279 ( 4.339 -2.870 0.890) 5.278 18.409 ( 6.473 -1.587 2.798) 7.229 18.442 ( 4.283 4.318 1.264) 6.212 18.748 ( 3.210 -1.034 -1.088) 3.543 27.727 ( 0.243 0.489 -1.028) 1.164 27.751 ( 1.703 -1.369 0.066) 2.186 27.893 ( 2.081 -1.399 2.634) 3.637 27.976 ( 0.467 -1.025 3.934) 4.092 28.902 ( 1.670 1.489 2.365) 3.256 29.093 ( 0.343 2.430 0.327) 2.475 29.185 ( -2.985 2.484 4.911) 6.261 29.540 ( 3.019 -2.430 -1.348) 4.103 29.913 ( -8.605 1.691 7.319) 11.423 30.004 ( -4.269 2.610 0.090) 5.004 30.478 ( -2.082 9.163 -2.387) 9.695 30.845 ( -0.939 0.063 2.176) 2.371 31.261 ( -3.134 -4.914 -5.294) 7.874 31.780 ( 1.778 11.023 -7.172) 13.270 32.592 ( 3.571 -8.512 8.357) 12.451 33.715 ( 11.752 -7.650 -12.781) 18.974 ======================= Grid point 162 (80/168) ======================= q-point: (-0.50 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.239 ( -17.595 4.778 -3.093) 18.493 2.404 ( -17.189 16.447 0.661) 23.799 2.820 ( 3.868 7.704 6.724) 10.933 2.840 ( 9.882 3.088 -5.596) 11.769 3.225 ( 7.569 -1.199 -1.645) 7.838 3.386 ( 1.937 3.463 4.398) 5.924 3.636 ( 0.262 -5.466 4.135) 6.859 3.756 ( 1.707 0.280 -1.837) 2.524 3.921 ( -1.641 -0.505 -5.054) 5.338 3.992 ( -0.532 3.020 -1.091) 3.255 4.256 ( -2.992 14.802 -2.598) 15.323 4.451 ( 0.595 2.901 -6.959) 7.563 4.742 ( -1.384 -3.730 -0.208) 3.984 4.773 ( 2.432 -8.430 2.978) 9.266 4.993 ( -1.697 -6.744 0.090) 6.955 5.299 ( 2.307 5.585 2.552) 6.559 5.422 ( 4.887 -3.596 -13.351) 14.665 5.692 ( 2.986 -1.404 3.599) 4.883 5.767 ( -1.067 4.065 -5.134) 6.635 5.922 ( 3.727 -3.432 0.989) 5.162 5.987 ( -5.394 -0.272 2.125) 5.804 6.329 ( -0.672 -0.496 4.766) 4.839 6.548 ( -0.200 2.124 -6.098) 6.460 6.744 ( -4.280 -2.076 6.467) 8.028 6.795 ( -3.649 -2.764 1.450) 4.802 6.834 ( -2.077 -2.242 3.605) 4.726 7.087 ( -2.659 2.574 3.474) 5.076 7.291 ( -0.068 1.738 -0.679) 1.867 7.512 ( -2.808 2.459 1.938) 4.205 7.662 ( 9.172 3.353 -2.432) 10.064 7.941 ( -2.372 -2.511 -1.403) 3.728 8.195 ( -2.430 -1.007 -8.517) 8.914 8.283 ( 13.522 5.658 2.328) 14.842 8.591 ( 3.764 3.326 -14.819) 15.647 9.010 ( -8.630 -6.508 4.404) 11.672 9.204 ( -4.973 0.531 -2.407) 5.551 11.055 ( 4.672 0.652 -4.710) 6.666 11.214 ( 1.094 -0.267 2.559) 2.796 11.632 ( -2.324 -1.822 1.436) 3.284 11.709 ( 1.030 -2.404 -6.174) 6.704 13.592 ( 4.091 -2.170 4.706) 6.603 13.655 ( 0.771 -1.068 8.438) 8.540 13.773 ( -3.824 1.006 3.072) 5.007 14.166 ( 2.381 -2.046 -0.975) 3.287 15.252 ( 0.178 3.325 1.975) 3.871 15.353 ( -0.375 5.467 0.987) 5.568 15.849 ( 2.486 -2.856 1.632) 4.123 15.903 ( 3.189 -0.377 -2.086) 3.830 16.101 ( -0.491 -1.935 -5.928) 6.255 16.113 ( -1.401 -1.870 -0.426) 2.375 16.395 ( -4.425 2.497 6.512) 8.260 16.698 ( 0.051 -0.989 3.751) 3.880 18.326 ( -0.470 -2.504 1.958) 3.214 18.478 ( -1.782 4.037 2.647) 5.146 18.539 ( 5.280 -2.343 2.554) 6.316 18.741 ( -1.653 -0.654 -2.022) 2.692 27.724 ( -0.161 -0.305 0.090) 0.356 27.770 ( 0.946 -0.190 -0.251) 0.997 27.958 ( 1.415 -2.606 3.466) 4.562 28.017 ( -0.424 -1.107 3.188) 3.401 28.971 ( 2.394 1.187 3.825) 4.666 29.085 ( -2.118 1.663 1.359) 3.016 29.197 ( -1.877 5.440 3.479) 6.725 29.591 ( 4.697 -2.117 -0.535) 5.180 29.885 ( -3.465 0.813 5.033) 6.164 29.976 ( -2.485 3.951 3.790) 6.013 30.403 ( -3.188 7.643 -3.390) 8.948 30.898 ( 2.502 -1.621 4.109) 5.076 31.171 ( 0.414 -2.559 -6.330) 6.840 31.671 ( -3.010 7.581 -9.937) 12.856 32.683 ( -4.243 -5.719 8.537) 11.117 33.731 ( 9.512 -8.624 -13.381) 18.545 ======================= Grid point 163 (81/168) ======================= q-point: (-0.40 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.912 ( -23.014 7.176 2.458) 24.232 2.108 ( -21.755 19.460 2.143) 29.268 2.925 ( 7.531 1.863 -4.069) 8.760 2.931 ( -1.676 2.174 9.106) 9.510 3.273 ( -1.282 -0.519 2.270) 2.658 3.415 ( 3.554 6.108 -5.759) 9.116 3.553 ( -15.554 -1.058 2.355) 15.766 3.766 ( -0.218 -4.828 -6.531) 8.125 3.862 ( 0.978 1.182 -1.107) 1.892 3.947 ( -2.295 4.080 -7.949) 9.225 4.180 ( -5.003 7.872 4.495) 10.354 4.371 ( -5.730 4.922 -1.714) 7.746 4.589 ( -9.541 -0.486 -6.259) 11.421 4.781 ( -5.340 -6.540 0.953) 8.497 4.948 ( -4.393 -2.724 -0.820) 5.234 5.284 ( -4.420 -6.072 -5.804) 9.492 5.340 ( 0.418 5.970 -1.932) 6.288 5.652 ( -2.666 1.214 -7.880) 8.407 5.768 ( -1.663 -0.457 2.458) 3.003 5.856 ( -3.237 -2.588 -0.438) 4.167 6.105 ( 2.149 -0.981 8.723) 9.037 6.354 ( 0.036 7.310 1.703) 7.506 6.487 ( -3.075 -7.083 1.144) 7.806 6.621 ( -7.797 -7.373 -3.671) 11.342 6.758 ( -1.877 0.083 5.964) 6.253 6.965 ( -1.674 -0.622 7.009) 7.233 7.128 ( 5.247 0.628 5.041) 7.303 7.271 ( -2.260 2.962 1.532) 4.029 7.493 ( -2.444 2.111 1.405) 3.522 7.763 ( 5.858 -1.046 -2.485) 6.449 7.862 ( -1.770 -2.056 -4.817) 5.529 8.090 ( -1.470 0.940 -2.951) 3.428 8.475 ( 1.961 4.405 -9.989) 11.092 8.552 ( 20.925 4.576 -8.680) 23.112 8.953 ( -5.171 -4.799 5.598) 9.006 9.093 ( -4.154 -1.096 -1.605) 4.586 11.089 ( 4.749 -0.538 -2.721) 5.500 11.232 ( 1.049 -2.065 -2.149) 3.159 11.602 ( -2.723 -0.814 -0.082) 2.843 11.700 ( 3.749 -0.475 -1.784) 4.179 13.672 ( -2.350 -3.949 3.406) 5.720 13.795 ( 6.099 -1.474 7.764) 9.982 13.836 ( 8.504 1.874 1.895) 8.912 14.244 ( 9.140 -1.913 -1.217) 9.417 15.283 ( 0.204 3.812 2.569) 4.602 15.347 ( -1.436 6.976 1.094) 7.206 15.853 ( 1.176 -1.522 -4.773) 5.146 15.938 ( 1.744 -0.814 0.730) 2.058 16.047 ( 0.612 -0.723 -3.633) 3.755 16.089 ( -0.639 -2.441 -0.946) 2.694 16.439 ( -2.021 1.767 9.298) 9.678 16.736 ( 1.120 -0.836 1.497) 2.048 18.308 ( -5.201 -2.084 2.572) 6.165 18.440 ( -6.381 3.794 2.161) 7.732 18.604 ( -1.901 -4.236 -1.424) 4.857 18.683 ( -1.580 -0.646 1.750) 2.445 27.718 ( -1.061 -0.912 0.461) 1.473 27.779 ( 0.726 1.062 -0.328) 1.328 27.995 ( -1.639 -2.768 2.453) 4.045 28.050 ( 1.034 -1.714 2.371) 3.103 29.016 ( -2.082 1.162 1.208) 2.673 29.103 ( 1.317 1.411 4.913) 5.278 29.206 ( -0.465 8.631 1.643) 8.798 29.667 ( 5.860 -1.782 -0.829) 6.181 29.936 ( 1.093 1.133 7.440) 7.604 29.997 ( -0.072 5.088 2.155) 5.526 30.313 ( -4.958 5.382 0.126) 7.319 30.968 ( 3.201 -4.168 -2.286) 5.731 31.158 ( 3.645 0.185 0.206) 3.655 31.475 ( -6.497 4.762 -10.591) 13.306 32.662 ( -10.641 -3.077 8.621) 14.036 33.703 ( 7.076 -11.530 -14.926) 20.144 ======================= Grid point 164 (82/168) ======================= q-point: (-0.30 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.608 ( -25.550 10.483 12.156) 30.173 1.795 ( -24.484 20.028 6.498) 32.293 2.882 ( -16.029 5.618 -0.107) 16.985 2.983 ( -4.466 -2.077 7.827) 9.248 3.146 ( -19.465 7.328 -0.509) 20.805 3.338 ( -6.071 -2.592 2.297) 6.989 3.420 ( 2.825 5.417 -3.332) 6.959 3.628 ( -1.372 -0.292 -13.112) 13.187 3.684 ( -10.651 3.653 -3.521) 11.798 3.853 ( -14.896 -5.817 -6.227) 17.161 4.094 ( -0.944 2.797 1.533) 3.326 4.318 ( -1.249 -0.384 1.107) 1.713 4.488 ( 2.444 7.364 -1.280) 7.864 4.622 ( -13.859 -6.462 -2.944) 15.572 4.836 ( -6.448 -1.152 -0.324) 6.558 5.134 ( -5.429 -0.004 -5.692) 7.866 5.336 ( -3.264 0.153 4.449) 5.520 5.532 ( -2.036 2.437 -6.278) 7.035 5.659 ( -7.402 0.455 -2.760) 7.913 5.882 ( 0.887 -1.864 2.435) 3.193 6.123 ( -5.867 -1.501 3.166) 6.833 6.350 ( -8.792 4.968 6.105) 11.800 6.451 ( -2.090 -11.114 -3.316) 11.785 6.560 ( 2.600 -1.359 1.600) 3.341 6.843 ( 4.075 -0.340 5.060) 6.506 6.943 ( -6.357 3.076 3.979) 8.106 7.231 ( -0.945 0.176 0.138) 0.971 7.314 ( 2.989 -0.026 3.260) 4.422 7.454 ( 0.067 2.084 -0.979) 2.303 7.805 ( 2.987 -6.383 -0.260) 7.052 7.850 ( 2.773 -0.282 2.308) 3.619 8.077 ( 0.933 0.762 -0.465) 1.291 8.377 ( 4.860 3.043 -15.269) 16.310 8.662 ( 6.837 5.475 -13.873) 16.407 8.948 ( -4.453 -2.601 6.627) 8.398 9.168 ( 8.807 -6.546 8.848) 14.096 11.109 ( 1.567 -3.530 -3.568) 5.258 11.238 ( 4.595 0.672 -2.784) 5.415 11.551 ( -2.656 -0.503 -1.034) 2.894 11.760 ( 3.803 -0.092 0.848) 3.898 13.649 ( -2.154 -2.154 0.124) 3.049 13.970 ( 8.689 2.318 0.463) 9.005 14.032 ( 10.851 -3.112 5.213) 12.434 14.410 ( 13.750 -1.535 -2.135) 13.999 15.299 ( -0.365 3.887 0.247) 3.912 15.359 ( 0.798 8.078 2.191) 8.408 15.824 ( 1.688 0.008 -2.283) 2.839 15.945 ( 0.627 -1.359 -3.115) 3.456 16.031 ( -0.882 -1.779 0.160) 1.992 16.079 ( 1.606 -0.730 -1.274) 2.177 16.528 ( -0.959 0.726 9.758) 9.832 16.768 ( 2.147 -0.432 -0.455) 2.237 18.225 ( -8.628 -1.478 2.166) 9.018 18.336 ( -9.802 2.839 2.155) 10.430 18.468 ( -8.340 -1.889 -3.905) 9.401 18.704 ( -2.447 -6.906 2.086) 7.618 27.704 ( -1.187 0.078 0.405) 1.256 27.783 ( 0.321 1.381 -0.688) 1.576 27.974 ( -2.868 -1.786 0.583) 3.428 28.091 ( 1.006 -2.829 1.402) 3.314 28.979 ( -2.510 2.897 -0.055) 3.834 29.172 ( -2.370 1.444 6.593) 7.153 29.236 ( 5.650 11.208 -3.469) 13.023 29.755 ( 6.565 -0.084 -0.372) 6.577 29.977 ( 0.124 6.050 -7.144) 9.362 30.081 ( 5.065 3.334 8.302) 10.281 30.327 ( -2.723 0.717 17.400) 17.626 30.952 ( 4.320 -4.455 -8.792) 10.761 31.249 ( -7.205 3.092 -9.011) 11.944 31.261 ( 3.494 -0.159 5.293) 6.344 32.563 ( -14.645 -1.734 9.218) 17.391 33.581 ( 0.803 -16.176 -19.488) 25.339 ======================= Grid point 165 (83/168) ======================= q-point: (-0.20 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.418 ( -21.703 18.734 17.919) 33.809 1.479 ( -30.189 11.578 13.286) 34.956 2.446 ( -39.465 23.997 16.498) 49.046 2.854 ( -18.705 -0.578 -5.207) 19.425 2.970 ( -4.941 -4.507 3.458) 7.529 3.184 ( -18.532 0.967 0.656) 18.569 3.322 ( -10.193 9.108 -5.936) 14.902 3.525 ( -0.976 -5.577 -10.851) 12.239 3.559 ( 0.629 0.279 -1.463) 1.617 3.607 ( 2.068 -4.112 -0.124) 4.604 4.167 ( 4.427 -3.530 -0.189) 5.665 4.281 ( -12.029 -2.625 2.176) 12.503 4.363 ( -2.815 -2.090 -2.824) 4.502 4.526 ( 1.368 5.004 -1.715) 5.464 4.808 ( 0.582 0.065 3.546) 3.594 4.999 ( -4.187 1.751 -4.171) 6.164 5.339 ( -3.651 -0.299 5.374) 6.503 5.419 ( -7.122 1.147 0.961) 7.278 5.574 ( 1.449 6.795 -1.976) 7.224 5.897 ( -2.886 1.474 2.347) 4.001 6.087 ( -0.073 -1.494 0.717) 1.659 6.243 ( -11.295 -1.224 4.138) 12.091 6.400 ( 0.373 -4.738 -2.451) 5.348 6.617 ( 1.404 0.148 1.406) 1.992 6.889 ( -4.548 0.149 2.859) 5.374 6.952 ( 1.924 2.539 3.783) 4.945 7.224 ( 1.211 -1.839 0.129) 2.206 7.259 ( -4.795 0.151 -3.394) 5.876 7.533 ( 4.279 -0.969 0.482) 4.414 7.862 ( 2.142 -5.197 2.344) 6.090 7.945 ( 2.680 0.768 4.148) 4.997 8.065 ( -0.370 -1.674 -5.871) 6.116 8.285 ( 4.236 3.077 -11.484) 12.621 8.540 ( -0.031 5.203 -12.085) 13.157 8.961 ( -5.237 -1.356 7.062) 8.896 9.409 ( 5.954 -14.180 6.948) 16.876 11.083 ( 2.082 -3.138 -4.716) 6.035 11.286 ( 3.804 2.972 -2.214) 5.311 11.516 ( -0.945 -1.707 0.895) 2.147 11.820 ( 2.577 -0.633 0.656) 2.733 13.630 ( 0.826 1.204 -0.422) 1.520 14.073 ( 6.257 3.332 -2.955) 7.680 14.255 ( 10.256 -3.817 3.657) 11.538 14.593 ( 13.755 -0.938 -4.652) 14.550 15.296 ( 0.443 3.594 -0.552) 3.663 15.383 ( 1.333 6.959 -2.776) 7.610 15.879 ( 3.851 -1.391 -3.750) 5.552 15.922 ( 3.388 -0.123 1.683) 3.785 16.010 ( -0.323 -2.418 1.850) 3.062 16.120 ( 2.548 1.139 1.822) 3.333 16.615 ( -1.283 -0.174 7.839) 7.945 16.789 ( 2.050 0.027 -1.880) 2.782 18.103 ( -8.844 -0.767 1.263) 8.966 18.189 ( -11.776 1.190 1.601) 11.944 18.294 ( -8.321 -1.364 -2.614) 8.828 18.578 ( -14.013 -12.281 -4.665) 19.208 27.699 ( 0.088 1.708 0.421) 1.762 27.766 ( -0.725 1.887 -1.878) 2.759 27.926 ( -2.773 -1.236 -0.968) 3.186 28.105 ( -0.005 -3.000 -0.447) 3.034 28.949 ( -0.905 3.696 -0.433) 3.829 29.193 ( -1.863 6.146 3.357) 7.246 29.247 ( 3.396 10.430 -9.179) 14.303 29.861 ( 7.189 4.270 -7.927) 11.522 29.880 ( -0.207 3.343 0.255) 3.359 30.246 ( 4.224 4.732 7.560) 9.869 30.696 ( 14.727 -2.915 31.208) 34.631 30.939 ( 7.752 -4.970 -7.750) 12.036 31.069 ( -4.288 2.689 -5.761) 7.669 31.353 ( 0.962 -0.461 4.174) 4.308 32.421 ( -17.367 -2.903 9.066) 19.805 33.213 ( -16.799 -18.186 -25.819) 35.771 ======================= Grid point 166 (84/168) ======================= q-point: (-0.10 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.125 ( -26.661 13.299 15.149) 33.424 1.409 ( -14.318 23.078 23.806) 36.115 2.216 ( -26.591 18.524 28.444) 43.119 2.449 ( -20.263 7.729 -3.041) 21.899 2.881 ( -14.232 4.458 0.687) 14.929 2.959 ( -0.750 -2.845 1.792) 3.445 3.139 ( -6.314 6.850 -2.592) 9.670 3.418 ( 0.204 -6.171 -6.510) 8.972 3.580 ( 1.678 -3.560 -3.533) 5.289 3.683 ( 4.561 -2.156 2.375) 5.576 4.066 ( -4.111 0.853 -0.264) 4.206 4.305 ( 3.880 -5.768 5.671) 8.971 4.408 ( 4.843 -3.391 0.254) 5.918 4.508 ( -0.964 0.128 -0.310) 1.021 4.854 ( 2.510 -0.878 -1.189) 2.913 4.956 ( 1.577 1.499 0.439) 2.220 5.287 ( -6.067 1.952 4.190) 7.627 5.472 ( 0.769 0.170 8.962) 8.996 5.643 ( 6.526 5.355 3.733) 9.230 5.873 ( -2.504 3.713 3.316) 5.572 6.091 ( -8.991 -3.444 3.068) 10.105 6.145 ( 1.740 0.520 -0.634) 1.923 6.405 ( 3.193 3.822 -1.818) 5.301 6.636 ( 0.545 -0.388 -0.586) 0.890 6.870 ( -1.972 -2.071 2.331) 3.689 7.001 ( 0.020 4.045 3.513) 5.358 7.142 ( -6.038 -4.186 -2.877) 7.891 7.294 ( 7.486 -3.961 -0.543) 8.487 7.521 ( -4.710 -1.890 -2.491) 5.653 7.810 ( -5.307 6.043 -17.047) 18.849 7.921 ( -0.813 -4.351 1.098) 4.560 8.035 ( -0.535 4.479 5.645) 7.226 8.301 ( 6.101 -0.446 -1.912) 6.410 8.465 ( 3.241 3.954 -3.568) 6.234 8.911 ( -9.856 -0.683 3.887) 10.617 9.434 ( -6.145 -16.239 -1.494) 17.427 11.074 ( 3.229 -1.139 -4.388) 5.566 11.297 ( 2.596 5.221 -4.051) 7.100 11.543 ( 0.084 -3.799 4.187) 5.655 11.857 ( 1.364 -1.682 0.614) 2.251 13.674 ( 3.043 3.580 1.457) 4.919 14.101 ( 3.489 4.281 -5.139) 7.544 14.409 ( 4.717 -3.851 1.906) 6.380 14.711 ( 9.358 -1.159 -6.979) 11.732 15.294 ( 0.968 3.385 -1.795) 3.951 15.330 ( -1.866 5.370 -4.701) 7.377 15.828 ( 1.116 -3.804 -7.467) 8.454 15.924 ( 1.497 -1.164 -5.873) 6.172 16.185 ( 1.840 1.145 3.611) 4.211 16.285 ( 17.908 -3.720 10.750) 21.216 16.656 ( -2.369 -0.620 4.637) 5.244 16.780 ( 0.031 -0.203 -3.048) 3.055 17.982 ( -12.234 -1.564 -3.451) 12.808 18.005 ( -9.215 -0.046 1.296) 9.305 18.170 ( -11.758 -4.076 0.988) 12.484 18.197 ( -15.174 -3.218 -1.839) 15.620 27.707 ( -0.573 0.772 -0.701) 1.190 27.726 ( 0.191 4.323 -2.188) 4.849 27.872 ( -1.870 -1.011 -1.923) 2.866 28.076 ( -1.276 -2.325 -2.869) 3.907 28.938 ( 0.140 2.763 -0.862) 2.898 29.128 ( 0.754 16.453 -13.491) 21.290 29.201 ( -3.724 0.766 4.439) 5.845 29.783 ( 1.166 -0.067 -8.502) 8.582 29.994 ( 4.821 7.251 3.615) 9.428 30.381 ( 1.564 5.833 7.268) 9.450 30.979 ( 9.605 -6.085 -4.213) 12.125 31.000 ( 2.349 0.584 -1.819) 3.027 31.340 ( 4.145 -2.502 1.447) 5.053 31.528 ( 28.110 -0.435 19.021) 33.944 32.131 ( -32.077 -12.737 2.162) 34.581 32.623 ( -18.998 -3.443 -5.864) 20.178 ======================= Grid point 167 (85/168) ======================= q-point: ( 0.00 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.455 ( 6.508 16.102 8.570) 19.367 1.966 ( -1.101 6.787 -7.790) 10.390 2.068 ( -4.928 14.543 19.765) 25.029 2.816 ( -8.258 0.628 8.664) 11.985 2.949 ( -12.019 13.473 10.895) 21.087 3.045 ( 4.610 7.581 8.059) 11.986 3.211 ( 6.399 5.341 6.201) 10.389 3.327 ( 4.140 2.116 -7.395) 8.735 3.564 ( 10.133 1.704 -5.769) 11.784 3.788 ( 5.884 0.876 6.513) 8.821 4.103 ( -1.404 -0.335 5.182) 5.379 4.238 ( 6.623 -8.770 -1.434) 11.083 4.396 ( 3.474 -5.806 5.610) 8.789 4.510 ( -0.026 0.609 1.507) 1.625 4.873 ( 2.183 -0.936 -0.685) 2.472 5.007 ( 2.440 0.440 -1.824) 3.078 5.302 ( -8.769 2.042 8.148) 12.143 5.519 ( -4.441 -0.386 6.347) 7.756 5.757 ( 1.788 -1.950 3.665) 4.520 5.927 ( -1.264 -0.393 4.816) 4.994 6.021 ( -4.668 -1.809 5.848) 7.698 6.153 ( 2.017 -0.534 2.066) 2.936 6.587 ( -2.741 1.671 -2.870) 4.306 6.622 ( 1.117 6.492 0.212) 6.591 6.840 ( 3.368 1.470 -0.124) 3.677 6.897 ( -6.685 -0.776 -8.327) 10.706 7.144 ( -0.868 3.172 3.917) 5.115 7.339 ( 3.407 2.675 -2.301) 4.905 7.365 ( -7.677 -3.493 3.370) 9.083 7.765 ( 13.577 -1.125 -15.320) 20.502 7.932 ( 0.243 2.426 1.425) 2.824 8.106 ( -1.458 0.496 1.431) 2.103 8.322 ( 4.995 -2.873 -1.415) 5.934 8.583 ( 4.286 -2.836 4.259) 6.675 8.754 ( -6.565 1.998 -4.968) 8.472 9.061 ( -2.469 -9.017 -1.896) 9.539 11.109 ( 2.437 2.385 -0.103) 3.412 11.395 ( 3.508 1.655 -2.717) 4.736 11.498 ( -1.550 -1.478 2.668) 3.422 11.812 ( 1.185 -3.914 -1.715) 4.435 13.806 ( -2.505 6.154 1.548) 6.822 14.159 ( -0.634 3.115 -6.063) 6.846 14.348 ( -2.688 -3.191 0.739) 4.238 14.645 ( 0.749 -4.958 -6.795) 8.445 15.341 ( -1.897 5.735 -6.446) 8.834 15.399 ( 2.695 5.808 -2.050) 6.723 15.667 ( 0.955 -4.641 -7.192) 8.613 15.833 ( 1.680 -4.357 -5.187) 6.979 16.291 ( 2.306 2.276 3.397) 4.694 16.414 ( -0.017 -2.245 2.179) 3.129 16.648 ( 0.921 -3.519 1.771) 4.046 16.670 ( -4.844 -2.975 -2.207) 6.098 17.767 ( -6.944 2.460 3.753) 8.268 17.928 ( -4.442 -2.213 3.967) 6.354 18.033 ( -0.340 1.965 0.311) 2.018 18.167 ( 4.731 -1.928 0.563) 5.139 27.694 ( -1.401 1.669 -1.763) 2.803 27.759 ( -0.006 0.340 -2.436) 2.459 27.825 ( 0.197 0.066 -0.668) 0.699 27.968 ( -1.030 -2.667 -3.148) 4.253 28.966 ( -1.859 2.906 -0.436) 3.477 29.148 ( -3.218 -0.348 1.338) 3.502 29.306 ( -0.174 10.149 -11.541) 15.370 29.657 ( -1.053 -2.326 -9.691) 10.021 30.251 ( 1.270 8.578 2.884) 9.138 30.561 ( -6.516 6.140 0.245) 8.956 30.943 ( -0.741 -3.495 4.861) 6.033 31.118 ( 8.086 -1.417 5.458) 9.857 31.315 ( 2.311 0.947 -1.778) 3.066 31.569 ( -20.186 7.419 2.737) 21.680 31.953 ( 7.799 -7.182 10.342) 14.811 32.496 ( 16.244 -12.892 1.402) 20.786 ======================= Grid point 168 (86/168) ======================= q-point: ( 0.10 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.815 ( 26.711 9.868 4.187) 28.782 1.972 ( 15.838 7.282 -6.664) 18.662 2.293 ( 2.200 19.774 19.273) 27.700 2.813 ( -6.276 9.824 11.014) 16.038 2.894 ( -2.381 1.320 2.302) 3.565 3.178 ( -0.069 5.598 -3.512) 6.609 3.265 ( 10.935 3.309 -2.802) 11.763 3.593 ( 15.792 -1.912 9.451) 18.503 3.718 ( 17.862 3.107 -2.968) 18.371 3.928 ( 0.371 9.173 4.405) 10.183 4.108 ( 0.012 -6.923 1.291) 7.042 4.333 ( 7.880 -5.648 -3.875) 10.441 4.442 ( -0.194 0.466 3.628) 3.663 4.646 ( 5.444 -4.063 7.602) 10.194 4.882 ( 1.385 -2.057 -3.754) 4.499 5.024 ( 4.207 -3.806 -4.058) 6.975 5.259 ( -9.212 2.738 9.933) 13.821 5.537 ( -1.666 -2.300 6.453) 7.051 5.839 ( 0.946 0.400 5.123) 5.225 5.910 ( -4.349 -1.118 2.509) 5.144 6.058 ( -2.074 -0.368 8.292) 8.555 6.211 ( 1.799 -0.226 1.815) 2.565 6.500 ( -2.314 -1.498 -0.442) 2.792 6.654 ( -0.472 5.182 2.012) 5.579 6.726 ( -1.927 -1.339 -8.639) 8.952 6.896 ( 4.228 5.603 -2.501) 7.451 7.075 ( -10.145 2.211 -1.547) 10.498 7.239 ( -4.853 1.482 -1.147) 5.202 7.409 ( 4.650 4.506 1.499) 6.646 7.802 ( 8.517 1.562 -9.446) 12.814 7.966 ( 1.162 2.331 1.906) 3.228 8.164 ( 5.708 -2.792 1.392) 6.505 8.407 ( 5.747 -5.095 1.710) 7.869 8.521 ( -6.102 -0.903 -8.465) 10.474 8.804 ( 9.931 -1.074 4.597) 10.996 9.014 ( 1.374 -5.109 -4.833) 7.166 11.135 ( 0.978 3.588 -0.000) 3.719 11.381 ( 1.680 6.948 -6.339) 9.554 11.527 ( -1.486 -6.791 5.917) 9.129 11.808 ( 0.734 -4.779 -2.022) 5.241 13.744 ( -7.839 5.132 2.534) 9.706 14.039 ( -6.325 1.474 -5.288) 8.374 14.264 ( -8.513 -1.757 0.569) 8.711 14.537 ( -5.194 -5.252 -5.204) 9.036 15.253 ( -1.701 6.064 -3.038) 6.993 15.423 ( 3.291 5.470 -2.925) 7.022 15.614 ( 0.721 -4.894 -4.019) 6.373 15.794 ( 2.228 -3.464 -6.693) 7.859 16.329 ( -8.274 1.060 0.318) 8.348 16.362 ( 0.569 1.961 4.914) 5.322 16.557 ( -5.653 -3.442 -2.648) 7.128 16.675 ( -1.897 -5.475 1.049) 5.888 17.819 ( 6.979 0.467 2.602) 7.463 17.955 ( 2.306 -2.742 3.704) 5.154 18.101 ( 8.223 3.155 -0.351) 8.814 18.301 ( 10.174 -2.451 1.093) 10.522 27.662 ( -0.586 1.053 -0.785) 1.438 27.735 ( 0.826 -0.310 -2.424) 2.580 27.831 ( 0.779 0.199 0.366) 0.884 27.914 ( -0.978 -1.138 -3.394) 3.711 28.932 ( -1.835 2.873 -0.186) 3.414 29.118 ( -0.979 1.629 -0.405) 1.943 29.219 ( -1.110 4.927 -2.521) 5.645 29.546 ( -0.395 -3.870 -7.381) 8.344 30.255 ( -6.689 6.616 4.320) 10.352 30.421 ( -8.847 3.323 -1.565) 9.580 30.876 ( -8.497 6.254 4.453) 11.452 31.216 ( -12.533 5.109 1.015) 13.573 31.328 ( 7.773 -7.339 1.334) 10.774 31.586 ( 10.514 9.562 8.197) 16.406 31.995 ( -3.001 -2.890 1.613) 4.468 32.893 ( 28.021 -18.427 -3.392) 33.708 ======================= Grid point 169 (87/168) ======================= q-point: ( 0.20 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.228 ( 23.674 8.753 0.825) 25.253 2.318 ( 23.491 9.325 4.173) 25.616 2.561 ( 8.783 15.500 12.093) 21.532 2.857 ( 0.870 8.936 2.964) 9.454 2.931 ( 1.203 2.655 4.729) 5.555 3.106 ( 1.220 0.532 -5.532) 5.690 3.407 ( 7.682 0.294 -2.834) 8.194 3.780 ( 4.324 5.843 -5.783) 9.288 3.920 ( 7.767 0.766 -1.106) 7.882 4.064 ( 15.408 -2.625 4.396) 16.237 4.195 ( 5.422 -0.848 4.877) 7.342 4.342 ( 0.487 0.771 -4.204) 4.301 4.538 ( 7.825 0.104 0.262) 7.831 4.699 ( -3.667 -5.560 -0.669) 6.694 4.844 ( 2.086 0.678 -7.952) 8.249 5.081 ( 8.266 -9.824 -2.193) 13.025 5.247 ( -7.667 5.779 10.236) 14.034 5.620 ( 0.493 -3.174 8.874) 9.437 5.790 ( -4.519 -1.117 -1.642) 4.936 5.995 ( 3.451 3.711 4.947) 7.082 6.071 ( -4.523 -0.653 1.757) 4.896 6.217 ( -4.329 0.776 3.309) 5.504 6.536 ( 5.237 1.371 1.914) 5.742 6.612 ( -5.565 -4.949 -2.052) 7.725 6.697 ( 3.723 -1.635 2.502) 4.774 6.877 ( 4.422 3.909 -8.318) 10.199 6.953 ( -3.851 6.839 2.651) 8.285 7.195 ( -0.106 2.245 0.131) 2.251 7.511 ( 5.488 6.807 1.335) 8.845 7.827 ( 5.776 3.227 -7.847) 10.264 8.006 ( 0.883 2.894 3.065) 4.307 8.228 ( 2.643 -3.831 -4.715) 6.625 8.341 ( -4.196 0.308 -5.294) 6.763 8.560 ( 6.564 -4.862 6.415) 10.386 8.987 ( 3.695 -3.329 -7.032) 8.613 9.012 ( 9.121 -3.504 4.156) 10.618 11.143 ( -0.262 4.720 0.550) 4.759 11.318 ( 0.226 7.330 -6.811) 10.009 11.569 ( -1.714 -7.541 5.282) 9.365 11.783 ( -0.166 -5.802 -3.327) 6.691 13.640 ( -9.733 3.206 4.100) 11.037 13.853 ( -10.546 0.210 -3.099) 10.994 14.114 ( -11.169 0.116 0.907) 11.206 14.383 ( -8.060 -4.909 -2.963) 9.892 15.232 ( 0.970 5.508 0.334) 5.603 15.424 ( 1.611 5.201 -3.210) 6.321 15.606 ( 1.415 -4.389 -0.563) 4.646 15.763 ( 3.514 -2.924 -5.969) 7.519 16.214 ( -6.415 1.452 0.455) 6.593 16.390 ( -3.332 -2.169 -1.725) 4.334 16.473 ( -2.276 -0.897 4.042) 4.725 16.623 ( -5.210 -3.072 0.989) 6.128 17.981 ( 10.301 -1.154 0.373) 10.373 18.071 ( 7.086 -2.687 2.851) 8.097 18.254 ( 10.694 3.798 0.178) 11.350 18.480 ( 10.629 -2.580 0.785) 10.966 27.659 ( 0.577 -0.079 0.233) 0.627 27.732 ( 1.363 -0.670 -1.255) 1.970 27.856 ( 0.940 -0.364 1.105) 1.495 27.868 ( -0.223 0.164 -2.179) 2.196 28.910 ( -1.363 3.023 0.954) 3.450 29.112 ( -0.218 1.338 0.707) 1.529 29.198 ( -0.921 2.885 1.251) 3.277 29.480 ( 0.723 -4.085 -4.643) 6.226 30.158 ( -11.849 4.823 6.008) 14.133 30.271 ( -8.074 1.975 -1.609) 8.466 30.839 ( -2.840 14.496 2.984) 15.070 31.031 ( -9.499 2.532 -1.922) 10.017 31.354 ( -4.819 -6.273 0.495) 7.926 31.888 ( 11.104 -8.700 9.328) 16.912 32.008 ( 8.561 12.592 -4.338) 15.832 33.218 ( 21.228 -17.057 -7.020) 28.122 ======================= Grid point 170 (88/168) ======================= q-point: ( 0.30 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.587 ( 9.638 9.662 7.447) 15.547 2.639 ( 16.335 10.313 0.650) 19.329 2.763 ( 6.213 6.338 2.112) 9.123 2.888 ( 2.605 12.815 -2.452) 13.305 3.033 ( 2.302 0.500 5.819) 6.278 3.159 ( 12.662 -3.711 -1.700) 13.303 3.414 ( 0.705 6.754 -4.249) 8.011 3.777 ( 3.696 5.836 -2.290) 7.277 4.014 ( 3.863 -7.203 -5.879) 10.068 4.194 ( 2.003 -7.597 -1.072) 7.930 4.336 ( 4.791 2.597 0.583) 5.481 4.387 ( 11.195 5.962 -0.879) 12.714 4.588 ( -5.154 -6.258 1.700) 8.284 4.667 ( 6.014 4.853 -5.419) 9.439 4.787 ( 5.799 -1.443 -8.106) 10.070 5.185 ( 8.502 -11.745 -4.229) 15.103 5.254 ( -4.098 7.367 8.566) 12.018 5.685 ( -5.024 -3.646 1.414) 6.366 5.745 ( 1.203 -0.039 4.883) 5.030 5.969 ( -4.040 2.201 -3.280) 5.650 6.083 ( 3.592 6.903 1.737) 7.974 6.193 ( -6.174 -2.951 5.831) 8.991 6.511 ( -1.481 -3.721 -0.296) 4.016 6.722 ( 10.571 4.298 -0.217) 11.414 6.761 ( -0.429 -3.256 4.086) 5.242 6.927 ( 4.643 -3.033 1.763) 5.819 6.985 ( 5.825 7.229 -0.801) 9.318 7.219 ( 3.097 3.705 -0.669) 4.875 7.589 ( 2.113 6.530 1.461) 7.017 7.781 ( 1.481 4.547 -9.077) 10.260 8.037 ( -0.286 0.791 -2.137) 2.296 8.164 ( -0.748 5.250 -1.146) 5.425 8.274 ( -0.345 -6.233 -4.168) 7.506 8.720 ( 3.577 -3.077 5.556) 7.290 8.959 ( 2.488 -3.334 -6.381) 7.618 9.167 ( 5.144 -4.724 2.821) 7.532 11.137 ( -1.039 5.630 -0.338) 5.735 11.251 ( 0.646 5.425 -5.180) 7.528 11.587 ( -2.633 -6.294 3.802) 7.811 11.728 ( -0.705 -6.905 -4.638) 8.348 13.546 ( -8.548 1.257 4.981) 9.973 13.675 ( -9.779 -0.122 1.120) 9.843 13.959 ( -10.076 1.598 1.863) 10.371 14.232 ( -7.517 -4.361 -1.601) 8.836 15.272 ( 1.432 4.629 2.127) 5.292 15.422 ( 2.055 6.004 -1.264) 6.471 15.635 ( 1.969 -4.179 0.972) 4.720 15.777 ( 4.761 -3.047 -3.152) 6.472 16.141 ( -3.404 0.469 -0.048) 3.437 16.273 ( -4.362 -3.481 -5.294) 7.692 16.505 ( -3.972 -0.002 4.782) 6.216 16.576 ( -2.227 -1.069 3.894) 4.611 18.131 ( 8.435 -1.104 0.106) 8.508 18.222 ( 8.009 -2.574 2.244) 8.707 18.415 ( 8.515 4.056 0.959) 9.480 18.632 ( 7.642 -2.410 0.279) 8.018 27.680 ( 1.089 -1.030 0.867) 1.731 27.743 ( 0.914 -0.548 -0.204) 1.085 27.847 ( 0.750 0.439 -0.924) 1.268 27.900 ( 1.088 -1.087 2.606) 3.026 28.915 ( -0.655 3.237 2.636) 4.226 29.117 ( -2.093 -0.264 3.013) 3.678 29.216 ( 1.130 3.729 1.716) 4.258 29.462 ( 1.748 -3.466 -1.911) 4.327 30.053 ( -10.406 4.331 6.365) 12.944 30.138 ( -6.781 1.632 -0.929) 7.036 30.789 ( -4.275 12.893 -3.041) 13.920 30.919 ( -4.177 4.789 1.298) 6.486 31.249 ( -5.544 -6.481 -2.125) 8.789 31.991 ( 6.059 -7.023 -8.478) 12.566 32.241 ( 11.528 9.651 8.859) 17.451 33.406 ( 15.011 -15.064 -8.953) 23.074 ======================= Grid point 171 (89/168) ======================= q-point: ( 0.40 0.29 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.589 ( -8.331 5.970 -1.877) 10.420 2.777 ( 5.644 8.854 -3.336) 11.017 2.909 ( 1.410 9.081 0.656) 9.213 2.970 ( 4.766 14.206 2.954) 15.272 3.065 ( 3.565 -4.312 2.220) 6.019 3.403 ( 8.508 -0.667 1.537) 8.672 3.416 ( 8.757 7.718 0.547) 11.686 3.796 ( 3.822 1.804 -6.598) 7.836 3.937 ( -1.933 -6.298 -5.523) 8.597 4.153 ( -3.948 -2.202 -1.661) 4.816 4.429 ( 3.026 -3.526 -2.166) 5.127 4.498 ( 4.037 3.717 -1.228) 5.623 4.568 ( 3.766 -0.787 2.628) 4.659 4.689 ( 4.350 5.658 -1.576) 7.309 4.839 ( 4.666 -2.847 -1.687) 5.721 5.254 ( 6.878 -10.724 -3.938) 13.335 5.321 ( 2.152 4.201 4.350) 6.419 5.624 ( -0.936 -0.968 -1.864) 2.299 5.813 ( -0.012 -0.524 3.172) 3.215 5.930 ( -0.137 3.833 2.155) 4.399 6.118 ( -5.132 6.886 2.879) 9.058 6.189 ( 1.490 -2.614 3.623) 4.709 6.536 ( 0.975 -5.457 4.511) 7.147 6.712 ( -0.890 -0.328 -6.237) 6.309 6.868 ( 2.125 6.264 1.770) 6.848 6.937 ( -3.623 -2.665 -3.669) 5.804 7.077 ( 3.649 1.793 1.807) 4.449 7.284 ( 6.268 2.970 -1.490) 7.095 7.614 ( -1.279 5.996 1.848) 6.403 7.707 ( 2.996 3.957 -7.619) 9.094 7.969 ( -1.287 -0.146 -4.187) 4.383 8.203 ( 0.531 -5.669 -5.495) 7.913 8.226 ( 4.448 5.552 2.421) 7.514 8.765 ( 0.996 3.439 -3.693) 5.144 8.918 ( -2.589 -8.134 -1.226) 8.624 9.227 ( 0.314 -4.281 0.000) 4.292 11.102 ( 0.841 4.190 -4.500) 6.206 11.225 ( -0.207 2.746 -1.066) 2.953 11.582 ( -2.136 -3.931 2.680) 5.216 11.670 ( 0.311 -6.358 -4.376) 7.725 13.505 ( -3.962 -0.017 5.534) 6.806 13.591 ( -6.139 -1.151 6.005) 8.664 13.854 ( -6.070 2.620 2.090) 6.934 14.127 ( -3.569 -3.953 -1.051) 5.428 15.313 ( 0.663 5.282 2.440) 5.856 15.456 ( 2.077 6.847 0.664) 7.186 15.695 ( 3.083 -4.748 2.485) 6.183 15.826 ( 4.091 -3.080 -0.986) 5.215 16.099 ( -1.467 -1.081 -0.912) 2.037 16.151 ( -2.997 -2.847 -5.661) 7.009 16.472 ( -4.824 2.269 3.823) 6.560 16.620 ( -0.596 -1.721 5.310) 5.613 18.241 ( 4.772 -0.742 0.926) 4.918 18.361 ( 6.157 -2.911 2.502) 7.256 18.528 ( 3.952 4.026 1.431) 5.820 18.716 ( 3.058 -1.989 -0.252) 3.656 27.705 ( 0.398 -1.156 1.158) 1.684 27.755 ( 0.841 0.240 0.069) 0.877 27.867 ( 1.232 -0.825 1.195) 1.904 27.946 ( 0.660 -1.797 2.835) 3.421 28.950 ( 0.051 3.188 4.414) 5.445 29.114 ( -3.469 -0.472 4.123) 5.409 29.266 ( 2.260 4.798 2.073) 5.694 29.489 ( 2.744 -2.582 0.354) 3.785 29.974 ( -7.418 3.907 3.972) 9.278 30.054 ( -4.560 2.043 2.273) 5.489 30.686 ( -2.129 8.744 -5.365) 10.478 30.874 ( -3.499 3.508 0.918) 5.039 31.170 ( -0.740 -2.211 -2.857) 3.687 31.934 ( 1.880 -2.368 -12.273) 12.640 32.482 ( 5.655 4.046 9.062) 11.423 33.491 ( 10.066 -14.060 -10.308) 20.131 ======================= Grid point 172 (90/168) ======================= q-point: (-0.50 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( -14.074 8.672 -2.708) 16.751 2.743 ( -8.960 14.842 -1.291) 17.385 2.897 ( 3.841 2.037 -4.137) 6.001 2.980 ( -3.254 2.576 2.935) 5.083 3.209 ( 4.123 4.143 4.362) 7.293 3.463 ( 6.650 3.109 -4.178) 8.446 3.616 ( 4.432 0.992 5.769) 7.342 3.756 ( 2.717 0.591 -7.612) 8.104 3.856 ( 0.575 -5.001 -6.978) 8.605 4.094 ( -2.310 4.461 1.034) 5.129 4.386 ( -0.829 -4.498 -5.031) 6.799 4.520 ( -3.906 5.211 3.659) 7.471 4.646 ( -0.559 -2.044 2.577) 3.337 4.778 ( 6.001 5.877 -2.292) 8.707 4.868 ( -0.846 -3.235 3.845) 5.096 5.264 ( 1.057 -8.515 -7.341) 11.292 5.413 ( 2.222 2.838 4.850) 6.042 5.607 ( 0.947 -1.478 -2.942) 3.426 5.805 ( -4.280 -3.095 2.226) 5.732 5.956 ( -1.624 3.489 -0.573) 3.891 6.081 ( -1.721 7.783 4.919) 9.367 6.260 ( -0.195 -1.958 6.721) 7.003 6.550 ( -7.778 -2.396 -2.329) 8.465 6.667 ( 4.257 -3.585 2.468) 6.088 6.751 ( -7.011 -2.312 -6.650) 9.936 6.887 ( -2.995 5.214 3.007) 6.723 7.121 ( 1.093 1.618 0.291) 1.974 7.330 ( 1.754 1.190 -2.455) 3.243 7.590 ( -3.394 5.041 1.507) 6.261 7.733 ( 7.948 3.471 -5.415) 10.225 7.893 ( -3.365 -2.326 -3.687) 5.506 8.141 ( 3.159 -4.630 -8.877) 10.499 8.391 ( 11.833 4.706 2.242) 12.930 8.698 ( 0.616 7.179 -9.006) 11.534 8.851 ( -5.699 -8.706 2.446) 10.689 9.178 ( -3.781 -3.333 -3.487) 6.128 11.078 ( 3.693 1.590 -5.778) 7.039 11.201 ( -1.252 -1.119 -1.207) 2.068 11.593 ( -0.950 -1.663 2.909) 3.483 11.647 ( 2.528 -3.234 -3.156) 5.178 13.550 ( 0.601 -1.551 6.003) 6.229 13.613 ( -2.381 -2.579 9.151) 9.801 13.825 ( 0.696 3.802 0.745) 3.936 14.106 ( 2.564 -3.751 -1.013) 4.655 15.354 ( 0.660 6.416 2.889) 7.068 15.491 ( 0.950 7.626 1.279) 7.791 15.769 ( 2.433 -4.901 1.978) 5.819 15.876 ( 3.291 -2.521 -0.384) 4.164 16.058 ( -1.360 -2.136 -4.350) 5.033 16.067 ( -1.250 -2.219 -1.335) 2.876 16.459 ( -3.069 3.597 5.043) 6.912 16.666 ( -0.015 -2.147 3.701) 4.278 18.296 ( 0.036 -0.361 1.938) 1.972 18.463 ( 2.485 -4.143 3.166) 5.776 18.565 ( -1.151 3.689 1.062) 4.008 18.721 ( -1.710 -1.311 -0.532) 2.219 27.716 ( -0.648 -0.130 1.240) 1.405 27.774 ( 1.332 0.344 0.180) 1.388 27.903 ( 0.571 -2.350 2.354) 3.374 27.981 ( 0.137 -2.320 2.084) 3.121 29.012 ( 0.151 2.571 5.545) 6.114 29.107 ( -3.315 0.384 4.207) 5.370 29.329 ( 2.417 6.504 2.570) 7.399 29.554 ( 4.341 -1.626 1.364) 4.832 29.927 ( -3.502 3.282 3.646) 6.027 30.042 ( -2.348 2.206 4.538) 5.566 30.588 ( -1.853 8.843 -7.103) 11.493 30.853 ( 0.605 -2.778 -0.294) 2.859 31.152 ( 1.181 2.307 -1.204) 2.857 31.775 ( -2.895 -0.715 -13.714) 14.034 32.615 ( -1.369 2.296 8.272) 8.694 33.489 ( 5.773 -14.546 -11.525) 19.435 ======================= Grid point 173 (91/168) ======================= q-point: (-0.40 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.115 ( -18.208 12.147 1.632) 21.949 2.521 ( -15.696 18.829 -1.830) 24.581 2.904 ( -1.252 -6.221 -1.009) 6.425 2.962 ( -3.765 0.651 4.512) 5.912 3.284 ( 0.557 3.408 3.118) 4.653 3.486 ( 4.736 2.139 -7.057) 8.764 3.632 ( -0.784 -6.010 -7.843) 9.912 3.727 ( -5.713 11.572 4.675) 13.726 3.819 ( 3.451 -3.591 -5.100) 7.129 4.051 ( -3.563 6.412 -5.245) 9.017 4.327 ( -5.398 -1.725 4.091) 6.989 4.415 ( -11.719 4.855 -2.739) 12.978 4.580 ( -7.521 -2.883 -0.087) 8.055 4.772 ( -2.160 7.528 -4.215) 8.894 4.891 ( -5.588 -2.415 5.983) 8.536 5.139 ( -4.328 -6.015 -5.758) 9.384 5.456 ( -3.441 5.015 2.780) 6.687 5.558 ( 0.332 -4.593 -4.951) 6.762 5.786 ( -5.653 -4.111 5.858) 9.120 5.850 ( -5.016 -1.147 -2.377) 5.668 6.125 ( -4.987 4.002 5.762) 8.607 6.303 ( -7.560 -6.086 2.829) 10.109 6.476 ( 6.508 3.295 2.788) 7.810 6.556 ( -4.330 2.789 -3.053) 5.988 6.813 ( 1.548 2.574 1.629) 3.417 6.923 ( 1.772 -3.105 8.426) 9.153 7.139 ( 2.561 0.431 -0.255) 2.609 7.304 ( -1.125 0.298 -1.614) 1.990 7.554 ( -3.214 3.776 0.737) 5.013 7.715 ( -1.502 -2.774 -6.642) 7.353 7.839 ( 2.237 -0.157 -3.710) 4.335 8.096 ( 3.255 -1.636 -6.925) 7.825 8.562 ( 7.443 2.629 -13.231) 15.407 8.651 ( 8.731 6.221 0.777) 10.749 8.836 ( -2.759 -6.268 6.895) 9.718 9.048 ( -5.571 -3.312 -4.911) 8.132 11.075 ( 3.044 -0.666 -4.886) 5.795 11.173 ( 1.681 -3.468 -3.027) 4.901 11.598 ( -1.343 0.577 0.931) 1.733 11.683 ( 4.243 -1.091 -0.397) 4.399 13.609 ( -1.561 -1.667 5.060) 5.551 13.738 ( 5.402 -3.545 8.246) 10.476 13.902 ( 8.030 4.131 0.105) 9.031 14.186 ( 9.183 -3.707 -1.129) 9.967 15.392 ( 0.265 6.642 2.081) 6.965 15.517 ( 0.949 8.874 0.894) 8.969 15.801 ( 0.851 -3.670 -0.549) 3.808 15.914 ( 2.945 -1.716 -2.068) 3.987 16.022 ( -0.016 -2.586 0.258) 2.599 16.027 ( -1.748 -2.267 -1.519) 3.241 16.492 ( -1.262 3.333 6.375) 7.303 16.707 ( 1.278 -2.117 1.788) 3.051 18.284 ( -4.810 -0.112 2.555) 5.447 18.492 ( -3.740 -5.280 2.607) 6.976 18.517 ( -5.411 2.802 -0.392) 6.107 18.664 ( -5.206 -1.250 0.894) 5.428 27.718 ( -0.765 0.924 1.287) 1.759 27.794 ( 1.029 0.522 -0.046) 1.155 27.930 ( -0.738 -3.094 2.287) 3.918 28.000 ( 0.311 -2.995 1.015) 3.178 29.055 ( -2.222 2.315 3.704) 4.900 29.124 ( -1.236 0.617 5.771) 5.934 29.409 ( 5.210 9.875 1.529) 11.269 29.653 ( 6.275 0.066 1.365) 6.422 29.963 ( 0.166 1.817 7.663) 7.878 30.074 ( 0.216 2.008 3.656) 4.177 30.466 ( -3.188 8.631 -6.834) 11.461 30.863 ( 2.716 -5.752 -4.053) 7.543 31.184 ( 2.231 2.925 2.438) 4.413 31.549 ( -6.053 0.717 -12.853) 14.225 32.630 ( -8.088 1.675 7.558) 11.196 33.405 ( 0.853 -16.544 -12.802) 20.936 ======================= Grid point 174 (92/168) ======================= q-point: (-0.30 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.876 ( -19.777 15.250 9.780) 26.821 2.223 ( -20.549 19.878 -1.219) 28.616 2.853 ( -5.962 -9.877 3.302) 12.000 2.920 ( -8.171 -1.855 1.788) 8.567 3.292 ( -3.702 -0.269 1.024) 3.850 3.436 ( -9.350 4.384 -3.800) 11.004 3.516 ( 3.552 3.185 -8.541) 9.783 3.610 ( -13.583 13.882 3.804) 19.791 3.747 ( -7.227 -3.236 -7.700) 11.044 3.859 ( -11.615 7.790 -4.610) 14.725 4.142 ( -8.319 0.816 -6.936) 10.862 4.293 ( -6.002 -1.778 3.798) 7.322 4.459 ( -11.966 -5.007 1.977) 13.122 4.659 ( -3.513 4.301 -3.201) 6.410 4.841 ( -3.881 1.674 1.996) 4.675 5.052 ( -3.055 -4.007 -1.610) 5.289 5.403 ( -6.067 4.889 4.447) 8.972 5.523 ( -1.011 -2.638 -2.714) 3.918 5.699 ( -5.075 0.740 0.679) 5.173 5.849 ( -1.408 -5.472 5.483) 7.873 6.072 ( -7.689 -0.151 4.763) 9.046 6.181 ( -7.507 -8.112 0.915) 11.090 6.494 ( -1.106 5.179 -1.968) 5.650 6.647 ( 4.259 9.907 2.769) 11.133 6.861 ( 3.484 0.925 2.505) 4.389 6.977 ( -3.281 0.160 3.432) 4.750 7.215 ( 3.141 -1.789 -1.522) 3.922 7.297 ( 2.052 -1.053 1.289) 2.642 7.488 ( -3.912 0.070 -0.926) 4.021 7.659 ( 2.877 -5.820 -2.580) 6.986 7.855 ( 3.405 0.540 0.548) 3.491 8.084 ( 2.367 -1.530 -3.986) 4.882 8.459 ( 1.519 4.869 -12.582) 13.577 8.752 ( 3.129 2.855 -10.348) 11.182 8.873 ( -1.830 -4.561 6.491) 8.141 9.008 ( 2.626 -7.792 5.984) 10.169 11.052 ( 1.262 -1.782 -4.254) 4.782 11.201 ( 5.090 -3.955 -1.813) 6.696 11.575 ( -1.341 2.819 -1.143) 3.324 11.749 ( 3.815 -1.107 0.163) 3.976 13.639 ( 0.457 1.568 2.643) 3.107 13.941 ( 9.540 -5.297 5.763) 12.340 14.045 ( 9.883 4.463 -0.834) 10.876 14.354 ( 13.616 -3.811 -1.599) 14.229 15.403 ( -0.220 6.287 -0.068) 6.291 15.540 ( 2.897 8.354 -2.752) 9.261 15.816 ( 1.910 -1.155 1.214) 2.541 15.907 ( 0.967 -2.256 -4.698) 5.300 15.979 ( -2.754 -2.523 0.130) 3.738 16.059 ( 2.325 -1.446 2.156) 3.485 16.557 ( -0.522 2.190 6.961) 7.316 16.746 ( 2.193 -1.850 0.209) 2.876 18.207 ( -8.463 -0.127 2.395) 8.796 18.387 ( -7.791 -1.492 -4.112) 8.935 18.406 ( -10.787 -0.616 3.392) 11.324 18.578 ( -9.487 -4.466 2.520) 10.784 27.725 ( -0.172 1.914 1.180) 2.256 27.802 ( 0.361 0.604 -0.549) 0.893 27.927 ( -1.935 -2.502 0.824) 3.268 28.017 ( 0.706 -4.133 0.414) 4.213 29.044 ( -2.621 3.289 1.880) 4.607 29.173 ( -1.837 -0.530 5.918) 6.219 29.524 ( 10.696 14.214 -4.555) 18.362 29.788 ( 8.273 2.766 3.293) 9.324 30.059 ( 0.618 2.254 -1.596) 2.830 30.157 ( 5.826 1.921 9.615) 11.405 30.375 ( -3.150 4.943 3.810) 6.991 30.832 ( 2.420 -6.982 -7.891) 10.811 31.264 ( 1.860 0.823 4.024) 4.509 31.320 ( -5.901 2.887 -9.006) 11.147 32.544 ( -13.256 0.846 6.963) 14.997 33.207 ( -7.157 -18.632 -14.203) 24.497 ======================= Grid point 175 (93/168) ======================= q-point: (-0.20 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.728 ( -21.859 15.609 16.272) 31.404 1.871 ( -21.674 20.813 4.614) 30.402 2.700 ( -17.785 -3.984 -5.470) 19.029 2.817 ( -4.876 -9.966 6.348) 12.783 3.096 ( -18.831 8.468 -0.821) 20.664 3.220 ( -19.125 14.667 9.910) 26.059 3.421 ( -7.090 2.139 -3.988) 8.411 3.524 ( -9.806 4.139 -3.819) 11.308 3.561 ( 2.649 1.125 -3.066) 4.205 3.622 ( -3.798 7.399 -5.970) 10.238 4.072 ( 2.460 -5.534 -2.338) 6.492 4.246 ( -12.302 -0.459 2.219) 12.509 4.269 ( -2.661 -5.350 0.040) 5.975 4.580 ( -5.581 -1.701 1.892) 6.134 4.862 ( 2.894 4.434 -0.209) 5.299 4.986 ( -1.983 -1.698 -1.519) 3.020 5.386 ( -3.928 4.021 4.067) 6.939 5.461 ( -5.892 2.142 5.124) 8.096 5.678 ( 0.403 1.182 0.342) 1.295 5.900 ( -1.299 -4.446 6.540) 8.014 6.014 ( -5.997 -1.964 4.014) 7.479 6.114 ( -2.397 -4.531 0.779) 5.185 6.469 ( 2.168 5.985 -2.081) 6.697 6.696 ( 0.407 8.923 1.479) 9.054 6.856 ( -3.609 -3.174 -0.469) 4.829 7.022 ( 1.688 3.251 3.170) 4.844 7.213 ( 2.224 1.830 -2.077) 3.551 7.257 ( -5.797 -0.483 -2.900) 6.500 7.468 ( -1.057 -6.264 0.392) 6.365 7.742 ( 8.158 -5.316 -0.360) 9.743 7.932 ( 2.592 -1.263 0.404) 2.911 8.078 ( 1.676 0.012 -1.216) 2.071 8.343 ( 0.304 3.535 -9.121) 9.787 8.613 ( -3.180 1.350 -8.241) 8.935 8.923 ( -1.838 -2.201 4.391) 5.245 9.117 ( 0.267 -12.443 5.323) 13.536 11.039 ( 2.426 -0.734 -2.584) 3.620 11.273 ( 4.727 -4.450 0.374) 6.503 11.537 ( -0.878 4.109 -2.035) 4.669 11.796 ( 2.675 -1.912 -1.030) 3.446 13.696 ( 3.812 5.156 1.649) 6.620 14.130 ( 8.777 -3.913 -0.451) 9.620 14.184 ( 8.817 3.046 0.878) 9.370 14.541 ( 13.093 -4.026 -3.635) 14.172 15.393 ( 0.480 5.857 -1.620) 6.096 15.525 ( 2.375 6.018 -7.392) 9.823 15.832 ( 0.794 -3.180 -7.949) 8.598 15.885 ( 0.976 -3.898 -0.808) 4.099 15.997 ( 3.138 1.737 8.071) 8.833 16.132 ( 3.923 -0.132 1.850) 4.339 16.620 ( -1.193 0.901 5.906) 6.093 16.773 ( 1.437 -1.760 -0.969) 2.470 18.088 ( -9.318 -0.494 1.874) 9.518 18.194 ( -10.662 -2.132 -3.834) 11.529 18.261 ( -11.936 -0.309 3.096) 12.335 18.394 ( -16.630 -5.093 0.974) 17.420 27.738 ( 0.483 2.377 0.432) 2.463 27.793 ( -0.311 0.710 -1.055) 1.309 27.893 ( -2.188 -1.760 -0.840) 2.930 28.026 ( 0.317 -4.556 -0.530) 4.598 29.022 ( -2.135 3.639 0.856) 4.305 29.193 ( -3.169 -1.282 4.489) 5.643 29.582 ( 9.188 15.202 -14.547) 22.960 29.935 ( 1.844 2.501 -12.918) 13.286 30.005 ( 7.197 8.513 5.697) 12.519 30.363 ( 4.550 6.282 8.144) 11.246 30.598 ( 12.116 -6.606 20.415) 24.641 30.807 ( 6.374 -7.401 -1.977) 9.965 31.147 ( -3.345 4.578 -6.242) 8.433 31.340 ( 0.304 -0.930 3.922) 4.042 32.373 ( -17.755 -0.835 4.189) 18.262 32.852 ( -17.949 -15.804 -12.067) 26.787 ======================= Grid point 176 (94/168) ======================= q-point: (-0.10 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( -20.853 18.261 10.389) 29.602 1.853 ( -8.191 20.319 23.170) 31.887 2.300 ( -18.375 -4.472 -10.159) 21.467 2.856 ( -4.715 -7.977 8.382) 12.495 2.893 ( -5.407 6.773 5.073) 10.042 3.038 ( -19.969 27.928 15.790) 37.790 3.250 ( -11.226 -2.107 -0.101) 11.422 3.386 ( 0.196 7.996 -7.251) 10.796 3.524 ( 4.692 0.889 -7.440) 8.841 3.654 ( 4.256 -1.415 2.658) 5.214 4.075 ( -0.958 0.563 0.432) 1.192 4.165 ( 0.312 -6.814 3.481) 7.658 4.291 ( 2.356 -4.792 2.426) 5.865 4.535 ( -3.932 -1.863 2.316) 4.929 4.864 ( 0.858 1.009 -2.468) 2.801 4.986 ( 1.733 1.120 -0.095) 2.065 5.343 ( -6.491 3.501 4.914) 8.862 5.495 ( -3.273 2.626 9.135) 10.053 5.700 ( 1.549 -1.403 1.285) 2.454 5.916 ( -3.895 -0.664 3.898) 5.551 6.009 ( -2.513 -5.951 6.206) 8.958 6.113 ( 0.991 1.479 0.584) 1.873 6.528 ( 5.089 5.128 0.877) 7.278 6.693 ( -0.487 7.659 -3.210) 8.319 6.815 ( -1.306 -3.342 1.070) 3.744 7.059 ( -1.503 1.185 1.024) 2.171 7.115 ( -4.627 1.021 -3.264) 5.754 7.270 ( 6.305 2.770 -0.442) 6.901 7.424 ( -4.677 -7.644 1.222) 9.044 7.806 ( 5.214 -5.847 -11.702) 14.082 7.912 ( 0.249 3.255 -0.602) 3.319 8.114 ( 0.124 1.732 1.963) 2.621 8.289 ( 2.103 0.447 -3.308) 3.946 8.523 ( -0.883 0.831 -0.429) 1.286 8.891 ( -5.618 -1.138 -0.156) 5.735 9.121 ( -4.019 -12.692 1.543) 13.402 11.067 ( 3.201 0.863 -0.728) 3.394 11.346 ( 3.646 -3.179 0.736) 4.893 11.508 ( -0.453 3.192 -1.173) 3.431 11.811 ( 1.656 -2.909 -1.834) 3.816 13.779 ( 3.346 6.522 1.557) 7.494 14.194 ( 4.483 2.532 -5.216) 7.329 14.318 ( 4.744 -2.842 1.739) 5.797 14.653 ( 7.913 -4.364 -6.184) 10.950 15.385 ( 1.900 5.405 -2.909) 6.426 15.451 ( -0.801 5.857 -7.284) 9.381 15.744 ( 0.636 -4.242 -8.443) 9.470 15.862 ( 0.526 -4.645 -3.275) 5.708 16.203 ( 5.144 0.542 4.729) 7.008 16.242 ( 10.156 -0.353 5.125) 11.381 16.645 ( -2.817 -0.216 3.834) 4.763 16.754 ( -1.804 -2.186 -2.304) 3.652 17.943 ( -13.891 -1.371 -0.726) 13.977 17.995 ( -9.482 -0.970 2.480) 9.849 18.116 ( -12.149 -0.278 3.771) 12.724 18.172 ( -6.280 -0.970 -1.277) 6.482 27.733 ( -0.670 1.841 -1.572) 2.512 27.778 ( 0.029 1.210 -0.958) 1.543 27.848 ( -1.434 -1.063 -1.641) 2.425 28.011 ( -0.474 -3.981 -1.977) 4.470 28.997 ( -1.824 3.298 0.060) 3.769 29.180 ( -3.895 -1.406 3.066) 5.153 29.472 ( 2.499 13.779 -18.625) 23.302 29.790 ( -1.003 0.447 -10.757) 10.813 30.169 ( 5.833 9.234 2.068) 11.116 30.541 ( 2.977 9.352 9.548) 13.693 30.799 ( 9.230 -9.859 -1.434) 13.581 31.036 ( -0.047 1.173 1.505) 1.908 31.279 ( 13.412 -3.518 5.495) 14.915 31.425 ( 13.838 -8.265 15.519) 22.375 32.022 ( -26.916 2.128 -4.054) 27.303 32.503 ( -14.113 -7.815 0.565) 16.143 ======================= Grid point 177 (95/168) ======================= q-point: ( 0.00 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( 3.189 12.356 3.318) 13.185 1.938 ( 0.309 -5.475 -4.023) 6.801 2.417 ( -2.072 15.665 18.804) 24.562 2.688 ( -3.508 -10.557 12.190) 16.504 2.997 ( 1.881 1.528 4.157) 4.812 3.062 ( 3.129 -4.540 1.111) 5.625 3.408 ( 2.744 6.535 -4.471) 8.380 3.528 ( -0.592 -0.763 -2.813) 2.974 3.640 ( 2.766 13.807 3.455) 14.499 3.816 ( 5.494 0.266 4.501) 7.107 4.081 ( 0.946 0.627 2.061) 2.353 4.151 ( 4.087 -0.615 2.590) 4.877 4.367 ( 2.918 0.821 7.906) 8.467 4.433 ( 0.089 -6.123 5.658) 8.337 4.868 ( 0.610 2.240 -1.304) 2.663 4.965 ( 1.259 -4.945 -2.021) 5.488 5.394 ( -8.463 6.175 7.914) 13.129 5.502 ( -6.526 -3.218 6.061) 9.470 5.740 ( -0.405 2.568 7.057) 7.521 5.849 ( -1.971 -6.470 6.584) 9.439 6.009 ( -1.729 2.504 4.856) 5.731 6.098 ( -2.119 -4.841 2.201) 5.725 6.647 ( -3.048 3.412 -5.418) 7.091 6.693 ( -0.475 -0.352 -0.880) 1.060 6.910 ( 3.372 4.048 -2.594) 5.873 6.937 ( 2.307 2.877 -9.793) 10.464 7.192 ( -1.320 1.886 4.520) 5.072 7.258 ( -3.295 -4.904 6.426) 8.730 7.454 ( 4.409 8.033 -3.060) 9.660 7.647 ( 10.613 -9.340 -8.994) 16.756 8.003 ( -0.223 3.853 1.158) 4.029 8.078 ( -1.071 -3.190 0.632) 3.424 8.334 ( 1.745 4.414 -2.477) 5.354 8.465 ( 0.306 -7.326 -0.746) 7.370 8.823 ( -1.155 4.170 -2.444) 4.969 8.919 ( -0.561 -5.400 -0.493) 5.451 11.181 ( 1.719 4.743 2.591) 5.671 11.299 ( 1.394 -6.503 3.609) 7.567 11.595 ( 1.154 6.516 -4.049) 7.758 11.718 ( 1.542 -5.384 -3.645) 6.682 13.951 ( -2.860 7.762 0.716) 8.303 14.107 ( -2.858 -6.858 -1.213) 7.528 14.390 ( -0.416 6.048 -4.134) 7.338 14.525 ( -0.037 -6.548 -6.008) 8.887 15.452 ( 0.435 5.071 -6.977) 8.637 15.520 ( 1.946 2.676 -3.119) 4.547 15.590 ( 0.341 0.128 -6.566) 6.576 15.712 ( 1.204 -7.090 -3.956) 8.208 16.341 ( 3.999 2.450 2.667) 5.396 16.381 ( 3.988 -1.440 2.254) 4.802 16.600 ( -4.816 -0.859 0.708) 4.943 16.615 ( -5.820 -2.107 -1.592) 6.391 17.823 ( -6.111 2.896 3.772) 7.744 17.880 ( -5.441 -2.562 3.874) 7.153 18.077 ( 1.780 2.237 -0.029) 2.859 18.123 ( 3.527 -2.274 0.222) 4.202 27.728 ( -1.170 1.503 -2.224) 2.928 27.752 ( -0.633 -0.826 -2.476) 2.685 27.845 ( 0.198 2.085 -0.474) 2.147 27.904 ( -0.215 -3.341 -1.710) 3.759 29.036 ( -2.847 3.690 0.954) 4.757 29.107 ( -3.355 -3.056 2.144) 5.019 29.485 ( -1.447 7.018 -13.695) 15.457 29.595 ( -1.910 -3.969 -12.065) 12.844 30.435 ( 1.283 8.991 0.264) 9.086 30.587 ( -3.155 -4.504 -2.309) 5.965 30.945 ( -0.372 4.266 7.055) 8.252 31.052 ( -1.269 -4.841 4.955) 7.043 31.388 ( 5.906 6.165 6.257) 10.585 31.545 ( 1.154 -7.824 11.929) 14.312 31.996 ( 2.444 9.868 -0.321) 10.171 32.235 ( 5.397 -12.569 0.083) 13.679 ======================= Grid point 178 (96/168) ======================= q-point: ( 0.10 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.993 ( 21.186 6.628 2.367) 22.324 2.057 ( 18.183 0.637 -1.338) 18.243 2.594 ( -0.570 10.750 16.004) 19.288 2.773 ( -1.225 -7.045 9.605) 11.974 3.046 ( 3.580 8.532 -0.668) 9.277 3.189 ( 7.766 -4.933 -1.539) 9.328 3.408 ( 2.839 9.198 -3.998) 10.424 3.570 ( 7.924 -4.351 0.361) 9.047 3.782 ( 10.410 4.619 1.653) 11.508 3.922 ( 1.226 -8.734 1.058) 8.883 4.132 ( 5.039 10.163 1.092) 11.396 4.267 ( 8.424 -2.014 -0.357) 8.669 4.489 ( 1.010 1.988 7.161) 7.500 4.560 ( 5.009 -5.037 7.591) 10.397 4.860 ( 0.899 2.521 -1.982) 3.331 4.954 ( 0.331 -4.056 -2.383) 4.716 5.370 ( -6.749 6.803 9.424) 13.440 5.488 ( -3.990 -3.845 7.241) 9.118 5.816 ( -1.094 -0.020 7.926) 8.001 5.857 ( -4.267 -3.152 3.574) 6.396 6.067 ( 0.770 1.090 5.983) 6.130 6.134 ( 1.133 -5.243 5.679) 7.812 6.527 ( -2.276 3.591 -5.152) 6.679 6.613 ( -3.251 -4.377 -5.171) 7.514 6.868 ( -0.078 8.803 -5.494) 10.376 6.980 ( 3.716 -0.458 -4.373) 5.757 7.124 ( -8.460 3.749 1.522) 9.378 7.210 ( -5.557 -3.550 1.354) 6.731 7.558 ( 9.023 9.937 1.197) 13.475 7.755 ( 10.281 -7.014 -4.622) 13.276 8.026 ( 2.533 3.345 1.163) 4.355 8.098 ( 3.498 -3.523 0.137) 4.966 8.350 ( 3.482 0.763 -2.067) 4.120 8.432 ( 0.693 -6.056 -6.371) 8.818 8.835 ( 3.671 3.862 1.136) 5.448 8.924 ( 2.827 -4.368 -1.602) 5.444 11.226 ( 0.396 5.381 2.482) 5.939 11.353 ( 0.487 -6.748 3.244) 7.503 11.559 ( 0.118 7.027 -4.095) 8.134 11.696 ( 0.852 -6.131 -3.811) 7.269 13.865 ( -9.138 6.507 1.403) 11.305 13.993 ( -9.558 -5.376 -1.039) 11.016 14.301 ( -5.286 4.845 -3.117) 7.819 14.419 ( -5.111 -6.077 -4.764) 9.260 15.383 ( -0.650 6.387 -3.823) 7.472 15.507 ( 0.421 -5.623 -3.747) 6.770 15.551 ( 2.837 6.829 -3.755) 8.294 15.690 ( 2.521 -6.400 -5.109) 8.568 16.366 ( -5.894 2.349 -0.297) 6.352 16.398 ( -1.091 0.411 1.858) 2.193 16.507 ( -5.133 -0.193 -0.325) 5.147 16.566 ( -1.614 -4.815 1.471) 5.287 17.849 ( 3.978 2.229 2.942) 5.426 17.900 ( 2.720 -2.652 3.230) 4.986 18.169 ( 9.064 3.491 0.162) 9.714 18.240 ( 9.725 -3.356 0.771) 10.316 27.690 ( -0.750 1.577 -1.495) 2.299 27.720 ( -0.025 -1.186 -2.000) 2.325 27.845 ( 0.473 1.307 -0.327) 1.428 27.881 ( -0.104 -1.907 -1.789) 2.616 29.005 ( -2.673 4.007 1.385) 5.012 29.084 ( -2.993 -3.376 2.559) 5.187 29.348 ( -0.223 6.193 -7.895) 10.036 29.459 ( -0.676 -4.757 -7.995) 9.328 30.385 ( -7.869 5.401 0.656) 9.566 30.452 ( -9.385 -0.845 -1.665) 9.569 31.002 ( 1.764 6.775 4.132) 8.129 31.161 ( 6.323 -8.502 3.198) 11.068 31.373 ( -13.410 9.705 4.275) 17.096 31.575 ( -8.037 -8.606 7.650) 14.042 32.148 ( 16.196 15.742 -0.897) 22.603 32.510 ( 23.661 -18.701 -0.836) 30.170 ======================= Grid point 179 (97/168) ======================= q-point: ( 0.20 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.381 ( 23.092 5.604 3.325) 23.994 2.430 ( 24.919 1.439 3.081) 25.150 2.755 ( 1.641 6.002 9.739) 11.557 2.870 ( 1.658 -5.336 6.354) 8.461 3.102 ( 5.885 11.339 -2.584) 13.034 3.208 ( 1.514 2.190 -5.438) 6.055 3.459 ( 6.467 7.648 -1.168) 10.083 3.693 ( 9.064 -11.184 -3.819) 14.894 3.897 ( 0.237 -2.507 -2.815) 3.777 3.935 ( 4.515 -7.031 -0.472) 8.369 4.271 ( 10.779 9.142 1.005) 14.169 4.397 ( 9.961 0.855 -2.605) 10.331 4.581 ( 2.747 1.482 4.212) 5.242 4.640 ( -1.518 -2.318 0.823) 2.890 4.882 ( 3.167 2.004 -3.349) 5.026 4.923 ( 2.004 -3.776 -2.751) 5.084 5.391 ( -5.653 7.672 10.093) 13.881 5.540 ( -3.026 -5.751 9.647) 11.631 5.807 ( -2.527 3.915 1.800) 4.996 5.922 ( 0.616 -6.086 8.285) 10.298 6.120 ( -0.384 3.461 0.248) 3.491 6.205 ( -0.809 -3.578 2.216) 4.286 6.504 ( 0.654 -0.683 3.776) 3.892 6.541 ( 0.289 -3.377 -0.730) 3.467 6.768 ( -1.143 6.878 -5.401) 8.820 6.879 ( -2.295 -3.078 -6.078) 7.189 7.109 ( 0.975 6.570 1.470) 6.802 7.197 ( 1.268 -2.087 1.516) 2.874 7.684 ( 6.046 9.166 -0.926) 11.019 7.827 ( 5.885 -3.647 -4.982) 8.529 8.091 ( 2.697 4.273 0.304) 5.062 8.156 ( 3.836 -2.823 -2.040) 5.181 8.345 ( -0.268 1.242 -5.093) 5.249 8.436 ( 6.201 -6.889 1.693) 9.422 8.921 ( 5.141 0.441 -0.976) 5.252 8.971 ( 5.319 -3.026 -0.694) 6.159 11.253 ( -0.408 6.067 2.410) 6.541 11.383 ( -0.005 -5.529 0.649) 5.567 11.506 ( -1.462 5.986 -2.615) 6.694 11.651 ( -0.562 -7.014 -4.655) 8.437 13.721 ( -11.955 4.482 3.221) 13.167 13.811 ( -12.839 -3.868 0.980) 13.445 14.166 ( -8.050 4.529 -1.768) 9.404 14.274 ( -7.587 -5.595 -2.774) 9.826 15.358 ( 0.515 6.446 -0.321) 6.475 15.477 ( 0.361 -4.022 -1.425) 4.282 15.566 ( 3.280 4.319 -2.671) 6.045 15.677 ( 3.458 -5.249 -4.912) 7.978 16.257 ( -5.867 2.751 -1.440) 6.638 16.324 ( -5.482 -3.631 -2.857) 7.169 16.492 ( -1.653 2.246 4.528) 5.318 16.553 ( -2.981 -3.477 2.571) 5.252 17.982 ( 8.763 1.128 1.437) 8.952 18.019 ( 7.657 -2.310 2.284) 8.318 18.335 ( 10.728 4.020 0.632) 11.474 18.415 ( 10.638 -3.691 0.846) 11.292 27.674 ( 0.018 1.396 -0.342) 1.438 27.708 ( 0.452 -1.631 -0.751) 1.852 27.855 ( 0.796 0.306 0.224) 0.881 27.864 ( 0.281 -0.451 -1.095) 1.217 28.988 ( -2.414 4.287 2.714) 5.619 29.072 ( -3.014 -3.667 3.689) 6.012 29.294 ( 1.442 5.138 -3.464) 6.362 29.393 ( 0.962 -4.490 -4.191) 6.217 30.249 ( -10.300 3.539 2.107) 11.093 30.290 ( -9.284 -0.398 -0.573) 9.310 31.071 ( -1.963 6.665 2.257) 7.306 31.199 ( -10.546 8.466 3.113) 13.878 31.218 ( -1.056 0.258 -1.851) 2.146 31.561 ( 1.852 -17.797 2.320) 18.043 32.410 ( 17.054 21.153 -1.160) 27.196 32.834 ( 19.953 -20.095 -3.282) 28.508 ======================= Grid point 180 (98/168) ======================= q-point: ( 0.30 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.723 ( 8.444 5.577 4.603) 11.118 2.797 ( 15.719 1.357 3.344) 16.128 2.878 ( 8.276 4.977 1.217) 9.733 2.950 ( 2.869 -3.544 2.086) 5.014 3.145 ( 2.685 9.315 -2.013) 9.901 3.214 ( 7.858 2.837 -2.549) 8.734 3.537 ( 4.618 7.583 -0.779) 8.913 3.764 ( 5.663 -12.161 -4.136) 14.038 3.863 ( 1.034 -0.861 -5.655) 5.813 3.940 ( 2.571 -9.535 -4.972) 11.056 4.433 ( 4.048 6.752 4.931) 9.289 4.511 ( 9.122 2.303 -4.898) 10.607 4.596 ( -3.723 3.581 2.655) 5.808 4.685 ( 8.106 -5.081 -2.798) 9.967 4.830 ( 1.661 6.475 -5.806) 8.855 4.976 ( 6.222 -8.225 -3.721) 10.964 5.404 ( -6.263 7.413 8.674) 13.016 5.564 ( -6.442 -7.541 7.547) 12.463 5.839 ( 1.644 8.621 4.103) 9.688 6.003 ( -1.326 -4.405 4.480) 6.421 6.083 ( 2.254 3.040 -3.934) 5.459 6.188 ( -1.035 -3.760 1.092) 4.050 6.501 ( -2.665 3.971 2.212) 5.269 6.634 ( -0.622 -7.674 6.032) 9.781 6.802 ( 8.754 3.842 0.006) 9.560 6.871 ( 5.222 -2.832 -0.578) 5.968 7.147 ( 4.222 7.391 -2.012) 8.747 7.245 ( 4.346 -1.659 -1.310) 4.832 7.730 ( 3.002 6.402 -2.756) 7.589 7.819 ( 2.653 -1.574 -7.785) 8.374 8.064 ( -1.526 2.689 -5.116) 5.977 8.148 ( -1.385 -5.137 -4.361) 6.880 8.334 ( 2.419 10.480 1.383) 10.844 8.570 ( 4.491 -11.205 4.506) 12.885 8.953 ( 3.816 3.365 -4.805) 6.998 9.057 ( 4.619 -5.846 0.274) 7.455 11.262 ( -1.449 6.121 0.731) 6.333 11.341 ( -1.326 1.062 -5.507) 5.763 11.488 ( -0.963 -0.865 2.926) 3.199 11.580 ( -0.973 -7.083 -4.519) 8.458 13.587 ( -10.701 2.599 5.141) 12.153 13.643 ( -11.613 -2.570 4.055) 12.566 14.027 ( -7.573 4.676 -0.442) 8.911 14.132 ( -7.117 -5.244 -1.361) 8.945 15.385 ( 1.393 6.110 2.032) 6.588 15.497 ( 2.147 -2.945 1.569) 3.968 15.586 ( 2.539 3.538 -1.737) 4.688 15.693 ( 4.084 -5.100 -2.668) 7.057 16.160 ( -3.639 1.505 -2.493) 4.661 16.205 ( -4.145 -2.896 -4.238) 6.597 16.517 ( -2.772 1.125 4.908) 5.748 16.547 ( -2.245 -1.641 4.438) 5.237 18.131 ( 8.248 1.087 0.908) 8.369 18.169 ( 8.083 -2.403 1.763) 8.615 18.497 ( 8.271 3.887 1.050) 9.199 18.572 ( 7.853 -3.392 0.773) 8.589 27.681 ( 0.494 1.087 0.779) 1.426 27.715 ( 0.575 -1.891 0.557) 2.054 27.861 ( 0.650 0.824 -0.344) 1.104 27.879 ( 0.934 -0.917 1.131) 1.729 28.993 ( -2.124 4.174 4.460) 6.467 29.073 ( -3.278 -3.380 4.984) 6.857 29.306 ( 2.672 4.359 -0.566) 5.144 29.388 ( 2.167 -3.792 -1.061) 4.495 30.131 ( -8.501 2.779 3.085) 9.461 30.158 ( -7.411 0.060 0.508) 7.429 30.939 ( -8.717 5.344 -2.843) 10.613 31.052 ( -10.160 -3.521 -1.473) 10.853 31.255 ( 4.952 15.382 -0.259) 16.162 31.645 ( 5.977 -20.009 -1.619) 20.946 32.628 ( 12.559 21.390 -1.442) 24.847 33.050 ( 14.123 -19.458 -5.379) 24.638 ======================= Grid point 181 (99/168) ======================= q-point: ( 0.40 0.43 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.727 ( -5.470 7.619 -1.178) 9.453 2.889 ( -3.479 -6.805 -0.518) 7.660 2.987 ( 4.622 7.224 -1.266) 8.669 3.049 ( 3.847 3.211 -1.354) 5.191 3.233 ( 9.018 9.062 1.583) 12.882 3.367 ( 11.559 -3.961 -1.170) 12.275 3.586 ( 2.091 7.710 0.513) 8.005 3.744 ( -2.148 -9.299 -3.036) 10.016 3.831 ( 5.314 1.968 -6.432) 8.572 3.961 ( 6.648 -10.429 -3.746) 12.922 4.477 ( -2.638 2.435 -3.764) 5.201 4.514 ( -3.019 1.359 5.373) 6.311 4.633 ( 5.035 5.080 -1.060) 7.231 4.764 ( 4.099 -5.609 -0.258) 6.952 4.858 ( 7.340 9.169 -2.416) 11.991 5.043 ( 6.799 -9.321 -1.763) 11.671 5.412 ( -3.640 5.706 6.859) 9.636 5.553 ( -4.197 -6.494 6.222) 9.925 5.891 ( -0.286 7.716 1.063) 7.794 6.011 ( -1.235 -0.252 1.831) 2.223 6.117 ( 2.850 1.712 0.723) 3.402 6.212 ( 0.475 -2.899 3.049) 4.234 6.507 ( -0.958 3.853 3.828) 5.516 6.634 ( -3.708 -6.497 1.342) 7.600 6.897 ( -0.419 0.492 -3.175) 3.240 6.923 ( 1.469 -1.155 0.497) 1.933 7.189 ( 5.387 7.659 -4.259) 10.287 7.301 ( 5.899 -2.246 -3.902) 7.421 7.733 ( 1.148 4.434 -2.026) 5.008 7.761 ( 3.261 1.193 -7.355) 8.133 7.974 ( -1.190 1.355 -6.240) 6.495 8.057 ( -1.153 -6.512 -6.075) 8.980 8.406 ( 3.044 10.746 2.828) 11.522 8.647 ( -0.084 -11.979 2.813) 12.305 8.937 ( 1.886 7.382 -5.685) 9.507 9.100 ( 1.539 -7.726 -1.598) 8.038 11.201 ( -1.760 4.737 -5.800) 7.693 11.257 ( -2.270 -0.217 -4.506) 5.050 11.521 ( 0.199 -1.409 3.503) 3.781 11.551 ( 1.528 -4.378 -0.750) 4.697 13.519 ( -6.424 1.355 6.674) 9.362 13.555 ( -7.580 -2.027 6.961) 10.489 13.933 ( -3.936 4.747 0.123) 6.168 14.035 ( -3.420 -4.942 -0.756) 6.058 15.439 ( 1.703 6.768 2.999) 7.596 15.570 ( 2.804 -3.824 3.791) 6.071 15.611 ( 2.317 4.556 -0.489) 5.134 15.737 ( 3.349 -5.575 -0.116) 6.505 16.086 ( -1.879 -0.008 -2.921) 3.474 16.103 ( -2.395 -1.668 -4.552) 5.408 16.523 ( -2.857 2.655 4.510) 5.962 16.576 ( -1.430 -2.485 4.948) 5.719 18.250 ( 5.073 1.539 1.307) 5.460 18.298 ( 5.501 -2.978 1.915) 6.542 18.605 ( 3.663 3.424 1.202) 5.156 18.668 ( 3.267 -2.757 0.640) 4.322 27.703 ( 0.465 0.962 1.549) 1.882 27.736 ( 0.582 -1.795 1.362) 2.327 27.873 ( 0.620 1.297 0.451) 1.507 27.907 ( 0.689 -1.899 1.411) 2.464 29.022 ( -1.882 3.490 5.909) 7.116 29.083 ( -3.334 -2.371 5.794) 7.093 29.358 ( 3.288 4.037 1.489) 5.416 29.431 ( 3.005 -3.142 1.346) 4.551 30.050 ( -6.070 2.919 2.506) 7.186 30.078 ( -4.914 0.099 2.591) 5.556 30.800 ( -3.381 4.246 -4.579) 7.101 30.889 ( -5.620 -3.610 -4.569) 8.092 31.309 ( 2.367 15.512 -0.860) 15.715 31.675 ( 2.374 -18.160 -5.099) 19.011 32.766 ( 6.977 18.921 -1.224) 20.204 33.156 ( 8.409 -18.336 -6.822) 21.294 ======================= Grid point 182 (100/168) ======================= q-point: (-0.50 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.580 ( -10.489 10.730 -1.496) 15.079 2.799 ( -6.720 -9.826 -0.481) 11.914 2.984 ( -4.018 7.791 -0.746) 8.797 3.030 ( -1.846 3.021 -1.938) 4.036 3.353 ( 4.968 6.168 -1.770) 8.115 3.463 ( 8.192 -4.496 -8.485) 12.622 3.606 ( 1.189 1.781 -2.535) 3.319 3.696 ( -0.889 -5.785 -0.724) 5.897 3.897 ( 7.244 7.223 0.182) 10.231 4.051 ( 5.020 -7.247 3.007) 9.315 4.379 ( -1.868 4.129 -6.378) 7.824 4.501 ( -3.852 -6.155 0.484) 7.277 4.674 ( -2.075 6.073 3.449) 7.286 4.806 ( -1.356 -4.157 3.908) 5.865 4.961 ( 5.817 8.519 -0.149) 10.317 5.114 ( 2.729 -6.493 -1.335) 7.169 5.447 ( -1.749 3.857 6.304) 7.595 5.573 ( -2.407 -5.712 5.885) 8.547 5.827 ( -7.506 6.503 -2.156) 10.163 5.951 ( -7.404 -3.900 -1.819) 8.564 6.207 ( 3.141 4.378 5.223) 7.504 6.251 ( -1.007 -0.579 3.180) 3.386 6.525 ( -5.152 0.409 0.662) 5.210 6.583 ( 1.870 -4.502 3.056) 5.753 6.782 ( -5.076 5.473 -4.702) 8.822 6.899 ( -4.087 -4.172 1.432) 6.013 7.203 ( 2.946 6.050 -4.909) 8.330 7.311 ( 1.654 -3.459 -4.664) 6.037 7.706 ( -1.662 5.890 -1.286) 6.254 7.797 ( 6.405 -0.661 -3.922) 7.539 7.863 ( -1.666 3.089 -8.994) 9.654 8.007 ( 6.181 -8.008 -9.920) 14.168 8.497 ( 4.715 6.358 2.918) 8.437 8.658 ( -1.419 -9.021 3.149) 9.660 8.883 ( -0.253 9.513 -5.970) 11.234 9.064 ( -1.787 -7.630 -4.298) 8.938 11.118 ( 0.803 2.284 -6.674) 7.100 11.166 ( -1.603 -2.191 -5.281) 5.938 11.574 ( 1.331 -0.047 3.219) 3.483 11.592 ( 3.122 -1.868 0.831) 3.731 13.538 ( -1.859 0.399 7.401) 7.642 13.564 ( -2.686 -1.994 8.538) 9.170 13.916 ( 2.122 4.924 -0.229) 5.366 14.017 ( 2.540 -4.792 -0.788) 5.480 15.500 ( 1.524 7.560 2.833) 8.216 15.643 ( 2.354 -0.051 -0.116) 2.358 15.656 ( 1.617 0.936 4.379) 4.761 15.791 ( 2.580 -5.773 1.365) 6.469 16.027 ( -1.583 -0.594 -3.166) 3.590 16.033 ( -0.947 -1.053 -2.830) 3.164 16.537 ( -1.644 3.834 4.211) 5.927 16.610 ( -0.540 -3.269 3.819) 5.056 18.313 ( 0.470 2.066 2.023) 2.929 18.377 ( 1.205 -3.959 2.345) 4.756 18.634 ( -1.568 2.987 0.996) 3.517 18.686 ( -1.707 -2.143 0.523) 2.790 27.728 ( 0.172 1.355 1.860) 2.308 27.763 ( 0.742 -1.602 1.549) 2.349 27.887 ( 0.170 1.040 0.856) 1.358 27.929 ( 0.194 -2.569 1.010) 2.768 29.065 ( -1.875 2.347 6.478) 7.141 29.100 ( -3.041 -1.042 5.884) 6.705 29.442 ( 4.311 4.433 2.983) 6.866 29.513 ( 4.586 -2.635 2.792) 5.981 30.006 ( -3.307 3.817 2.882) 5.814 30.057 ( -2.565 -0.895 3.642) 4.544 30.717 ( -0.003 4.015 -6.771) 7.873 30.788 ( -0.194 -3.400 -4.953) 6.011 31.312 ( -0.307 12.808 -0.929) 12.846 31.605 ( -1.925 -13.797 -7.247) 15.703 32.815 ( 0.723 15.281 -0.766) 15.317 33.159 ( 2.701 -17.257 -7.740) 19.105 ======================= Grid point 183 (101/168) ======================= q-point: (-0.40 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.389 ( -13.561 14.286 1.583) 19.761 2.680 ( -9.403 -13.687 2.076) 16.734 2.838 ( -11.511 11.646 -1.995) 16.496 2.970 ( -5.868 -1.473 0.560) 6.076 3.367 ( 1.055 3.651 -3.190) 4.961 3.457 ( 4.028 -5.158 -8.669) 10.862 3.583 ( 2.757 2.901 -6.015) 7.225 3.684 ( 2.076 -6.296 -3.433) 7.465 3.999 ( 0.811 11.015 4.290) 11.849 4.152 ( 1.664 -1.136 1.677) 2.622 4.263 ( -5.637 0.853 -2.978) 6.432 4.370 ( -8.704 -6.960 -6.925) 13.121 4.636 ( -10.069 7.342 5.265) 13.529 4.798 ( -8.684 -7.077 6.027) 12.721 4.970 ( -2.656 9.005 -2.943) 9.839 5.083 ( -1.777 -1.664 -3.087) 3.932 5.485 ( -3.745 2.375 6.909) 8.210 5.605 ( -2.859 0.316 4.364) 5.226 5.645 ( -10.975 -1.908 1.601) 11.254 5.769 ( -10.775 -6.219 -1.797) 12.570 6.185 ( -7.003 1.319 1.355) 7.254 6.217 ( -8.233 -2.581 0.621) 8.651 6.602 ( 11.025 8.157 7.310) 15.541 6.696 ( -0.984 8.951 -1.630) 9.151 6.762 ( 10.856 -6.345 6.914) 14.349 6.858 ( -3.784 -5.155 1.842) 6.655 7.172 ( 0.027 3.676 -3.898) 5.357 7.267 ( -0.929 -4.189 -2.973) 5.220 7.640 ( -3.757 4.279 -3.396) 6.630 7.691 ( -4.040 -0.412 -8.495) 9.415 7.860 ( 6.143 3.464 -6.154) 9.360 7.995 ( 6.872 -7.717 -10.258) 14.561 8.607 ( 4.561 3.227 0.986) 5.674 8.705 ( 0.348 -5.841 6.065) 8.427 8.809 ( 0.038 7.864 -4.447) 9.035 8.954 ( -3.677 -5.915 -6.460) 9.499 11.072 ( 1.795 0.587 -5.605) 5.914 11.106 ( 1.549 -2.712 -4.584) 5.547 11.623 ( 1.497 1.655 1.256) 2.561 11.657 ( 3.620 -1.528 0.730) 3.997 13.610 ( 0.600 1.585 6.599) 6.813 13.664 ( 3.223 -3.426 7.655) 8.984 13.997 ( 8.450 4.987 -0.520) 9.826 14.098 ( 8.915 -4.786 -0.926) 10.161 15.541 ( 0.637 7.548 1.050) 7.648 15.664 ( 1.895 0.135 -2.432) 3.086 15.726 ( 1.156 1.506 4.261) 4.664 15.844 ( 2.884 -5.442 -0.260) 6.164 15.981 ( -1.728 -0.340 -0.424) 1.811 15.995 ( -1.053 -1.332 -0.430) 1.751 16.569 ( -0.168 4.068 3.963) 5.682 16.649 ( 0.837 -3.516 2.526) 4.410 18.307 ( -4.562 2.358 2.300) 5.627 18.381 ( -4.044 -4.799 1.870) 6.549 18.580 ( -6.595 2.822 0.959) 7.238 18.630 ( -6.331 -2.078 0.890) 6.723 27.751 ( 0.135 2.080 1.777) 2.739 27.791 ( 0.741 -1.302 1.109) 1.864 27.895 ( -0.434 0.349 0.896) 1.055 27.936 ( -0.120 -2.997 0.249) 3.010 29.099 ( -2.621 1.846 5.298) 6.193 29.125 ( -2.330 -0.602 5.893) 6.366 29.572 ( 8.161 5.755 3.431) 10.559 29.645 ( 8.003 -1.549 3.306) 8.797 30.016 ( -1.030 3.323 5.171) 6.232 30.076 ( -0.316 -1.806 3.261) 3.741 30.627 ( -0.534 6.673 -8.500) 10.820 30.746 ( 1.714 -5.544 -6.160) 8.463 31.295 ( -0.945 7.875 0.524) 7.949 31.470 ( -4.211 -7.709 -6.825) 11.124 32.769 ( -5.872 11.580 -0.241) 12.986 33.063 ( -3.503 -16.288 -8.146) 18.545 ======================= Grid point 184 (102/168) ======================= q-point: (-0.30 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.211 ( -14.586 17.164 6.487) 23.440 2.536 ( -13.646 -5.052 -0.346) 14.555 2.618 ( -14.671 3.863 3.909) 15.666 2.835 ( -13.070 -7.795 0.583) 15.229 3.303 ( -3.522 2.519 -5.453) 6.963 3.390 ( -1.690 -4.695 -6.784) 8.422 3.574 ( 4.432 4.087 -5.217) 7.972 3.663 ( 0.519 -4.049 -5.360) 6.738 3.965 ( -9.195 6.962 -1.212) 11.597 4.029 ( -14.173 8.971 -1.896) 16.880 4.101 ( -5.943 -0.300 -7.193) 9.336 4.235 ( -4.910 -4.255 3.804) 7.529 4.477 ( -16.406 5.761 3.804) 17.799 4.618 ( -15.738 -5.926 1.969) 16.932 4.938 ( 0.301 5.505 0.582) 5.544 5.012 ( -2.293 -1.265 -3.539) 4.403 5.472 ( -5.060 -0.048 3.503) 6.154 5.502 ( -7.878 2.647 5.110) 9.756 5.654 ( -4.647 -4.652 3.216) 7.320 5.671 ( -3.016 -6.565 10.135) 12.447 6.095 ( -6.448 1.139 2.110) 6.879 6.115 ( -5.266 -0.789 1.917) 5.660 6.648 ( -1.077 9.035 -3.108) 9.615 6.807 ( -3.076 -5.062 -1.329) 6.070 6.881 ( 10.245 9.825 4.189) 14.800 6.992 ( 6.500 0.561 5.418) 8.481 7.158 ( 2.743 -1.916 -0.241) 3.355 7.236 ( -0.261 -6.501 -0.254) 6.511 7.499 ( -4.994 3.944 -6.386) 9.015 7.590 ( 2.185 -3.105 -6.829) 7.813 7.884 ( 3.703 2.966 -1.634) 5.018 7.990 ( 4.395 -6.615 -5.603) 9.720 8.579 ( -2.711 6.887 -6.317) 9.731 8.724 ( -5.318 -6.388 -2.317) 8.629 8.830 ( 4.310 1.779 0.711) 4.716 8.889 ( 0.783 -3.957 3.124) 5.102 11.047 ( 2.146 1.441 -3.648) 4.471 11.109 ( 3.592 -4.308 -2.399) 6.101 11.646 ( 1.320 3.698 -1.042) 4.062 11.712 ( 3.146 -2.562 -0.589) 4.100 13.708 ( 4.002 4.823 4.330) 7.618 13.822 ( 7.142 -6.027 5.207) 10.698 14.149 ( 11.428 5.522 -1.011) 12.733 14.261 ( 12.779 -5.201 -1.271) 13.855 15.544 ( 0.151 7.053 -1.306) 7.174 15.645 ( 1.597 -0.355 -5.284) 5.531 15.787 ( 2.112 0.570 0.795) 2.327 15.848 ( 1.303 -3.581 -5.186) 6.436 15.968 ( -1.243 1.560 3.597) 4.113 16.017 ( 1.045 -2.593 4.312) 5.139 16.617 ( 0.391 3.558 3.777) 5.203 16.691 ( 1.476 -3.403 1.506) 4.004 18.225 ( -8.627 1.990 1.736) 9.022 18.291 ( -8.612 -4.424 0.011) 9.682 18.456 ( -11.025 2.707 1.762) 11.488 18.511 ( -10.923 -2.708 1.613) 11.368 27.773 ( 0.416 2.479 1.327) 2.842 27.807 ( 0.360 -0.498 0.084) 0.621 27.892 ( -1.068 -0.141 0.446) 1.166 27.934 ( -0.034 -3.640 -0.287) 3.652 29.106 ( -2.874 2.699 3.656) 5.377 29.151 ( -2.592 -1.637 5.015) 5.878 29.762 ( 13.578 8.192 -3.392) 16.216 29.835 ( 11.999 0.648 2.470) 12.268 30.090 ( 0.243 1.370 5.046) 5.235 30.137 ( 3.613 -2.799 8.643) 9.777 30.517 ( -1.962 7.950 -5.538) 9.885 30.679 ( 0.073 -7.795 -7.494) 10.813 31.299 ( -0.647 2.404 1.537) 2.926 31.341 ( -3.655 -0.985 -4.317) 5.741 32.630 ( -11.876 7.937 0.415) 14.290 32.863 ( -10.513 -14.544 -7.591) 19.485 ======================= Grid point 185 (103/168) ======================= q-point: (-0.20 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.073 ( -18.129 17.636 9.707) 27.091 2.252 ( -16.298 14.016 1.857) 21.576 2.475 ( -18.373 -13.154 5.175) 23.182 2.602 ( -11.806 -12.207 2.573) 17.176 3.136 ( -9.459 3.939 -4.375) 11.142 3.253 ( -7.638 -5.798 -3.462) 10.195 3.561 ( -1.921 1.972 -8.251) 8.698 3.580 ( 2.308 0.867 -4.152) 4.829 3.760 ( -7.693 8.034 -4.185) 11.885 3.855 ( -12.120 7.456 6.421) 15.612 3.996 ( -2.668 7.997 -1.146) 8.508 4.187 ( -5.742 -3.255 2.406) 7.025 4.279 ( -11.118 3.670 4.023) 12.380 4.451 ( -10.472 -10.375 5.002) 15.567 4.932 ( -0.355 1.888 -3.976) 4.416 4.960 ( 0.528 -0.826 -0.824) 1.280 5.442 ( -3.217 1.612 3.086) 4.741 5.489 ( -4.195 -0.957 7.501) 8.647 5.651 ( -3.765 0.379 6.531) 7.548 5.746 ( -2.936 -7.242 10.310) 12.938 6.040 ( -4.561 3.401 2.814) 6.348 6.096 ( -1.442 -1.087 3.070) 3.562 6.598 ( 1.582 7.066 -4.339) 8.441 6.739 ( -1.060 -6.146 -3.226) 7.021 6.965 ( 0.708 13.740 -1.361) 13.826 7.093 ( 0.851 4.180 2.196) 4.797 7.191 ( -0.161 -4.452 -1.854) 4.825 7.234 ( -0.624 -8.827 0.211) 8.851 7.398 ( 0.005 7.111 -3.094) 7.755 7.600 ( 7.054 -9.586 -5.562) 13.137 7.940 ( 2.577 2.626 1.796) 4.094 8.022 ( 3.821 -4.550 -0.023) 5.942 8.452 ( -3.852 6.653 -5.346) 9.363 8.579 ( -5.590 -4.719 -4.581) 8.631 8.893 ( 1.025 0.107 1.339) 1.689 8.942 ( -0.849 -4.892 3.765) 6.231 11.062 ( 3.012 3.042 -0.733) 4.343 11.157 ( 3.663 -5.832 0.627) 6.916 11.642 ( 1.097 5.341 -2.884) 6.168 11.738 ( 2.307 -3.837 -2.389) 5.074 13.828 ( 6.108 7.448 2.433) 9.935 13.988 ( 7.909 -7.877 2.467) 11.432 14.304 ( 10.170 6.684 -2.292) 12.383 14.437 ( 11.849 -6.020 -2.887) 13.601 15.524 ( 0.932 6.372 -3.395) 7.279 15.602 ( 1.710 0.409 -6.543) 6.775 15.767 ( -0.316 -1.819 -6.759) 7.006 15.798 ( -0.649 -3.777 -3.086) 4.920 16.053 ( 4.487 3.178 6.449) 8.475 16.110 ( 4.514 -2.071 3.815) 6.262 16.657 ( -0.679 2.658 3.080) 4.125 16.720 ( 0.272 -3.184 0.590) 3.249 18.091 ( -10.195 0.901 1.270) 10.313 18.129 ( -10.905 -2.850 -0.692) 11.292 18.287 ( -13.161 1.916 2.372) 13.510 18.329 ( -13.972 -2.237 1.326) 14.212 27.790 ( 0.498 2.050 -0.068) 2.110 27.802 ( -0.324 0.290 -0.803) 0.913 27.872 ( -1.339 0.471 -0.451) 1.489 27.930 ( 0.103 -4.432 -0.472) 4.458 29.095 ( -2.976 3.339 2.327) 5.041 29.155 ( -3.230 -2.471 3.601) 5.432 29.826 ( 7.103 8.725 -14.101) 18.039 29.940 ( 4.172 -2.488 -13.685) 14.522 30.206 ( 8.613 10.594 7.045) 15.364 30.412 ( 11.201 -8.260 11.322) 17.941 30.514 ( 2.923 5.358 6.909) 9.219 30.654 ( 5.243 -7.396 4.164) 9.977 31.240 ( -2.597 4.160 -3.653) 6.115 31.308 ( -1.341 -2.399 0.788) 2.859 32.414 ( -16.245 5.123 0.227) 17.035 32.579 ( -15.979 -10.857 -4.177) 19.765 ======================= Grid point 186 (104/168) ======================= q-point: (-0.10 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.828 ( -17.683 16.639 5.319) 24.856 2.115 ( -15.119 -9.664 -1.671) 18.021 2.263 ( -7.185 16.123 15.406) 23.429 2.600 ( -3.262 -15.369 11.359) 19.387 2.974 ( -6.449 5.156 1.205) 8.344 3.108 ( -7.277 -7.102 -0.042) 10.168 3.459 ( -0.467 4.217 -6.325) 7.616 3.556 ( 1.977 -3.628 -4.608) 6.190 3.662 ( -7.473 14.656 3.012) 16.725 3.742 ( -4.051 12.450 2.664) 13.361 4.017 ( 4.052 -1.346 0.568) 4.307 4.122 ( -6.109 -0.960 5.411) 8.218 4.264 ( -0.110 1.991 5.774) 6.109 4.401 ( -4.024 -10.038 5.318) 12.051 4.885 ( -0.051 2.366 -2.857) 3.710 4.965 ( 1.427 -3.727 -1.670) 4.326 5.429 ( -5.857 4.586 6.199) 9.683 5.515 ( -4.159 -2.684 7.129) 8.679 5.678 ( -1.753 2.797 6.138) 6.969 5.802 ( -2.962 -7.893 8.041) 11.650 6.007 ( -3.490 4.803 2.867) 6.593 6.110 ( -1.691 -3.407 2.424) 4.510 6.624 ( 5.094 5.032 -0.998) 7.230 6.724 ( 1.560 -4.535 -1.870) 5.147 6.919 ( 0.030 11.477 -5.708) 12.818 7.080 ( -3.113 -1.069 -6.928) 7.670 7.130 ( 0.220 1.117 1.919) 2.232 7.231 ( -2.864 -8.317 4.347) 9.812 7.415 ( 4.607 9.333 -2.041) 10.606 7.633 ( 6.450 -10.678 -8.269) 14.967 7.986 ( 0.554 4.009 1.767) 4.416 8.075 ( 0.836 -4.289 1.497) 4.619 8.362 ( -1.831 5.813 -2.503) 6.589 8.480 ( -2.892 -4.783 -0.416) 5.605 8.882 ( -1.807 0.906 -1.819) 2.719 8.942 ( -2.305 -5.236 1.184) 5.842 11.118 ( 2.938 4.123 1.767) 5.362 11.229 ( 2.714 -6.401 2.867) 7.520 11.620 ( 1.216 6.137 -3.819) 7.330 11.734 ( 1.748 -4.748 -3.523) 6.165 13.932 ( 3.638 8.227 1.247) 9.082 14.102 ( 4.121 -8.028 0.205) 9.026 14.396 ( 5.635 7.028 -3.777) 9.768 14.539 ( 6.686 -6.563 -5.148) 10.690 15.500 ( 2.483 5.279 -5.585) 8.076 15.551 ( 0.657 2.475 -5.549) 6.112 15.673 ( -0.521 -1.090 -7.583) 7.678 15.748 ( -0.728 -6.005 -3.187) 6.837 16.220 ( 6.924 1.133 4.447) 8.307 16.239 ( 7.436 -0.488 3.082) 8.064 16.656 ( -3.224 1.426 1.769) 3.944 16.701 ( -2.959 -2.738 -0.663) 4.085 17.940 ( -11.452 0.892 1.768) 11.622 17.968 ( -9.950 -1.559 2.534) 10.385 18.128 ( -9.004 1.053 1.598) 9.205 18.151 ( -7.459 -1.082 -0.206) 7.540 27.770 ( -0.779 1.382 -2.201) 2.713 27.788 ( -0.588 -0.309 -1.503) 1.643 27.851 ( -0.442 2.062 -0.415) 2.149 27.923 ( -0.047 -4.339 -1.073) 4.470 29.069 ( -2.980 3.559 1.357) 4.836 29.135 ( -3.562 -2.851 2.533) 5.218 29.685 ( 0.069 7.299 -17.829) 19.265 29.779 ( -1.386 -2.136 -14.732) 14.951 30.364 ( 6.152 9.917 0.846) 11.701 30.572 ( 6.239 -10.024 -1.235) 11.872 30.771 ( 7.690 10.617 15.753) 20.494 30.978 ( 5.763 -7.913 14.692) 17.654 31.233 ( 10.288 0.588 2.000) 10.497 31.289 ( 1.115 -4.469 0.216) 4.611 32.140 ( -16.297 8.126 -1.091) 18.243 32.323 ( -13.384 -9.313 1.002) 16.336 ======================= Grid point 217 (105/168) ======================= q-point: ( 0.00 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.235 ( 5.963 0.000 6.676) 8.952 1.443 ( -5.070 0.000 1.516) 5.292 1.817 ( -13.706 0.000 9.849) 16.878 2.536 ( 6.593 0.000 -14.859) 16.256 2.886 ( -6.730 0.000 18.956) 20.116 3.127 ( -0.852 0.000 3.574) 3.674 3.195 ( -6.128 0.000 14.017) 15.298 3.441 ( 6.129 0.000 -6.894) 9.225 3.548 ( 7.389 0.000 10.436) 12.787 3.906 ( 6.607 0.000 5.769) 8.772 3.985 ( -7.779 0.000 -9.538) 12.308 4.281 ( 6.584 0.000 -1.688) 6.797 4.644 ( -0.253 0.000 2.846) 2.857 4.796 ( 13.336 0.000 -1.167) 13.387 4.955 ( 0.173 0.000 2.847) 2.852 4.994 ( 4.035 0.000 3.084) 5.079 5.388 ( -0.390 0.000 5.113) 5.127 5.675 ( -5.393 0.000 7.067) 8.890 5.730 ( -6.389 0.000 -5.833) 8.651 5.997 ( 7.303 0.000 0.556) 7.324 6.072 ( 9.702 0.000 5.196) 11.006 6.081 ( -3.547 0.000 1.283) 3.772 6.331 ( -5.357 0.000 3.928) 6.642 6.620 ( 1.128 0.000 -4.327) 4.471 6.910 ( 1.943 0.000 -0.734) 2.077 6.991 ( -7.185 0.000 -4.333) 8.391 7.084 ( -11.193 0.000 -1.115) 11.248 7.090 ( -2.243 0.000 -5.382) 5.831 7.346 ( -7.073 0.000 -1.020) 7.147 7.381 ( 14.925 0.000 -5.010) 15.744 8.036 ( -3.508 0.000 3.951) 5.283 8.165 ( 4.565 0.000 0.090) 4.566 8.497 ( -0.476 0.000 8.077) 8.091 8.562 ( 14.867 0.000 1.324) 14.926 8.766 ( -13.036 0.000 1.499) 13.122 9.165 ( -4.945 0.000 -14.099) 14.941 11.004 ( 1.928 0.000 -1.270) 2.308 11.105 ( 1.424 0.000 -5.097) 5.292 11.781 ( -0.313 0.000 5.927) 5.935 11.914 ( 0.672 0.000 -0.734) 0.995 13.728 ( -2.060 0.000 3.845) 4.362 13.921 ( 1.354 0.000 -5.683) 5.842 14.491 ( -4.703 0.000 1.743) 5.015 14.624 ( 3.795 0.000 -5.495) 6.678 15.165 ( -4.346 0.000 -0.616) 4.389 15.219 ( 3.457 0.000 -2.910) 4.519 15.715 ( 1.750 0.000 -3.824) 4.205 15.746 ( -0.432 0.000 -4.160) 4.183 16.337 ( 2.147 0.000 4.314) 4.819 16.468 ( -6.369 0.000 -3.241) 7.146 16.686 ( -3.200 0.000 -0.692) 3.274 16.773 ( 8.188 0.000 -3.584) 8.938 17.802 ( -3.494 0.000 4.825) 5.957 17.935 ( 1.132 0.000 -1.770) 2.101 18.128 ( -7.695 0.000 4.267) 8.799 18.213 ( 6.423 0.000 -0.337) 6.431 27.660 ( 0.760 0.000 0.677) 1.017 27.676 ( 0.559 0.000 -0.595) 0.816 27.814 ( 0.017 0.000 -0.426) 0.426 27.915 ( -2.188 0.000 -5.132) 5.579 28.873 ( 1.799 0.000 0.407) 1.844 28.890 ( -1.454 0.000 -0.781) 1.650 29.290 ( -3.909 0.000 6.084) 7.231 29.563 ( 2.766 0.000 -8.247) 8.698 30.162 ( 1.559 0.000 7.373) 7.536 30.369 ( -3.044 0.000 -2.175) 3.741 31.088 ( -3.581 0.000 3.540) 5.035 31.225 ( 22.335 0.000 -0.991) 22.357 31.243 ( -20.833 0.000 1.357) 20.877 31.257 ( -7.471 0.000 -2.516) 7.883 32.443 ( -19.114 0.000 11.088) 22.097 32.792 ( 31.134 0.000 -6.698) 31.846 ======================= Grid point 218 (106/168) ======================= q-point: ( 0.10 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.538 ( 22.442 0.000 -4.266) 22.844 1.652 ( 34.428 0.000 3.383) 34.594 1.877 ( -4.740 0.000 21.838) 22.346 2.505 ( 11.851 0.000 -15.387) 19.422 2.982 ( -10.880 0.000 13.636) 17.445 3.166 ( 4.902 0.000 -3.223) 5.867 3.244 ( 6.085 0.000 6.467) 8.880 3.515 ( 3.071 0.000 -0.663) 3.142 3.759 ( -0.840 0.000 -10.114) 10.149 3.829 ( 8.920 0.000 9.977) 13.384 4.079 ( 7.143 0.000 5.563) 9.053 4.326 ( 6.265 0.000 -9.957) 11.765 4.584 ( -5.761 0.000 -4.305) 7.192 4.855 ( 2.446 0.000 -7.844) 8.216 5.055 ( 4.764 0.000 2.258) 5.272 5.084 ( 5.444 0.000 -0.338) 5.455 5.465 ( 0.021 0.000 9.660) 9.660 5.466 ( -6.716 0.000 -8.789) 11.061 5.793 ( -1.878 0.000 10.012) 10.186 6.038 ( -3.469 0.000 0.138) 3.471 6.061 ( 2.882 0.000 -5.433) 6.150 6.194 ( 3.111 0.000 -4.425) 5.409 6.363 ( 2.104 0.000 13.149) 13.316 6.557 ( -0.276 0.000 -7.744) 7.749 6.848 ( -2.906 0.000 1.635) 3.335 6.851 ( -5.000 0.000 -1.747) 5.296 7.009 ( -11.655 0.000 4.363) 12.445 7.049 ( 1.834 0.000 -0.160) 1.841 7.312 ( 6.817 0.000 0.034) 6.817 7.519 ( 8.710 0.000 -4.353) 9.738 8.028 ( -2.583 0.000 3.488) 4.340 8.237 ( 5.636 0.000 -4.653) 7.308 8.420 ( -9.604 0.000 -0.424) 9.614 8.750 ( 6.480 0.000 -5.024) 8.199 8.805 ( 2.708 0.000 16.178) 16.403 9.045 ( 8.325 0.000 -7.192) 11.001 11.018 ( 0.771 0.000 0.099) 0.778 11.064 ( 0.886 0.000 -5.343) 5.416 11.828 ( -1.290 0.000 4.269) 4.459 11.904 ( 0.291 0.000 -2.377) 2.394 13.715 ( -5.583 0.000 5.309) 7.704 13.844 ( -3.543 0.000 -5.626) 6.649 14.391 ( -11.047 0.000 2.891) 11.419 14.576 ( -3.272 0.000 -3.464) 4.765 15.115 ( -1.546 0.000 1.396) 2.083 15.244 ( 2.955 0.000 -2.450) 3.839 15.699 ( -0.107 0.000 -2.730) 2.732 15.721 ( 2.564 0.000 -1.265) 2.859 16.326 ( -7.730 0.000 -0.536) 7.748 16.419 ( 1.274 0.000 3.694) 3.907 16.608 ( -5.131 0.000 0.151) 5.133 16.771 ( -2.163 0.000 -3.580) 4.183 17.905 ( 8.639 0.000 2.854) 9.098 17.985 ( 7.357 0.000 -1.479) 7.504 18.115 ( 0.372 0.000 2.956) 2.980 18.350 ( 11.086 0.000 -0.655) 11.105 27.681 ( 1.488 0.000 -0.107) 1.492 27.685 ( 1.387 0.000 -0.924) 1.667 27.841 ( 1.880 0.000 2.474) 3.108 27.842 ( -0.780 0.000 -3.006) 3.106 28.861 ( -0.971 0.000 -0.735) 1.218 28.913 ( 2.765 0.000 0.291) 2.781 29.302 ( -4.148 0.000 6.903) 8.053 29.517 ( 2.504 0.000 -6.836) 7.280 30.248 ( -2.035 0.000 8.098) 8.350 30.272 ( -4.564 0.000 -4.098) 6.134 30.752 ( -25.670 0.000 4.300) 26.028 31.100 ( -7.706 0.000 -3.583) 8.499 31.329 ( 9.162 0.000 3.029) 9.650 31.540 ( 13.632 0.000 2.417) 13.844 32.291 ( -10.173 0.000 6.432) 12.035 33.134 ( 26.694 0.000 -13.077) 29.725 ======================= Grid point 219 (107/168) ======================= q-point: ( 0.20 0.00 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.977 ( 30.863 0.000 2.161) 30.938 2.128 ( 5.095 0.000 20.645) 21.265 2.176 ( 27.434 0.000 -6.941) 28.299 2.627 ( 24.730 0.000 -6.755) 25.636 2.870 ( -12.407 0.000 3.147) 12.800 3.084 ( -5.036 0.000 -11.884) 12.908 3.517 ( 3.020 0.000 0.474) 3.057 3.519 ( 9.681 0.000 14.172) 17.163 3.799 ( 8.173 0.000 -3.177) 8.769 3.993 ( 0.489 0.000 6.225) 6.244 4.249 ( 3.726 0.000 -15.555) 15.995 4.266 ( 12.827 0.000 -0.890) 12.858 4.439 ( 0.323 0.000 -8.636) 8.643 4.771 ( -0.823 0.000 -7.083) 7.131 5.056 ( 0.416 0.000 -8.047) 8.058 5.156 ( 8.585 0.000 -6.696) 10.888 5.303 ( -6.290 0.000 -2.225) 6.672 5.588 ( -1.924 0.000 12.285) 12.434 5.812 ( -4.103 0.000 0.104) 4.104 5.978 ( -2.309 0.000 -1.692) 2.863 6.017 ( 1.647 0.000 -3.221) 3.618 6.195 ( 4.357 0.000 -6.323) 7.679 6.469 ( 1.181 0.000 -6.136) 6.249 6.602 ( 10.567 0.000 8.712) 13.695 6.821 ( -3.131 0.000 8.034) 8.623 6.876 ( -9.921 0.000 6.291) 11.748 6.898 ( 4.224 0.000 2.051) 4.696 7.095 ( 1.628 0.000 2.511) 2.993 7.461 ( 6.289 0.000 3.519) 7.206 7.559 ( 3.595 0.000 -4.611) 5.847 8.031 ( -2.065 0.000 2.840) 3.511 8.159 ( -5.253 0.000 -4.136) 6.686 8.363 ( 2.067 0.000 -3.992) 4.495 8.675 ( 0.799 0.000 -12.318) 12.344 9.087 ( 4.387 0.000 19.976) 20.452 9.181 ( 9.647 0.000 -0.765) 9.677 11.014 ( 0.728 0.000 -5.359) 5.408 11.040 ( 1.039 0.000 1.961) 2.219 11.830 ( -3.350 0.000 2.150) 3.981 11.865 ( -0.247 0.000 -4.711) 4.717 13.691 ( -6.185 0.000 6.931) 9.290 13.693 ( -6.963 0.000 -4.678) 8.388 14.232 ( -14.167 0.000 4.687) 14.922 14.452 ( -8.011 0.000 -2.122) 8.287 15.161 ( 3.253 0.000 3.359) 4.676 15.247 ( 0.222 0.000 -1.300) 1.318 15.693 ( 1.730 0.000 -0.065) 1.731 15.759 ( 3.221 0.000 -0.199) 3.227 16.229 ( -5.426 0.000 1.598) 5.657 16.383 ( -5.500 0.000 -3.686) 6.621 16.610 ( 0.866 0.000 5.520) 5.588 16.666 ( -6.611 0.000 -1.421) 6.762 18.083 ( 10.776 0.000 0.687) 10.798 18.118 ( 9.878 0.000 0.696) 9.903 18.194 ( 5.844 0.000 1.786) 6.111 18.521 ( 11.321 0.000 -1.016) 11.367 27.688 ( 1.076 0.000 -1.938) 2.217 27.707 ( 2.261 0.000 -0.236) 2.273 27.835 ( 1.566 0.000 0.738) 1.731 27.917 ( 2.409 0.000 4.479) 5.086 28.848 ( 0.038 0.000 -0.059) 0.070 28.962 ( 3.259 0.000 -0.139) 3.262 29.313 ( -5.136 0.000 7.404) 9.011 29.490 ( 2.943 0.000 -5.302) 6.064 30.140 ( -5.457 0.000 -5.178) 7.523 30.270 ( -10.531 0.000 11.987) 15.956 30.487 ( -11.363 0.000 0.631) 11.380 30.954 ( -5.939 0.000 -2.359) 6.390 31.487 ( 7.874 0.000 0.526) 7.892 31.583 ( -8.276 0.000 -1.495) 8.410 32.382 ( 10.752 0.000 7.528) 13.126 33.336 ( 20.917 0.000 -15.845) 26.241 ======================= Grid point 220 (108/168) ======================= q-point: ( 0.30 0.00 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.348 ( 17.361 0.000 -15.532) 23.294 2.403 ( 4.577 0.000 18.727) 19.279 2.487 ( 27.374 0.000 -3.382) 27.582 2.678 ( -12.069 0.000 -0.484) 12.079 2.876 ( -8.120 0.000 -2.297) 8.439 3.083 ( 25.098 0.000 5.542) 25.703 3.598 ( 6.794 0.000 0.047) 6.795 3.791 ( 4.193 0.000 12.734) 13.406 3.799 ( 2.809 0.000 -11.679) 12.012 4.017 ( -2.092 0.000 0.785) 2.235 4.129 ( -4.146 0.000 -2.741) 4.970 4.376 ( 4.617 0.000 -6.604) 8.058 4.494 ( 21.064 0.000 -12.274) 24.379 4.735 ( 4.465 0.000 -3.630) 5.755 4.967 ( 4.104 0.000 -8.766) 9.680 5.161 ( 5.127 0.000 -10.646) 11.816 5.257 ( -0.041 0.000 3.254) 3.255 5.665 ( -4.090 0.000 9.923) 10.733 5.719 ( -0.959 0.000 -5.260) 5.347 5.952 ( 0.449 0.000 -0.164) 0.478 6.050 ( 7.908 0.000 -8.073) 11.301 6.168 ( -1.248 0.000 -0.977) 1.585 6.471 ( 4.021 0.000 -1.402) 4.258 6.843 ( 7.432 0.000 5.567) 9.286 6.862 ( -3.071 0.000 8.626) 9.157 6.902 ( -3.016 0.000 11.741) 12.122 6.981 ( 6.702 0.000 -1.860) 6.955 7.147 ( 1.743 0.000 1.935) 2.604 7.537 ( -0.286 0.000 -3.686) 3.698 7.548 ( -0.168 0.000 3.286) 3.291 8.029 ( -0.742 0.000 1.323) 1.517 8.072 ( -3.720 0.000 1.695) 4.088 8.309 ( -0.143 0.000 -8.495) 8.496 8.539 ( 1.112 0.000 -13.618) 13.663 9.262 ( 2.281 0.000 -2.014) 3.043 9.311 ( -3.297 0.000 14.816) 15.179 10.972 ( 1.410 0.000 -4.588) 4.799 11.104 ( 2.720 0.000 3.957) 4.802 11.777 ( -4.922 0.000 0.819) 4.990 11.786 ( -1.143 0.000 -7.221) 7.311 13.569 ( -3.352 0.000 -1.254) 3.579 13.683 ( -5.396 0.000 7.748) 9.442 14.077 ( -13.378 0.000 6.443) 14.848 14.300 ( -7.810 0.000 -1.865) 8.030 15.231 ( -1.017 0.000 0.269) 1.052 15.254 ( 3.052 0.000 2.852) 4.177 15.754 ( 3.875 0.000 2.687) 4.715 15.809 ( 3.252 0.000 -0.447) 3.282 16.183 ( -3.039 0.000 1.241) 3.282 16.234 ( -4.980 0.000 -6.502) 8.189 16.556 ( -7.184 0.000 1.982) 7.452 16.689 ( 0.692 0.000 4.845) 4.894 18.245 ( 8.988 0.000 0.412) 8.997 18.288 ( 7.946 0.000 3.495) 8.681 18.322 ( 7.762 0.000 1.668) 7.939 18.661 ( 7.827 0.000 -1.328) 7.939 27.686 ( 1.255 0.000 -1.255) 1.775 27.742 ( 2.168 0.000 0.020) 2.168 27.893 ( 2.862 0.000 2.719) 3.947 28.005 ( 1.544 0.000 4.898) 5.136 28.866 ( 1.625 0.000 1.096) 1.960 29.010 ( 3.156 0.000 -0.300) 3.171 29.308 ( -6.410 0.000 7.493) 9.861 29.489 ( 3.837 0.000 -4.057) 5.584 29.996 ( -4.717 0.000 -5.408) 7.176 30.195 ( -15.273 0.000 12.366) 19.651 30.401 ( -1.626 0.000 -0.602) 1.734 30.882 ( -2.148 0.000 1.366) 2.546 31.370 ( -9.240 0.000 -7.991) 12.217 31.572 ( 4.318 0.000 -2.777) 5.134 32.667 ( 9.280 0.000 10.799) 14.239 33.443 ( 17.092 0.000 -16.866) 24.012 ======================= Grid point 221 (109/168) ======================= q-point: ( 0.40 0.00 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.447 ( 14.411 0.000 -13.127) 19.494 2.481 ( -12.287 0.000 3.353) 12.737 2.499 ( -12.029 0.000 6.065) 13.472 2.762 ( 9.787 0.000 -0.760) 9.816 2.902 ( 11.697 0.000 4.015) 12.367 3.423 ( 8.216 0.000 6.543) 10.503 3.705 ( 6.466 0.000 -13.369) 14.851 3.730 ( 4.845 0.000 5.343) 7.213 3.897 ( -2.735 0.000 -1.587) 3.162 3.961 ( -1.556 0.000 -0.700) 1.706 4.097 ( -1.288 0.000 4.406) 4.590 4.322 ( 0.671 0.000 -6.388) 6.423 4.708 ( 21.569 0.000 -12.389) 24.874 4.753 ( 2.064 0.000 -2.028) 2.893 5.019 ( 6.493 0.000 -2.212) 6.860 5.154 ( 5.022 0.000 -3.983) 6.410 5.313 ( 2.785 0.000 1.769) 3.299 5.699 ( -4.356 0.000 7.575) 8.739 5.713 ( 6.570 0.000 -2.969) 7.210 5.964 ( 1.359 0.000 -16.656) 16.711 5.985 ( 2.712 0.000 1.615) 3.156 6.206 ( -1.072 0.000 6.810) 6.894 6.551 ( 4.804 0.000 2.886) 5.605 6.884 ( -4.884 0.000 1.214) 5.033 6.941 ( -2.697 0.000 9.240) 9.625 6.970 ( -2.780 0.000 10.708) 11.063 7.089 ( 5.004 0.000 0.445) 5.024 7.205 ( 5.773 0.000 -2.530) 6.303 7.493 ( 1.894 0.000 -2.689) 3.289 7.552 ( -3.225 0.000 3.116) 4.485 8.040 ( -5.618 0.000 1.116) 5.728 8.047 ( 4.430 0.000 -3.295) 5.521 8.193 ( -1.476 0.000 -6.321) 6.491 8.412 ( 1.771 0.000 -11.849) 11.981 9.218 ( -2.719 0.000 -3.823) 4.691 9.301 ( -11.079 0.000 4.802) 12.075 10.964 ( 2.770 0.000 -2.106) 3.479 11.198 ( 3.021 0.000 3.125) 4.347 11.680 ( -0.676 0.000 -7.434) 7.464 11.714 ( -4.164 0.000 0.851) 4.250 13.574 ( 2.770 0.000 2.453) 3.700 13.704 ( -2.451 0.000 6.821) 7.249 13.965 ( -10.979 0.000 7.002) 13.022 14.184 ( -3.449 0.000 -2.391) 4.197 15.232 ( -0.302 0.000 1.970) 1.993 15.308 ( 0.599 0.000 1.559) 1.670 15.838 ( 1.715 0.000 -1.706) 2.419 15.852 ( 3.991 0.000 2.446) 4.681 16.100 ( -2.633 0.000 -5.928) 6.487 16.150 ( -1.642 0.000 -0.802) 1.828 16.504 ( -5.355 0.000 6.466) 8.395 16.732 ( -0.153 0.000 1.982) 1.988 18.365 ( 4.942 0.000 1.380) 5.131 18.419 ( 2.747 0.000 4.019) 4.868 18.469 ( 8.192 0.000 1.999) 8.432 18.723 ( 2.399 0.000 -2.022) 3.138 27.701 ( 1.583 0.000 0.005) 1.583 27.768 ( 0.906 0.000 -0.134) 0.916 27.975 ( 3.083 0.000 3.181) 4.430 28.066 ( -0.262 0.000 3.733) 3.742 28.925 ( 3.386 0.000 2.197) 4.036 29.047 ( 1.520 0.000 -0.059) 1.521 29.285 ( -7.114 0.000 7.207) 10.126 29.513 ( 5.049 0.000 -4.216) 6.578 29.894 ( -1.249 0.000 -3.147) 3.386 30.105 ( -10.424 0.000 6.955) 12.531 30.384 ( -3.270 0.000 4.180) 5.307 30.918 ( 1.511 0.000 4.770) 5.003 31.159 ( -3.243 0.000 -10.628) 11.112 31.554 ( -0.153 0.000 -5.955) 5.957 32.871 ( -0.132 0.000 11.687) 11.688 33.497 ( 14.854 0.000 -17.039) 22.604 ======================= Grid point 222 (110/168) ======================= q-point: (-0.50 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.267 ( -22.591 0.000 5.106) 23.161 2.283 ( -19.973 0.000 11.918) 23.259 2.604 ( 18.479 0.000 -10.054) 21.038 2.905 ( 10.347 0.000 -4.297) 11.204 3.095 ( 7.147 0.000 4.351) 8.367 3.488 ( -7.238 0.000 4.633) 8.593 3.713 ( 8.010 0.000 -8.574) 11.733 3.724 ( -2.572 0.000 -16.243) 16.445 3.858 ( 2.365 0.000 8.058) 8.398 3.921 ( -7.592 0.000 3.420) 8.327 4.157 ( 0.237 0.000 6.411) 6.416 4.286 ( 0.534 0.000 -2.805) 2.856 4.702 ( -6.465 0.000 -5.331) 8.380 4.839 ( 12.165 0.000 -11.932) 17.040 5.037 ( -4.147 0.000 3.156) 5.212 5.184 ( 1.816 0.000 -2.783) 3.324 5.374 ( 1.114 0.000 3.652) 3.819 5.663 ( -5.449 0.000 -2.393) 5.952 5.825 ( -0.725 0.000 -5.210) 5.260 5.834 ( 8.573 0.000 -0.124) 8.573 6.091 ( 7.918 0.000 4.600) 9.157 6.198 ( -5.887 0.000 -0.132) 5.888 6.661 ( 1.099 0.000 6.265) 6.360 6.794 ( -6.036 0.000 -0.244) 6.040 6.949 ( -6.290 0.000 7.459) 9.757 7.096 ( 2.434 0.000 9.081) 9.401 7.114 ( -6.543 0.000 4.151) 7.749 7.219 ( 3.505 0.000 -3.482) 4.941 7.527 ( -3.871 0.000 1.953) 4.336 7.593 ( 12.119 0.000 -2.092) 12.298 7.897 ( -5.569 0.000 -5.854) 8.080 8.082 ( 11.876 0.000 -14.105) 18.439 8.147 ( -3.787 0.000 2.703) 4.652 8.350 ( 3.684 0.000 -5.137) 6.321 9.132 ( -2.570 0.000 -1.668) 3.064 9.153 ( -8.988 0.000 0.424) 8.998 11.015 ( 4.204 0.000 1.390) 4.428 11.223 ( 0.154 0.000 -4.061) 4.064 11.639 ( 2.889 0.000 -1.734) 3.369 11.661 ( -3.617 0.000 -0.064) 3.617 13.687 ( 6.581 0.000 3.341) 7.380 13.747 ( 0.051 0.000 1.606) 1.607 13.907 ( -6.161 0.000 8.362) 10.387 14.148 ( 3.261 0.000 -3.406) 4.715 15.264 ( 0.263 0.000 3.216) 3.227 15.313 ( -1.513 0.000 0.779) 1.702 15.822 ( -0.310 0.000 -2.539) 2.557 15.908 ( 3.051 0.000 -2.899) 4.209 16.036 ( -0.679 0.000 -0.073) 0.683 16.117 ( -0.847 0.000 -1.552) 1.768 16.532 ( -2.608 0.000 8.724) 9.105 16.737 ( 0.301 0.000 -0.913) 0.961 18.429 ( 0.287 0.000 2.711) 2.726 18.455 ( -2.944 0.000 2.508) 3.868 18.614 ( 7.283 0.000 1.783) 7.498 18.689 ( -2.807 0.000 -3.178) 4.241 27.731 ( 1.410 0.000 0.728) 1.587 27.764 ( -0.702 0.000 -0.681) 0.978 28.055 ( 2.650 0.000 2.679) 3.768 28.079 ( -2.045 0.000 1.750) 2.691 29.014 ( 4.394 0.000 2.100) 4.870 29.044 ( -1.755 0.000 -0.376) 1.795 29.256 ( -6.752 0.000 7.099) 9.798 29.546 ( 6.947 0.000 -6.255) 9.347 29.900 ( 3.017 0.000 1.627) 3.428 30.017 ( -6.422 0.000 0.382) 6.433 30.405 ( -4.878 0.000 11.459) 12.454 30.938 ( 1.222 0.000 -9.031) 9.114 31.113 ( 3.870 0.000 4.671) 6.066 31.437 ( -4.064 0.000 -8.249) 9.195 32.933 ( -8.449 0.000 11.691) 14.425 33.519 ( 12.901 0.000 -17.313) 21.592 ======================= Grid point 223 (111/168) ======================= q-point: (-0.40 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.962 ( -25.589 0.000 8.848) 27.076 2.130 ( -23.541 0.000 20.488) 31.208 2.786 ( 16.401 0.000 -6.989) 17.828 2.951 ( 8.727 0.000 -12.388) 15.153 3.291 ( 4.684 0.000 14.085) 14.844 3.323 ( -18.595 0.000 2.189) 18.723 3.486 ( -2.367 0.000 -17.268) 17.430 3.645 ( -7.484 0.000 -6.274) 9.765 3.826 ( -10.883 0.000 6.128) 12.490 4.002 ( 5.571 0.000 5.362) 7.732 4.197 ( -11.690 0.000 -3.114) 12.097 4.244 ( 3.521 0.000 3.619) 5.049 4.441 ( -12.510 0.000 -6.422) 14.062 4.800 ( -2.240 0.000 -8.408) 8.701 5.004 ( -5.224 0.000 5.044) 7.261 5.109 ( -6.836 0.000 -3.743) 7.793 5.440 ( -0.222 0.000 6.925) 6.929 5.533 ( -4.180 0.000 -5.110) 6.602 5.749 ( -6.477 0.000 -2.633) 6.992 5.915 ( 4.503 0.000 -2.733) 5.268 6.057 ( -6.121 0.000 -4.396) 7.536 6.339 ( 12.733 0.000 6.093) 14.116 6.683 ( -8.638 0.000 7.308) 11.314 6.688 ( -7.037 0.000 -1.443) 7.184 6.930 ( -5.078 0.000 5.255) 7.308 7.030 ( -6.692 0.000 3.000) 7.333 7.236 ( 6.126 0.000 2.970) 6.808 7.244 ( 0.738 0.000 -0.487) 0.885 7.449 ( -4.692 0.000 -2.858) 5.494 7.755 ( 10.497 0.000 -1.439) 10.595 7.845 ( 2.180 0.000 2.577) 3.375 8.070 ( 9.993 0.000 -17.109) 19.814 8.120 ( -4.314 0.000 4.410) 6.169 8.394 ( 7.215 0.000 -6.728) 9.866 9.077 ( -3.417 0.000 3.131) 4.634 9.170 ( 5.949 0.000 6.709) 8.967 11.115 ( 4.330 0.000 3.542) 5.594 11.138 ( -0.482 0.000 -8.432) 8.446 11.598 ( -3.210 0.000 -1.175) 3.418 11.705 ( 4.382 0.000 1.398) 4.599 13.705 ( -2.905 0.000 -3.276) 4.378 13.824 ( 7.317 0.000 0.557) 7.338 13.994 ( 4.120 0.000 7.832) 8.849 14.210 ( 10.058 0.000 -4.454) 11.000 15.287 ( -2.253 0.000 0.377) 2.284 15.304 ( 0.058 0.000 2.895) 2.896 15.795 ( -0.247 0.000 -0.152) 0.290 15.900 ( 2.409 0.000 -4.866) 5.430 16.057 ( 0.217 0.000 3.166) 3.173 16.084 ( -0.936 0.000 -2.104) 2.303 16.606 ( -0.730 0.000 8.249) 8.281 16.728 ( 1.690 0.000 -3.097) 3.528 18.392 ( -7.361 0.000 1.003) 7.429 18.433 ( -4.430 0.000 3.443) 5.611 18.572 ( -6.510 0.000 -3.914) 7.596 18.723 ( 4.949 0.000 -0.400) 4.965 27.734 ( -1.746 0.000 -1.105) 2.066 27.755 ( 0.529 0.000 0.549) 0.763 28.046 ( -3.192 0.000 -0.072) 3.192 28.113 ( 1.701 0.000 1.370) 2.184 28.989 ( -3.736 0.000 -1.146) 3.907 29.079 ( 1.795 0.000 -0.681) 1.920 29.254 ( -3.950 0.000 8.010) 8.931 29.589 ( 8.613 0.000 -7.770) 11.600 29.917 ( -4.087 0.000 -2.952) 5.042 30.008 ( 5.290 0.000 5.098) 7.347 30.513 ( -2.390 0.000 18.446) 18.600 30.843 ( 3.969 0.000 -12.890) 13.488 31.256 ( -6.012 0.000 -8.881) 10.725 31.263 ( 3.629 0.000 8.422) 9.171 32.894 ( -13.609 0.000 12.557) 18.517 33.488 ( 8.874 0.000 -19.330) 21.270 ======================= Grid point 224 (112/168) ======================= q-point: (-0.30 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.698 ( -25.235 0.000 15.306) 29.515 1.984 ( -27.094 0.000 20.613) 34.044 2.883 ( -5.839 0.000 1.803) 6.111 2.924 ( 4.865 0.000 -11.279) 12.284 3.042 ( -16.318 0.000 6.530) 17.576 3.281 ( -0.250 0.000 -14.752) 14.754 3.343 ( -20.116 0.000 -6.383) 21.105 3.537 ( 3.302 0.000 16.249) 16.581 3.723 ( -9.121 0.000 -0.125) 9.122 3.834 ( -25.936 0.000 3.251) 26.139 4.128 ( 5.583 0.000 0.098) 5.584 4.317 ( 2.186 0.000 -3.311) 3.967 4.333 ( 5.177 0.000 -1.132) 5.300 4.596 ( -15.570 0.000 -1.112) 15.610 4.931 ( -7.374 0.000 -4.264) 8.518 4.989 ( -4.313 0.000 4.067) 5.929 5.424 ( -3.311 0.000 -4.046) 5.229 5.514 ( -3.248 0.000 10.185) 10.690 5.574 ( -8.056 0.000 -2.725) 8.504 5.941 ( 4.504 0.000 -4.386) 6.287 5.950 ( -4.280 0.000 -0.972) 4.389 6.488 ( 2.960 0.000 -8.578) 9.074 6.549 ( -6.491 0.000 -3.319) 7.290 6.613 ( -11.545 0.000 15.245) 19.123 6.934 ( 0.433 0.000 1.463) 1.526 6.990 ( -4.703 0.000 4.621) 6.593 7.230 ( 1.122 0.000 -3.249) 3.437 7.256 ( -1.618 0.000 -4.224) 4.523 7.458 ( 5.512 0.000 2.231) 5.947 7.840 ( 5.758 0.000 -8.951) 10.643 7.951 ( 3.245 0.000 5.089) 6.036 8.059 ( 5.494 0.000 -3.788) 6.673 8.133 ( -0.911 0.000 6.111) 6.178 8.353 ( 1.967 0.000 -11.660) 11.825 9.094 ( -2.296 0.000 6.085) 6.504 9.439 ( 13.249 0.000 8.179) 15.570 11.046 ( 1.069 0.000 -7.949) 8.020 11.197 ( 1.642 0.000 1.059) 1.954 11.560 ( -0.658 0.000 1.446) 1.589 11.783 ( 3.844 0.000 0.833) 3.933 13.621 ( -1.762 0.000 -3.717) 4.114 13.917 ( 6.607 0.000 -3.325) 7.397 14.174 ( 8.796 0.000 5.080) 10.157 14.339 ( 13.395 0.000 -5.967) 14.664 15.265 ( -0.792 0.000 0.278) 0.839 15.319 ( -0.802 0.000 0.300) 0.856 15.829 ( 2.630 0.000 2.125) 3.381 15.876 ( 0.987 0.000 -4.123) 4.239 16.048 ( -0.552 0.000 -0.257) 0.609 16.108 ( 1.357 0.000 3.667) 3.910 16.683 ( -0.234 0.000 5.906) 5.911 16.722 ( 2.902 0.000 -4.246) 5.143 18.262 ( -9.590 0.000 0.204) 9.592 18.365 ( -8.891 0.000 2.730) 9.301 18.411 ( -8.235 0.000 -3.509) 8.952 18.727 ( -1.126 0.000 -5.881) 5.987 27.691 ( -1.892 0.000 -1.030) 2.154 27.754 ( -0.962 0.000 -0.306) 1.009 27.984 ( -3.578 0.000 -1.380) 3.835 28.134 ( 0.296 0.000 -0.781) 0.835 28.917 ( -3.287 0.000 -1.266) 3.522 29.053 ( -2.065 0.000 -2.508) 3.249 29.295 ( -2.709 0.000 6.327) 6.882 29.629 ( 8.228 0.000 -8.742) 12.005 29.853 ( -0.727 0.000 0.004) 0.727 30.166 ( 5.990 0.000 6.605) 8.917 30.775 ( 6.755 0.000 22.382) 23.379 30.779 ( 7.032 0.000 -13.094) 14.863 31.074 ( -4.942 0.000 -6.659) 8.293 31.387 ( 0.798 0.000 6.525) 6.574 32.811 ( -16.290 0.000 14.272) 21.658 33.312 ( -1.610 0.000 -23.666) 23.721 ======================= Grid point 225 (113/168) ======================= q-point: (-0.20 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.539 ( -21.931 0.000 21.447) 30.675 1.708 ( -33.524 0.000 14.946) 36.705 2.703 ( -23.761 0.000 -9.511) 25.594 2.763 ( -17.393 0.000 19.063) 25.805 2.921 ( -13.568 0.000 6.929) 15.235 3.054 ( 0.524 0.000 -7.010) 7.030 3.085 ( -9.370 0.000 -9.873) 13.611 3.497 ( -7.347 0.000 0.887) 7.401 3.715 ( -3.868 0.000 4.443) 5.891 3.717 ( -5.063 0.000 12.596) 13.576 4.097 ( -3.382 0.000 -8.402) 9.057 4.354 ( 0.867 0.000 -4.380) 4.465 4.398 ( 10.122 0.000 -0.782) 10.152 4.439 ( -5.192 0.000 9.736) 11.034 4.845 ( 0.212 0.000 -0.652) 0.685 4.951 ( -3.669 0.000 1.500) 3.964 5.344 ( -1.899 0.000 -0.939) 2.119 5.560 ( 3.381 0.000 7.739) 8.446 5.565 ( -6.206 0.000 12.023) 13.530 5.892 ( -3.355 0.000 1.839) 3.826 5.958 ( 5.044 0.000 -6.012) 7.848 6.336 ( -8.315 0.000 -5.056) 9.731 6.430 ( -4.035 0.000 -2.622) 4.812 6.628 ( -3.158 0.000 4.607) 5.586 6.941 ( -1.121 0.000 -0.337) 1.170 6.983 ( -1.556 0.000 3.435) 3.771 7.201 ( -0.327 0.000 -2.309) 2.333 7.222 ( 4.260 0.000 -5.753) 7.158 7.526 ( 1.280 0.000 -1.797) 2.206 7.734 ( -2.809 0.000 -13.236) 13.531 8.035 ( 0.915 0.000 4.954) 5.038 8.083 ( -4.259 0.000 2.071) 4.736 8.236 ( 3.408 0.000 7.101) 7.876 8.280 ( 5.110 0.000 -6.128) 7.979 9.099 ( -6.612 0.000 5.124) 8.365 9.618 ( 3.233 0.000 -4.142) 5.254 10.995 ( 2.487 0.000 -5.741) 6.257 11.186 ( -0.133 0.000 -3.648) 3.651 11.615 ( 1.266 0.000 5.976) 6.109 11.847 ( 3.331 0.000 0.736) 3.411 13.599 ( 2.413 0.000 -0.047) 2.413 13.955 ( 4.894 0.000 -5.663) 7.484 14.362 ( 8.565 0.000 3.039) 9.088 14.475 ( 13.317 0.000 -7.126) 15.104 15.262 ( -0.082 0.000 -0.382) 0.390 15.284 ( -2.081 0.000 -2.180) 3.014 15.834 ( 0.317 0.000 -6.335) 6.343 15.838 ( 0.268 0.000 -3.986) 3.995 16.166 ( 10.230 0.000 8.753) 13.464 16.181 ( 2.105 0.000 4.019) 4.537 16.720 ( -1.303 0.000 2.088) 2.461 16.721 ( 2.890 0.000 -3.927) 4.876 18.113 ( -9.051 0.000 -0.265) 9.055 18.210 ( -12.886 0.000 -0.979) 12.923 18.256 ( -6.783 0.000 -2.151) 7.116 18.531 ( -13.233 0.000 -7.230) 15.080 27.658 ( -1.235 0.000 -0.400) 1.299 27.721 ( -1.990 0.000 -0.793) 2.142 27.910 ( -3.165 0.000 -2.086) 3.790 28.100 ( -1.467 0.000 -3.585) 3.873 28.867 ( -1.601 0.000 -0.707) 1.751 28.982 ( -2.974 0.000 -2.106) 3.644 29.300 ( -4.212 0.000 4.773) 6.366 29.639 ( 6.209 0.000 -9.348) 11.222 29.907 ( 3.060 0.000 5.295) 6.116 30.326 ( 4.065 0.000 6.428) 7.605 30.781 ( 12.593 0.000 -12.095) 17.460 30.959 ( -0.330 0.000 -2.976) 2.994 31.252 ( 20.231 0.000 19.226) 27.909 31.428 ( -2.805 0.000 3.260) 4.301 32.714 ( -17.874 0.000 15.407) 23.597 32.875 ( -19.072 0.000 -22.435) 29.446 ======================= Grid point 226 (114/168) ======================= q-point: (-0.10 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.349 ( -29.178 0.000 11.965) 31.536 1.489 ( -16.929 0.000 21.287) 27.198 2.156 ( -26.679 0.000 -9.484) 28.315 2.652 ( -1.312 0.000 -12.853) 12.919 2.850 ( -15.822 0.000 18.153) 24.080 3.006 ( -6.019 0.000 25.173) 25.883 3.076 ( 4.439 0.000 -0.336) 4.451 3.466 ( -3.190 0.000 3.836) 4.989 3.572 ( -12.240 0.000 -4.864) 13.171 3.762 ( 4.947 0.000 2.473) 5.531 4.075 ( 2.055 0.000 2.367) 3.135 4.276 ( -0.976 0.000 -7.318) 7.383 4.550 ( 2.103 0.000 9.062) 9.302 4.580 ( 12.785 0.000 0.700) 12.804 4.896 ( 3.715 0.000 2.684) 4.584 4.937 ( -0.053 0.000 0.915) 0.916 5.346 ( -0.529 0.000 3.450) 3.491 5.610 ( -6.227 0.000 13.480) 14.849 5.802 ( 12.978 0.000 7.106) 14.797 5.908 ( 0.490 0.000 5.765) 5.786 5.926 ( 0.637 0.000 -10.498) 10.518 6.158 ( -8.385 0.000 -0.796) 8.422 6.365 ( -2.431 0.000 -0.233) 2.442 6.629 ( 0.964 0.000 -1.139) 1.492 6.905 ( -0.991 0.000 -1.291) 1.627 7.024 ( 1.170 0.000 2.025) 2.339 7.171 ( -0.366 0.000 -3.553) 3.571 7.240 ( 10.738 0.000 -9.085) 14.065 7.438 ( -17.986 0.000 -8.909) 20.072 7.465 ( -4.606 0.000 -2.881) 5.433 8.041 ( -3.269 0.000 3.433) 4.741 8.103 ( 1.669 0.000 3.102) 3.522 8.361 ( 8.886 0.000 0.079) 8.886 8.373 ( 2.871 0.000 7.928) 8.432 8.982 ( -13.087 0.000 1.416) 13.163 9.448 ( -8.463 0.000 -13.631) 16.045 10.989 ( 2.859 0.000 -3.032) 4.167 11.141 ( 1.032 0.000 -4.873) 4.981 11.706 ( 0.510 0.000 6.818) 6.837 11.897 ( 1.931 0.000 0.376) 1.968 13.676 ( 3.515 0.000 2.861) 4.532 13.949 ( 3.321 0.000 -6.106) 6.951 14.486 ( 3.071 0.000 1.818) 3.569 14.583 ( 10.239 0.000 -6.848) 12.318 15.226 ( -0.372 0.000 -3.073) 3.095 15.235 ( -2.535 0.000 -1.171) 2.792 15.757 ( 0.465 0.000 -6.554) 6.571 15.796 ( 0.227 0.000 -4.246) 4.252 16.259 ( 2.018 0.000 3.980) 4.462 16.458 ( 13.841 0.000 2.010) 13.986 16.694 ( -0.724 0.000 -1.060) 1.283 16.718 ( 0.853 0.000 -2.169) 2.330 17.946 ( -15.971 0.000 -1.562) 16.047 17.988 ( -5.504 0.000 -1.034) 5.600 18.175 ( -0.950 0.000 -0.735) 1.201 18.263 ( -15.000 0.000 2.668) 15.236 27.647 ( -0.159 0.000 0.468) 0.494 27.687 ( -1.062 0.000 -0.652) 1.247 27.845 ( -1.938 0.000 -1.973) 2.766 28.014 ( -2.518 0.000 -5.304) 5.871 28.853 ( 0.282 0.000 0.007) 0.283 28.925 ( -2.097 0.000 -0.847) 2.261 29.289 ( -4.199 0.000 5.160) 6.653 29.612 ( 4.031 0.000 -9.196) 10.040 30.037 ( 3.478 0.000 7.271) 8.060 30.404 ( -0.577 0.000 1.958) 2.042 30.927 ( 20.086 0.000 -6.747) 21.189 30.984 ( 4.482 0.000 1.555) 4.744 31.377 ( -5.817 0.000 0.038) 5.817 31.611 ( -4.455 0.000 -0.078) 4.456 32.470 ( 3.257 0.000 -3.987) 5.148 32.598 ( -19.207 0.000 14.511) 24.072 ======================= Grid point 227 (115/168) ======================= q-point: ( 0.00 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.335 ( 5.768 9.559 6.659) 12.999 1.600 ( -4.563 10.911 -7.811) 14.174 2.027 ( -9.778 19.349 16.689) 27.359 2.703 ( 4.524 14.667 -13.000) 20.114 2.930 ( -7.286 3.890 13.693) 15.991 3.106 ( 0.740 -1.951 2.549) 3.294 3.197 ( -8.816 0.366 12.338) 15.168 3.435 ( 8.416 -0.775 -6.960) 10.949 3.539 ( 9.136 -1.539 14.446) 17.162 3.850 ( 0.418 1.167 4.838) 4.994 4.126 ( -2.641 6.540 -5.042) 8.670 4.264 ( 6.057 -1.794 -4.555) 7.788 4.538 ( -0.196 -6.812 3.975) 7.889 4.698 ( 10.733 -8.141 2.031) 13.623 4.883 ( 2.663 -3.512 1.295) 4.594 5.004 ( 1.773 -1.215 0.322) 2.174 5.420 ( -3.465 2.124 6.318) 7.512 5.639 ( -3.325 -3.149 -1.228) 4.742 5.782 ( -1.266 4.566 4.952) 6.854 5.980 ( -2.294 0.271 1.139) 2.575 6.111 ( 3.571 4.541 7.673) 9.605 6.186 ( 1.749 2.255 1.302) 3.137 6.388 ( 0.059 7.302 -1.359) 7.428 6.593 ( 1.046 -2.262 -3.065) 3.950 6.843 ( 0.551 -3.737 -1.054) 3.922 6.918 ( -9.888 -6.263 -3.105) 12.109 7.102 ( 3.426 4.302 -0.137) 5.501 7.197 ( -11.549 4.372 -6.124) 13.784 7.370 ( -2.312 3.309 0.516) 4.069 7.452 ( 11.118 4.959 -7.551) 14.325 8.006 ( -2.320 -2.325 4.608) 5.659 8.146 ( 3.755 -1.620 -0.262) 4.098 8.424 ( 6.810 -5.054 4.728) 9.709 8.620 ( 1.696 3.237 0.129) 3.656 8.736 ( -6.732 -3.041 2.360) 7.755 9.099 ( -4.494 -5.484 -11.148) 13.212 11.039 ( 1.754 3.222 -0.122) 3.671 11.170 ( 1.494 5.677 -5.691) 8.176 11.721 ( -0.441 -5.355 6.120) 8.144 11.874 ( 0.889 -3.825 -1.388) 4.166 13.761 ( -2.211 3.134 3.728) 5.349 13.957 ( 1.139 3.298 -6.021) 6.959 14.456 ( -4.362 -3.305 1.834) 5.772 14.595 ( 3.283 -2.725 -5.832) 7.226 15.195 ( -4.048 2.867 -0.654) 5.003 15.255 ( 3.369 3.322 -2.971) 5.587 15.666 ( 0.790 -3.538 -2.304) 4.295 15.756 ( 0.626 -0.334 -5.773) 5.816 16.342 ( 2.484 0.449 4.085) 4.802 16.454 ( -5.361 -1.206 -2.214) 5.925 16.664 ( -2.948 -1.967 -0.948) 3.669 16.735 ( 6.171 -3.298 -2.539) 7.444 17.811 ( -4.348 1.020 4.644) 6.443 17.946 ( 1.686 0.985 -1.944) 2.755 18.105 ( -7.787 -1.963 4.658) 9.284 18.202 ( 6.534 -1.130 -0.483) 6.648 27.657 ( -0.651 0.182 0.085) 0.681 27.697 ( 0.778 1.109 -1.660) 2.142 27.816 ( 0.552 0.300 0.236) 0.671 27.918 ( -2.008 0.014 -4.519) 4.945 28.908 ( -1.768 1.951 -0.242) 2.644 28.937 ( 1.922 5.825 -2.171) 6.507 29.287 ( -3.584 -0.439 5.559) 6.628 29.543 ( 1.812 -1.901 -7.935) 8.359 30.213 ( 1.566 4.483 6.573) 8.109 30.420 ( -4.060 4.455 -2.826) 6.657 31.071 ( -6.170 -1.874 3.391) 7.285 31.206 ( 19.781 -1.055 0.351) 19.813 31.249 ( -1.877 2.217 -0.067) 2.906 31.361 ( -18.473 8.061 -1.336) 20.200 32.366 ( -14.354 -7.300 11.308) 19.677 32.697 ( 26.023 -8.685 -5.345) 27.950 ======================= Grid point 228 (116/168) ======================= q-point: ( 0.10 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( 21.235 9.025 -4.610) 23.529 1.726 ( 30.983 6.970 3.301) 31.928 2.138 ( -2.797 22.270 18.743) 29.242 2.645 ( 7.953 11.867 -13.611) 19.732 2.971 ( -9.346 -0.428 11.129) 14.539 3.187 ( 0.704 -3.073 4.816) 5.756 3.209 ( 9.064 1.396 -1.078) 9.234 3.532 ( 10.114 -0.111 -3.145) 10.592 3.758 ( -6.206 5.392 -5.442) 9.859 3.915 ( 14.137 2.586 13.217) 19.525 4.115 ( 3.740 3.655 0.593) 5.263 4.290 ( 6.168 -3.430 -10.418) 12.584 4.530 ( -3.573 -4.413 -0.950) 5.757 4.763 ( 2.915 -4.911 -8.522) 10.259 4.933 ( -0.999 -8.365 0.374) 8.433 5.072 ( 8.389 -3.923 -0.784) 9.294 5.390 ( -8.243 -0.437 4.493) 9.398 5.615 ( 3.990 4.406 0.615) 5.976 5.834 ( -3.440 4.444 7.929) 9.719 5.954 ( -1.718 -1.991 -0.693) 2.720 6.132 ( -5.091 2.424 -0.708) 5.683 6.304 ( 8.332 4.121 -2.040) 9.517 6.357 ( -2.552 2.734 6.036) 7.101 6.573 ( 2.617 2.387 -6.287) 7.216 6.785 ( -1.839 -3.879 0.140) 4.295 6.874 ( -2.539 -4.545 4.334) 6.774 6.961 ( -9.159 3.750 -0.367) 9.904 7.152 ( -3.362 5.362 0.831) 6.383 7.330 ( 5.527 2.271 -0.790) 6.027 7.568 ( 8.877 4.278 -4.979) 11.040 8.019 ( -1.682 -0.632 3.879) 4.275 8.206 ( 5.246 -2.794 -4.701) 7.578 8.414 ( -8.867 -0.879 -2.881) 9.365 8.639 ( 6.483 -6.922 6.262) 11.365 8.879 ( 4.384 3.345 3.931) 6.772 8.986 ( 7.649 -5.109 -5.344) 10.638 11.057 ( 0.135 3.800 0.727) 3.872 11.123 ( 0.981 5.278 -5.640) 7.786 11.770 ( -1.334 -5.298 4.650) 7.174 11.859 ( 0.486 -4.180 -3.032) 5.187 13.742 ( -6.192 2.609 5.315) 8.567 13.874 ( -3.710 2.781 -5.478) 7.177 14.361 ( -10.733 -2.728 2.968) 11.465 14.541 ( -3.297 -3.264 -3.528) 5.828 15.148 ( -1.552 3.182 1.386) 3.802 15.278 ( 3.044 3.179 -2.502) 5.062 15.665 ( 0.453 -2.812 -0.306) 2.864 15.716 ( 2.101 -1.017 -3.855) 4.507 16.322 ( -7.546 -0.248 -0.512) 7.567 16.423 ( 0.979 0.308 3.066) 3.234 16.584 ( -5.052 -2.120 0.360) 5.491 16.743 ( -1.416 -2.608 -2.742) 4.041 17.884 ( 6.308 -1.180 2.902) 7.043 18.013 ( 8.706 2.016 -1.102) 9.004 18.095 ( 0.573 -1.574 3.237) 3.645 18.340 ( 11.296 -1.080 -0.827) 11.377 27.663 ( 0.720 -0.733 0.705) 1.246 27.696 ( 1.590 0.374 -1.428) 2.170 27.848 ( -0.789 0.641 -2.510) 2.708 27.852 ( 1.474 0.462 1.913) 2.459 28.881 ( -1.341 2.074 0.099) 2.472 28.960 ( 3.068 4.308 -1.003) 5.383 29.299 ( -3.907 -0.535 6.590) 7.680 29.490 ( 1.962 -2.390 -6.158) 6.890 30.285 ( -3.273 3.161 7.944) 9.155 30.303 ( -5.717 2.808 -3.852) 7.443 30.811 ( -20.525 5.215 2.638) 21.341 31.115 ( -8.951 1.724 -3.241) 9.675 31.370 ( 8.758 2.166 -0.140) 9.023 31.555 ( 15.187 3.336 5.482) 16.487 32.213 ( -11.626 -7.393 4.920) 14.630 33.039 ( 26.487 -8.950 -10.956) 30.028 ======================= Grid point 229 (117/168) ======================= q-point: ( 0.20 0.14 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( 30.787 6.348 -1.057) 31.453 2.230 ( 22.417 7.141 3.667) 23.811 2.362 ( 8.221 17.742 11.320) 22.595 2.692 ( 17.179 5.835 -8.336) 19.966 2.881 ( -9.871 1.625 3.667) 10.655 3.182 ( -2.577 7.578 -11.558) 14.059 3.347 ( 4.044 -8.905 9.008) 13.297 3.638 ( 4.624 3.028 4.771) 7.301 3.785 ( 14.180 3.465 -2.909) 14.884 4.120 ( -0.155 5.901 -2.836) 6.549 4.202 ( 4.530 -3.327 -6.347) 8.478 4.302 ( 14.320 3.757 -0.953) 14.836 4.434 ( 0.344 -0.860 -7.646) 7.702 4.679 ( 0.080 -6.251 -7.636) 9.869 4.881 ( -0.609 -10.560 -5.412) 11.881 5.164 ( 8.239 -3.396 -6.696) 11.147 5.305 ( -7.886 2.051 3.783) 8.983 5.721 ( 0.753 5.752 6.172) 8.471 5.807 ( -4.375 -0.787 -1.353) 4.646 5.912 ( -2.640 3.569 -0.773) 4.506 6.049 ( -2.839 -2.394 1.810) 4.131 6.292 ( 2.822 6.880 -7.337) 10.447 6.448 ( 3.053 -0.471 -4.504) 5.461 6.600 ( 5.341 0.026 5.939) 7.987 6.805 ( 2.161 -3.472 2.745) 4.925 6.867 ( -5.145 0.710 7.149) 8.837 6.941 ( 0.734 2.690 5.346) 6.029 7.123 ( 0.691 2.753 0.568) 2.895 7.459 ( 5.928 1.075 2.202) 6.414 7.606 ( 3.370 3.844 -4.039) 6.515 8.037 ( -1.488 0.474 2.409) 2.871 8.142 ( -2.820 -1.420 -5.318) 6.185 8.332 ( 0.479 -2.710 -3.484) 4.440 8.685 ( 1.012 0.961 -7.935) 8.057 9.019 ( 6.469 -6.744 10.111) 13.768 9.160 ( 8.522 -2.040 3.895) 9.590 11.038 ( -0.695 3.427 -3.659) 5.061 11.104 ( 1.320 4.825 0.277) 5.010 11.775 ( -2.913 -4.951 1.302) 5.890 11.821 ( -0.290 -4.342 -3.762) 5.753 13.690 ( -8.133 1.178 2.970) 8.738 13.742 ( -6.118 3.309 -0.111) 6.956 14.208 ( -13.771 -2.102 4.697) 14.701 14.420 ( -7.724 -3.004 -2.055) 8.539 15.187 ( 2.413 2.640 3.252) 4.835 15.286 ( 1.013 3.579 -1.290) 3.937 15.672 ( 1.643 -2.081 -0.227) 2.661 15.742 ( 3.438 -1.645 -0.008) 3.812 16.222 ( -5.515 -0.577 0.949) 5.625 16.367 ( -5.768 -1.644 -4.204) 7.325 16.597 ( 0.195 -0.954 5.761) 5.843 16.662 ( -5.140 -0.561 -0.521) 5.197 18.033 ( 9.382 -2.531 1.083) 9.778 18.157 ( 8.324 -0.028 0.947) 8.377 18.196 ( 8.767 1.942 1.761) 9.150 18.511 ( 11.447 -0.989 -1.131) 11.545 27.690 ( 1.663 -1.042 0.544) 2.036 27.709 ( 1.386 1.216 -1.030) 2.113 27.827 ( 1.043 -0.320 -0.025) 1.091 27.919 ( 1.966 -0.247 3.972) 4.438 28.874 ( -0.354 2.582 1.070) 2.817 29.004 ( 3.617 3.851 -0.641) 5.322 29.310 ( -4.788 -0.525 7.040) 8.530 29.467 ( 2.534 -1.939 -3.967) 5.091 30.161 ( -6.444 2.165 -4.202) 7.992 30.279 ( -11.212 0.777 10.946) 15.688 30.593 ( -8.655 9.632 -0.848) 12.977 30.961 ( -6.264 0.824 -2.073) 6.650 31.438 ( -1.191 -3.860 -1.801) 4.423 31.695 ( 0.912 9.698 -1.182) 9.812 32.270 ( 10.873 -10.305 6.679) 16.402 33.264 ( 20.777 -7.049 -13.769) 25.903 ======================= Grid point 230 (118/168) ======================= q-point: ( 0.30 0.14 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.393 ( 18.657 4.782 -11.837) 22.606 2.548 ( 11.810 9.618 10.597) 18.554 2.588 ( 13.492 10.131 0.536) 16.880 2.699 ( -8.434 3.431 -0.391) 9.113 2.980 ( -6.252 8.176 -3.854) 10.990 3.091 ( 22.285 1.610 3.475) 22.612 3.497 ( 3.775 -8.075 6.760) 11.187 3.710 ( 0.683 -0.649 -2.193) 2.387 3.992 ( 11.126 10.825 -3.806) 15.982 4.013 ( -1.576 -1.986 -4.686) 5.328 4.193 ( 1.264 3.927 -1.722) 4.471 4.400 ( 4.632 1.774 -7.409) 8.916 4.470 ( 12.152 -1.215 -7.649) 14.410 4.686 ( 7.487 -4.157 -1.348) 8.669 4.835 ( 4.332 -7.699 -4.291) 9.821 5.196 ( 7.649 0.197 -8.670) 11.564 5.256 ( -2.980 0.875 3.548) 4.715 5.667 ( -3.885 -3.005 -3.478) 6.018 5.798 ( 0.075 4.725 3.190) 5.701 5.864 ( -1.783 3.554 -1.198) 4.152 6.095 ( 0.209 -3.419 4.980) 6.045 6.254 ( 4.069 7.893 -6.769) 11.166 6.445 ( 4.317 -0.967 -4.048) 5.997 6.743 ( 0.349 -5.201 9.431) 10.775 6.879 ( -3.311 0.192 7.808) 8.483 6.943 ( 10.306 -1.905 -1.379) 10.571 7.008 ( -0.410 4.734 3.907) 6.152 7.163 ( 2.325 1.156 1.767) 3.141 7.519 ( 1.232 1.008 -1.179) 1.981 7.607 ( -0.813 3.633 0.909) 3.832 8.002 ( -2.169 -2.210 -1.091) 3.284 8.106 ( -0.105 2.866 2.092) 3.550 8.270 ( -0.857 -3.588 -7.645) 8.489 8.582 ( 1.000 4.017 -11.526) 12.247 9.176 ( 0.711 -8.474 4.502) 9.622 9.288 ( 0.370 -2.211 5.468) 5.909 10.986 ( 0.582 2.008 -4.459) 4.925 11.151 ( 1.748 3.845 3.158) 5.274 11.713 ( -2.348 -4.804 -3.803) 6.561 11.766 ( -2.814 -3.079 -1.759) 4.527 13.584 ( -4.506 1.527 0.024) 4.758 13.701 ( -5.806 1.632 6.936) 9.192 14.058 ( -13.141 -1.636 6.287) 14.659 14.273 ( -7.584 -2.551 -1.819) 8.205 15.246 ( 0.224 2.066 1.769) 2.729 15.308 ( 2.339 4.484 1.429) 5.255 15.724 ( 3.884 -2.694 1.602) 4.991 15.804 ( 3.312 -0.767 0.930) 3.525 16.164 ( -3.281 -1.588 0.198) 3.650 16.218 ( -4.862 -1.566 -5.768) 7.704 16.563 ( -6.553 0.621 2.646) 7.094 16.683 ( 0.488 -0.634 4.632) 4.701 18.190 ( 8.177 -2.897 1.772) 8.854 18.298 ( 8.521 -1.223 1.133) 8.682 18.363 ( 8.180 3.848 2.666) 9.425 18.653 ( 7.927 -0.819 -1.249) 8.067 27.711 ( 0.861 2.004 -0.746) 2.305 27.727 ( 1.689 -1.260 0.606) 2.192 27.875 ( 2.670 -1.397 2.408) 3.857 27.994 ( 1.262 -1.275 4.224) 4.589 28.898 ( 1.020 3.151 2.390) 4.084 29.054 ( 3.369 3.972 -0.298) 5.217 29.308 ( -5.444 -0.197 6.840) 8.744 29.478 ( 3.018 -0.869 -1.945) 3.694 30.015 ( -5.527 2.147 -4.328) 7.341 30.211 ( -13.187 0.959 11.799) 17.720 30.493 ( -2.430 8.475 -3.015) 9.318 30.888 ( -2.576 0.920 1.516) 3.128 31.297 ( -7.507 -5.471 -6.728) 11.470 31.683 ( 3.287 8.458 -6.732) 11.299 32.558 ( 10.264 -9.283 10.441) 17.336 33.386 ( 16.326 -5.672 -14.996) 22.882 ======================= Grid point 231 (119/168) ======================= q-point: ( 0.40 0.14 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.473 ( -2.237 3.047 -4.457) 5.844 2.537 ( 1.174 5.784 -1.127) 6.008 2.683 ( -8.123 14.371 0.854) 16.530 2.794 ( 10.981 3.291 -2.616) 11.758 2.976 ( 10.279 5.887 2.729) 12.156 3.427 ( 8.821 1.840 7.022) 11.424 3.612 ( 2.565 -7.092 2.559) 7.964 3.682 ( 4.456 -4.050 -2.724) 6.608 3.901 ( -2.446 -1.093 -7.735) 8.185 4.021 ( -1.501 6.594 -3.192) 7.478 4.248 ( 2.924 9.643 1.514) 10.190 4.366 ( 2.774 4.610 -5.142) 7.442 4.633 ( 16.220 -5.752 -5.536) 18.078 4.742 ( 1.534 -1.417 -0.242) 2.103 4.936 ( 8.153 -5.067 -1.132) 9.666 5.227 ( 6.714 3.702 -5.622) 9.508 5.281 ( 1.769 -1.601 1.379) 2.756 5.623 ( 2.933 -5.823 -3.535) 7.417 5.814 ( -3.172 6.648 -0.261) 7.371 5.862 ( 3.834 1.098 2.281) 4.595 6.085 ( -4.654 -0.244 1.539) 4.908 6.299 ( 5.789 8.769 -2.023) 10.701 6.487 ( 3.375 -4.917 0.528) 5.987 6.849 ( -0.691 -5.427 7.671) 9.422 6.897 ( -5.726 -2.300 6.192) 8.742 6.919 ( -4.978 -2.728 0.493) 5.698 7.127 ( 5.151 2.454 2.373) 6.180 7.220 ( 4.120 0.855 -1.079) 4.344 7.516 ( 3.436 2.341 -2.869) 5.051 7.592 ( -3.678 3.341 2.712) 5.660 7.975 ( -1.542 -3.082 -0.548) 3.489 8.125 ( -0.536 1.243 -7.074) 7.202 8.172 ( 2.354 0.636 -1.075) 2.665 8.469 ( 1.110 5.463 -10.475) 11.866 9.150 ( -5.471 -7.079 -0.470) 8.959 9.273 ( -6.093 -2.225 0.391) 6.499 10.968 ( 2.521 0.686 -2.536) 3.641 11.211 ( 1.220 0.903 1.827) 2.375 11.639 ( 0.258 -3.226 -5.194) 6.120 11.703 ( -3.764 -1.567 0.284) 4.087 13.580 ( 1.566 0.686 3.019) 3.470 13.711 ( -2.710 0.618 6.572) 7.135 13.943 ( -11.045 -1.742 6.599) 12.984 14.160 ( -3.308 -2.297 -2.442) 4.710 15.266 ( 0.145 3.207 2.204) 3.894 15.356 ( 1.110 4.506 1.359) 4.836 15.803 ( 3.341 -2.732 0.536) 4.349 15.858 ( 2.441 -0.144 0.831) 2.583 16.084 ( -2.414 -1.321 -4.814) 5.545 16.133 ( -1.883 -1.624 -1.031) 2.692 16.519 ( -5.064 1.331 5.912) 7.898 16.722 ( -0.250 -0.939 1.992) 2.217 18.316 ( 4.261 -2.704 2.873) 5.807 18.440 ( 7.745 -1.054 0.387) 7.826 18.493 ( 3.793 3.282 3.739) 6.256 18.720 ( 2.595 -0.353 -1.626) 3.082 27.720 ( 0.776 1.557 0.164) 1.748 27.755 ( 0.977 -1.056 0.298) 1.469 27.950 ( 2.695 -2.135 3.035) 4.586 28.046 ( -0.106 -1.982 3.045) 3.635 28.959 ( 2.478 3.321 3.381) 5.348 29.093 ( 1.324 3.959 0.158) 4.177 29.301 ( -5.322 1.293 6.701) 8.655 29.510 ( 3.738 -0.091 -2.120) 4.298 29.914 ( -1.805 2.119 -2.235) 3.570 30.148 ( -9.837 2.945 8.406) 13.271 30.434 ( -2.654 5.070 -0.230) 5.728 30.905 ( 0.176 -1.240 3.185) 3.423 31.127 ( -1.808 -2.250 -7.995) 8.500 31.620 ( -0.036 5.273 -9.262) 10.658 32.781 ( 1.785 -7.460 11.583) 13.893 33.440 ( 13.136 -5.669 -15.704) 21.244 ======================= Grid point 232 (120/168) ======================= q-point: (-0.50 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.292 ( -19.200 4.004 8.325) 21.306 2.454 ( -18.486 13.074 4.958) 23.179 2.672 ( 15.434 5.852 -8.863) 18.735 2.926 ( 10.054 2.061 -5.389) 11.592 3.144 ( 6.625 4.275 3.231) 8.521 3.515 ( -5.599 1.429 6.098) 8.401 3.661 ( 2.822 -2.491 -0.503) 3.798 3.685 ( -0.740 -4.259 -13.588) 14.259 3.832 ( 2.376 -1.958 4.016) 5.061 3.961 ( -3.322 4.104 -1.784) 5.573 4.277 ( -1.960 9.236 3.469) 10.059 4.369 ( 1.897 7.197 -2.675) 7.909 4.696 ( -6.069 -1.240 -3.373) 7.053 4.784 ( 7.864 -4.810 -4.223) 10.139 4.992 ( -1.924 -1.394 2.104) 3.174 5.236 ( 2.027 -0.817 -5.929) 6.319 5.336 ( 2.115 0.777 2.664) 3.489 5.590 ( 0.520 -5.683 -9.100) 10.741 5.811 ( 0.465 4.636 4.969) 6.812 5.919 ( -2.225 1.138 -0.778) 2.618 6.093 ( 3.440 2.433 7.378) 8.496 6.322 ( 1.098 8.280 -3.796) 9.174 6.550 ( 0.520 -8.021 4.180) 9.060 6.719 ( -7.999 -7.702 -4.965) 12.164 6.907 ( -7.381 -1.677 10.056) 12.586 7.007 ( 2.622 -4.387 9.408) 10.706 7.163 ( -4.031 0.877 3.871) 5.657 7.256 ( 4.225 1.452 -3.520) 5.688 7.550 ( -3.214 2.269 1.549) 4.228 7.610 ( 9.687 1.246 -2.799) 10.160 7.884 ( -5.300 -1.419 -4.059) 6.825 8.043 ( 4.470 -3.192 -9.662) 11.114 8.238 ( 4.390 7.030 -2.346) 8.614 8.402 ( 3.588 5.235 -5.340) 8.294 9.060 ( -4.589 -5.715 1.497) 7.481 9.152 ( -5.825 -1.271 -2.812) 6.592 11.009 ( 3.981 -0.456 0.631) 4.057 11.200 ( -0.539 -2.229 -4.583) 5.124 11.632 ( 3.470 -0.596 -0.964) 3.651 11.652 ( -3.488 -0.786 0.288) 3.587 13.677 ( 4.049 -0.875 4.076) 5.812 13.756 ( 1.728 0.990 1.179) 2.315 13.878 ( -6.433 -2.405 8.230) 10.719 14.125 ( 3.491 -2.175 -3.537) 5.425 15.302 ( 0.307 3.618 3.003) 4.711 15.370 ( -0.501 5.202 0.368) 5.239 15.817 ( -0.103 -0.586 -1.568) 1.677 15.897 ( 2.799 -1.070 -1.998) 3.601 16.032 ( -0.401 -0.351 -0.223) 0.578 16.097 ( -1.093 -1.872 -1.389) 2.575 16.540 ( -2.568 0.767 7.873) 8.317 16.728 ( 0.348 -0.899 -0.772) 1.235 18.381 ( -0.870 -2.345 3.650) 4.425 18.502 ( 0.322 1.612 -0.802) 1.829 18.593 ( 3.054 -1.083 3.326) 4.644 18.701 ( -1.294 0.792 -2.121) 2.608 27.734 ( -0.084 0.278 0.863) 0.910 27.764 ( 0.598 0.110 -0.451) 0.757 28.019 ( 1.498 -3.019 2.749) 4.349 28.059 ( -0.881 -2.021 1.095) 2.462 29.040 ( 1.819 2.740 3.098) 4.518 29.097 ( 0.097 4.132 -0.006) 4.133 29.293 ( -5.386 3.550 6.437) 9.113 29.545 ( 6.006 0.116 -4.597) 7.565 29.925 ( 2.730 2.363 2.735) 4.529 30.080 ( -5.891 4.959 0.653) 7.727 30.418 ( -4.412 1.575 8.017) 9.285 30.892 ( 1.349 -4.138 -8.192) 9.277 31.124 ( 3.507 1.230 4.712) 6.001 31.474 ( -3.823 3.058 -10.489) 11.576 32.875 ( -6.619 -4.920 11.825) 14.417 33.442 ( 10.580 -7.257 -16.480) 20.885 ======================= Grid point 233 (121/168) ======================= q-point: (-0.40 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.079 ( -22.546 8.750 11.714) 26.872 2.235 ( -21.742 10.765 12.626) 27.350 2.817 ( 12.639 2.459 -5.673) 14.070 2.960 ( 7.234 0.930 -11.383) 13.519 3.306 ( 3.695 1.073 11.039) 11.690 3.414 ( -11.521 6.472 -0.124) 13.215 3.472 ( -3.509 -1.213 -13.205) 13.717 3.658 ( -7.004 2.385 2.840) 7.925 3.848 ( -8.136 2.116 -1.241) 8.498 3.921 ( 0.171 -5.732 1.513) 5.931 4.205 ( -9.973 3.403 -1.301) 10.617 4.382 ( -0.180 8.016 1.726) 8.202 4.485 ( -10.294 4.415 -3.839) 11.841 4.770 ( -4.375 -4.962 -3.449) 7.460 4.947 ( -7.092 -0.959 4.256) 8.326 5.155 ( -3.231 -0.103 -6.196) 6.989 5.400 ( -0.125 -0.184 5.246) 5.250 5.493 ( 0.329 -2.672 -7.439) 7.911 5.774 ( -9.016 1.089 -1.572) 9.217 5.902 ( 0.284 1.909 3.850) 4.307 6.183 ( -2.674 6.430 -2.293) 7.332 6.358 ( 8.403 1.110 -0.115) 8.477 6.566 ( -6.044 -7.046 1.569) 9.415 6.585 ( -4.467 -7.790 4.955) 10.256 6.902 ( -6.265 -1.151 8.658) 10.749 7.067 ( -5.137 1.442 2.504) 5.894 7.188 ( 4.267 -2.927 -0.284) 5.182 7.281 ( 2.975 0.078 -0.104) 2.978 7.480 ( -4.554 2.738 -2.856) 6.033 7.730 ( 7.553 -2.433 -0.617) 7.959 7.829 ( 1.440 -1.384 2.236) 2.998 8.026 ( 5.653 -2.734 -8.007) 10.175 8.215 ( -0.164 7.158 -4.219) 8.310 8.457 ( 8.322 5.574 -7.355) 12.426 9.045 ( -3.085 -3.080 3.346) 5.495 9.124 ( 4.282 -4.323 5.397) 8.134 11.071 ( 0.510 -2.890 -1.398) 3.251 11.146 ( 3.870 -0.579 -3.268) 5.098 11.590 ( -3.454 -0.372 -1.008) 3.617 11.704 ( 4.367 -0.251 1.070) 4.503 13.686 ( -3.320 -1.309 -1.432) 3.846 13.839 ( 7.708 1.487 -0.267) 7.855 13.962 ( 3.820 -2.842 7.677) 9.033 14.192 ( 10.585 -1.815 -4.383) 11.599 15.322 ( -1.564 3.459 1.196) 3.980 15.365 ( 0.148 5.381 0.350) 5.394 15.800 ( -0.201 0.444 0.298) 0.571 15.898 ( 2.009 -0.447 -4.010) 4.508 16.048 ( -0.195 -0.937 1.795) 2.034 16.066 ( -0.395 -1.443 -0.925) 1.759 16.606 ( -0.714 0.016 7.598) 7.632 16.723 ( 1.898 -0.493 -2.766) 3.391 18.363 ( -6.355 -1.677 2.829) 7.155 18.457 ( -4.214 0.840 -1.103) 4.436 18.566 ( -6.836 -0.298 -1.072) 6.926 18.709 ( 2.041 -1.174 0.141) 2.359 27.727 ( -1.424 -0.030 0.354) 1.468 27.770 ( 0.736 0.954 -0.548) 1.324 28.021 ( -2.715 -2.351 0.079) 3.592 28.080 ( 1.489 -2.951 0.951) 3.440 29.028 ( -3.447 3.375 0.091) 4.825 29.145 ( 3.911 5.307 -1.001) 6.668 29.282 ( -4.939 3.176 6.396) 8.682 29.602 ( 8.721 1.348 -5.547) 10.424 29.971 ( -3.625 4.548 -3.927) 7.018 30.051 ( 5.179 3.981 5.569) 8.584 30.498 ( -2.619 -1.271 16.505) 16.760 30.810 ( 3.659 -3.115 -11.953) 12.882 31.264 ( 3.164 0.270 8.421) 9.000 31.278 ( -5.650 2.090 -9.835) 11.533 32.857 ( -12.647 -3.267 11.907) 17.675 33.382 ( 6.067 -9.519 -17.715) 21.006 ======================= Grid point 234 (122/168) ======================= q-point: (-0.30 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.874 ( -21.754 14.909 13.320) 29.545 2.047 ( -26.035 6.023 18.479) 32.490 2.867 ( -4.857 -0.704 -2.189) 5.374 2.930 ( 6.514 -0.200 -9.422) 11.457 3.201 ( -15.284 11.470 3.387) 19.407 3.281 ( -4.061 3.124 -7.696) 9.245 3.463 ( -14.320 8.154 -6.819) 17.834 3.499 ( -2.840 -1.793 11.911) 12.376 3.696 ( -8.917 -1.504 4.177) 9.961 3.752 ( -19.370 -6.440 0.942) 20.434 4.109 ( 0.791 -1.587 -1.048) 2.060 4.327 ( -2.602 2.013 0.439) 3.319 4.450 ( 3.709 7.375 -3.570) 8.994 4.585 ( -14.963 -1.640 0.496) 15.061 4.882 ( -5.885 -1.602 1.973) 6.410 5.033 ( -4.367 1.118 -2.694) 5.252 5.390 ( -1.414 -1.503 -3.388) 3.967 5.491 ( 0.330 0.643 4.863) 4.917 5.625 ( -7.870 3.286 1.417) 8.646 5.944 ( 0.045 2.828 3.239) 4.301 6.086 ( -2.864 7.394 -4.310) 9.026 6.363 ( -0.688 -9.651 -6.109) 11.443 6.467 ( -8.620 -5.549 1.412) 10.349 6.644 ( -2.589 2.104 9.464) 10.035 6.930 ( -0.289 -0.696 3.254) 3.340 7.007 ( -3.874 1.221 2.025) 4.538 7.183 ( 1.840 -2.892 -4.899) 5.979 7.294 ( -2.535 1.654 -4.125) 5.116 7.458 ( 4.655 -0.048 1.452) 4.877 7.825 ( 4.859 -2.364 -1.620) 5.641 7.914 ( 3.293 -3.325 1.701) 4.980 8.029 ( 2.699 -1.124 -1.565) 3.316 8.188 ( 0.541 4.371 -0.256) 4.411 8.431 ( 2.614 6.409 -9.904) 12.083 9.067 ( -1.830 -2.924 5.750) 6.705 9.334 ( 9.467 -9.184 7.038) 14.950 11.018 ( 0.877 -2.020 -5.561) 5.981 11.219 ( 3.607 1.050 0.616) 3.807 11.540 ( -1.591 -1.258 0.570) 2.107 11.775 ( 3.654 -0.915 0.295) 3.778 13.623 ( -1.154 0.686 -2.041) 2.443 13.937 ( 7.427 1.887 -3.635) 8.482 14.135 ( 8.504 -3.457 4.853) 10.384 14.333 ( 13.964 -1.004 -5.706) 15.119 15.299 ( -1.076 3.209 -0.460) 3.415 15.366 ( -0.321 4.339 -0.879) 4.439 15.818 ( 1.089 -1.101 -1.164) 1.937 15.883 ( 1.597 0.294 -1.952) 2.540 16.030 ( -0.591 -1.408 0.936) 1.792 16.105 ( 1.897 -0.305 2.865) 3.450 16.674 ( -0.151 -0.665 4.698) 4.747 16.728 ( 3.033 0.320 -3.003) 4.280 18.255 ( -9.349 -0.644 0.602) 9.390 18.346 ( -7.804 -1.690 -1.828) 8.191 18.429 ( -9.544 1.486 0.261) 9.662 18.681 ( -4.603 -3.811 -3.340) 6.846 27.708 ( -1.024 1.302 0.043) 1.657 27.765 ( -0.426 0.984 -1.156) 1.577 27.965 ( -3.199 -1.720 -1.466) 3.917 28.099 ( 0.372 -3.184 -0.609) 3.263 28.975 ( -2.580 4.535 -0.526) 5.244 29.143 ( 0.597 8.514 -5.384) 10.091 29.293 ( -3.169 0.111 5.652) 6.481 29.673 ( 8.755 3.712 -7.835) 12.321 29.889 ( -1.133 3.483 -0.694) 3.728 30.221 ( 6.196 4.925 7.441) 10.864 30.717 ( 5.071 -4.656 6.064) 9.174 30.765 ( 7.499 -2.158 2.714) 8.262 31.094 ( -4.764 2.050 -7.019) 8.727 31.390 ( 0.563 0.208 7.614) 7.638 32.762 ( -16.286 -4.337 10.977) 20.114 33.197 ( -4.250 -10.049 -18.492) 21.471 ======================= Grid point 235 (123/168) ======================= q-point: (-0.20 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.673 ( -26.076 10.919 14.369) 31.712 1.866 ( -22.686 14.211 19.686) 33.229 2.630 ( -21.325 -2.856 -4.976) 22.083 2.905 ( -0.552 3.899 -3.022) 4.964 3.025 ( -19.556 7.899 15.148) 25.967 3.114 ( -14.125 11.241 0.145) 18.053 3.149 ( -4.437 6.535 -9.962) 12.713 3.435 ( -8.472 -4.909 2.428) 10.088 3.634 ( -4.511 -6.319 5.956) 9.785 3.717 ( -5.446 -0.504 10.472) 11.815 4.072 ( -0.282 -2.355 -6.994) 7.386 4.332 ( 1.980 -1.588 -0.864) 2.681 4.383 ( -4.992 -4.810 6.637) 9.597 4.496 ( 0.188 7.678 -1.902) 7.912 4.830 ( -0.316 -0.812 -1.672) 1.885 4.969 ( -3.110 1.155 1.777) 3.763 5.354 ( -0.056 0.895 -0.001) 0.897 5.559 ( -0.200 1.764 6.875) 7.100 5.612 ( -0.406 3.275 7.961) 8.618 5.962 ( -4.352 5.352 4.744) 8.372 6.042 ( 4.606 5.820 -3.942) 8.404 6.248 ( -5.591 -7.375 -4.955) 10.498 6.386 ( -2.503 -2.036 0.553) 3.273 6.662 ( -4.109 2.087 3.659) 5.885 6.907 ( -1.946 -2.130 -1.070) 3.077 7.027 ( 0.304 2.424 2.607) 3.573 7.169 ( 1.660 -1.930 -4.317) 5.012 7.203 ( -0.860 -1.579 -3.757) 4.165 7.514 ( 1.211 -1.294 -1.768) 2.503 7.777 ( -1.714 3.631 -11.610) 12.285 7.958 ( -0.742 -8.457 3.309) 9.112 8.073 ( 0.010 2.019 3.930) 4.418 8.224 ( 3.315 0.226 0.636) 3.383 8.394 ( 2.703 7.284 -1.296) 7.876 9.070 ( -6.229 -3.107 4.059) 8.058 9.461 ( 0.821 -13.238 -1.997) 13.413 10.993 ( 2.714 0.111 -3.779) 4.654 11.237 ( 1.221 4.016 -3.289) 5.332 11.570 ( 0.758 -3.734 4.956) 6.252 11.827 ( 2.859 -2.050 0.016) 3.518 13.629 ( 3.262 3.037 0.613) 4.499 13.986 ( 5.850 2.823 -5.998) 8.841 14.317 ( 8.671 -3.845 2.680) 9.857 14.475 ( 13.115 -0.625 -7.125) 14.939 15.282 ( -0.353 2.202 -1.111) 2.492 15.330 ( -1.603 4.086 -2.533) 5.068 15.771 ( -0.650 -3.557 -5.644) 6.703 15.868 ( 0.382 0.142 -4.772) 4.789 16.148 ( 8.992 -1.355 7.828) 11.999 16.177 ( 2.690 -0.272 3.439) 4.374 16.701 ( 0.083 -0.829 0.559) 1.003 16.740 ( 1.487 0.619 -2.282) 2.793 18.104 ( -9.109 -0.841 -1.341) 9.246 18.188 ( -10.051 -1.710 -1.173) 10.263 18.273 ( -9.705 1.316 -0.819) 9.828 18.480 ( -15.042 -3.968 -3.099) 15.862 27.700 ( 0.050 2.449 -0.210) 2.459 27.730 ( -1.689 1.402 -1.717) 2.787 27.894 ( -2.908 -1.351 -2.235) 3.909 28.074 ( -1.094 -2.515 -2.890) 3.984 28.940 ( -0.942 5.041 -0.779) 5.187 29.061 ( -1.619 8.623 -6.473) 10.903 29.295 ( -3.705 -0.418 4.313) 5.701 29.666 ( 4.467 2.053 -10.101) 11.234 29.954 ( 4.544 4.729 5.209) 8.376 30.395 ( 4.090 6.181 7.551) 10.581 30.734 ( 11.435 -4.393 -10.644) 16.228 30.977 ( -0.102 1.986 -3.463) 3.993 31.192 ( 17.749 -4.932 16.622) 24.812 31.460 ( -0.294 1.837 7.387) 7.617 32.555 ( -22.040 -11.401 0.444) 24.819 32.864 ( -16.125 -2.975 -5.425) 17.271 ======================= Grid point 236 (124/168) ======================= q-point: (-0.10 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.408 ( -24.608 8.535 12.331) 28.818 1.777 ( -15.428 20.244 12.539) 28.374 2.181 ( -22.566 2.987 -3.495) 23.030 2.809 ( 0.035 12.735 -12.332) 17.727 2.941 ( -8.811 5.987 5.903) 12.179 3.062 ( -13.859 8.781 34.951) 38.610 3.086 ( 2.191 1.163 -2.046) 3.215 3.381 ( -3.291 -7.322 2.231) 8.332 3.546 ( -10.093 -3.458 -1.551) 10.781 3.740 ( 3.981 0.005 3.358) 5.208 4.096 ( 4.219 0.380 3.622) 5.573 4.329 ( -1.265 1.935 -5.568) 6.029 4.468 ( 1.439 -3.531 6.565) 7.592 4.505 ( 6.901 -6.374 1.350) 9.491 4.839 ( 2.707 -2.050 -0.702) 3.467 4.972 ( 0.082 1.000 2.184) 2.404 5.382 ( -0.332 2.638 4.463) 5.195 5.631 ( -2.740 0.371 9.094) 9.505 5.736 ( 3.847 -0.415 3.981) 5.552 5.972 ( -1.346 4.396 6.515) 7.973 6.065 ( -0.771 4.888 -4.111) 6.433 6.142 ( 0.434 0.115 0.320) 0.552 6.382 ( 1.215 3.267 -0.543) 3.528 6.623 ( -1.897 -0.312 -1.140) 2.235 6.868 ( -1.173 -2.935 -1.908) 3.692 7.046 ( -0.492 -0.579 -0.910) 1.185 7.111 ( -3.714 -1.564 -0.495) 4.060 7.221 ( 9.823 -1.094 -6.019) 11.573 7.476 ( -1.038 0.638 -3.568) 3.770 7.534 ( -12.050 6.131 -9.376) 16.453 7.979 ( -1.492 -4.526 4.476) 6.538 8.111 ( 0.715 0.816 1.444) 1.806 8.297 ( 4.826 -2.668 1.399) 5.690 8.482 ( 4.646 6.049 5.354) 9.319 8.945 ( -12.286 -3.865 -0.466) 12.888 9.323 ( -7.368 -10.406 -9.611) 15.967 11.009 ( 2.974 2.060 -1.578) 3.947 11.207 ( 1.509 5.507 -5.149) 7.689 11.649 ( 0.365 -4.994 6.509) 8.212 11.863 ( 1.748 -3.258 -0.272) 3.707 13.713 ( 3.422 3.525 2.706) 5.608 13.988 ( 3.853 3.526 -6.580) 8.401 14.443 ( 3.613 -3.833 1.607) 5.507 14.570 ( 9.316 -1.457 -7.148) 11.833 15.254 ( -0.488 2.415 -2.270) 3.351 15.271 ( -2.057 3.640 -2.404) 4.823 15.701 ( 0.048 -3.894 -5.024) 6.356 15.813 ( 0.469 -0.027 -5.646) 5.666 16.258 ( 2.669 -0.010 3.562) 4.451 16.407 ( 12.123 -4.005 3.330) 13.194 16.687 ( -1.506 -0.644 -1.188) 2.023 16.719 ( 0.361 -0.277 -2.618) 2.657 17.932 ( -11.552 -0.733 -1.083) 11.626 18.011 ( -8.450 1.528 -0.572) 8.606 18.165 ( -1.530 -0.849 -0.971) 2.002 18.235 ( -14.998 -2.236 3.970) 15.675 27.683 ( -1.864 0.974 -1.098) 2.372 27.701 ( 0.644 2.778 -0.885) 2.986 27.833 ( -1.529 -0.879 -1.816) 2.531 28.004 ( -2.087 -1.195 -4.490) 5.093 28.925 ( 0.049 4.341 -0.918) 4.437 28.972 ( -1.605 6.460 -3.955) 7.743 29.286 ( -3.712 -0.334 4.574) 5.900 29.608 ( 2.563 -0.438 -9.260) 9.618 30.094 ( 4.203 5.191 6.098) 9.044 30.475 ( -1.056 6.390 1.535) 6.656 30.887 ( 18.664 -3.525 -4.040) 19.419 31.001 ( 4.927 1.740 1.529) 5.444 31.351 ( -4.571 -2.098 0.475) 5.051 31.683 ( -1.512 6.165 0.460) 6.364 32.225 ( -3.764 -17.031 5.738) 18.362 32.647 ( -14.229 -0.623 6.304) 15.576 ======================= Grid point 237 (125/168) ======================= q-point: ( 0.00 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.579 ( 3.920 12.810 5.116) 14.340 1.793 ( -2.404 7.380 -7.536) 10.818 2.455 ( -3.605 18.887 18.349) 26.579 2.989 ( -7.606 4.392 -0.626) 8.805 2.997 ( -5.828 2.822 2.740) 7.031 3.097 ( 6.983 4.638 0.761) 8.417 3.202 ( -3.147 0.027 -2.291) 3.893 3.445 ( 8.609 2.287 -7.337) 11.540 3.526 ( 5.061 3.825 20.221) 21.193 3.947 ( 4.015 4.509 9.427) 11.195 4.144 ( -4.723 -6.139 -6.590) 10.169 4.172 ( 5.697 -2.730 -1.469) 6.486 4.500 ( 0.105 0.488 5.537) 5.560 4.579 ( 6.804 -1.195 5.413) 8.776 4.851 ( 0.739 -0.288 -1.338) 1.555 4.950 ( 1.328 -2.542 -3.798) 4.759 5.460 ( -6.445 2.424 7.325) 10.053 5.597 ( -2.806 -0.599 1.205) 3.112 5.856 ( 2.823 1.869 6.293) 7.146 5.980 ( -2.735 -0.989 0.281) 2.922 6.151 ( -0.991 -2.183 7.285) 7.669 6.200 ( 0.410 1.019 3.177) 3.362 6.542 ( -3.148 -1.053 -1.121) 3.504 6.590 ( 4.146 9.592 -4.643) 11.435 6.783 ( -5.799 -6.609 -2.473) 9.134 6.818 ( 2.655 1.528 -2.168) 3.753 7.187 ( -0.120 3.731 0.562) 3.775 7.281 ( -6.480 4.292 -4.256) 8.862 7.426 ( -2.852 0.705 2.391) 3.788 7.537 ( 12.660 2.508 -7.099) 14.729 7.978 ( -0.344 0.383 3.603) 3.639 8.112 ( 1.387 -1.531 -1.180) 2.379 8.321 ( 5.672 -4.312 2.016) 7.405 8.580 ( -8.773 -7.927 -7.928) 14.236 8.727 ( 5.038 3.222 5.666) 8.238 8.987 ( -3.228 -4.957 -5.608) 8.151 11.127 ( 1.098 5.172 2.276) 5.756 11.302 ( 2.160 6.359 -5.790) 8.867 11.591 ( -0.941 -6.508 5.777) 8.753 11.770 ( 1.456 -5.910 -2.965) 6.771 13.850 ( -2.529 5.453 3.195) 6.808 14.039 ( 0.473 4.018 -6.291) 7.479 14.372 ( -3.376 -4.219 1.878) 5.721 14.518 ( 2.092 -4.637 -6.049) 7.904 15.275 ( -2.819 4.726 -0.889) 5.574 15.348 ( 2.774 5.716 -3.220) 7.123 15.584 ( 0.370 -4.439 -1.300) 4.641 15.717 ( 1.109 -3.488 -6.434) 7.403 16.357 ( 3.265 1.053 3.276) 4.744 16.428 ( -2.209 -1.140 -0.339) 2.509 16.615 ( -2.992 -2.542 -1.438) 4.181 16.659 ( 1.391 -3.709 -1.577) 4.264 17.846 ( -5.253 2.334 4.343) 7.204 17.967 ( 1.045 0.696 -0.779) 1.478 18.066 ( -6.169 -1.318 3.594) 7.260 18.168 ( 6.229 -2.186 -0.755) 6.645 27.670 ( -0.949 1.047 -0.598) 1.535 27.709 ( -0.038 0.178 -2.454) 2.461 27.824 ( 0.601 0.478 0.692) 1.034 27.906 ( -1.219 -1.295 -3.246) 3.701 28.971 ( -2.655 4.066 0.959) 4.949 29.078 ( 1.396 6.881 -5.391) 8.853 29.269 ( -2.851 -0.982 3.665) 4.746 29.489 ( 0.388 -3.309 -7.808) 8.490 30.323 ( 1.463 6.022 4.569) 7.700 30.515 ( -5.076 3.697 -4.324) 7.625 31.028 ( -2.070 -1.701 4.078) 4.879 31.159 ( 6.863 -3.230 -1.771) 7.789 31.359 ( 7.709 7.953 6.406) 12.794 31.566 ( -14.841 11.272 -2.421) 18.793 32.168 ( -3.220 -11.152 11.182) 16.118 32.472 ( 14.268 -12.643 -3.856) 19.449 ======================= Grid point 238 (126/168) ======================= q-point: ( 0.10 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.853 ( 20.444 10.430 -1.842) 23.025 1.901 ( 25.536 8.909 0.831) 27.058 2.622 ( -0.642 21.345 15.864) 26.603 2.856 ( -0.858 5.663 -6.571) 8.717 3.014 ( -3.517 3.148 6.376) 7.933 3.087 ( -2.477 -1.060 -1.010) 2.878 3.266 ( 8.314 2.171 1.635) 8.747 3.533 ( 14.627 0.293 -9.651) 17.526 3.864 ( 6.800 0.938 8.010) 10.549 3.940 ( 0.134 0.988 -1.558) 1.850 4.141 ( 5.399 -2.473 2.994) 6.650 4.217 ( 7.273 -1.699 -7.754) 10.766 4.507 ( -3.270 3.413 1.625) 4.998 4.734 ( 5.342 -0.036 -2.809) 6.035 4.785 ( -5.485 -3.145 -2.093) 6.661 4.959 ( 5.382 -5.429 -1.971) 7.895 5.434 ( -6.967 4.028 7.384) 10.922 5.634 ( 3.959 -0.449 3.883) 5.563 5.873 ( -6.533 -0.779 -0.787) 6.626 5.981 ( 2.351 1.753 2.836) 4.080 6.160 ( -4.988 -0.381 1.932) 5.363 6.294 ( 2.819 -1.098 7.200) 7.810 6.473 ( -1.281 5.542 -4.297) 7.129 6.623 ( 5.108 -1.795 0.297) 5.422 6.695 ( -3.052 -2.979 0.683) 4.319 6.809 ( -2.819 1.334 -5.143) 6.015 7.068 ( -6.837 5.403 2.300) 9.013 7.236 ( -4.377 2.414 0.633) 5.039 7.415 ( 5.277 5.971 -1.376) 8.086 7.657 ( 9.275 3.324 -5.247) 11.162 8.019 ( 0.312 0.997 3.487) 3.640 8.139 ( 3.918 -3.328 -4.245) 6.667 8.372 ( -5.280 -3.224 -6.654) 9.086 8.492 ( 8.875 -7.508 7.357) 13.757 8.880 ( 2.577 -3.766 -4.415) 6.350 8.916 ( 6.303 0.018 2.664) 6.843 11.159 ( -0.421 5.777 2.574) 6.339 11.255 ( 0.972 7.062 -6.564) 9.690 11.634 ( -1.581 -7.275 5.138) 9.046 11.748 ( 0.819 -6.373 -4.325) 7.745 13.816 ( -7.461 4.467 5.038) 10.051 13.943 ( -4.667 3.457 -4.570) 7.390 14.296 ( -9.371 -3.092 2.828) 10.265 14.452 ( -3.380 -5.110 -3.509) 7.060 15.240 ( -1.342 5.513 1.298) 5.821 15.364 ( 3.076 4.981 -2.827) 6.501 15.591 ( 0.478 -4.315 1.140) 4.489 15.673 ( 2.363 -3.189 -5.316) 6.634 16.322 ( -7.095 0.418 -0.798) 7.152 16.423 ( -1.011 -0.626 0.385) 1.250 16.538 ( -3.565 -1.683 2.007) 4.424 16.673 ( -0.163 -3.946 -0.792) 4.028 17.878 ( 3.507 0.750 3.140) 4.767 18.020 ( 3.051 -2.024 2.390) 4.372 18.097 ( 7.632 2.530 0.290) 8.045 18.303 ( 11.452 -2.516 -0.956) 11.764 27.659 ( -0.268 0.381 0.462) 0.656 27.701 ( 1.469 0.074 -0.943) 1.748 27.852 ( 0.491 -0.326 0.730) 0.938 27.858 ( -0.127 0.101 -1.271) 1.281 28.949 ( -2.105 4.460 1.980) 5.314 29.068 ( 2.837 5.478 -2.651) 6.715 29.274 ( -3.341 -1.751 5.484) 6.656 29.428 ( 1.289 -3.621 -5.045) 6.342 30.355 ( -5.972 3.357 6.084) 9.163 30.371 ( -6.932 3.285 -3.386) 8.385 30.932 ( -7.595 5.965 1.531) 9.778 31.183 ( -9.842 4.549 -3.263) 11.323 31.350 ( 3.441 -2.511 -0.094) 4.260 31.730 ( 17.668 11.016 6.722) 21.879 32.022 ( -13.901 -9.171 0.535) 16.662 32.793 ( 25.512 -14.511 -6.692) 30.103 ======================= Grid point 239 (127/168) ======================= q-point: ( 0.20 0.29 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.219 ( 27.891 9.880 -2.494) 29.694 2.368 ( 27.296 5.938 1.415) 27.970 2.760 ( -0.809 12.788 4.893) 13.716 2.823 ( 4.762 11.482 0.024) 12.431 2.978 ( -0.355 8.040 0.001) 8.047 3.133 ( -0.307 -8.657 4.559) 9.788 3.352 ( 3.853 4.747 -3.515) 7.053 3.657 ( 11.746 -0.973 -4.975) 12.793 3.859 ( 6.004 -0.497 -3.882) 7.167 4.108 ( 5.878 -7.727 -1.579) 9.836 4.156 ( 6.697 3.035 -11.286) 13.470 4.348 ( 4.845 -1.415 6.103) 7.920 4.476 ( 8.480 4.769 -5.743) 11.298 4.656 ( -3.579 5.020 -6.845) 9.212 4.731 ( -2.125 -2.055 1.320) 3.237 5.031 ( 6.399 -8.486 -3.485) 11.185 5.404 ( -6.693 6.770 5.366) 10.928 5.743 ( -1.582 0.709 -0.843) 1.928 5.777 ( -0.774 -2.459 2.969) 3.932 6.000 ( 0.131 0.982 -0.578) 1.147 6.078 ( -4.405 3.150 0.650) 5.454 6.349 ( -8.070 1.507 4.257) 9.248 6.487 ( 10.036 1.873 -2.028) 10.408 6.608 ( -5.203 0.035 -3.679) 6.372 6.736 ( 9.628 -1.281 -0.311) 9.717 6.816 ( 3.330 -5.333 7.313) 9.644 7.031 ( -4.934 5.782 4.582) 8.875 7.187 ( 0.549 2.821 -1.092) 3.075 7.523 ( 6.489 4.599 -0.431) 7.965 7.690 ( 3.393 3.439 -4.981) 6.939 8.035 ( -1.531 -0.646 -2.514) 3.013 8.132 ( 2.661 1.066 -1.760) 3.364 8.272 ( -2.038 -2.453 -2.930) 4.331 8.698 ( 4.122 -2.006 5.243) 6.965 8.846 ( 5.956 -7.069 -5.592) 10.803 9.095 ( 7.091 -4.438 4.493) 9.495 11.149 ( -1.839 6.845 -3.372) 7.849 11.213 ( 0.655 5.567 -0.495) 5.628 11.651 ( -2.201 -6.618 2.058) 7.272 11.700 ( -0.295 -7.039 -4.012) 8.107 13.736 ( -10.021 3.125 4.470) 11.409 13.814 ( -7.312 3.263 0.274) 8.011 14.163 ( -12.139 -1.804 4.128) 12.948 14.338 ( -7.148 -4.760 -1.825) 8.780 15.268 ( 1.286 5.062 2.877) 5.963 15.380 ( 2.301 5.277 -1.128) 5.867 15.609 ( 1.412 -3.953 -0.316) 4.209 15.692 ( 3.944 -3.241 -0.019) 5.105 16.213 ( -5.773 -0.199 -0.469) 5.796 16.318 ( -6.193 -2.946 -4.432) 8.166 16.582 ( -0.298 -0.348 5.885) 5.902 16.640 ( -3.078 -1.462 1.144) 3.594 18.002 ( 8.149 -0.404 1.581) 8.311 18.120 ( 6.520 -2.597 2.078) 7.319 18.264 ( 11.440 3.838 0.913) 12.101 18.477 ( 11.673 -2.339 -1.037) 11.950 27.672 ( 0.757 -0.274 1.092) 1.357 27.726 ( 1.519 0.075 0.607) 1.637 27.831 ( 0.345 0.659 -0.906) 1.172 27.901 ( 1.343 -1.379 2.822) 3.416 28.954 ( -1.302 5.102 3.616) 6.388 29.099 ( 3.419 4.716 -0.846) 5.887 29.285 ( -3.647 -1.757 5.781) 7.057 29.418 ( 2.104 -2.900 -1.394) 3.844 30.221 ( -7.506 3.282 -2.528) 8.573 30.296 ( -10.773 0.680 7.476) 13.131 30.846 ( -5.507 14.597 -2.669) 15.828 30.996 ( -6.331 2.841 -1.052) 7.019 31.338 ( -5.882 -5.859 -2.291) 8.612 31.859 ( -0.046 -4.709 -8.240) 9.491 32.090 ( 16.343 4.067 8.690) 18.951 33.056 ( 20.158 -12.970 -9.586) 25.815 ======================= Grid point 240 (128/168) ======================= q-point: ( 0.30 0.29 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.541 ( 17.923 9.245 -8.258) 21.793 2.674 ( 6.060 4.362 0.082) 7.467 2.756 ( 6.530 6.483 -2.753) 9.605 2.940 ( 3.283 15.548 7.901) 17.747 3.079 ( -0.665 -1.947 -7.490) 7.767 3.164 ( 15.649 5.458 7.293) 18.107 3.395 ( 2.129 -0.486 2.571) 3.373 3.709 ( 1.074 0.957 -6.338) 6.499 3.910 ( 2.667 -7.745 -3.447) 8.887 4.082 ( 8.285 -13.728 -10.035) 18.916 4.238 ( 10.121 11.525 -5.601) 16.329 4.444 ( 7.494 3.260 0.805) 8.212 4.526 ( -0.303 4.201 -5.507) 6.933 4.642 ( 5.932 0.847 2.594) 6.529 4.754 ( 3.022 0.134 2.608) 3.994 5.089 ( 7.872 -8.153 -4.918) 12.354 5.362 ( -3.451 7.259 2.645) 8.462 5.642 ( -4.295 0.933 -2.571) 5.092 5.800 ( 1.667 0.576 -1.769) 2.498 5.987 ( -3.235 2.198 3.270) 5.099 6.141 ( 5.322 4.304 4.750) 8.331 6.252 ( -6.552 -0.783 1.706) 6.815 6.534 ( 5.964 5.229 -10.062) 12.812 6.611 ( 1.271 -6.546 5.955) 8.940 6.883 ( 7.449 -2.740 -2.806) 8.418 6.917 ( -1.559 1.877 7.643) 8.023 7.058 ( 0.901 0.587 4.503) 4.630 7.196 ( 2.806 2.023 -1.826) 3.911 7.569 ( 3.489 3.005 -4.612) 6.518 7.686 ( -0.742 3.234 1.086) 3.491 7.952 ( -1.382 -1.857 -4.940) 5.456 8.159 ( 0.822 -2.259 -4.284) 4.913 8.213 ( -1.107 3.316 0.736) 3.572 8.696 ( 1.438 7.073 -7.446) 10.370 8.938 ( 2.281 -14.060 3.379) 14.640 9.209 ( 2.540 -5.781 1.538) 6.499 11.063 ( -1.193 5.321 -5.842) 7.992 11.232 ( -0.355 3.578 1.662) 3.961 11.604 ( -0.696 -5.379 -4.216) 6.869 11.670 ( -2.228 -5.761 1.399) 6.333 13.631 ( -7.085 3.004 2.844) 8.204 13.738 ( -7.350 1.532 6.021) 9.625 14.027 ( -11.706 -0.896 5.057) 12.783 14.202 ( -7.150 -4.143 -1.565) 8.411 15.316 ( 1.054 4.630 2.044) 5.169 15.423 ( 2.877 6.496 1.226) 7.209 15.650 ( 3.654 -4.458 0.902) 5.834 15.769 ( 3.603 -2.779 2.115) 5.018 16.131 ( -3.734 -1.382 -1.113) 4.134 16.175 ( -4.819 -2.395 -4.456) 6.987 16.579 ( -4.915 0.936 3.570) 6.146 16.663 ( -0.108 -1.292 4.262) 4.455 18.150 ( 7.905 -0.783 1.929) 8.174 18.259 ( 8.221 -2.509 1.477) 8.721 18.443 ( 8.736 3.801 1.861) 9.707 18.626 ( 8.247 -1.840 -0.843) 8.491 27.703 ( 1.074 -0.633 1.495) 1.947 27.748 ( 0.356 0.975 0.538) 1.170 27.852 ( 1.812 -0.522 1.275) 2.276 27.954 ( 1.050 -2.421 2.821) 3.863 28.990 ( -0.501 5.508 5.073) 7.505 29.146 ( 2.237 4.076 0.814) 4.721 29.297 ( -2.373 -0.464 5.125) 5.667 29.455 ( 1.987 -1.681 1.760) 3.142 30.082 ( -6.488 4.044 -2.363) 8.002 30.222 ( -10.043 0.105 8.836) 13.377 30.695 ( -4.801 9.547 -6.525) 12.520 30.947 ( -4.008 5.554 1.277) 6.967 31.178 ( -5.104 -5.333 -5.318) 9.098 31.792 ( 4.074 -2.118 -11.646) 12.519 32.418 ( 11.793 0.336 9.409) 15.090 33.209 ( 14.933 -11.544 -11.373) 22.036 ======================= Grid point 241 (129/168) ======================= q-point: ( 0.40 0.29 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.568 ( -7.809 6.258 0.193) 10.009 2.692 ( 8.027 8.512 -3.975) 12.356 2.874 ( 5.115 5.721 -3.766) 8.549 2.946 ( 0.499 6.072 -9.127) 10.974 3.123 ( 6.550 9.280 6.629) 13.151 3.431 ( 0.236 -8.306 2.434) 8.659 3.525 ( 12.330 3.136 7.643) 14.841 3.641 ( 3.051 2.598 -6.371) 7.526 3.823 ( -2.422 -6.101 -6.974) 9.577 4.132 ( 0.691 -1.424 -1.458) 2.152 4.270 ( 7.828 -2.135 -8.099) 11.464 4.563 ( 3.576 10.615 3.611) 11.769 4.609 ( 11.221 5.378 -0.229) 12.445 4.687 ( -0.966 -4.246 0.678) 4.407 4.864 ( 5.253 -1.632 3.287) 6.408 5.155 ( 6.011 -5.228 -4.466) 9.133 5.382 ( 3.097 5.649 1.358) 6.584 5.581 ( -0.651 2.487 -1.648) 3.054 5.817 ( 2.262 -0.201 -1.385) 2.660 5.984 ( -1.399 2.998 1.292) 3.551 6.160 ( -3.674 7.888 3.021) 9.211 6.307 ( 1.911 -5.178 7.571) 9.369 6.513 ( 5.558 5.265 -11.207) 13.572 6.693 ( -1.412 -7.648 10.071) 12.724 6.829 ( -6.469 -2.842 -5.057) 8.690 6.959 ( -2.692 4.802 5.298) 7.641 7.124 ( 1.205 -3.330 2.386) 4.270 7.234 ( 5.420 0.491 -3.964) 6.733 7.569 ( 5.636 2.402 -5.866) 8.481 7.672 ( -4.540 4.021 3.084) 6.804 7.905 ( 0.454 -3.890 -3.182) 5.046 8.044 ( -2.338 -5.822 -9.295) 11.214 8.278 ( 5.103 7.030 2.092) 8.936 8.625 ( 0.801 9.365 -7.579) 12.074 8.945 ( -3.813 -12.122 1.308) 12.775 9.203 ( -2.388 -5.169 -2.510) 6.222 11.001 ( 1.056 2.605 -4.320) 5.154 11.214 ( -2.117 -1.066 -1.927) 3.055 11.576 ( 2.216 -2.334 -1.973) 3.775 11.652 ( -2.477 -3.057 1.993) 4.410 13.606 ( -1.700 1.914 4.758) 5.403 13.722 ( -3.991 0.085 6.920) 7.989 13.915 ( -9.536 -0.475 4.330) 10.484 14.096 ( -3.129 -3.777 -2.350) 5.438 15.357 ( 1.323 5.555 2.210) 6.123 15.476 ( 2.011 6.817 0.931) 7.168 15.730 ( 3.741 -4.331 1.891) 6.027 15.837 ( 2.295 -2.115 1.275) 3.371 16.056 ( -2.326 -1.276 -2.952) 3.969 16.091 ( -2.401 -2.256 -1.047) 3.457 16.554 ( -4.072 2.032 4.700) 6.543 16.694 ( -0.583 -1.820 2.114) 2.849 18.278 ( 4.536 -0.784 2.952) 5.469 18.396 ( 7.143 -2.895 0.875) 7.757 18.564 ( 3.638 3.379 2.248) 5.450 18.706 ( 3.127 -1.050 -0.795) 3.393 27.732 ( 0.158 -0.437 1.590) 1.656 27.757 ( 0.669 1.442 0.176) 1.599 27.903 ( 1.713 -2.118 2.332) 3.586 27.991 ( 0.315 -3.082 1.736) 3.551 29.050 ( 0.312 5.124 5.540) 7.553 29.173 ( -1.025 2.936 2.124) 3.766 29.336 ( 0.041 2.469 4.781) 5.381 29.508 ( 1.973 -0.475 1.677) 2.633 29.983 ( -3.140 4.564 -0.631) 5.576 30.185 ( -7.926 0.462 8.829) 11.873 30.569 ( -2.218 6.873 -6.288) 9.576 30.861 ( -3.572 -3.383 -3.495) 6.035 31.123 ( 1.578 3.518 -0.836) 3.945 31.690 ( 0.590 -0.717 -12.911) 12.944 32.658 ( 4.809 -1.837 9.725) 11.003 33.268 ( 10.271 -10.898 -12.632) 19.592 ======================= Grid point 242 (130/168) ======================= q-point: (-0.50 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.420 ( -15.465 8.198 7.061) 18.874 2.734 ( -11.710 13.250 0.320) 17.686 2.785 ( 8.958 3.944 -6.578) 11.792 2.975 ( 7.509 2.019 -6.311) 10.014 3.249 ( 3.779 4.989 1.752) 6.500 3.449 ( -2.903 -6.594 4.788) 8.651 3.569 ( 0.057 -5.868 -8.592) 10.405 3.693 ( 5.877 0.255 -6.099) 8.474 3.823 ( 1.364 4.475 7.875) 9.160 4.070 ( -3.110 5.941 -4.037) 7.827 4.348 ( 5.864 -4.708 1.927) 7.763 4.551 ( -7.728 6.190 -3.524) 10.510 4.668 ( -2.101 -1.474 1.755) 3.109 4.743 ( 4.264 6.331 -0.858) 7.681 4.978 ( 1.500 -1.349 5.413) 5.777 5.138 ( -1.251 -3.745 -4.711) 6.147 5.461 ( 4.288 6.209 0.959) 7.606 5.542 ( -2.159 2.953 -3.225) 4.877 5.844 ( 1.709 -2.486 2.013) 3.627 5.925 ( -5.919 -0.283 -2.313) 6.361 6.209 ( 0.458 7.569 7.515) 10.676 6.397 ( -0.296 -5.370 5.664) 7.811 6.444 ( -0.242 3.286 -5.101) 6.073 6.627 ( -8.010 0.461 -4.513) 9.205 6.829 ( 0.663 -6.364 10.687) 12.456 6.982 ( -1.826 2.205 6.146) 6.780 7.128 ( -1.834 -4.405 -0.079) 4.773 7.255 ( 4.236 -1.166 -5.688) 7.187 7.606 ( 1.063 2.452 -2.900) 3.943 7.636 ( 1.856 1.718 -1.308) 2.848 7.836 ( -4.856 -3.150 -2.611) 6.350 7.944 ( 5.566 -6.638 -11.011) 14.010 8.393 ( 6.131 7.761 0.330) 9.895 8.559 ( 1.513 9.694 -5.711) 11.353 8.913 ( -1.890 -8.336 3.754) 9.335 9.094 ( -5.094 -4.518 -5.006) 8.452 11.002 ( 2.928 -0.136 -1.400) 3.249 11.137 ( -1.420 -3.741 -5.399) 6.720 11.620 ( 3.622 -0.474 0.420) 3.677 11.634 ( -2.107 -0.841 1.104) 2.523 13.665 ( -0.131 -0.021 5.710) 5.712 13.774 ( 1.799 -0.576 4.933) 5.282 13.841 ( -4.167 0.271 3.069) 5.182 14.064 ( 3.712 -3.669 -3.604) 6.342 15.403 ( 0.683 6.027 2.486) 6.555 15.501 ( 1.135 6.979 -1.021) 7.144 15.788 ( 0.919 -2.465 1.413) 2.986 15.867 ( 1.841 -1.894 -1.248) 2.921 16.022 ( -0.104 -0.766 0.269) 0.818 16.050 ( -1.752 -2.275 -0.758) 2.970 16.564 ( -2.153 1.625 5.653) 6.263 16.700 ( 0.312 -1.793 -0.247) 1.837 18.349 ( -0.443 -0.634 3.538) 3.622 18.478 ( 3.029 -3.199 -1.713) 4.727 18.611 ( -1.754 2.227 3.596) 4.579 18.709 ( -0.880 -0.161 -0.978) 1.326 27.742 ( -0.893 0.616 1.371) 1.749 27.775 ( 1.293 0.883 -0.220) 1.581 27.950 ( 0.623 -3.332 2.407) 4.157 28.003 ( -0.120 -3.258 0.169) 3.264 29.114 ( -0.761 4.020 4.776) 6.289 29.174 ( -0.883 2.826 2.286) 3.740 29.391 ( -0.311 5.534 4.200) 6.954 29.554 ( 4.828 0.573 -1.861) 5.206 29.990 ( 1.305 3.871 4.452) 6.042 30.160 ( -5.322 1.823 3.895) 6.842 30.482 ( -2.893 4.557 -1.161) 5.521 30.787 ( 1.483 -5.672 -7.185) 9.273 31.177 ( 2.308 4.375 4.450) 6.654 31.523 ( -3.074 0.496 -12.480) 12.863 32.784 ( -3.037 -2.451 9.829) 10.576 33.245 ( 6.084 -11.326 -13.615) 18.726 ======================= Grid point 243 (131/168) ======================= q-point: (-0.40 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.269 ( -18.130 10.169 13.393) 24.728 2.520 ( -16.870 15.210 2.173) 22.818 2.845 ( 5.365 -1.093 -3.870) 6.705 2.985 ( 2.227 1.590 -5.941) 6.541 3.314 ( 0.770 -1.261 3.707) 3.990 3.425 ( -2.513 -3.660 -6.355) 7.752 3.462 ( -1.832 -0.074 0.313) 1.860 3.711 ( 3.533 -5.714 -6.304) 9.213 3.879 ( -7.648 11.251 8.106) 15.836 3.954 ( -5.057 5.153 -4.464) 8.489 4.285 ( -14.909 1.460 -7.737) 16.861 4.442 ( -4.102 -2.254 5.744) 7.409 4.630 ( -5.406 1.369 3.841) 6.772 4.688 ( -6.198 8.691 -3.978) 11.392 4.957 ( -7.822 -0.736 0.989) 7.918 5.081 ( -1.754 -3.887 -0.830) 4.345 5.459 ( -2.003 3.076 -3.622) 5.156 5.527 ( 1.554 7.370 2.889) 8.068 5.784 ( -7.460 -0.445 -1.941) 7.722 5.905 ( 0.373 -4.247 4.595) 6.269 6.224 ( -6.713 -0.430 4.103) 7.880 6.319 ( -6.677 -3.588 -1.364) 7.702 6.510 ( -2.579 2.841 -2.403) 4.528 6.580 ( 7.809 6.381 7.372) 12.492 6.892 ( -4.526 -0.161 6.833) 8.197 7.045 ( -2.201 -4.228 1.667) 5.050 7.118 ( 6.080 -3.318 -1.517) 7.091 7.248 ( 2.968 -2.190 -3.703) 5.227 7.536 ( -4.264 2.165 -3.243) 5.778 7.649 ( -0.028 -5.457 1.036) 5.554 7.804 ( 3.427 -0.737 0.605) 3.557 7.948 ( 7.810 -5.042 -7.707) 12.076 8.389 ( -2.041 9.537 -4.253) 10.640 8.594 ( 7.670 7.349 -5.556) 11.988 8.949 ( -3.204 -6.399 1.792) 7.377 9.012 ( 2.068 -6.119 4.108) 7.655 11.017 ( -0.302 -2.109 -2.337) 3.163 11.105 ( 4.933 -3.154 -1.883) 6.150 11.596 ( -2.418 1.000 -0.883) 2.762 11.691 ( 3.888 -1.007 0.411) 4.037 13.677 ( -2.904 0.722 1.814) 3.500 13.875 ( 6.325 -0.802 0.878) 6.436 13.900 ( 5.231 -0.197 4.599) 6.968 14.136 ( 11.008 -3.486 -4.111) 12.257 15.420 ( -1.437 5.822 0.968) 6.074 15.493 ( 1.065 6.463 -2.772) 7.113 15.803 ( -0.085 -0.513 0.783) 0.940 15.871 ( 1.159 -2.295 -2.246) 3.414 16.017 ( -1.805 -1.584 -0.021) 2.402 16.045 ( 1.401 -0.697 1.513) 2.176 16.611 ( -0.422 0.595 5.633) 5.680 16.706 ( 2.064 -1.293 -1.793) 3.024 18.339 ( -5.686 -0.583 2.847) 6.385 18.439 ( -3.212 -2.405 -4.265) 5.856 18.578 ( -7.430 1.457 2.930) 8.119 18.681 ( -2.550 -1.471 0.550) 2.994 27.741 ( -0.838 1.381 0.993) 1.896 27.787 ( 0.933 0.714 -0.762) 1.400 27.961 ( -1.737 -3.106 0.598) 3.609 28.006 ( 0.871 -3.986 -0.006) 4.080 29.109 ( -3.542 4.169 2.019) 5.831 29.221 ( 1.380 1.593 3.143) 3.784 29.411 ( 0.494 8.729 -0.592) 8.763 29.639 ( 9.411 1.908 -2.816) 10.007 30.066 ( -2.434 4.148 -0.814) 4.878 30.141 ( 4.190 3.667 5.125) 7.568 30.478 ( -3.047 -0.014 9.588) 10.060 30.725 ( 2.700 -5.006 -9.702) 11.246 31.282 ( 1.553 1.633 7.102) 7.451 31.330 ( -4.359 2.485 -9.559) 10.796 32.788 ( -10.181 -2.568 9.032) 13.850 33.146 ( 0.824 -12.424 -13.431) 18.315 ======================= Grid point 244 (132/168) ======================= q-point: (-0.30 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.180 ( -16.794 12.192 19.477) 28.461 2.248 ( -22.966 14.702 4.626) 27.659 2.865 ( -2.582 -1.088 0.568) 2.859 2.889 ( -3.559 -2.887 -6.831) 8.226 3.267 ( -5.914 -0.790 -4.954) 7.755 3.351 ( -2.896 -6.275 -1.916) 7.172 3.473 ( -0.222 4.305 2.736) 5.105 3.621 ( -7.716 -4.901 -2.388) 9.447 3.739 ( -13.374 6.867 -6.237) 16.276 3.784 ( -15.784 18.157 9.656) 25.924 4.059 ( -4.478 -3.475 -1.233) 5.800 4.361 ( -8.790 0.157 3.259) 9.376 4.465 ( -13.794 -1.083 -0.948) 13.869 4.664 ( -1.384 5.716 2.546) 6.409 4.860 ( -3.403 -0.168 -0.373) 3.428 5.018 ( -4.285 -2.217 -1.089) 4.946 5.410 ( 0.100 3.302 -2.555) 4.177 5.582 ( -1.077 7.087 5.769) 9.202 5.681 ( -3.229 1.538 -0.436) 3.603 5.958 ( 0.076 -4.094 4.754) 6.275 6.153 ( -8.237 0.305 4.528) 9.405 6.214 ( -6.416 -3.588 1.437) 7.490 6.430 ( -1.117 3.319 -4.638) 5.812 6.726 ( -0.096 6.746 5.356) 8.614 6.888 ( -2.160 -4.616 -0.817) 5.161 7.019 ( 0.966 0.956 1.245) 1.843 7.151 ( 2.885 0.116 -4.309) 5.187 7.278 ( 0.648 -3.318 -3.254) 4.692 7.460 ( 0.271 -0.114 -0.850) 0.899 7.702 ( 0.513 -8.926 6.409) 11.001 7.880 ( 4.226 -0.224 -2.295) 4.814 7.998 ( 6.088 -2.390 -1.342) 6.677 8.307 ( -1.828 7.199 -3.612) 8.260 8.573 ( 0.164 6.676 -6.499) 9.318 8.959 ( 0.715 -7.554 2.719) 8.061 9.135 ( 2.712 -8.785 6.166) 11.070 10.989 ( 1.355 -0.378 -2.303) 2.699 11.198 ( 5.472 -3.460 1.767) 6.711 11.544 ( -1.920 2.013 -1.669) 3.244 11.743 ( 3.112 -2.265 -1.051) 3.989 13.667 ( 0.889 3.725 0.428) 3.853 13.978 ( 8.561 0.250 -3.651) 9.310 14.061 ( 8.278 -1.896 4.008) 9.391 14.290 ( 14.232 -3.205 -5.044) 15.435 15.388 ( -1.457 5.253 -1.689) 5.707 15.474 ( 0.053 5.557 -2.479) 6.085 15.781 ( -0.782 -2.463 -4.569) 5.249 15.866 ( 0.590 -2.405 -1.168) 2.738 16.014 ( 0.533 0.373 3.159) 3.225 16.096 ( 2.741 -0.598 1.792) 3.329 16.664 ( 0.097 -0.169 3.436) 3.442 16.725 ( 2.943 -0.737 -1.871) 3.565 18.241 ( -8.946 -0.553 0.590) 8.983 18.303 ( -7.473 -2.338 -3.775) 8.693 18.464 ( -10.585 1.832 2.173) 10.960 18.602 ( -9.033 -3.464 0.181) 9.676 27.740 ( -0.339 1.846 0.283) 1.898 27.785 ( 0.260 0.834 -1.251) 1.526 27.922 ( -2.430 -2.181 -1.275) 3.505 28.017 ( 0.374 -4.528 -0.404) 4.561 29.073 ( -3.109 4.814 1.074) 5.831 29.258 ( -0.623 -0.205 1.842) 1.955 29.396 ( 2.751 11.334 -6.951) 13.577 29.745 ( 9.148 2.355 -8.243) 12.537 29.995 ( -0.451 6.877 -0.220) 6.896 30.333 ( 7.407 4.895 8.579) 12.346 30.598 ( 2.035 -6.446 4.089) 7.900 30.699 ( 6.556 -4.040 3.905) 8.635 31.161 ( -4.241 4.547 -6.554) 9.034 31.389 ( -0.405 -0.526 8.008) 8.035 32.668 ( -15.422 -3.770 4.192) 16.420 32.964 ( -7.646 -11.566 -8.598) 16.314 ======================= Grid point 245 (133/168) ======================= q-point: (-0.20 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.933 ( -26.517 14.005 9.296) 31.396 2.186 ( -12.689 15.185 20.540) 28.522 2.577 ( -22.021 -2.776 -5.280) 22.815 2.906 ( 1.376 -3.106 3.069) 4.578 3.096 ( -11.130 -0.307 0.669) 11.154 3.217 ( -1.941 -0.116 -8.593) 8.811 3.430 ( -8.572 7.218 -8.042) 13.793 3.498 ( -2.692 -4.467 3.051) 6.043 3.557 ( -16.293 19.258 16.393) 30.085 3.705 ( -9.553 2.721 9.266) 13.584 4.012 ( 1.616 -3.847 -4.187) 5.911 4.285 ( -5.699 -1.929 3.666) 7.045 4.309 ( -5.055 -0.555 3.163) 5.988 4.630 ( -5.464 2.092 1.509) 6.042 4.829 ( 0.763 1.429 -2.743) 3.186 4.967 ( -0.513 -1.502 -0.399) 1.637 5.408 ( 0.858 4.277 1.146) 4.510 5.617 ( -3.625 4.045 7.436) 9.208 5.685 ( 2.259 2.275 1.385) 3.493 6.027 ( 1.356 -3.158 4.954) 6.029 6.060 ( -8.173 -0.844 2.376) 8.553 6.157 ( -4.385 0.584 3.612) 5.711 6.426 ( 6.046 5.097 -2.410) 8.267 6.722 ( -4.390 5.123 1.119) 6.839 6.826 ( -0.705 -6.497 -3.540) 7.432 7.064 ( 1.437 1.621 0.763) 2.297 7.163 ( -1.545 -0.088 -3.889) 4.185 7.180 ( 0.676 0.994 -3.608) 3.803 7.468 ( -0.655 -3.243 0.261) 3.319 7.740 ( -2.390 -9.972 -2.397) 10.531 7.886 ( 2.669 4.049 -0.845) 4.922 8.096 ( 3.729 -0.611 2.456) 4.507 8.259 ( -0.330 3.793 -2.030) 4.315 8.529 ( -0.415 5.028 0.751) 5.100 8.960 ( -3.320 -7.305 -0.795) 8.063 9.187 ( -2.377 -11.597 1.575) 11.943 11.013 ( 3.100 2.116 0.105) 3.755 11.289 ( 3.854 -0.826 0.442) 3.966 11.514 ( -0.602 -0.024 0.446) 0.749 11.766 ( 2.294 -3.743 -1.967) 4.811 13.723 ( 4.706 5.936 1.229) 7.674 14.051 ( 7.839 2.371 -6.328) 10.350 14.230 ( 8.081 -3.534 2.501) 9.167 14.436 ( 12.642 -3.132 -6.827) 14.705 15.350 ( -0.265 4.263 -2.470) 4.934 15.434 ( -1.399 5.657 -2.687) 6.417 15.694 ( -1.530 -3.886 -6.321) 7.576 15.835 ( -0.572 -3.362 -3.884) 5.169 16.130 ( 7.269 -0.092 5.522) 9.129 16.171 ( 4.012 -0.370 2.214) 4.597 16.688 ( -0.216 -0.422 0.892) 1.011 16.738 ( 1.132 -0.824 -2.382) 2.763 18.086 ( -9.114 -0.682 -2.398) 9.449 18.150 ( -8.347 -1.903 -0.348) 8.568 18.302 ( -11.941 1.467 0.625) 12.047 18.406 ( -15.884 -2.863 1.186) 16.184 27.730 ( -0.452 1.318 -1.277) 1.890 27.772 ( -0.067 1.605 -1.133) 1.966 27.864 ( -2.333 -1.280 -1.928) 3.286 28.004 ( -0.487 -4.095 -1.827) 4.510 29.038 ( -2.709 4.737 0.681) 5.499 29.239 ( -1.509 1.827 -2.744) 3.626 29.333 ( 0.417 9.000 -7.203) 11.535 29.696 ( 2.111 0.397 -11.907) 12.099 30.090 ( 6.547 8.095 3.882) 11.112 30.551 ( 5.288 8.508 10.204) 14.299 30.612 ( 9.409 -7.264 -6.993) 13.792 31.049 ( 0.713 4.998 -3.638) 6.223 31.070 ( 15.603 -6.810 15.528) 23.042 31.455 ( -1.897 -3.009 8.891) 9.576 32.377 ( -21.512 -4.086 -4.640) 22.383 32.747 ( -14.641 -7.983 2.200) 16.821 ======================= Grid point 246 (134/168) ======================= q-point: (-0.10 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.655 ( -20.850 13.950 8.657) 26.538 2.065 ( -18.152 4.884 -5.867) 19.691 2.340 ( -10.339 13.354 18.253) 24.867 2.987 ( 2.683 1.702 3.007) 4.375 3.006 ( -6.110 -0.764 8.300) 10.335 3.170 ( 6.352 2.855 -5.278) 8.738 3.215 ( -9.123 1.939 -5.159) 10.659 3.444 ( -18.792 19.948 14.795) 31.144 3.453 ( -4.719 -2.374 1.390) 5.463 3.761 ( 4.277 0.365 8.346) 9.385 4.070 ( 7.039 -2.965 0.388) 7.648 4.253 ( -6.331 -4.456 4.242) 8.828 4.354 ( 5.015 -2.646 3.893) 6.878 4.557 ( -3.894 2.704 0.413) 4.759 4.831 ( 2.345 1.004 -1.267) 2.849 4.965 ( 0.858 -1.374 -1.593) 2.272 5.450 ( -1.493 4.045 5.438) 6.940 5.633 ( -4.586 1.234 5.417) 7.203 5.755 ( 2.249 0.236 4.150) 4.726 5.984 ( -2.984 -1.268 2.163) 3.897 6.104 ( 0.815 -3.888 3.613) 5.370 6.160 ( -2.068 3.914 5.492) 7.054 6.522 ( 7.756 7.883 -1.684) 11.186 6.633 ( -5.099 2.011 -2.589) 6.062 6.803 ( 2.016 -3.352 -2.820) 4.822 6.963 ( -7.641 -4.955 -7.166) 11.588 7.151 ( 2.860 2.856 3.001) 5.034 7.237 ( 7.733 3.141 -2.329) 8.666 7.470 ( 0.766 -1.525 1.414) 2.216 7.583 ( -7.716 -2.554 -8.232) 11.568 7.940 ( 1.070 1.945 2.921) 3.669 8.131 ( -0.721 0.504 -0.556) 1.041 8.255 ( 2.058 -0.713 -0.407) 2.215 8.582 ( 1.572 2.070 6.203) 6.725 8.827 ( -7.852 -6.019 -6.518) 11.847 9.109 ( -5.503 -9.303 -2.789) 11.162 11.073 ( 2.762 4.103 1.680) 5.223 11.319 ( 2.706 4.025 -3.639) 6.063 11.539 ( -0.188 -4.391 4.412) 6.227 11.774 ( 1.794 -5.147 -2.218) 5.885 13.813 ( 3.279 6.099 2.145) 7.249 14.073 ( 4.844 3.935 -7.109) 9.460 14.350 ( 3.749 -4.462 1.538) 6.027 14.518 ( 7.971 -3.690 -7.330) 11.440 15.320 ( -0.170 3.933 -2.485) 4.656 15.374 ( -1.567 6.187 -2.937) 7.026 15.615 ( -0.268 -4.416 -4.516) 6.322 15.776 ( 0.187 -3.630 -5.569) 6.650 16.261 ( 4.372 0.352 2.632) 5.115 16.333 ( 9.629 -2.793 3.701) 10.687 16.670 ( -2.321 -0.841 -1.162) 2.728 16.700 ( -1.380 -1.424 -2.859) 3.479 17.931 ( -8.033 0.753 -0.224) 8.071 18.032 ( -7.932 0.115 0.934) 7.987 18.147 ( -4.819 -0.643 -1.324) 5.039 18.193 ( -13.758 -1.626 4.169) 14.468 27.699 ( -0.934 1.091 -1.731) 2.249 27.748 ( -0.842 0.979 -2.196) 2.548 27.822 ( -0.614 0.130 -0.722) 0.957 27.962 ( -1.143 -2.857 -3.044) 4.328 29.004 ( -2.632 4.221 0.627) 5.014 29.151 ( -0.423 7.471 -8.116) 11.039 29.283 ( -2.226 1.307 0.726) 2.682 29.587 ( 0.453 -1.841 -10.145) 10.321 30.225 ( 4.924 7.112 3.582) 9.363 30.601 ( 1.010 2.384 -3.865) 4.652 30.843 ( 12.753 2.574 5.996) 14.326 31.052 ( 5.163 3.047 1.804) 6.260 31.305 ( -1.361 -2.264 0.619) 2.713 31.757 ( 22.140 -8.263 13.948) 27.441 31.948 ( -24.577 -0.162 -2.969) 24.756 32.555 ( -14.799 -7.737 4.304) 17.245 ======================= Grid point 247 (135/168) ======================= q-point: ( 0.00 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.803 ( 1.962 7.982 2.217) 8.513 1.879 ( 0.202 0.548 -2.175) 2.252 2.748 ( -2.458 10.410 14.406) 17.943 2.916 ( -6.564 -6.494 8.873) 12.806 3.047 ( -3.028 1.804 2.759) 4.476 3.093 ( 4.666 -2.687 3.362) 6.348 3.321 ( 3.291 7.335 -5.113) 9.528 3.444 ( 6.458 -3.394 -6.168) 9.553 3.708 ( 0.388 10.129 4.459) 11.074 3.901 ( 1.920 -8.372 1.346) 8.694 4.099 ( 1.770 4.790 1.209) 5.248 4.171 ( 1.917 -0.027 -0.364) 1.952 4.513 ( 5.329 0.061 6.717) 8.574 4.549 ( -1.101 -2.982 5.578) 6.420 4.861 ( -0.762 3.521 0.787) 3.688 4.936 ( 1.046 -1.500 -1.388) 2.296 5.532 ( -5.680 4.302 5.986) 9.306 5.595 ( -4.466 -0.914 3.225) 5.584 5.870 ( 1.244 1.054 5.330) 5.573 5.930 ( -2.616 -3.729 1.453) 4.782 6.120 ( -0.557 0.541 6.634) 6.679 6.172 ( -1.388 -3.318 5.855) 6.871 6.545 ( -4.156 2.603 -4.180) 6.444 6.640 ( -5.385 -5.965 -6.472) 10.318 6.791 ( 6.094 7.424 -2.850) 10.019 6.862 ( 7.463 0.666 -3.292) 8.184 7.254 ( -3.890 3.115 1.197) 5.126 7.321 ( -8.338 -2.374 -2.445) 9.007 7.445 ( 6.514 3.929 4.274) 8.725 7.533 ( 10.749 -2.971 -1.594) 11.265 8.019 ( -0.795 2.963 0.660) 3.138 8.076 ( -0.699 -2.294 -1.051) 2.618 8.289 ( 1.903 2.075 -1.582) 3.230 8.401 ( -2.649 -8.132 -5.719) 10.289 8.804 ( 1.302 4.120 0.971) 4.429 8.893 ( -0.843 -4.466 -2.111) 5.011 11.242 ( 0.532 6.022 3.856) 7.171 11.354 ( 1.450 -3.358 1.170) 3.840 11.533 ( 0.219 3.111 -1.335) 3.393 11.644 ( 1.685 -6.241 -4.125) 7.669 13.972 ( -2.654 6.099 1.626) 6.847 14.070 ( -1.577 -2.203 -2.709) 3.832 14.333 ( -0.909 1.609 -1.424) 2.332 14.415 ( 0.904 -5.195 -5.167) 7.383 15.379 ( -1.157 5.261 -0.884) 5.459 15.474 ( 1.690 2.681 -2.002) 3.748 15.492 ( 0.044 -0.842 -3.105) 3.217 15.617 ( 1.361 -6.085 -5.630) 8.401 16.383 ( 3.786 1.415 1.985) 4.503 16.408 ( 2.010 -0.952 0.843) 2.379 16.578 ( -4.134 -0.691 -1.589) 4.482 16.595 ( -2.775 -2.281 -1.467) 3.881 17.901 ( -5.491 2.894 4.138) 7.460 17.954 ( -4.157 -1.987 3.188) 5.603 18.071 ( 0.849 1.675 -0.324) 1.906 18.117 ( 4.668 -2.581 -1.002) 5.427 27.693 ( -0.801 1.056 -1.279) 1.841 27.708 ( -0.396 -0.346 -1.944) 2.014 27.838 ( 0.157 1.078 -0.116) 1.096 27.870 ( -0.330 -1.900 -1.695) 2.568 29.063 ( -2.973 4.639 1.981) 5.855 29.140 ( -2.029 -1.856 0.614) 2.817 29.301 ( -0.437 4.806 -5.212) 7.103 29.407 ( -0.185 -4.799 -7.813) 9.171 30.447 ( 0.896 5.711 1.126) 5.889 30.534 ( -2.169 -2.097 -3.057) 4.295 31.026 ( -0.828 1.712 2.545) 3.177 31.085 ( 0.503 -3.643 -0.392) 3.699 31.558 ( 6.097 10.963 9.947) 16.009 31.731 ( -5.227 -0.745 5.425) 7.570 32.007 ( 3.279 1.229 2.637) 4.384 32.204 ( 4.386 -13.039 -3.493) 14.193 ======================= Grid point 248 (136/168) ======================= q-point: ( 0.10 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.021 ( 20.858 5.174 0.081) 21.490 2.039 ( 22.153 3.525 -0.393) 22.435 2.852 ( -3.014 3.331 8.587) 9.691 2.919 ( -0.638 -3.200 4.997) 5.968 3.056 ( -0.174 9.564 3.787) 10.288 3.167 ( 0.632 -0.132 -0.535) 0.838 3.343 ( 6.053 6.900 -2.406) 9.489 3.488 ( 9.975 -5.410 -9.638) 14.888 3.843 ( 7.064 -1.271 4.872) 8.674 3.877 ( 0.145 -5.050 -5.056) 7.148 4.154 ( 4.087 4.870 0.708) 6.397 4.228 ( 7.211 -0.108 -3.128) 7.861 4.562 ( -0.593 2.142 -0.559) 2.292 4.659 ( 3.974 -6.000 2.303) 7.556 4.849 ( -1.584 5.825 1.165) 6.148 4.915 ( -1.137 -0.487 -2.094) 2.432 5.533 ( -3.679 5.360 7.063) 9.600 5.619 ( 0.860 -1.968 5.882) 6.262 5.867 ( -4.512 1.268 -0.432) 4.707 5.941 ( 1.681 -4.699 2.772) 5.709 6.173 ( -2.806 2.789 3.999) 5.625 6.251 ( 0.782 -3.543 5.640) 6.706 6.510 ( 1.694 -1.027 3.440) 3.970 6.533 ( -0.272 -3.588 -1.580) 3.930 6.755 ( -3.607 6.655 -5.975) 9.644 6.844 ( -2.128 -0.859 -9.210) 9.491 7.171 ( -4.464 4.516 3.364) 7.186 7.240 ( -4.244 -1.903 2.118) 5.111 7.559 ( 6.924 7.330 -2.478) 10.383 7.670 ( 8.755 -2.554 -4.395) 10.124 8.053 ( 2.760 1.759 1.591) 3.639 8.084 ( 3.427 -1.804 -1.272) 4.077 8.312 ( -0.265 -1.462 -4.420) 4.663 8.350 ( 5.981 -5.260 2.041) 8.223 8.852 ( 2.111 0.879 -0.855) 2.442 8.891 ( 4.148 -2.172 -0.269) 4.690 11.282 ( -0.541 5.990 3.219) 6.822 11.364 ( 0.945 0.849 -3.134) 3.382 11.524 ( -1.359 -0.746 1.529) 2.177 11.613 ( 0.611 -6.504 -4.764) 8.085 13.913 ( -8.399 4.594 3.601) 10.228 13.978 ( -7.353 -0.926 -0.582) 7.434 14.270 ( -5.945 1.399 0.098) 6.108 14.345 ( -3.807 -5.061 -2.837) 6.939 15.363 ( -0.842 6.267 1.293) 6.454 15.467 ( 0.908 2.245 -2.186) 3.262 15.497 ( 2.143 -2.247 -0.094) 3.106 15.588 ( 2.893 -4.968 -4.928) 7.572 16.344 ( -6.400 1.714 -1.597) 6.815 16.389 ( -4.879 -2.402 -2.043) 5.809 16.538 ( -0.341 1.640 3.151) 3.568 16.594 ( 0.387 -3.530 1.419) 3.824 17.911 ( 1.796 2.351 3.207) 4.363 17.966 ( 1.330 -2.838 3.262) 4.524 18.165 ( 10.404 3.720 -0.586) 11.064 18.240 ( 11.197 -3.527 -0.824) 11.768 27.676 ( -0.375 1.092 -0.002) 1.154 27.696 ( 0.533 -0.678 -0.416) 0.957 27.846 ( 0.506 0.008 0.297) 0.587 27.853 ( 0.245 -0.478 -0.866) 1.019 29.051 ( -2.478 5.109 3.471) 6.655 29.129 ( -0.731 -1.179 1.440) 2.000 29.265 ( -0.291 2.427 -0.428) 2.481 29.346 ( 1.088 -4.349 -4.040) 6.034 30.410 ( -7.442 1.744 2.049) 7.914 30.418 ( -7.747 1.034 -1.733) 8.006 31.050 ( 2.954 5.901 1.371) 6.740 31.173 ( 6.762 -5.443 -0.683) 8.708 31.435 ( -17.337 10.743 0.770) 20.410 31.685 ( -12.960 -12.271 2.972) 18.093 32.125 ( 16.699 15.889 -1.231) 23.083 32.469 ( 23.019 -16.840 -3.135) 28.693 ======================= Grid point 249 (137/168) ======================= q-point: ( 0.20 0.43 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.399 ( 26.873 6.487 -1.629) 27.693 2.452 ( 27.506 1.413 -0.608) 27.549 2.860 ( -1.126 4.222 0.771) 4.437 2.969 ( -0.709 -6.456 2.498) 6.958 3.127 ( 0.566 9.513 4.852) 10.694 3.150 ( 1.165 6.307 0.272) 6.419 3.415 ( 7.053 3.219 -5.003) 9.227 3.550 ( 12.881 -8.301 -8.875) 17.708 3.831 ( -0.199 -0.457 -3.974) 4.005 3.907 ( -1.297 -8.141 -2.948) 8.755 4.264 ( 12.078 5.313 -3.704) 13.705 4.351 ( 10.729 -1.404 0.599) 10.837 4.542 ( 3.036 6.530 -4.219) 8.346 4.704 ( 0.950 -5.407 1.426) 5.672 4.811 ( -3.659 6.182 -1.475) 7.334 4.885 ( 1.167 -3.691 -2.458) 4.586 5.550 ( -4.558 7.349 5.614) 10.310 5.692 ( -2.945 -5.878 4.749) 8.110 5.827 ( 1.292 7.312 0.039) 7.426 5.984 ( 3.056 -6.022 -0.878) 6.810 6.112 ( -5.524 5.935 0.651) 8.134 6.281 ( -4.685 -8.431 6.404) 11.577 6.557 ( -2.196 4.575 1.611) 5.325 6.648 ( 2.391 3.167 -7.223) 8.241 6.676 ( 5.999 -4.526 10.439) 12.862 6.737 ( 6.354 -2.158 -5.789) 8.862 7.152 ( -3.852 5.232 2.518) 6.968 7.215 ( -0.613 -0.632 0.327) 0.940 7.620 ( 6.448 4.635 -5.526) 9.675 7.701 ( 4.935 -2.555 -7.336) 9.203 8.056 ( -1.249 3.142 -3.023) 4.535 8.129 ( 1.125 -2.816 -1.447) 3.359 8.303 ( 2.473 6.942 0.821) 7.415 8.511 ( 7.412 -12.061 4.826) 14.957 8.859 ( 3.162 5.044 -3.870) 7.101 8.982 ( 5.306 -6.281 1.050) 8.289 11.288 ( -1.765 5.784 -1.889) 6.336 11.316 ( -0.463 3.572 -3.231) 4.839 11.531 ( -1.384 -3.982 3.145) 5.259 11.558 ( -0.572 -5.912 -3.992) 7.157 13.805 ( -11.238 3.265 4.958) 12.710 13.848 ( -10.242 -0.389 3.007) 10.681 14.161 ( -8.759 2.032 1.366) 9.095 14.237 ( -7.003 -4.820 -1.065) 8.568 15.384 ( 0.712 5.989 2.127) 6.395 15.479 ( 1.863 1.252 1.216) 2.552 15.527 ( 2.676 -1.071 -1.605) 3.299 15.610 ( 4.254 -4.736 -0.711) 6.405 16.221 ( -6.131 1.085 -2.027) 6.548 16.258 ( -6.339 -2.559 -3.473) 7.668 16.585 ( -0.731 0.665 4.837) 4.937 16.608 ( -1.562 -1.490 3.076) 3.758 18.016 ( 7.141 1.707 1.956) 7.598 18.064 ( 6.617 -2.720 2.188) 7.481 18.344 ( 11.809 3.861 0.320) 12.428 18.418 ( 11.817 -3.364 -0.452) 12.295 27.683 ( 0.300 1.174 1.196) 1.702 27.711 ( 0.782 -1.337 1.104) 1.902 27.849 ( 0.633 0.973 -0.261) 1.190 27.872 ( 1.049 -1.327 1.192) 2.069 29.066 ( -2.106 5.359 5.288) 7.818 29.147 ( -0.732 -1.463 3.319) 3.701 29.276 ( 0.700 2.231 1.679) 2.879 29.348 ( 2.154 -3.848 -0.123) 4.411 30.278 ( -8.160 2.039 -0.358) 8.419 30.301 ( -9.365 -0.308 3.196) 9.900 31.077 ( -9.344 5.533 -2.123) 11.064 31.170 ( 3.464 11.208 -2.228) 11.941 31.218 ( -11.088 -0.560 -1.645) 11.223 31.552 ( 0.856 -18.234 -3.544) 18.595 32.388 ( 16.671 17.905 -0.863) 24.480 32.749 ( 18.743 -16.800 -5.416) 25.746 ======================= Grid point 250 (138/168) ======================= q-point: ( 0.30 0.43 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.730 ( 14.576 7.760 -3.617) 16.904 2.774 ( 13.615 4.453 -2.946) 14.625 2.859 ( 4.577 3.347 -3.594) 6.714 2.963 ( 1.807 -7.013 -1.514) 7.399 3.180 ( 2.579 6.358 3.794) 7.840 3.228 ( 4.507 0.554 1.379) 4.746 3.480 ( 9.365 8.363 -3.377) 13.002 3.678 ( 11.002 -8.454 -5.745) 15.018 3.771 ( -2.213 -1.947 -1.407) 3.266 3.818 ( 1.365 -8.260 -6.911) 10.856 4.389 ( 7.418 4.749 -5.596) 10.436 4.497 ( 6.193 -5.078 -2.530) 8.399 4.594 ( 6.056 10.473 3.088) 12.486 4.744 ( 3.709 1.948 -1.314) 4.391 4.765 ( -2.038 2.297 4.293) 5.278 4.909 ( 7.171 -8.499 -2.577) 11.415 5.517 ( -4.566 7.832 2.664) 9.449 5.649 ( -4.327 -3.330 1.615) 5.694 5.858 ( 2.757 6.498 -2.068) 7.356 6.013 ( 1.037 -5.976 -1.861) 6.344 6.116 ( 0.724 6.129 7.731) 9.892 6.284 ( -4.224 -5.736 6.352) 9.544 6.535 ( 0.266 3.911 0.900) 4.022 6.609 ( 4.688 -0.524 -8.382) 9.618 6.848 ( 5.611 -0.385 -0.061) 5.624 6.884 ( 4.632 -3.701 7.961) 9.926 7.127 ( -0.836 5.572 -0.277) 5.641 7.210 ( 1.572 -1.568 -2.289) 3.189 7.626 ( 4.502 2.786 -7.727) 9.367 7.689 ( 3.334 -2.770 -5.026) 6.637 7.971 ( -3.751 3.753 -4.157) 6.741 8.067 ( -3.917 -4.967 -4.186) 7.585 8.374 ( 3.258 10.869 1.996) 11.521 8.638 ( 3.673 -14.448 1.417) 14.975 8.865 ( 2.386 9.176 -3.088) 9.971 9.055 ( 3.063 -8.915 -0.451) 9.437 11.184 ( -2.600 5.935 -7.246) 9.720 11.268 ( -2.746 -1.114 -3.617) 4.676 11.523 ( 0.615 -1.432 -0.256) 1.579 11.560 ( -0.749 -4.305 3.705) 5.729 13.697 ( -9.412 3.126 5.513) 11.347 13.745 ( -9.595 -1.161 6.394) 11.588 14.040 ( -8.729 2.357 1.864) 9.232 14.113 ( -7.159 -4.334 -0.620) 8.392 15.426 ( 2.054 5.860 1.539) 6.397 15.546 ( 3.012 -5.670 0.985) 6.495 15.562 ( 3.526 6.786 1.713) 7.837 15.687 ( 3.814 -5.222 2.216) 6.836 16.116 ( -4.286 -0.037 -1.987) 4.724 16.132 ( -4.717 -1.601 -3.046) 5.839 16.602 ( -2.899 1.334 3.945) 5.074 16.633 ( -1.198 -1.587 4.055) 4.516 18.158 ( 7.751 1.467 1.861) 8.105 18.203 ( 7.877 -2.691 1.712) 8.498 18.516 ( 8.815 3.358 0.922) 9.478 18.579 ( 8.612 -2.716 -0.052) 9.030 27.708 ( 0.544 1.114 1.927) 2.291 27.739 ( 0.520 -1.510 1.803) 2.408 27.863 ( 1.005 1.519 0.447) 1.876 27.904 ( 1.043 -2.320 1.306) 2.859 29.102 ( -1.943 4.908 6.326) 8.239 29.174 ( -1.968 -1.703 4.854) 5.508 29.325 ( 2.333 3.411 2.798) 4.990 29.402 ( 2.228 -3.447 3.087) 5.136 30.162 ( -6.808 3.369 0.608) 7.620 30.211 ( -7.741 -1.398 4.653) 9.139 30.850 ( -8.631 6.463 -6.739) 12.715 30.978 ( -11.170 -5.355 -6.317) 13.905 31.245 ( 4.905 13.805 -0.685) 14.667 31.571 ( 5.309 -16.004 -5.729) 17.808 32.608 ( 12.242 14.869 -0.393) 19.264 32.929 ( 13.519 -15.427 -6.996) 21.673 ======================= Grid point 251 (139/168) ======================= q-point: ( 0.40 0.43 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.721 ( -6.664 8.110 1.121) 10.557 2.831 ( 1.087 1.341 -5.373) 5.643 2.942 ( 10.171 2.435 -4.505) 11.387 3.010 ( 2.224 0.627 -0.895) 2.478 3.255 ( 4.245 0.998 -2.786) 5.175 3.288 ( 5.636 -2.374 -3.237) 6.920 3.577 ( 0.730 3.513 -2.682) 4.480 3.673 ( 0.923 -5.071 -7.177) 8.836 3.781 ( 8.059 5.870 5.064) 11.183 3.943 ( 11.685 -10.506 2.414) 15.898 4.346 ( -0.775 6.678 -6.653) 9.458 4.518 ( 0.706 -9.082 -3.550) 9.777 4.727 ( 1.797 6.608 7.163) 9.910 4.822 ( 4.203 6.675 2.989) 8.435 4.844 ( 7.244 1.611 1.390) 7.550 5.026 ( 7.499 -7.876 -0.373) 10.881 5.503 ( -0.899 7.195 3.085) 7.880 5.631 ( -1.144 -2.495 2.655) 3.819 5.857 ( 0.218 5.943 -3.347) 6.824 5.987 ( -0.783 -3.937 -3.693) 5.455 6.231 ( 0.800 3.152 9.574) 10.111 6.305 ( -0.894 -0.336 4.507) 4.607 6.577 ( 1.747 0.810 -4.666) 5.048 6.585 ( 0.197 -1.690 3.007) 3.455 6.834 ( -4.946 3.922 -1.859) 6.581 6.968 ( -2.150 -7.219 3.605) 8.351 7.114 ( 1.743 5.829 -3.208) 6.878 7.216 ( 3.898 -2.960 -4.985) 6.986 7.623 ( 6.936 3.509 -7.131) 10.548 7.704 ( 3.248 -2.609 -1.568) 4.451 7.855 ( -3.300 1.159 -6.319) 7.222 7.930 ( -5.629 -4.976 -6.286) 9.796 8.450 ( 3.917 9.905 2.175) 10.871 8.678 ( 1.478 -11.876 0.529) 11.980 8.846 ( -0.522 10.371 -3.443) 10.940 9.055 ( -0.669 -9.169 -3.119) 9.708 11.072 ( -1.293 4.195 -6.267) 7.652 11.160 ( -3.096 -3.959 -5.870) 7.727 11.558 ( 2.071 0.628 1.900) 2.880 11.593 ( -0.198 -2.502 3.163) 4.038 13.654 ( -5.119 2.592 6.896) 8.971 13.703 ( -6.108 -1.933 7.903) 10.174 13.939 ( -5.644 2.780 0.525) 6.313 14.013 ( -3.542 -4.125 -1.597) 5.667 15.482 ( 2.697 6.355 1.527) 7.071 15.588 ( 3.363 -0.707 -1.361) 3.696 15.659 ( 2.648 1.905 4.830) 5.829 15.765 ( 2.520 -4.996 2.234) 6.025 16.040 ( -2.621 -0.138 -1.577) 3.062 16.052 ( -2.715 -1.332 -0.910) 3.158 16.600 ( -2.610 2.422 3.451) 4.958 16.650 ( -1.330 -2.391 2.555) 3.743 18.286 ( 5.028 1.466 2.405) 5.763 18.333 ( 5.881 -2.961 1.609) 6.778 18.627 ( 3.763 2.743 1.041) 4.772 18.675 ( 3.606 -1.955 0.069) 4.103 27.739 ( 0.354 1.094 2.045) 2.346 27.766 ( 0.372 -0.928 1.583) 1.872 27.886 ( 0.826 0.909 0.862) 1.501 27.929 ( 0.592 -2.846 0.708) 2.992 29.145 ( -1.737 3.750 6.259) 7.500 29.194 ( -2.792 -0.850 5.087) 5.865 29.405 ( 3.004 3.915 3.533) 6.069 29.476 ( 2.161 -2.694 3.579) 4.974 30.086 ( -4.476 4.967 1.949) 6.964 30.165 ( -5.870 -2.503 5.731) 8.577 30.683 ( -2.600 4.483 -7.543) 9.152 30.774 ( -4.178 -4.620 -7.429) 9.695 31.291 ( 2.108 11.998 -0.678) 12.200 31.551 ( 1.558 -11.685 -7.345) 13.889 32.757 ( 6.546 10.370 0.564) 12.276 33.013 ( 8.091 -13.423 -7.698) 17.461 ======================= Grid point 252 (140/168) ======================= q-point: (-0.50 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.612 ( -10.958 10.017 4.637) 15.554 2.784 ( -1.884 -5.143 -1.631) 5.715 2.966 ( -5.620 8.153 -1.154) 9.970 3.016 ( 1.538 2.327 0.604) 2.854 3.269 ( 6.099 -1.669 -7.565) 9.860 3.328 ( 3.527 -5.440 -3.169) 7.216 3.519 ( -0.289 2.165 -4.558) 5.055 3.608 ( 1.710 -5.562 -6.594) 8.794 3.991 ( 6.064 8.465 6.998) 12.546 4.131 ( 4.711 -4.006 3.626) 7.169 4.270 ( 0.301 3.824 -3.176) 4.980 4.435 ( -5.264 -9.601 -5.449) 12.230 4.796 ( -4.004 7.266 6.447) 10.507 4.910 ( 0.379 -0.796 5.649) 5.718 4.949 ( 3.776 5.756 -1.588) 7.064 5.074 ( 0.461 -3.753 -2.841) 4.730 5.559 ( 0.587 5.684 6.055) 8.326 5.663 ( -0.456 0.898 3.808) 3.939 5.778 ( -5.085 1.347 -2.339) 5.757 5.885 ( -6.056 -4.175 -4.620) 8.686 6.311 ( -5.221 2.137 2.993) 6.386 6.341 ( -2.441 -1.057 5.116) 5.766 6.536 ( 2.079 6.117 3.152) 7.189 6.667 ( 2.787 -4.940 4.922) 7.510 6.741 ( -2.634 6.280 0.972) 6.879 6.937 ( -4.357 -9.412 0.933) 10.414 7.107 ( 2.645 4.969 -4.128) 6.981 7.209 ( 3.333 -3.812 -5.844) 7.733 7.654 ( 5.034 3.809 -9.203) 11.160 7.693 ( -5.391 3.229 -1.504) 6.462 7.766 ( -1.889 -3.579 -1.773) 4.418 7.788 ( 6.274 -7.595 -10.555) 14.438 8.556 ( 4.740 8.320 3.953) 10.359 8.733 ( 1.656 -8.958 4.956) 10.370 8.772 ( -1.139 10.455 -5.915) 12.066 8.965 ( -3.736 -8.091 -5.977) 10.730 11.012 ( 0.948 1.388 -3.738) 4.098 11.061 ( -0.912 -3.309 -5.250) 6.272 11.615 ( 2.330 0.039 1.340) 2.689 11.621 ( 0.353 -0.445 1.575) 1.675 13.682 ( -2.546 1.714 7.341) 7.956 13.729 ( -2.723 -2.695 8.238) 9.085 13.895 ( 2.001 3.934 -2.077) 4.878 13.981 ( 3.425 -4.306 -3.204) 6.367 15.533 ( 1.451 6.247 1.171) 6.519 15.611 ( 2.139 1.286 -2.670) 3.655 15.740 ( 1.230 0.082 3.787) 3.983 15.809 ( 1.484 -4.015 -0.124) 4.282 16.007 ( -1.159 -0.184 0.847) 1.447 16.018 ( -1.518 -1.041 0.602) 1.937 16.606 ( -1.183 2.371 3.006) 4.007 16.656 ( -0.179 -2.432 0.938) 2.613 18.358 ( 0.296 1.486 2.476) 2.903 18.408 ( 1.483 -3.223 0.647) 3.607 18.657 ( -1.593 2.123 1.460) 3.029 18.693 ( -1.159 -1.340 0.056) 1.773 27.763 ( 0.011 1.440 1.697) 2.225 27.787 ( 0.584 -0.270 0.746) 0.985 27.905 ( 0.182 -0.374 1.020) 1.102 27.937 ( 0.066 -2.865 -0.170) 2.871 29.184 ( -2.425 2.382 5.359) 6.346 29.205 ( -2.341 0.248 4.514) 5.091 29.495 ( 3.920 4.176 2.572) 6.279 29.551 ( 4.679 -1.279 0.811) 4.918 30.076 ( -1.487 4.330 4.817) 6.646 30.150 ( -4.035 -2.433 4.923) 6.815 30.580 ( -0.733 4.673 -6.198) 7.797 30.676 ( 0.990 -4.991 -6.781) 8.478 31.307 ( 0.275 7.922 0.778) 7.965 31.463 ( -1.680 -6.209 -7.093) 9.575 32.820 ( -0.114 6.114 1.597) 6.320 33.007 ( 2.469 -11.260 -7.746) 13.888 ======================= Grid point 253 (141/168) ======================= q-point: (-0.40 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.497 ( -13.357 11.886 9.146) 20.083 2.722 ( -7.645 -8.146 2.027) 11.354 2.826 ( -9.978 11.759 0.547) 15.432 3.003 ( -6.008 -2.585 2.098) 6.868 3.260 ( 2.622 -1.159 -6.798) 7.378 3.326 ( 2.306 -5.571 -5.103) 7.900 3.493 ( 1.544 3.126 -1.168) 3.678 3.581 ( 3.328 -5.454 -5.595) 8.492 4.061 ( -6.010 5.697 -4.110) 9.245 4.115 ( -0.265 7.539 1.779) 7.751 4.218 ( -11.975 -3.718 -6.722) 14.227 4.327 ( -0.654 -7.522 5.144) 9.137 4.737 ( -11.370 7.819 4.972) 14.668 4.858 ( -11.768 -0.882 -0.139) 11.802 4.951 ( -1.318 4.525 0.559) 4.746 5.025 ( -1.726 -1.876 -2.446) 3.533 5.568 ( -6.748 6.904 0.529) 9.669 5.665 ( -3.459 4.580 6.127) 8.395 5.730 ( -4.841 -5.517 -0.714) 7.374 5.773 ( -1.196 -5.244 5.837) 7.937 6.234 ( -7.860 1.092 4.185) 8.971 6.264 ( -9.387 -1.925 3.759) 10.293 6.648 ( -2.189 9.401 -4.318) 10.574 6.745 ( 11.553 8.791 6.629) 15.959 6.835 ( -1.567 -7.080 -1.747) 7.459 6.912 ( 6.819 -7.501 4.865) 11.244 7.106 ( 2.251 3.168 -2.083) 4.409 7.198 ( 2.826 -3.774 -4.100) 6.248 7.550 ( -6.069 -1.499 -4.291) 7.582 7.554 ( -2.953 -1.446 -4.935) 5.930 7.800 ( 5.780 0.438 -0.501) 5.818 7.843 ( 8.105 -4.190 -4.110) 10.007 8.592 ( -3.838 10.076 -2.978) 11.186 8.743 ( 4.179 6.854 -2.036) 8.281 8.790 ( -3.292 -8.673 -0.561) 9.293 8.883 ( 2.832 -6.502 2.758) 7.610 10.998 ( 0.978 0.470 -2.186) 2.441 11.036 ( 3.299 -3.068 -1.733) 4.827 11.627 ( 0.154 1.849 -0.722) 1.991 11.664 ( 2.508 -1.633 -0.286) 3.007 13.718 ( -1.076 3.170 4.288) 5.439 13.797 ( 1.233 -4.291 5.582) 7.148 13.967 ( 9.665 4.202 -2.255) 10.778 14.055 ( 10.662 -4.296 -3.451) 12.001 15.543 ( -0.919 5.557 -0.474) 5.653 15.594 ( 0.675 1.978 -3.726) 4.272 15.777 ( -0.031 -0.899 0.546) 1.052 15.811 ( 0.566 -3.209 -1.835) 3.740 16.007 ( -0.823 0.642 2.037) 2.289 16.028 ( 0.697 -1.051 1.998) 2.363 16.634 ( 0.458 1.601 2.720) 3.190 16.672 ( 1.543 -1.932 -0.004) 2.473 18.343 ( -5.015 1.082 1.306) 5.294 18.382 ( -4.103 -2.627 -1.497) 5.097 18.613 ( -6.586 1.821 2.109) 7.151 18.649 ( -5.176 -1.672 0.983) 5.528 27.778 ( 0.008 1.919 0.917) 2.127 27.799 ( 0.565 0.138 -0.309) 0.659 27.911 ( -0.825 -1.217 0.560) 1.573 27.931 ( -0.003 -2.922 -0.491) 2.963 29.184 ( -3.346 2.972 3.370) 5.602 29.225 ( -1.971 -0.993 4.008) 4.576 29.578 ( 6.530 6.533 -2.819) 9.657 29.655 ( 9.389 -1.055 -2.326) 9.730 30.133 ( -1.118 2.498 3.961) 4.814 30.169 ( 1.648 -0.756 6.743) 6.982 30.519 ( -1.584 3.854 -0.871) 4.257 30.617 ( 0.936 -5.324 -6.655) 8.574 31.327 ( -0.581 2.398 2.895) 3.804 31.358 ( -2.641 -0.127 -4.483) 5.205 32.786 ( -7.018 2.987 2.135) 7.921 32.916 ( -3.531 -9.381 -6.665) 12.037 ======================= Grid point 254 (142/168) ======================= q-point: (-0.30 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.419 ( -14.009 11.678 14.241) 23.139 2.536 ( -17.285 8.957 1.988) 19.569 2.734 ( -7.849 -5.287 5.762) 11.079 2.851 ( -15.582 -6.611 0.990) 16.955 3.193 ( -2.432 0.730 -4.661) 5.308 3.287 ( -1.301 -4.682 -3.322) 5.887 3.516 ( 0.404 1.921 -0.695) 2.082 3.551 ( -0.778 -1.800 -4.217) 4.651 3.855 ( -9.779 4.063 -7.996) 13.269 3.940 ( -5.416 -4.776 -6.193) 9.513 4.145 ( -6.266 11.937 6.914) 15.151 4.315 ( -7.049 -4.893 4.787) 9.826 4.555 ( -17.775 8.333 4.494) 20.140 4.685 ( -12.059 -2.653 4.043) 12.992 4.909 ( -0.806 2.821 -3.464) 4.539 4.957 ( -2.706 -2.868 -2.607) 4.727 5.493 ( -2.596 4.793 0.920) 5.528 5.615 ( -5.763 -5.527 3.901) 8.887 5.748 ( -0.975 5.728 5.462) 7.974 5.849 ( -0.342 -4.473 7.876) 9.064 6.175 ( -8.910 1.084 5.990) 10.791 6.187 ( -5.817 0.197 5.798) 8.215 6.548 ( -0.851 7.619 -7.100) 10.449 6.731 ( -2.541 -9.398 -6.391) 11.646 6.923 ( 4.440 10.958 -0.194) 11.825 7.070 ( 5.014 1.458 2.144) 5.645 7.141 ( 3.377 -1.707 -1.133) 3.950 7.201 ( 2.724 -3.048 -3.624) 5.463 7.439 ( -4.132 -0.780 -0.032) 4.205 7.512 ( -0.163 -7.963 1.102) 8.041 7.892 ( 5.296 1.518 0.724) 5.557 7.939 ( 6.688 -2.893 1.024) 7.358 8.473 ( -4.028 8.734 -4.594) 10.658 8.628 ( -5.624 -4.127 -3.952) 8.017 8.861 ( 3.925 1.792 0.865) 4.401 8.976 ( 0.996 -7.223 4.474) 8.554 11.014 ( 2.698 2.919 0.340) 3.989 11.101 ( 4.370 -5.177 1.867) 7.027 11.609 ( 0.180 3.817 -2.669) 4.661 11.685 ( 2.058 -3.370 -2.292) 4.565 13.768 ( 3.393 5.876 1.791) 7.018 13.894 ( 5.807 -6.106 1.697) 8.596 14.112 ( 11.437 4.575 -2.396) 12.549 14.208 ( 13.353 -4.564 -4.037) 14.678 15.500 ( -1.345 5.220 -3.095) 6.216 15.557 ( -0.430 1.097 -2.910) 3.140 15.739 ( -1.503 -0.246 -4.388) 4.645 15.793 ( -0.819 -4.155 -1.685) 4.558 16.042 ( 2.001 1.898 2.946) 4.035 16.077 ( 2.774 -1.365 1.858) 3.607 16.672 ( 0.880 0.991 1.639) 2.108 16.700 ( 2.061 -1.540 -0.395) 2.603 18.238 ( -8.523 0.400 -0.489) 8.546 18.260 ( -7.977 -1.692 -2.297) 8.472 18.502 ( -10.846 1.906 2.245) 11.238 18.544 ( -10.569 -2.338 1.652) 10.950 27.782 ( 0.122 1.886 -0.813) 2.058 27.797 ( 0.186 0.283 -0.775) 0.845 27.891 ( -1.457 -0.333 -0.661) 1.634 27.928 ( -0.161 -3.696 -0.138) 3.702 29.163 ( -3.299 3.868 2.161) 5.524 29.228 ( -2.638 -2.388 2.727) 4.483 29.613 ( 6.777 8.862 -10.408) 15.258 29.739 ( 8.172 -3.225 -10.237) 13.490 30.163 ( 2.813 9.162 2.257) 9.847 30.337 ( 7.495 -6.213 5.693) 11.278 30.533 ( 0.586 1.973 4.892) 5.307 30.610 ( 4.298 -4.452 5.181) 8.071 31.267 ( -3.435 5.273 -2.621) 6.817 31.355 ( -2.070 -3.041 3.864) 5.335 32.646 ( -12.821 2.110 0.245) 12.995 32.756 ( -9.989 -8.269 -2.211) 13.154 ======================= Grid point 255 (143/168) ======================= q-point: (-0.20 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.216 ( -24.184 12.939 5.900) 28.055 2.402 ( -17.205 -0.606 6.204) 18.300 2.545 ( -15.314 5.642 9.712) 18.991 2.760 ( -5.037 -10.817 10.769) 16.074 3.088 ( -6.981 3.495 0.080) 7.808 3.203 ( -5.346 -4.612 -1.985) 7.334 3.431 ( -2.858 1.224 -3.696) 4.830 3.504 ( -0.700 -3.382 -5.390) 6.401 3.700 ( -2.383 8.704 -0.547) 9.041 3.888 ( 1.443 -8.249 -2.641) 8.781 4.069 ( -13.251 17.321 7.032) 22.914 4.264 ( -6.250 -2.799 5.299) 8.659 4.380 ( -10.008 7.574 6.126) 13.966 4.560 ( -10.175 -7.499 5.430) 13.757 4.860 ( 0.137 1.604 -3.239) 3.617 4.921 ( 1.878 -3.168 -2.903) 4.689 5.505 ( 0.208 5.000 3.621) 6.177 5.611 ( -2.067 -4.737 5.574) 7.601 5.772 ( -3.137 6.793 4.690) 8.831 5.917 ( -2.514 -6.755 6.631) 9.794 6.104 ( -6.798 5.460 3.486) 9.390 6.183 ( -4.535 -0.611 6.665) 8.085 6.518 ( 5.668 4.468 -3.456) 8.002 6.655 ( 2.758 -8.781 -5.475) 10.709 6.895 ( -2.386 10.298 -5.737) 12.028 7.072 ( -2.801 -5.371 -7.958) 10.001 7.150 ( 0.384 4.111 2.286) 4.719 7.233 ( 4.708 -0.164 -1.083) 4.834 7.410 ( -2.946 0.352 3.793) 4.815 7.532 ( 0.827 -9.353 -0.861) 9.429 7.973 ( 3.168 4.100 1.514) 5.398 8.051 ( 4.008 -3.357 2.338) 5.727 8.380 ( -2.833 7.572 -2.623) 8.499 8.533 ( -4.140 -5.584 0.453) 6.966 8.880 ( -0.152 2.054 -2.524) 3.258 8.996 ( -2.660 -7.751 1.480) 8.327 11.085 ( 3.438 4.861 3.083) 6.705 11.202 ( 3.861 -6.066 3.903) 8.182 11.577 ( 0.508 4.867 -3.595) 6.072 11.679 ( 1.696 -4.762 -3.620) 6.218 13.861 ( 6.007 7.320 0.937) 9.515 14.005 ( 7.460 -6.157 -1.104) 9.735 14.247 ( 9.441 4.536 -3.070) 10.915 14.352 ( 11.445 -4.973 -5.678) 13.710 15.447 ( -0.331 4.877 -3.636) 6.092 15.517 ( -0.570 0.007 -2.517) 2.580 15.647 ( -2.364 1.577 -5.895) 6.544 15.741 ( -1.685 -5.480 -3.601) 6.770 16.141 ( 6.169 0.933 3.115) 6.974 16.160 ( 5.245 -0.760 1.850) 5.613 16.689 ( -0.208 0.640 0.078) 0.678 16.712 ( 0.299 -1.459 -1.377) 2.029 18.085 ( -8.613 0.726 -1.632) 8.796 18.112 ( -8.108 -1.721 -0.570) 8.308 18.331 ( -13.435 1.410 1.621) 13.605 18.362 ( -14.812 -1.672 2.057) 15.048 27.761 ( -0.317 1.562 -2.279) 2.780 27.784 ( -0.409 -0.454 -1.624) 1.735 27.860 ( -1.194 1.399 -0.621) 1.941 27.919 ( -0.423 -3.895 -0.834) 4.005 29.132 ( -3.368 4.278 1.460) 5.637 29.207 ( -3.155 -2.997 1.719) 4.678 29.539 ( 2.415 8.681 -14.362) 16.954 29.666 ( 1.822 -3.688 -13.924) 14.519 30.267 ( 6.728 8.891 0.873) 11.183 30.447 ( 7.067 -8.623 -3.171) 11.591 30.731 ( 10.456 8.968 13.820) 19.512 30.911 ( 15.240 -8.456 15.689) 23.450 31.182 ( -3.304 7.582 -2.234) 8.567 31.341 ( -4.753 -7.438 3.161) 9.376 32.402 ( -16.831 5.684 -1.313) 17.813 32.564 ( -14.638 -9.225 2.432) 17.472 ======================= Grid point 256 (144/168) ======================= q-point: (-0.10 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.918 ( -19.159 10.676 4.120) 22.317 2.065 ( -18.899 -3.647 -2.160) 19.368 2.616 ( -4.538 12.426 18.033) 22.365 2.850 ( -2.443 -10.769 13.507) 17.446 3.026 ( -3.355 2.674 4.706) 6.368 3.100 ( -5.082 -3.908 -0.672) 6.446 3.364 ( -1.528 4.130 -4.360) 6.197 3.441 ( 3.525 -0.606 -6.984) 7.847 3.707 ( -2.101 6.047 3.341) 7.221 3.844 ( -4.967 0.077 5.357) 7.306 4.034 ( 2.566 7.491 1.973) 8.160 4.207 ( -6.374 -3.192 2.582) 7.582 4.388 ( 0.238 4.587 6.370) 7.853 4.516 ( -4.265 -5.681 6.518) 9.641 4.851 ( 0.938 2.272 -0.244) 2.470 4.927 ( 2.197 -3.163 -2.009) 4.344 5.545 ( -3.063 5.046 5.376) 7.984 5.635 ( -4.521 -2.842 5.111) 7.392 5.792 ( -0.131 5.086 5.175) 7.257 5.924 ( -2.768 -6.227 4.116) 7.961 6.076 ( -2.024 3.863 4.126) 6.003 6.175 ( -5.213 -3.169 5.009) 7.893 6.618 ( 6.868 2.713 0.455) 7.399 6.674 ( 1.206 -2.035 -3.045) 3.856 6.787 ( 3.897 4.491 -7.476) 9.552 6.880 ( -5.044 -3.632 -11.834) 13.367 7.220 ( 2.582 4.368 5.028) 7.144 7.299 ( 5.040 -0.234 0.517) 5.072 7.425 ( -2.124 -0.388 4.932) 5.384 7.491 ( -1.029 -4.697 -5.648) 7.417 8.018 ( 0.217 4.340 1.553) 4.615 8.098 ( -0.259 -3.334 0.662) 3.409 8.315 ( -1.709 6.470 -2.528) 7.153 8.486 ( -3.308 -9.162 -0.136) 9.741 8.822 ( -1.566 4.621 -3.230) 5.851 8.946 ( -3.395 -7.015 -0.855) 7.841 11.174 ( 2.310 5.753 4.143) 7.456 11.296 ( 2.381 -5.416 3.683) 6.969 11.549 ( 0.927 4.710 -3.144) 5.738 11.662 ( 1.791 -5.713 -3.938) 7.166 13.951 ( 3.471 7.117 0.820) 7.961 14.080 ( 4.395 -4.279 -2.831) 6.756 14.327 ( 4.865 3.152 -2.825) 6.449 14.424 ( 6.575 -5.207 -6.356) 10.524 15.409 ( 0.037 4.603 -2.782) 5.379 15.486 ( -0.182 0.262 -1.854) 1.881 15.549 ( -1.132 2.222 -5.645) 6.171 15.672 ( -0.556 -6.317 -4.965) 8.054 16.273 ( 6.378 0.795 2.072) 6.753 16.294 ( 7.984 -1.286 2.574) 8.487 16.659 ( -2.884 -0.087 -1.481) 3.243 16.671 ( -2.671 -1.186 -2.293) 3.715 17.962 ( -6.034 2.150 0.638) 6.437 18.009 ( -5.751 -2.108 1.358) 6.274 18.148 ( -9.525 0.695 -0.013) 9.551 18.167 ( -11.798 -1.056 2.299) 12.066 27.726 ( -0.655 1.320 -2.297) 2.729 27.747 ( -1.089 -0.692 -2.427) 2.748 27.843 ( -0.354 1.880 -0.384) 1.952 27.897 ( -0.515 -3.196 -1.582) 3.603 29.095 ( -3.304 4.404 1.333) 5.665 29.173 ( -3.109 -2.847 1.008) 4.334 29.401 ( -0.132 7.411 -11.306) 13.519 29.524 ( -0.405 -4.493 -11.609) 12.454 30.375 ( 5.996 7.580 0.556) 9.681 30.527 ( 6.797 -6.865 -3.189) 10.173 31.015 ( -0.965 10.106 7.374) 12.547 31.106 ( 1.430 1.144 3.122) 3.619 31.278 ( 7.857 1.348 3.266) 8.614 31.457 ( 17.311 -14.701 13.536) 26.439 32.122 ( -16.278 11.347 -0.789) 19.859 32.357 ( -15.106 -11.113 2.258) 18.889 ======================= Grid point 287 (145/168) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 88 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.341 ( -6.309 0.000 -6.016) 8.717 1.341 ( 6.309 0.000 6.016) 8.717 2.176 ( 11.218 0.000 -21.260) 24.038 2.176 ( -11.218 0.000 21.260) 24.038 3.115 ( -2.136 0.000 -6.676) 7.010 3.115 ( 2.136 0.000 6.676) 7.010 3.350 ( -13.052 0.000 2.969) 13.386 3.350 ( 13.052 0.000 -2.969) 13.386 3.772 ( -8.982 0.000 -11.765) 14.802 3.772 ( 8.982 0.000 11.765) 14.802 4.125 ( 3.130 0.000 -14.094) 14.437 4.125 ( -3.130 0.000 14.094) 14.437 4.715 ( 7.854 0.000 -5.045) 9.335 4.715 ( -7.854 0.000 5.045) 9.335 5.031 ( 0.255 0.000 -1.360) 1.384 5.031 ( -0.255 0.000 1.360) 1.384 5.499 ( -4.521 0.000 -8.319) 9.468 5.499 ( 4.521 0.000 8.319) 9.468 5.918 ( 5.354 0.000 -8.440) 9.995 5.918 ( -5.354 0.000 8.440) 9.995 6.111 ( -4.816 0.000 1.277) 4.983 6.111 ( 4.816 0.000 -1.277) 4.983 6.480 ( 2.138 0.000 -9.751) 9.982 6.480 ( -2.138 0.000 9.751) 9.982 6.905 ( -0.157 0.000 -1.983) 1.989 6.905 ( 0.157 0.000 1.983) 1.989 7.057 ( -5.875 0.000 -1.057) 5.969 7.057 ( 5.875 0.000 1.057) 5.969 7.343 ( -10.715 0.000 0.507) 10.727 7.343 ( 10.715 0.000 -0.507) 10.727 8.116 ( 4.923 0.000 -4.062) 6.382 8.116 ( -4.923 0.000 4.062) 6.382 8.586 ( -11.315 0.000 -0.007) 11.315 8.586 ( 11.315 0.000 0.007) 11.315 8.896 ( 0.951 0.000 -12.683) 12.719 8.896 ( -0.951 0.000 12.683) 12.719 11.024 ( 0.049 0.000 -3.051) 3.051 11.024 ( -0.049 0.000 3.051) 3.051 11.873 ( 0.714 0.000 -3.619) 3.688 11.873 ( -0.714 0.000 3.619) 3.688 13.816 ( 1.800 0.000 -5.260) 5.560 13.816 ( -1.800 0.000 5.260) 5.560 14.539 ( 4.496 0.000 -3.421) 5.649 14.539 ( -4.496 0.000 3.421) 5.649 15.173 ( 3.830 0.000 -1.556) 4.134 15.173 ( -3.830 0.000 1.556) 4.134 15.692 ( -1.113 0.000 -1.138) 1.592 15.692 ( 1.113 0.000 1.138) 1.592 16.406 ( -4.222 0.000 -3.199) 5.297 16.406 ( 4.222 0.000 3.199) 5.297 16.708 ( 5.435 0.000 -2.779) 6.104 16.708 ( -5.435 0.000 2.779) 6.104 17.884 ( 2.024 0.000 -3.616) 4.144 17.884 ( -2.024 0.000 3.616) 4.144 18.190 ( -7.178 0.000 2.199) 7.507 18.190 ( 7.178 0.000 -2.199) 7.507 27.669 ( 0.013 0.000 -0.299) 0.299 27.669 ( -0.013 0.000 0.299) 0.299 27.836 ( -1.355 0.000 -2.873) 3.177 27.836 ( 1.355 0.000 2.873) 3.177 28.880 ( -1.873 0.000 -0.380) 1.912 28.880 ( 1.873 0.000 0.380) 1.912 29.416 ( 3.484 0.000 -7.217) 8.014 29.416 ( -3.484 0.000 7.217) 8.014 30.290 ( -2.398 0.000 -5.831) 6.305 30.290 ( 2.398 0.000 5.831) 6.305 31.161 ( 8.227 0.000 -4.020) 9.156 31.161 ( -8.227 0.000 4.020) 9.156 31.253 ( -9.999 0.000 -0.183) 10.001 31.253 ( 9.999 0.000 0.183) 10.001 32.639 ( 24.325 0.000 -9.356) 26.063 32.639 ( -24.325 0.000 9.356) 26.063 ======================= Grid point 289 (146/168) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.479 ( 27.405 0.000 -3.047) 27.574 1.702 ( 26.526 0.000 -0.172) 26.527 2.191 ( 20.198 0.000 -14.076) 24.619 2.299 ( -4.084 0.000 21.458) 21.843 3.022 ( 1.486 0.000 -9.514) 9.629 3.077 ( -10.840 0.000 0.153) 10.842 3.425 ( 12.226 0.000 9.979) 15.781 3.481 ( 1.535 0.000 -9.648) 9.769 3.603 ( 12.506 0.000 -5.865) 13.813 3.946 ( 1.681 0.000 -22.635) 22.698 4.014 ( 4.585 0.000 8.832) 9.951 4.179 ( -0.865 0.000 3.791) 3.889 4.576 ( -12.924 0.000 1.023) 12.964 4.706 ( 1.332 0.000 -7.717) 7.831 4.997 ( -0.657 0.000 -6.621) 6.653 5.010 ( 3.242 0.000 -6.045) 6.859 5.385 ( -3.917 0.000 -1.200) 4.097 5.690 ( 2.022 0.000 13.060) 13.216 5.878 ( 5.795 0.000 -12.938) 14.177 5.882 ( -6.185 0.000 -0.617) 6.216 6.013 ( -4.341 0.000 -3.869) 5.815 6.147 ( 2.610 0.000 -0.481) 2.654 6.409 ( 1.040 0.000 -5.624) 5.719 6.560 ( 1.151 0.000 6.927) 7.022 6.879 ( 0.075 0.000 1.520) 1.522 6.934 ( -2.586 0.000 8.871) 9.240 7.086 ( 2.462 0.000 4.222) 4.887 7.107 ( -13.353 0.000 5.020) 14.265 7.330 ( 13.650 0.000 2.652) 13.905 7.460 ( 6.075 0.000 -1.933) 6.376 8.094 ( -3.069 0.000 2.814) 4.164 8.130 ( 2.990 0.000 -5.701) 6.437 8.390 ( -8.343 0.000 -2.203) 8.629 8.577 ( 0.079 0.000 -11.752) 11.752 8.987 ( 13.954 0.000 -0.132) 13.954 9.141 ( 6.798 0.000 17.947) 19.191 10.985 ( -0.906 0.000 -2.407) 2.572 11.056 ( -0.398 0.000 3.640) 3.662 11.827 ( 0.083 0.000 -5.543) 5.544 11.885 ( -1.856 0.000 1.757) 2.556 13.746 ( -3.721 0.000 -4.508) 5.846 13.828 ( -4.518 0.000 6.427) 7.856 14.467 ( -10.645 0.000 5.115) 11.811 14.523 ( -2.615 0.000 -2.227) 3.435 15.162 ( -0.394 0.000 3.305) 3.328 15.220 ( 2.676 0.000 -0.013) 2.676 15.682 ( 0.052 0.000 1.311) 1.313 15.732 ( 1.275 0.000 2.218) 2.558 16.310 ( -4.339 0.000 -1.443) 4.572 16.461 ( -4.412 0.000 1.100) 4.547 16.647 ( -2.634 0.000 3.136) 4.096 16.713 ( -1.035 0.000 -1.787) 2.065 17.953 ( 10.506 0.000 -1.559) 10.621 17.956 ( 6.118 0.000 2.308) 6.539 18.156 ( 0.191 0.000 1.436) 1.449 18.319 ( 12.239 0.000 -2.541) 12.500 27.664 ( 0.377 0.000 -1.220) 1.277 27.679 ( 1.172 0.000 0.122) 1.178 27.819 ( 1.000 0.000 0.421) 1.085 27.914 ( 2.519 0.000 4.910) 5.519 28.854 ( -0.868 0.000 -0.149) 0.880 28.917 ( 2.448 0.000 0.186) 2.455 29.395 ( 3.582 0.000 -6.018) 7.003 29.446 ( -4.187 0.000 8.200) 9.207 30.170 ( -3.950 0.000 -6.464) 7.576 30.377 ( 0.935 0.000 4.742) 4.833 30.825 ( -24.591 0.000 4.085) 24.929 31.032 ( -6.755 0.000 -3.320) 7.527 31.368 ( 8.077 0.000 1.179) 8.162 31.585 ( 12.854 0.000 2.100) 13.024 32.396 ( -11.122 0.000 4.534) 12.010 32.874 ( 22.712 0.000 -14.325) 26.852 ======================= Grid point 290 (147/168) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.929 ( 19.419 0.000 -18.298) 26.682 1.940 ( 34.235 0.000 -7.676) 35.085 2.521 ( 0.733 0.000 19.823) 19.837 2.580 ( 29.855 0.000 2.537) 29.963 2.933 ( -7.840 0.000 4.733) 9.157 2.957 ( -0.553 0.000 0.378) 0.670 3.417 ( 9.563 0.000 -13.309) 16.389 3.709 ( -0.063 0.000 -18.033) 18.034 3.772 ( 13.716 0.000 9.825) 16.872 3.813 ( 23.366 0.000 -11.918) 26.230 4.042 ( -3.005 0.000 -2.505) 3.912 4.267 ( 4.677 0.000 3.120) 5.622 4.390 ( -10.105 0.000 -0.189) 10.107 4.624 ( 2.365 0.000 -8.826) 9.138 4.892 ( -1.282 0.000 -6.505) 6.630 5.005 ( 4.941 0.000 -5.566) 7.442 5.329 ( -3.380 0.000 1.498) 3.697 5.718 ( -5.755 0.000 -8.004) 9.858 5.806 ( -3.906 0.000 9.198) 9.993 5.830 ( 7.868 0.000 -13.378) 15.520 5.940 ( 0.114 0.000 -2.646) 2.648 6.207 ( 1.067 0.000 5.897) 5.993 6.406 ( 3.084 0.000 -0.578) 3.138 6.688 ( 9.771 0.000 0.100) 9.771 6.926 ( 2.372 0.000 1.091) 2.611 6.972 ( -3.977 0.000 4.306) 5.861 7.045 ( -4.301 0.000 11.831) 12.588 7.154 ( 0.632 0.000 3.081) 3.145 7.507 ( 1.966 0.000 -0.639) 2.068 7.550 ( 5.290 0.000 6.470) 8.358 8.070 ( -2.840 0.000 0.681) 2.921 8.104 ( 1.029 0.000 -1.221) 1.597 8.278 ( -3.453 0.000 -4.122) 5.377 8.432 ( -0.263 0.000 -12.483) 12.486 9.164 ( 8.367 0.000 -1.761) 8.550 9.430 ( 2.868 0.000 15.002) 15.274 10.948 ( -1.115 0.000 -0.907) 1.437 11.105 ( 0.974 0.000 4.350) 4.457 11.748 ( -0.958 0.000 -7.235) 7.298 11.852 ( -3.824 0.000 0.332) 3.838 13.624 ( -5.166 0.000 -2.537) 5.756 13.829 ( -5.398 0.000 7.289) 9.070 14.341 ( -13.547 0.000 6.651) 15.092 14.412 ( -7.798 0.000 -2.261) 8.119 15.229 ( 2.900 0.000 3.454) 4.510 15.246 ( 0.033 0.000 0.874) 0.874 15.730 ( 2.088 0.000 4.012) 4.523 15.778 ( 1.368 0.000 2.168) 2.564 16.236 ( -3.377 0.000 -1.346) 3.635 16.298 ( -9.472 0.000 -5.355) 10.881 16.662 ( -4.494 0.000 1.601) 4.771 16.703 ( 1.665 0.000 3.491) 3.868 18.101 ( 9.390 0.000 0.959) 9.439 18.153 ( 12.591 0.000 3.143) 12.978 18.223 ( 5.952 0.000 1.423) 6.120 18.494 ( 12.264 0.000 -1.199) 12.322 27.661 ( 0.914 0.000 -0.815) 1.225 27.709 ( 2.150 0.000 0.430) 2.193 27.867 ( 2.791 0.000 2.226) 3.570 28.013 ( 2.296 0.000 5.200) 5.684 28.854 ( 0.714 0.000 0.580) 0.920 28.961 ( 2.953 0.000 0.270) 2.965 29.393 ( 4.100 0.000 -4.959) 6.435 29.466 ( -5.746 0.000 8.712) 10.436 30.025 ( -4.676 0.000 -6.597) 8.086 30.414 ( -0.813 0.000 -1.259) 1.499 30.552 ( -18.938 0.000 10.549) 21.678 30.930 ( -3.242 0.000 0.017) 3.242 31.475 ( 5.646 0.000 -1.658) 5.884 31.499 ( -14.625 0.000 -7.909) 16.627 32.561 ( 14.981 0.000 11.954) 19.166 33.024 ( 19.591 0.000 -16.787) 25.799 ======================= Grid point 291 (148/168) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.023 ( 20.723 0.000 -18.016) 27.459 2.298 ( 27.564 0.000 -13.610) 30.741 2.726 ( -2.467 0.000 13.844) 14.062 2.732 ( -9.543 0.000 7.028) 11.851 2.999 ( -4.434 0.000 12.769) 13.517 3.204 ( 23.033 0.000 7.112) 24.106 3.414 ( 14.040 0.000 -22.380) 26.419 3.658 ( 8.386 0.000 1.890) 8.596 3.866 ( -0.483 0.000 -14.339) 14.347 4.031 ( -2.075 0.000 9.091) 9.325 4.035 ( 20.302 0.000 -10.780) 22.986 4.298 ( 3.102 0.000 -3.611) 4.760 4.307 ( -1.689 0.000 -0.052) 1.690 4.650 ( 9.776 0.000 -4.998) 10.980 4.879 ( 6.304 0.000 0.073) 6.304 5.044 ( 5.670 0.000 -2.591) 6.234 5.331 ( -0.146 0.000 4.328) 4.331 5.608 ( 2.785 0.000 -5.054) 5.771 5.768 ( 4.843 0.000 -14.418) 15.209 5.834 ( -3.744 0.000 5.832) 6.930 5.949 ( 2.736 0.000 -0.314) 2.754 6.301 ( -1.480 0.000 10.034) 10.142 6.486 ( 5.551 0.000 2.621) 6.138 6.846 ( 14.852 0.000 -7.894) 16.819 6.939 ( -1.492 0.000 0.197) 1.505 7.003 ( 1.012 0.000 4.319) 4.436 7.107 ( -3.847 0.000 8.980) 9.769 7.191 ( 0.602 0.000 2.669) 2.736 7.492 ( -2.525 0.000 -1.539) 2.957 7.642 ( -2.879 0.000 7.841) 8.353 8.021 ( -2.427 0.000 -2.227) 3.294 8.146 ( -4.663 0.000 -7.740) 9.036 8.160 ( 0.088 0.000 7.397) 7.398 8.300 ( 1.247 0.000 -11.025) 11.095 9.198 ( 1.396 0.000 -4.615) 4.821 9.492 ( -8.897 0.000 3.398) 9.523 10.942 ( -0.146 0.000 2.085) 2.091 11.179 ( 2.152 0.000 3.114) 3.785 11.643 ( -1.381 0.000 -6.908) 7.044 11.787 ( -4.396 0.000 0.249) 4.403 13.570 ( -0.333 0.000 1.414) 1.453 13.823 ( -5.577 0.000 6.479) 8.549 14.210 ( -13.229 0.000 7.257) 15.089 14.253 ( -7.760 0.000 -3.223) 8.402 15.252 ( -0.406 0.000 1.370) 1.429 15.300 ( 1.854 0.000 1.878) 2.639 15.817 ( 2.521 0.000 3.149) 4.034 15.820 ( 0.751 0.000 1.737) 1.893 16.112 ( -4.704 0.000 -6.030) 7.648 16.170 ( -2.296 0.000 -2.441) 3.351 16.627 ( -4.635 0.000 5.078) 6.876 16.739 ( 0.290 0.000 0.025) 0.291 18.258 ( 9.207 0.000 0.650) 9.230 18.357 ( 8.026 0.000 2.184) 8.318 18.363 ( 8.319 0.000 3.234) 8.926 18.648 ( 6.572 0.000 1.139) 6.670 27.677 ( 1.594 0.000 0.282) 1.619 27.747 ( 1.748 0.000 0.361) 1.784 27.945 ( 3.474 0.000 2.545) 4.306 28.090 ( 0.756 0.000 3.688) 3.765 28.892 ( 2.581 0.000 1.440) 2.955 29.016 ( 2.821 0.000 1.100) 3.028 29.404 ( 4.367 0.000 -5.062) 6.685 29.462 ( -7.492 0.000 8.631) 11.429 29.897 ( -2.666 0.000 -4.320) 5.077 30.275 ( -8.565 0.000 -3.946) 9.431 30.521 ( -7.040 0.000 13.181) 14.943 30.937 ( 0.458 0.000 4.102) 4.128 31.157 ( -9.187 0.000 -14.373) 17.058 31.497 ( 1.888 0.000 -4.950) 5.298 32.925 ( 7.382 0.000 16.773) 18.325 33.114 ( 17.136 0.000 -17.210) 24.286 ======================= Grid point 292 (149/168) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.179 ( 22.222 0.000 -13.491) 25.997 2.494 ( 15.897 0.000 -13.460) 20.830 2.666 ( -13.910 0.000 14.303) 19.952 2.671 ( -11.925 0.000 2.934) 12.281 3.150 ( 0.296 0.000 16.150) 16.153 3.453 ( 16.012 0.000 -10.529) 19.164 3.524 ( 6.882 0.000 3.763) 7.843 3.642 ( -1.862 0.000 -17.332) 17.431 3.845 ( 6.788 0.000 4.566) 8.181 4.032 ( -5.176 0.000 2.541) 5.766 4.171 ( 4.976 0.000 1.869) 5.316 4.272 ( -1.475 0.000 -0.353) 1.517 4.444 ( 22.358 0.000 -9.435) 24.268 4.720 ( 1.820 0.000 -0.230) 1.834 5.039 ( 7.429 0.000 3.407) 8.173 5.097 ( 5.349 0.000 -3.821) 6.573 5.410 ( 0.771 0.000 7.048) 7.090 5.642 ( 0.243 0.000 -13.526) 13.529 5.696 ( 9.422 0.000 1.603) 9.557 5.843 ( -2.887 0.000 4.614) 5.443 6.011 ( 4.961 0.000 1.240) 5.114 6.335 ( -7.835 0.000 5.249) 9.431 6.628 ( 6.854 0.000 4.407) 8.148 6.841 ( -0.572 0.000 -6.518) 6.543 7.026 ( 12.949 0.000 -5.334) 14.005 7.050 ( -0.005 0.000 1.832) 1.832 7.161 ( -1.359 0.000 8.207) 8.319 7.221 ( -3.081 0.000 3.142) 4.401 7.444 ( 2.849 0.000 -2.283) 3.651 7.653 ( -7.760 0.000 7.800) 11.003 7.937 ( -1.453 0.000 -6.473) 6.635 7.964 ( -7.600 0.000 -4.548) 8.857 8.238 ( 4.134 0.000 -7.408) 8.483 8.239 ( -2.827 0.000 7.948) 8.436 9.141 ( -0.953 0.000 -3.849) 3.965 9.296 ( -11.413 0.000 -4.776) 12.373 10.995 ( 1.456 0.000 5.348) 5.543 11.197 ( -0.670 0.000 -3.463) 3.527 11.590 ( 1.819 0.000 -1.440) 2.320 11.722 ( -4.234 0.000 -0.183) 4.238 13.634 ( 3.779 0.000 3.759) 5.331 13.801 ( -4.481 0.000 3.124) 5.462 14.099 ( -10.821 0.000 6.858) 12.811 14.116 ( -3.300 0.000 -4.961) 5.959 15.274 ( 0.927 0.000 1.761) 1.990 15.327 ( 0.065 0.000 0.267) 0.275 15.834 ( -1.340 0.000 1.630) 2.111 15.843 ( 1.393 0.000 -3.438) 3.709 16.048 ( -0.092 0.000 0.772) 0.777 16.115 ( -0.919 0.000 -2.642) 2.798 16.634 ( -3.040 0.000 6.452) 7.133 16.719 ( -0.031 0.000 -3.389) 3.390 18.392 ( 6.432 0.000 1.004) 6.510 18.471 ( 2.973 0.000 0.356) 2.994 18.510 ( 7.698 0.000 2.567) 8.115 18.703 ( -0.892 0.000 0.482) 1.014 27.712 ( 1.760 0.000 1.002) 2.025 27.764 ( 0.250 0.000 -0.333) 0.417 28.026 ( 3.333 0.000 1.994) 3.884 28.115 ( -1.127 0.000 1.265) 1.694 28.963 ( 3.957 0.000 1.717) 4.314 29.058 ( 0.341 0.000 1.136) 1.186 29.403 ( 4.650 0.000 -7.219) 8.587 29.433 ( -8.248 0.000 8.261) 11.674 29.871 ( 1.951 0.000 0.924) 2.159 30.106 ( -6.918 0.000 -4.380) 8.188 30.580 ( -5.230 0.000 13.945) 14.893 30.850 ( -1.985 0.000 -15.163) 15.292 31.095 ( 4.470 0.000 6.982) 8.290 31.422 ( -1.987 0.000 -7.877) 8.124 33.139 ( -4.154 0.000 16.608) 17.120 33.173 ( 14.917 0.000 -16.458) 22.212 ======================= Grid point 293 (150/168) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 84 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.394 ( 19.606 0.000 -7.467) 20.980 2.394 ( -19.606 0.000 7.467) 20.980 2.625 ( 14.833 0.000 -17.661) 23.064 2.625 ( -14.833 0.000 17.661) 23.064 3.366 ( -2.422 0.000 -18.137) 18.298 3.366 ( 2.422 0.000 18.137) 18.298 3.583 ( 8.877 0.000 -5.040) 10.208 3.583 ( -8.877 0.000 5.040) 10.208 3.960 ( -4.524 0.000 -1.399) 4.735 3.960 ( 4.524 0.000 1.399) 4.735 4.245 ( -0.718 0.000 -2.753) 2.845 4.245 ( 0.718 0.000 2.753) 2.845 4.662 ( -12.350 0.000 3.444) 12.821 4.662 ( 12.350 0.000 -3.444) 12.821 5.119 ( 2.734 0.000 -4.480) 5.249 5.119 ( -2.734 0.000 4.480) 5.249 5.506 ( -0.276 0.000 -9.286) 9.290 5.506 ( 0.276 0.000 9.286) 9.290 5.828 ( -4.619 0.000 1.001) 4.726 5.828 ( 4.619 0.000 -1.001) 4.726 6.169 ( -11.632 0.000 -3.191) 12.062 6.169 ( 11.632 0.000 3.191) 12.062 6.762 ( -3.473 0.000 -3.551) 4.967 6.762 ( 3.473 0.000 3.551) 4.967 7.082 ( 2.091 0.000 -6.350) 6.685 7.082 ( -2.091 0.000 6.350) 6.685 7.202 ( 1.002 0.000 -1.123) 1.506 7.202 ( -1.002 0.000 1.123) 1.506 7.553 ( -10.699 0.000 1.426) 10.794 7.553 ( 10.699 0.000 -1.426) 10.794 7.874 ( 3.631 0.000 -5.191) 6.335 7.874 ( -3.631 0.000 5.191) 6.335 8.244 ( 5.878 0.000 -6.260) 8.588 8.244 ( -5.878 0.000 6.260) 8.588 9.134 ( -3.324 0.000 -1.492) 3.644 9.134 ( 3.324 0.000 1.492) 3.644 11.101 ( -2.499 0.000 -6.913) 7.351 11.101 ( 2.499 0.000 6.913) 7.351 11.647 ( -4.183 0.000 -1.252) 4.366 11.647 ( 4.183 0.000 1.252) 4.366 13.740 ( -4.534 0.000 -1.904) 4.917 13.740 ( 4.534 0.000 1.904) 4.917 14.053 ( 4.207 0.000 -6.581) 7.811 14.053 ( -4.207 0.000 6.581) 7.811 15.311 ( -1.177 0.000 -1.253) 1.719 15.311 ( 1.177 0.000 1.253) 1.719 15.829 ( 2.273 0.000 -3.241) 3.959 15.829 ( -2.273 0.000 3.241) 3.959 16.076 ( -0.348 0.000 -2.636) 2.659 16.076 ( 0.348 0.000 2.636) 2.659 16.673 ( 1.105 0.000 -5.676) 5.782 16.673 ( -1.105 0.000 5.676) 5.782 18.472 ( -2.037 0.000 -1.056) 2.294 18.472 ( 2.037 0.000 1.056) 2.294 18.641 ( -5.600 0.000 -1.612) 5.827 18.641 ( 5.600 0.000 1.612) 5.827 27.748 ( -1.129 0.000 -0.989) 1.501 27.748 ( 1.129 0.000 0.989) 1.501 28.088 ( -2.528 0.000 -0.727) 2.630 28.088 ( 2.528 0.000 0.727) 2.630 29.038 ( -3.261 0.000 -0.567) 3.310 29.038 ( 3.261 0.000 0.567) 3.310 29.404 ( 7.063 0.000 -8.147) 10.782 29.404 ( -7.063 0.000 8.147) 10.782 29.962 ( -5.083 0.000 -4.219) 6.605 29.962 ( 5.083 0.000 4.219) 6.605 30.682 ( 2.946 0.000 -15.493) 15.770 30.682 ( -2.946 0.000 15.493) 15.770 31.268 ( -4.556 0.000 -9.294) 10.350 31.268 ( 4.556 0.000 9.294) 10.350 33.197 ( 11.319 0.000 -15.928) 19.540 33.197 ( -11.319 0.000 15.928) 19.540 ======================= Grid point 299 (151/168) ======================= q-point: ( 0.00 0.14 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 148 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.450 ( -5.203 9.604 -6.596) 12.760 1.450 ( 5.203 9.604 6.596) 12.760 2.383 ( 8.507 17.942 -18.892) 27.408 2.383 ( -8.507 17.942 18.892) 27.408 3.105 ( 0.674 -0.773 -4.368) 4.487 3.105 ( -0.674 -0.773 4.368) 4.487 3.321 ( -1.858 -2.600 -1.001) 3.349 3.321 ( 1.858 -2.600 1.001) 3.349 3.835 ( -10.395 5.018 -12.065) 16.698 3.835 ( 10.395 5.018 12.065) 16.698 4.124 ( 1.572 -0.240 -9.611) 9.742 4.124 ( -1.572 -0.240 9.611) 9.742 4.636 ( 4.337 -5.137 -5.771) 8.860 4.636 ( -4.337 -5.137 5.771) 8.860 4.972 ( -3.444 -5.095 -4.482) 7.609 4.972 ( 3.444 -5.095 4.482) 7.609 5.529 ( -3.335 2.029 -5.989) 7.149 5.529 ( 3.335 2.029 5.989) 7.149 5.934 ( 0.601 1.287 -6.661) 6.810 5.934 ( -0.601 1.287 6.661) 6.810 6.188 ( 2.527 5.438 -1.924) 6.298 6.188 ( -2.527 5.438 1.924) 6.298 6.476 ( 2.333 0.603 -8.462) 8.799 6.476 ( -2.333 0.603 8.462) 8.799 6.852 ( -5.617 -4.145 -2.404) 7.383 6.852 ( 5.617 -4.145 2.404) 7.383 7.112 ( -10.261 4.328 -2.344) 11.381 7.112 ( 10.261 4.328 2.344) 11.381 7.383 ( -10.954 3.599 -0.285) 11.534 7.383 ( 10.954 3.599 0.285) 11.534 8.095 ( 4.078 -1.819 -4.276) 6.183 8.095 ( -4.078 -1.819 4.276) 6.183 8.540 ( -9.846 -4.585 -6.329) 12.571 8.540 ( 9.846 -4.585 6.329) 12.571 8.881 ( -2.940 -1.097 -10.847) 11.292 8.881 ( 2.940 -1.097 10.847) 11.292 11.076 ( 0.089 4.754 -3.805) 6.090 11.076 ( -0.089 4.754 3.805) 6.090 11.821 ( 0.810 -4.835 -4.144) 6.419 11.821 ( -0.810 -4.835 4.144) 6.419 13.848 ( 1.776 3.011 -5.323) 6.368 13.848 ( -1.776 3.011 5.323) 6.368 14.506 ( 3.710 -3.090 -3.520) 5.976 14.506 ( -3.710 -3.090 3.520) 5.976 15.206 ( 3.346 3.097 -1.658) 4.851 15.206 ( -3.346 3.097 1.658) 4.851 15.672 ( -0.331 -1.978 -2.661) 3.332 15.672 ( 0.331 -1.978 2.661) 3.332 16.405 ( -4.359 -0.029 -2.796) 5.178 16.405 ( 4.359 -0.029 2.796) 5.178 16.682 ( 0.907 -2.448 -1.640) 3.083 16.682 ( -0.907 -2.448 1.640) 3.083 17.892 ( 1.811 0.882 -3.505) 4.043 17.892 ( -1.811 0.882 3.505) 4.043 18.174 ( 0.868 -1.497 -0.661) 1.852 18.174 ( -0.868 -1.497 0.661) 1.852 27.669 ( 0.334 0.057 -1.151) 1.200 27.669 ( -0.334 0.057 1.151) 1.200 27.846 ( -1.516 0.674 -2.868) 3.314 27.846 ( 1.516 0.674 2.868) 3.314 28.912 ( -1.244 3.191 0.194) 3.430 28.912 ( 1.244 3.191 -0.194) 3.430 29.403 ( 2.790 -1.320 -6.724) 7.398 29.403 ( -2.790 -1.320 6.724) 7.398 30.333 ( -2.774 3.800 -5.853) 7.510 30.333 ( 2.774 3.800 5.853) 7.510 31.142 ( -7.455 -1.651 -1.590) 7.799 31.142 ( 7.455 -1.651 1.590) 7.799 31.314 ( -13.469 5.859 -3.522) 15.105 31.314 ( 13.469 5.859 3.522) 15.105 32.560 ( -3.991 -7.467 -3.830) 9.292 32.560 ( 3.991 -7.467 3.830) 9.292 ======================= Grid point 301 (152/168) ======================= q-point: ( 0.10 0.14 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.562 ( 24.952 8.184 -4.734) 26.683 1.807 ( 26.369 7.943 4.576) 27.917 2.342 ( 13.033 14.091 -15.267) 24.525 2.502 ( -2.835 17.203 17.770) 24.895 3.050 ( -5.965 -0.637 -0.829) 6.056 3.093 ( 1.572 4.607 -6.926) 8.466 3.338 ( 3.351 -6.354 6.308) 9.561 3.511 ( 15.302 -3.869 -2.408) 15.966 3.599 ( 3.274 5.318 -10.296) 12.042 3.942 ( 3.369 1.037 -20.863) 21.159 4.138 ( 1.872 7.091 3.271) 8.030 4.167 ( 3.040 -0.423 8.154) 8.712 4.520 ( -9.295 -4.126 -1.431) 10.270 4.617 ( 0.281 -6.360 -6.661) 9.214 4.864 ( -2.116 -6.251 -4.270) 7.861 5.034 ( 3.407 -1.929 -3.540) 5.279 5.427 ( -4.984 3.275 -0.169) 5.966 5.697 ( 6.391 -0.333 4.884) 8.050 5.838 ( -2.033 -0.794 -7.763) 8.064 5.965 ( -2.717 4.111 2.964) 5.751 6.115 ( -3.908 5.324 -2.417) 7.032 6.179 ( 2.010 5.378 -5.741) 8.119 6.408 ( -0.372 0.634 -4.309) 4.371 6.559 ( 2.943 0.380 6.019) 6.711 6.816 ( -0.035 -4.168 3.017) 5.146 6.984 ( 0.415 -6.299 5.415) 8.317 7.019 ( -2.407 5.652 6.263) 8.773 7.171 ( -10.877 3.077 0.703) 11.326 7.352 ( 10.954 2.068 4.319) 11.955 7.508 ( 6.540 4.060 -1.771) 7.899 8.082 ( -0.751 -2.398 -1.945) 3.178 8.096 ( 1.014 -1.370 -1.664) 2.382 8.349 ( -5.508 -3.331 -3.584) 7.367 8.624 ( -1.052 3.675 -7.472) 8.393 8.905 ( 12.509 -8.020 2.690) 15.101 9.103 ( 7.171 -3.122 12.149) 14.449 11.026 ( -1.322 3.977 -3.113) 5.221 11.115 ( -0.424 5.112 4.070) 6.548 11.770 ( -0.058 -5.137 -5.765) 7.722 11.840 ( -1.588 -4.344 2.238) 5.138 13.778 ( -3.848 3.049 -4.137) 6.420 13.860 ( -4.819 2.977 6.588) 8.689 14.436 ( -9.844 -2.915 4.315) 11.136 14.492 ( -3.066 -2.877 -1.173) 4.365 15.196 ( -0.599 3.179 3.307) 4.626 15.251 ( 2.862 2.914 -0.251) 4.092 15.654 ( 0.358 -2.561 0.003) 2.586 15.721 ( 1.051 -1.334 3.611) 3.990 16.306 ( -4.858 -0.353 -1.441) 5.079 16.442 ( -5.138 -1.821 -0.604) 5.484 16.631 ( -1.083 -1.233 3.605) 3.961 16.703 ( -0.577 -1.120 -0.853) 1.521 17.923 ( 5.680 -0.947 0.831) 5.818 17.999 ( 10.247 2.312 0.078) 10.505 18.142 ( 0.378 -1.252 1.724) 2.164 18.304 ( 12.581 -1.429 -2.931) 12.996 27.673 ( 1.165 -0.206 0.123) 1.189 27.686 ( 0.724 1.415 0.543) 1.680 27.815 ( 0.276 0.012 -0.261) 0.381 27.918 ( 2.179 -0.047 4.296) 4.817 28.896 ( -1.252 4.005 1.408) 4.426 28.948 ( 2.961 3.075 -0.220) 4.275 29.376 ( 2.180 -1.686 -4.521) 5.295 29.445 ( -2.517 -0.411 7.394) 7.821 30.209 ( -4.602 3.573 -5.746) 8.183 30.425 ( 0.193 3.872 6.027) 7.166 30.843 ( -21.275 2.084 1.202) 21.411 31.050 ( -7.676 1.838 -3.314) 8.561 31.361 ( 7.819 -0.961 -0.625) 7.902 31.644 ( 13.296 6.103 3.673) 15.084 32.273 ( -11.993 -11.209 0.852) 16.438 32.823 ( 22.220 -5.193 -11.248) 25.440 ======================= Grid point 302 (153/168) ======================= q-point: ( 0.20 0.14 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.935 ( 28.113 5.508 -11.197) 30.758 2.159 ( 21.646 13.800 -9.949) 27.531 2.548 ( 20.479 2.043 2.136) 20.691 2.701 ( 4.341 11.478 13.612) 18.327 2.951 ( -4.838 2.224 4.357) 6.880 3.037 ( -1.110 5.688 -0.975) 5.876 3.406 ( 8.820 -1.834 -4.376) 10.015 3.691 ( -1.071 -2.816 -6.147) 6.846 3.743 ( 22.232 1.197 -18.167) 28.736 3.807 ( 16.219 0.259 -0.197) 16.222 4.066 ( -2.311 0.134 -7.997) 8.325 4.322 ( 1.542 1.578 0.279) 2.224 4.415 ( -2.936 6.255 3.607) 7.794 4.541 ( 4.132 -7.663 -7.365) 11.403 4.808 ( -1.288 -3.580 -0.929) 3.917 5.038 ( 4.818 0.161 -5.307) 7.169 5.351 ( -4.883 2.088 0.897) 5.386 5.693 ( -4.287 -0.557 -7.720) 8.848 5.764 ( 2.602 -2.076 -4.725) 5.780 5.949 ( -5.752 9.829 5.118) 12.485 6.080 ( 5.412 5.870 -4.255) 9.047 6.155 ( 0.342 -0.637 0.055) 0.725 6.388 ( 1.627 -1.763 -0.585) 2.469 6.704 ( 9.272 1.121 1.306) 9.430 6.856 ( -0.272 -5.057 3.288) 6.038 7.009 ( -3.439 0.205 5.240) 6.271 7.051 ( -2.464 2.185 6.943) 7.684 7.146 ( 2.283 -0.756 1.881) 3.053 7.488 ( 2.273 -0.465 0.842) 2.468 7.612 ( 4.038 4.399 5.058) 7.825 8.021 ( -1.284 -4.891 -3.292) 6.034 8.104 ( 0.647 1.147 0.211) 1.334 8.258 ( -2.908 -1.648 -3.467) 4.815 8.498 ( -1.011 5.486 -9.684) 11.176 9.107 ( 8.494 -6.237 0.268) 10.542 9.334 ( 3.487 -7.947 10.620) 13.715 10.971 ( -1.728 2.571 -1.736) 3.551 11.162 ( 0.315 4.740 4.245) 6.371 11.689 ( -0.978 -5.067 -6.829) 8.560 11.820 ( -3.131 -3.285 0.825) 4.612 13.657 ( -5.654 3.144 -2.247) 6.848 13.855 ( -6.108 2.363 7.439) 9.911 14.312 ( -12.486 -2.633 5.251) 13.799 14.388 ( -8.426 -2.205 -0.545) 8.727 15.250 ( 1.405 2.128 2.650) 3.677 15.288 ( 1.695 3.773 1.487) 4.395 15.689 ( 2.252 -3.223 2.596) 4.711 15.784 ( 1.454 -0.329 3.767) 4.052 16.222 ( -4.170 -1.219 -1.267) 4.526 16.275 ( -8.354 -1.957 -5.496) 10.190 16.666 ( -4.082 0.195 1.998) 4.549 16.698 ( 1.571 -0.473 3.529) 3.892 18.064 ( 9.240 -2.139 2.176) 9.731 18.171 ( 9.339 -0.009 0.680) 9.364 18.236 ( 9.173 1.764 2.384) 9.640 18.480 ( 12.761 -1.333 -1.793) 12.955 27.696 ( 0.442 2.175 0.045) 2.220 27.705 ( 1.856 0.342 0.867) 2.076 27.850 ( 2.467 -1.221 2.090) 3.456 28.002 ( 1.858 -1.304 4.401) 4.952 28.907 ( 0.060 4.979 2.314) 5.491 29.000 ( 3.427 3.796 0.635) 5.153 29.368 ( 2.158 -1.880 -2.990) 4.139 29.488 ( -3.405 1.285 8.058) 8.842 30.063 ( -5.461 3.619 -5.790) 8.743 30.476 ( -1.854 3.052 5.316) 6.404 30.560 ( -16.725 3.204 1.505) 17.095 30.942 ( -3.406 1.382 0.276) 3.686 31.377 ( -6.071 -5.228 -5.083) 9.488 31.614 ( -3.840 6.197 -7.165) 10.222 32.421 ( 16.916 -11.358 9.136) 22.330 33.001 ( 18.626 -3.246 -13.172) 23.043 ======================= Grid point 303 (154/168) ======================= q-point: ( 0.30 0.14 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( 19.780 9.700 -14.265) 26.245 2.377 ( 24.327 7.309 -15.165) 29.584 2.732 ( -6.114 0.249 6.956) 9.264 2.824 ( -1.635 7.424 7.037) 10.359 3.017 ( -1.855 1.452 9.652) 9.936 3.233 ( 17.713 4.819 8.881) 20.393 3.513 ( 9.728 6.841 -11.396) 16.472 3.593 ( 7.218 -6.533 -0.430) 9.745 3.853 ( 1.720 -0.769 -10.702) 10.867 3.949 ( 10.002 -2.068 -12.252) 15.951 4.070 ( 12.826 -0.630 -0.135) 12.842 4.350 ( 5.991 3.833 -2.075) 7.409 4.379 ( -3.327 5.574 1.824) 6.743 4.638 ( 11.375 -0.860 -3.639) 11.974 4.832 ( 3.681 -2.128 3.676) 5.621 5.077 ( 6.864 1.218 -4.522) 8.310 5.317 ( -2.071 -0.465 3.297) 3.921 5.575 ( -0.795 -1.028 -4.649) 4.828 5.741 ( 4.504 -0.817 -7.715) 8.971 5.926 ( -3.905 7.729 5.301) 10.153 6.092 ( 3.833 9.277 -6.070) 11.731 6.228 ( 1.902 -4.502 7.193) 8.697 6.444 ( 4.027 -4.366 2.007) 6.269 6.834 ( 9.366 -1.303 -8.294) 12.578 6.906 ( 1.355 -3.101 5.909) 6.810 7.018 ( -1.095 0.319 2.993) 3.203 7.073 ( -3.388 -0.915 4.619) 5.801 7.213 ( 2.018 0.962 3.670) 4.298 7.488 ( -1.411 -0.208 -1.588) 2.135 7.688 ( -3.233 4.030 7.081) 8.765 7.976 ( -0.961 -4.866 -2.612) 5.605 8.110 ( -0.351 -2.629 -6.169) 6.715 8.172 ( -2.638 2.121 2.558) 4.242 8.392 ( -0.122 7.285 -6.717) 9.910 9.159 ( 1.276 -4.532 -3.701) 5.989 9.389 ( -6.048 -8.729 1.849) 10.779 10.946 ( -0.520 0.723 0.988) 1.330 11.211 ( 0.418 2.503 2.195) 3.355 11.599 ( -0.586 -3.603 -5.619) 6.700 11.770 ( -3.931 -1.880 0.643) 4.405 13.591 ( -1.175 2.183 1.043) 2.690 13.838 ( -6.346 1.402 6.631) 9.284 14.177 ( -11.331 -2.828 3.997) 12.344 14.240 ( -9.681 -1.480 0.103) 9.794 15.278 ( 0.245 2.481 1.580) 2.952 15.343 ( 1.882 3.961 1.675) 4.694 15.766 ( 2.723 -3.049 2.877) 4.999 15.844 ( 0.950 0.312 2.691) 2.871 16.098 ( -4.303 -1.079 -5.327) 6.932 16.156 ( -2.620 -1.195 -2.220) 3.636 16.635 ( -4.414 0.618 4.593) 6.400 16.733 ( 0.035 -0.630 0.247) 0.678 18.235 ( 8.603 -1.856 2.476) 9.143 18.315 ( 8.379 -1.866 0.904) 8.632 18.418 ( 8.744 2.898 2.314) 9.498 18.637 ( 7.508 -1.083 0.365) 7.594 27.706 ( 0.870 2.215 0.134) 2.384 27.743 ( 1.248 -0.176 1.041) 1.635 27.924 ( 3.188 -1.733 2.588) 4.456 28.065 ( 0.570 -2.445 2.962) 3.883 28.949 ( 1.697 5.179 2.420) 5.963 29.066 ( 2.649 4.803 2.094) 5.871 29.372 ( 1.783 -1.830 -1.898) 3.183 29.515 ( -4.619 3.410 7.191) 9.201 29.929 ( -3.264 3.228 -4.052) 6.123 30.342 ( -9.819 5.401 -3.246) 11.667 30.511 ( -4.763 -0.536 10.049) 11.134 30.940 ( -1.453 0.240 2.894) 3.247 31.114 ( -6.851 -3.320 -11.860) 14.093 31.539 ( 1.660 3.174 -8.007) 8.772 32.780 ( 11.281 -10.834 11.657) 19.507 33.111 ( 14.009 -2.316 -11.926) 18.543 ======================= Grid point 304 (155/168) ======================= q-point: ( 0.40 0.14 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.290 ( 19.053 9.621 -11.044) 24.032 2.539 ( 16.691 4.043 -15.135) 22.891 2.680 ( -11.411 2.330 10.229) 15.501 2.754 ( -10.996 5.820 4.352) 13.180 3.172 ( 1.493 2.667 13.598) 13.937 3.465 ( 11.551 3.390 -1.836) 12.177 3.575 ( 0.885 -1.290 -10.621) 10.736 3.660 ( 1.796 2.076 -1.021) 2.928 3.811 ( 5.731 -2.310 4.094) 7.412 3.964 ( 1.908 -1.651 -3.745) 4.516 4.217 ( 9.460 1.057 -3.181) 10.037 4.372 ( -2.314 9.696 2.728) 10.335 4.493 ( 17.167 4.002 -5.222) 18.385 4.729 ( 2.368 -0.723 -0.313) 2.495 4.986 ( 7.231 -3.572 4.636) 9.303 5.121 ( 5.421 1.335 -5.529) 7.858 5.355 ( -0.235 -2.983 5.665) 6.407 5.528 ( 0.138 -3.345 -6.065) 6.928 5.765 ( 6.936 2.192 -1.585) 7.445 5.938 ( -1.038 6.130 1.485) 6.392 6.108 ( 2.054 7.201 2.734) 7.972 6.314 ( -0.985 -1.510 3.447) 3.890 6.535 ( 3.672 -6.347 2.688) 7.810 6.760 ( -2.553 -5.785 -9.130) 11.106 7.032 ( 3.156 -0.711 5.504) 6.384 7.065 ( 8.631 0.670 -6.186) 10.640 7.085 ( -2.844 -4.451 8.088) 9.660 7.259 ( -3.133 0.615 3.404) 4.667 7.458 ( 3.678 1.340 -2.046) 4.417 7.678 ( -7.739 2.156 5.608) 9.797 7.916 ( -0.338 -2.527 -5.839) 6.371 7.963 ( -6.138 -1.191 -4.849) 7.913 8.225 ( 2.930 2.267 1.906) 4.166 8.344 ( -1.691 7.446 -0.394) 7.646 9.103 ( -1.636 -4.292 -3.188) 5.592 9.237 ( -8.419 -4.973 -4.743) 10.868 10.984 ( 1.556 -0.919 4.100) 4.480 11.189 ( -2.365 -1.046 -3.834) 4.625 11.578 ( 2.707 -0.840 -0.525) 2.882 11.714 ( -4.075 -0.903 0.175) 4.177 13.639 ( 3.491 0.717 3.107) 4.728 13.807 ( -5.081 0.653 3.296) 6.092 14.062 ( -7.208 -2.994 2.182) 8.105 14.103 ( -7.183 -1.585 -0.354) 7.364 15.310 ( 1.222 3.395 2.106) 4.178 15.370 ( 0.358 3.986 -0.049) 4.003 15.819 ( 0.985 -1.194 1.092) 1.895 15.854 ( -0.484 0.509 -1.166) 1.361 16.038 ( 0.022 -0.835 0.155) 0.850 16.101 ( -1.245 -1.266 -2.279) 2.889 16.636 ( -3.006 0.188 5.788) 6.525 16.712 ( -0.218 -0.654 -3.051) 3.128 18.376 ( 5.456 -1.391 2.607) 6.204 18.434 ( 5.450 -2.196 -0.473) 5.895 18.551 ( 6.019 2.565 1.712) 6.763 18.701 ( 0.251 -0.253 0.068) 0.363 27.727 ( 1.332 1.248 0.382) 1.865 27.761 ( -0.071 -0.155 0.391) 0.426 28.000 ( 2.923 -2.265 2.058) 4.232 28.083 ( -0.955 -2.938 0.838) 3.201 29.013 ( 3.320 4.555 1.872) 5.940 29.110 ( -0.527 4.679 1.757) 5.025 29.384 ( 2.766 -0.411 -1.703) 3.274 29.493 ( -6.225 3.944 3.692) 8.242 29.904 ( 2.047 3.247 1.779) 4.230 30.165 ( -7.020 5.041 -5.064) 10.017 30.566 ( -4.479 -1.250 12.400) 13.244 30.809 ( -1.704 -3.785 -13.951) 14.555 31.110 ( 4.143 1.672 6.871) 8.195 31.440 ( -1.680 1.460 -9.562) 9.817 33.016 ( 4.338 -8.652 8.944) 13.179 33.162 ( 7.249 -3.357 -8.695) 11.808 ======================= Grid point 305 (156/168) ======================= q-point: (-0.50 0.14 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 147 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.472 ( 4.726 6.371 -6.432) 10.212 2.472 ( -4.726 6.371 6.432) 10.212 2.675 ( 12.014 4.862 -13.881) 18.991 2.675 ( -12.014 4.862 13.881) 18.991 3.369 ( -2.407 0.401 -15.909) 16.095 3.369 ( 2.407 0.401 15.909) 16.095 3.620 ( -1.570 2.012 -2.794) 3.784 3.620 ( 1.570 2.012 2.794) 3.784 3.924 ( -1.719 -1.771 -3.504) 4.285 3.924 ( 1.719 -1.771 3.504) 4.285 4.327 ( -4.118 6.983 -1.073) 8.178 4.327 ( 4.118 6.983 1.073) 8.178 4.682 ( -4.840 0.897 -0.050) 4.923 4.682 ( 4.840 0.897 0.050) 4.923 5.105 ( 2.855 -1.476 -7.766) 8.404 5.105 ( -2.855 -1.476 7.766) 8.404 5.434 ( -1.067 -2.764 -7.070) 7.666 5.434 ( 1.067 -2.764 7.070) 7.666 5.886 ( -4.625 2.625 -2.669) 5.950 5.886 ( 4.625 2.625 2.669) 5.950 6.231 ( -4.866 5.441 -6.027) 9.466 6.231 ( 4.866 5.441 6.027) 9.466 6.631 ( -3.871 -9.094 -4.285) 10.773 6.631 ( 3.871 -9.094 4.285) 10.773 7.082 ( 3.175 -0.817 -5.645) 6.528 7.082 ( -3.175 -0.817 5.645) 6.528 7.196 ( -5.683 -1.756 -0.676) 5.986 7.196 ( 5.683 -1.756 0.676) 5.986 7.568 ( -7.875 1.472 -0.846) 8.056 7.568 ( 7.875 1.472 0.846) 8.056 7.874 ( 4.067 -1.026 -4.853) 6.414 7.874 ( -4.067 -1.026 4.853) 6.414 8.295 ( 3.077 5.251 -5.621) 8.285 8.295 ( -3.077 5.251 5.621) 8.285 9.098 ( -2.430 -3.450 -2.644) 4.980 9.098 ( 2.430 -3.450 2.644) 4.980 11.081 ( -2.700 -1.835 -6.232) 7.035 11.081 ( 2.700 -1.835 6.232) 7.035 11.643 ( -4.177 -0.311 -1.061) 4.321 11.643 ( 4.177 -0.311 1.061) 4.321 13.740 ( -4.092 0.203 -2.129) 4.617 13.740 ( 4.092 0.203 2.129) 4.617 14.027 ( 4.304 -2.384 -6.745) 8.349 14.027 ( -4.304 -2.384 6.745) 8.349 15.353 ( -0.576 3.900 -2.054) 4.445 15.353 ( 0.576 3.900 2.054) 4.445 15.834 ( 1.961 0.367 -3.083) 3.672 15.834 ( -1.961 0.367 3.083) 3.672 16.062 ( -0.572 -1.260 -2.157) 2.563 16.062 ( 0.572 -1.260 2.157) 2.563 16.669 ( 1.128 -0.381 -5.255) 5.388 16.669 ( -1.128 -0.381 5.255) 5.388 18.454 ( 0.899 -1.496 -3.615) 4.014 18.454 ( -0.899 -1.496 3.615) 4.014 18.655 ( -2.796 1.084 -2.603) 3.970 18.655 ( 2.796 1.084 2.603) 3.970 27.751 ( -0.331 0.343 -0.779) 0.913 27.751 ( 0.331 0.343 0.779) 0.913 28.058 ( -1.843 -2.776 -1.103) 3.510 28.058 ( 1.843 -2.776 1.103) 3.510 29.084 ( -2.261 4.092 -1.135) 4.811 29.084 ( 2.261 4.092 1.135) 4.811 29.428 ( 5.142 2.166 -6.973) 8.931 29.428 ( -5.142 2.166 6.973) 8.931 30.009 ( -4.954 4.211 -5.489) 8.509 30.009 ( 4.954 4.211 5.489) 8.509 30.659 ( 2.990 -2.175 -14.338) 14.807 30.659 ( -2.990 -2.175 14.338) 14.807 31.279 ( -4.148 1.076 -9.890) 10.779 31.279 ( 4.148 1.076 9.890) 10.779 33.134 ( 8.592 -5.699 -15.221) 18.384 33.134 ( -8.592 -5.699 15.221) 18.384 ======================= Grid point 311 (157/168) ======================= q-point: ( 0.00 0.29 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 148 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.674 ( -2.832 10.887 -5.345) 12.455 1.674 ( 2.832 10.887 5.345) 12.455 2.768 ( 1.534 15.826 -14.717) 21.665 2.768 ( -1.534 15.826 14.717) 21.665 3.096 ( -2.895 0.539 -2.630) 3.948 3.096 ( 2.895 0.539 2.630) 3.948 3.276 ( 1.636 -0.821 -8.954) 9.140 3.276 ( -1.636 -0.821 8.954) 9.140 3.892 ( -3.585 -0.983 -17.008) 17.409 3.892 ( 3.585 -0.983 17.008) 17.409 4.112 ( -1.950 -0.156 -6.053) 6.361 4.112 ( 1.950 -0.156 6.053) 6.361 4.608 ( 0.372 1.856 -3.256) 3.766 4.608 ( -0.372 1.856 3.256) 3.766 4.869 ( -2.029 -3.081 -3.597) 5.153 4.869 ( 2.029 -3.081 3.598) 5.153 5.566 ( -1.180 1.792 -3.419) 4.036 5.566 ( 1.180 1.792 3.419) 4.036 5.953 ( -4.127 -0.003 -3.170) 5.204 5.953 ( 4.127 -0.003 3.170) 5.204 6.240 ( -0.762 -0.221 -1.923) 2.080 6.240 ( 0.762 -0.221 1.923) 2.080 6.531 ( -0.296 2.826 0.021) 2.842 6.531 ( 0.296 2.826 -0.021) 2.842 6.776 ( -3.545 -1.856 -0.794) 4.080 6.776 ( 3.545 -1.856 0.794) 4.080 7.203 ( -8.725 4.144 -2.118) 9.888 7.203 ( 8.725 4.144 2.118) 9.888 7.467 ( -10.211 3.891 -1.441) 11.022 7.467 ( 10.211 3.891 1.441) 11.022 8.058 ( 1.842 -1.390 -4.128) 4.729 8.058 ( -1.842 -1.390 4.128) 4.729 8.414 ( -7.615 -6.877 -7.696) 12.826 8.414 ( 7.615 -6.877 7.696) 12.826 8.861 ( -4.270 -0.908 -7.345) 8.544 8.861 ( 4.270 -0.908 7.345) 8.544 11.197 ( 0.633 6.554 -4.921) 8.221 11.197 ( -0.633 6.554 4.921) 8.221 11.695 ( 1.189 -6.903 -4.911) 8.555 11.695 ( -1.189 -6.903 4.911) 8.555 13.929 ( 1.650 4.628 -5.075) 7.064 13.929 ( -1.650 4.628 5.075) 7.064 14.425 ( 2.565 -4.517 -3.695) 6.375 14.425 ( -2.565 -4.517 3.695) 6.375 15.292 ( 2.399 5.086 -2.159) 6.024 15.292 ( -2.399 5.086 2.159) 6.024 15.613 ( 0.221 -3.789 -3.970) 5.492 15.613 ( -0.221 -3.789 3.970) 5.492 16.406 ( -4.170 0.158 -1.841) 4.561 16.406 ( 4.170 0.158 1.841) 4.561 16.620 ( -2.218 -3.191 -1.026) 4.019 16.620 ( 2.218 -3.191 1.026) 4.019 17.922 ( 0.762 2.001 -2.937) 3.634 17.922 ( -0.762 2.001 2.937) 3.634 18.133 ( 2.199 -2.359 -1.620) 3.609 18.133 ( -2.199 -2.359 1.620) 3.609 27.674 ( -0.031 0.470 -1.026) 1.129 27.674 ( 0.031 0.470 1.026) 1.129 27.852 ( -1.008 -0.129 -2.227) 2.448 27.852 ( 1.008 -0.129 2.227) 2.448 29.004 ( 2.312 5.427 -2.601) 6.447 29.004 ( -2.312 5.427 2.601) 6.447 29.361 ( 1.719 -2.808 -5.752) 6.627 29.361 ( -1.719 -2.808 5.752) 6.627 30.419 ( -2.748 4.026 -5.333) 7.225 30.419 ( 2.748 4.026 5.333) 7.225 31.101 ( -7.131 -2.203 -2.023) 7.733 31.101 ( 7.131 -2.203 2.023) 7.733 31.485 ( -15.947 10.555 -5.366) 19.863 31.485 ( 15.947 10.555 5.366) 19.863 32.355 ( -12.930 -11.948 -4.558) 18.186 32.355 ( 12.930 -11.948 4.558) 18.186 ======================= Grid point 313 (158/168) ======================= q-point: ( 0.10 0.29 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.780 ( 21.818 11.799 -4.907) 25.285 1.961 ( 23.507 6.411 4.354) 24.751 2.652 ( 5.114 13.248 -13.857) 19.841 2.896 ( -3.082 19.014 12.116) 22.756 3.047 ( -3.715 1.797 2.479) 4.814 3.155 ( 0.200 -5.803 1.384) 5.969 3.222 ( 7.097 1.130 -8.025) 10.772 3.426 ( 9.868 -3.794 0.894) 10.610 3.726 ( 8.262 5.317 -11.951) 15.472 3.980 ( -0.448 2.056 -13.353) 13.518 4.064 ( -0.344 -5.666 3.337) 6.585 4.252 ( 10.005 -0.693 4.658) 11.058 4.448 ( -7.552 -0.455 -6.107) 9.723 4.613 ( 1.549 4.995 -6.109) 8.042 4.804 ( -3.873 1.515 1.827) 4.543 4.945 ( 2.878 -5.882 0.123) 6.550 5.509 ( -3.225 4.484 0.065) 5.524 5.684 ( 7.047 -0.023 0.590) 7.071 5.833 ( -4.828 -0.076 -3.423) 5.919 5.993 ( -0.321 -0.207 -0.066) 0.388 6.162 ( -4.473 -1.011 -2.376) 5.165 6.297 ( 7.740 3.252 -6.049) 10.347 6.485 ( -6.265 6.910 2.029) 9.545 6.592 ( 5.152 2.198 0.581) 5.632 6.726 ( -4.391 -3.624 3.557) 6.713 6.836 ( 2.202 -7.996 5.913) 10.186 7.138 ( -1.977 5.484 3.810) 6.964 7.238 ( -11.960 3.555 -1.268) 12.542 7.405 ( 8.861 2.918 2.544) 9.670 7.584 ( 6.534 2.005 -3.245) 7.566 8.023 ( 0.001 -1.445 -5.448) 5.637 8.095 ( 1.510 0.487 2.749) 3.174 8.280 ( -2.318 -2.790 -3.061) 4.747 8.664 ( 9.106 -8.085 9.793) 15.627 8.729 ( -0.354 -0.022 -8.537) 8.544 9.024 ( 6.617 -4.641 5.712) 9.897 11.137 ( -1.198 6.420 -4.865) 8.143 11.236 ( -1.111 6.071 4.441) 7.603 11.643 ( 0.083 -6.639 -5.792) 8.811 11.721 ( -1.604 -6.764 3.395) 7.736 13.863 ( -4.257 4.934 -2.952) 7.154 13.938 ( -5.534 4.191 6.631) 9.600 14.361 ( -7.726 -4.027 2.294) 9.009 14.415 ( -4.082 -4.393 1.128) 6.102 15.284 ( -0.706 5.106 2.491) 5.725 15.333 ( 2.957 4.977 0.187) 5.792 15.586 ( 0.592 -3.945 -1.246) 4.179 15.671 ( 1.066 -3.624 4.746) 6.066 16.301 ( -5.920 -0.002 -1.515) 6.111 16.393 ( -6.331 -2.679 -2.688) 7.381 16.609 ( 1.224 -0.741 4.254) 4.488 16.668 ( 0.676 -2.057 0.671) 2.267 17.922 ( 3.333 0.882 1.231) 3.661 18.037 ( 8.150 0.681 0.051) 8.178 18.119 ( 3.949 -0.159 1.618) 4.271 18.264 ( 12.891 -2.346 -3.058) 13.455 27.673 ( 0.260 0.418 0.973) 1.090 27.708 ( 1.676 0.486 1.600) 2.367 27.824 ( -0.228 0.662 -0.885) 1.129 27.902 ( 1.354 -1.459 3.044) 3.637 29.004 ( -0.940 5.926 2.678) 6.571 29.039 ( 2.836 5.615 0.856) 6.348 29.331 ( 1.008 -2.559 -2.762) 3.898 29.418 ( -0.781 -2.373 7.112) 7.538 30.298 ( -5.536 4.712 -4.018) 8.306 30.484 ( -4.285 0.957 7.092) 8.341 30.929 ( -8.532 6.246 -2.192) 10.799 31.112 ( -9.403 4.191 -3.967) 11.033 31.327 ( 3.581 -1.750 -1.669) 4.321 31.833 ( 16.682 11.876 3.826) 20.832 31.986 ( -16.152 -15.689 -4.717) 23.006 32.660 ( 21.394 -10.566 -6.686) 24.780 ======================= Grid point 314 (159/168) ======================= q-point: ( 0.20 0.29 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.115 ( 26.613 10.900 -8.448) 29.973 2.383 ( 22.507 6.301 -0.338) 23.375 2.634 ( 11.708 6.825 -10.032) 16.861 2.950 ( -0.533 7.464 0.741) 7.519 3.026 ( -3.036 6.793 7.038) 10.242 3.128 ( 1.597 3.397 -0.763) 3.831 3.330 ( 8.796 -3.815 1.701) 9.738 3.587 ( 10.289 -6.774 -4.201) 13.015 3.797 ( 3.147 -1.206 -4.740) 5.816 3.908 ( 15.565 9.660 -12.863) 22.384 4.008 ( 1.165 -3.308 -6.411) 7.308 4.341 ( 1.667 2.691 -2.702) 4.162 4.413 ( 7.733 -3.088 -6.015) 10.272 4.604 ( 2.783 7.735 3.021) 8.758 4.781 ( -2.003 1.239 2.410) 3.369 4.975 ( 2.958 -5.716 -1.607) 6.633 5.439 ( -4.586 6.027 -1.101) 7.653 5.700 ( -3.103 2.436 -2.728) 4.796 5.753 ( 0.288 -0.512 -4.217) 4.258 6.046 ( 1.596 -0.757 2.042) 2.700 6.082 ( 1.114 0.162 0.544) 1.250 6.309 ( 7.087 7.335 -11.471) 15.350 6.384 ( -7.457 3.827 1.300) 8.482 6.702 ( -1.049 -4.987 7.709) 9.241 6.738 ( 6.176 -2.551 0.634) 6.712 6.985 ( 2.152 -2.919 8.484) 9.227 7.104 ( -3.366 2.837 2.826) 5.231 7.158 ( 0.227 2.602 -1.257) 2.899 7.492 ( 2.662 0.541 -2.073) 3.417 7.671 ( 5.068 -0.942 2.488) 5.724 7.943 ( -2.180 -0.420 -4.988) 5.459 8.131 ( 0.107 0.410 -0.734) 0.848 8.237 ( -1.168 0.907 -0.215) 1.494 8.624 ( 0.195 5.980 -7.626) 9.693 8.897 ( 6.724 -12.759 5.515) 15.441 9.170 ( 4.706 -7.860 2.970) 9.630 11.054 ( -2.431 5.263 -4.200) 7.159 11.262 ( -1.304 4.257 2.989) 5.362 11.573 ( -0.439 -5.419 -5.322) 7.608 11.724 ( -2.286 -5.689 2.505) 6.622 13.746 ( -6.627 5.360 -1.200) 8.607 13.914 ( -7.849 2.893 7.583) 11.291 14.246 ( -10.159 -3.390 2.515) 11.001 14.327 ( -9.356 -3.606 2.392) 10.309 15.314 ( 0.904 4.001 1.662) 4.426 15.390 ( 2.705 6.050 2.062) 6.940 15.611 ( 2.341 -4.307 1.918) 5.264 15.750 ( 1.958 -3.055 4.605) 5.863 16.196 ( -5.512 -1.052 -1.433) 5.791 16.232 ( -6.925 -2.017 -4.450) 8.476 16.665 ( -2.733 -0.233 2.415) 3.655 16.684 ( 1.181 -0.827 3.531) 3.814 18.037 ( 8.171 -0.330 2.233) 8.477 18.145 ( 6.967 -2.081 0.644) 7.299 18.288 ( 12.144 2.872 1.430) 12.560 18.444 ( 13.380 -2.047 -2.272) 13.725 27.699 ( 0.874 0.273 1.674) 1.908 27.748 ( 0.712 1.238 1.383) 1.988 27.833 ( 1.561 -0.144 1.045) 1.884 27.958 ( 1.187 -2.831 2.901) 4.224 29.031 ( 0.312 6.226 2.718) 6.800 29.111 ( 2.541 6.638 4.088) 8.199 29.327 ( 1.245 -1.821 -1.079) 2.456 29.493 ( -1.505 -1.088 8.953) 9.143 30.161 ( -6.472 5.529 -3.528) 9.214 30.453 ( -9.881 -3.210 8.630) 13.507 30.738 ( -8.076 11.491 -8.235) 16.282 31.000 ( -1.871 4.718 1.337) 5.248 31.264 ( -9.923 -5.985 -5.940) 13.021 31.666 ( -1.467 -4.326 -11.744) 12.601 32.247 ( 18.737 -1.336 7.840) 20.355 32.872 ( 17.522 -9.173 -9.176) 21.803 ======================= Grid point 315 (160/168) ======================= q-point: ( 0.30 0.29 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.367 ( 18.904 12.253 -8.799) 24.185 2.554 ( 16.603 8.681 -15.745) 24.473 2.749 ( -0.260 1.413 5.274) 5.466 2.917 ( 1.445 1.911 -5.460) 5.963 3.125 ( 2.465 8.503 9.279) 12.825 3.304 ( 13.666 -5.312 4.701) 15.397 3.472 ( 3.566 1.063 5.526) 6.662 3.586 ( 2.395 -0.018 -4.066) 4.719 3.809 ( -1.772 -4.849 -9.500) 10.812 3.923 ( 16.256 -3.349 -4.660) 17.239 4.116 ( 8.797 7.487 -6.853) 13.432 4.418 ( 10.653 2.798 -2.634) 11.325 4.461 ( 9.072 4.032 -1.263) 10.008 4.691 ( 1.907 4.459 0.778) 4.911 4.813 ( 2.381 0.145 3.526) 4.257 5.028 ( 6.536 -4.968 -1.713) 8.386 5.379 ( -1.703 5.713 0.487) 5.982 5.615 ( -4.082 4.871 -0.202) 6.359 5.742 ( 4.159 0.730 -4.263) 6.000 6.008 ( -1.727 -1.139 -0.749) 2.200 6.205 ( 2.925 4.473 1.780) 5.633 6.298 ( 8.649 7.890 -9.004) 14.770 6.335 ( -0.612 -4.066 3.613) 5.474 6.781 ( -0.412 -7.579 7.954) 10.994 6.823 ( 3.999 -0.334 -2.986) 5.002 7.039 ( -0.913 2.395 3.816) 4.597 7.091 ( -2.661 1.691 -1.080) 3.332 7.197 ( 2.070 -2.721 3.751) 5.075 7.486 ( 0.902 -0.055 -3.295) 3.417 7.759 ( -0.276 -1.395 5.423) 5.606 7.850 ( -1.238 -3.042 -6.227) 7.040 8.058 ( -4.539 -2.715 -4.985) 7.268 8.251 ( 1.191 5.753 2.718) 6.474 8.561 ( 1.018 8.618 -4.824) 9.929 8.981 ( -0.050 -11.986 0.515) 11.998 9.212 ( -0.601 -8.061 -1.706) 8.262 10.982 ( -1.611 2.872 -2.031) 3.869 11.241 ( -3.089 -0.622 -1.482) 3.482 11.535 ( 1.251 -1.549 -1.508) 2.498 11.711 ( -2.750 -3.727 2.157) 5.110 13.662 ( -3.134 4.625 0.842) 5.650 13.871 ( -7.986 1.391 6.940) 10.671 14.111 ( -9.291 -3.154 0.850) 9.848 14.193 ( -11.250 -2.930 2.868) 11.974 15.350 ( 1.436 4.431 1.837) 5.007 15.449 ( 2.130 5.979 1.039) 6.431 15.695 ( 3.342 -3.848 3.909) 6.422 15.824 ( 1.452 -2.366 3.001) 4.088 16.080 ( -3.962 -0.516 -3.639) 5.404 16.127 ( -3.377 -1.536 -1.445) 3.981 16.648 ( -3.520 0.625 3.454) 4.971 16.714 ( -0.565 -1.209 0.802) 1.557 18.202 ( 8.132 -0.980 3.343) 8.847 18.275 ( 8.355 -2.093 0.365) 8.621 18.475 ( 9.357 2.629 1.029) 9.774 18.607 ( 9.001 -1.707 -0.757) 9.193 27.731 ( 0.923 0.427 1.194) 1.569 27.762 ( -0.255 1.644 0.966) 1.923 27.887 ( 2.406 -1.658 2.150) 3.627 27.998 ( 0.469 -3.793 1.683) 4.176 29.072 ( 1.435 6.086 2.023) 6.572 29.193 ( 0.186 6.419 5.280) 8.314 29.347 ( 1.972 -0.003 0.356) 2.004 29.563 ( -3.450 0.690 9.065) 9.724 30.029 ( -4.638 6.372 -2.803) 8.365 30.392 ( -10.405 -1.969 7.050) 12.722 30.560 ( -2.467 5.806 -5.820) 8.583 30.920 ( -9.749 -3.527 -7.469) 12.777 31.090 ( 1.949 3.145 -0.701) 3.766 31.571 ( 2.649 -1.533 -11.045) 11.461 32.597 ( 12.977 -4.870 9.065) 16.561 33.000 ( 12.497 -8.185 -9.512) 17.710 ======================= Grid point 316 (161/168) ======================= q-point: ( 0.40 0.29 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.510 ( 12.314 10.691 -7.780) 18.068 2.651 ( 14.669 6.979 -12.727) 20.636 2.740 ( -5.797 2.720 6.121) 8.858 2.875 ( -4.242 6.509 1.594) 7.931 3.258 ( 1.533 4.162 7.540) 8.748 3.440 ( 4.608 -10.412 -4.092) 12.099 3.553 ( 4.835 2.293 -5.898) 7.964 3.599 ( -4.009 -5.894 3.769) 8.064 3.823 ( 5.761 3.764 7.412) 10.114 4.045 ( 3.717 6.913 -7.463) 10.830 4.192 ( 12.841 -3.950 0.592) 13.448 4.545 ( 7.422 1.802 -4.781) 9.010 4.628 ( 6.949 9.803 2.673) 12.310 4.686 ( 1.356 1.764 -1.608) 2.745 4.930 ( 6.880 -2.297 3.388) 8.005 5.100 ( 3.688 -2.760 -2.219) 5.113 5.401 ( 2.650 6.502 1.838) 7.258 5.565 ( -2.731 6.671 -0.700) 7.242 5.783 ( 5.718 -0.641 -1.647) 5.985 5.970 ( -1.919 -2.888 -2.229) 4.122 6.251 ( 0.909 6.190 5.200) 8.135 6.324 ( 6.649 1.440 -7.135) 9.858 6.435 ( 2.729 -1.159 5.035) 5.843 6.714 ( -7.207 2.013 -5.803) 9.470 6.915 ( 1.395 -8.832 10.081) 13.476 7.054 ( -0.369 -0.452 -0.819) 1.006 7.080 ( 4.365 1.128 -2.109) 4.977 7.210 ( -4.623 -4.967 1.286) 6.906 7.489 ( 4.398 1.145 -0.911) 4.636 7.726 ( -6.631 1.979 -0.733) 6.959 7.807 ( 2.215 -7.764 -3.773) 8.912 7.912 ( -6.502 -3.128 -3.724) 8.120 8.332 ( 4.481 7.546 3.432) 9.424 8.533 ( -1.615 10.478 -1.126) 10.661 8.952 ( -1.395 -9.748 -0.070) 9.848 9.127 ( -4.067 -5.926 -5.566) 9.091 10.970 ( 0.897 -0.065 1.173) 1.479 11.143 ( -4.230 -3.480 -4.433) 7.046 11.572 ( 3.056 0.553 1.165) 3.317 11.685 ( -3.103 -1.872 1.117) 3.792 13.674 ( 2.185 2.783 2.082) 4.105 13.827 ( -5.993 1.043 3.990) 7.274 13.992 ( -5.582 -3.505 -0.150) 6.593 14.055 ( -9.004 -2.947 1.327) 9.567 15.402 ( 1.945 5.336 2.524) 6.215 15.475 ( 0.840 5.739 -0.762) 5.850 15.782 ( 2.272 -2.480 2.996) 4.504 15.850 ( -0.406 -1.281 0.200) 1.358 16.023 ( -0.180 -0.338 -0.763) 0.854 16.071 ( -1.968 -1.397 -1.210) 2.700 16.641 ( -2.653 0.283 4.022) 4.827 16.694 ( -0.700 -1.130 -2.027) 2.424 18.347 ( 4.711 -1.159 3.783) 6.152 18.391 ( 6.093 -2.017 -1.025) 6.499 18.600 ( 5.551 2.109 0.827) 5.996 18.690 ( 2.467 -0.851 -0.695) 2.701 27.753 ( 1.031 0.977 -0.060) 1.421 27.767 ( -0.726 1.002 1.190) 1.717 27.946 ( 1.968 -2.772 1.914) 3.901 28.008 ( -0.442 -4.039 0.113) 4.065 29.122 ( 2.683 5.416 1.186) 6.159 29.217 ( -2.846 4.490 2.623) 5.928 29.402 ( 3.707 2.623 1.269) 4.715 29.564 ( -6.506 2.386 4.271) 8.140 29.998 ( 1.240 5.713 2.776) 6.471 30.264 ( -7.490 3.140 -3.743) 8.942 30.541 ( -2.017 -0.741 6.227) 6.588 30.712 ( -1.323 -5.152 -11.435) 12.611 31.173 ( 3.316 4.722 5.894) 8.249 31.461 ( -0.696 0.024 -10.896) 10.918 32.848 ( 6.262 -6.457 8.765) 12.559 33.043 ( 6.351 -7.565 -8.848) 13.261 ======================= Grid point 317 (162/168) ======================= q-point: (-0.50 0.29 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 147 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.610 ( 9.104 6.662 -10.553) 15.447 2.610 ( -9.104 6.662 10.553) 15.447 2.808 ( 8.394 7.650 -6.664) 13.168 2.808 ( -8.394 7.650 6.664) 13.168 3.369 ( -0.494 -1.641 -9.631) 9.782 3.369 ( 0.494 -1.641 9.631) 9.782 3.580 ( 5.685 -5.356 -6.417) 10.108 3.580 ( -5.685 -5.356 6.417) 10.108 3.968 ( -2.115 5.932 -6.576) 9.105 3.968 ( 2.115 5.932 6.576) 9.105 4.433 ( -9.492 -1.000 -6.488) 11.541 4.433 ( 9.492 -1.000 6.488) 11.541 4.714 ( 1.151 6.028 -2.116) 6.492 4.714 ( -1.151 6.028 2.116) 6.492 5.065 ( -2.859 -2.433 -3.999) 5.485 5.065 ( 2.859 -2.433 3.999) 5.485 5.489 ( -4.552 7.626 -2.293) 9.172 5.489 ( 4.552 7.626 2.293) 9.172 5.883 ( -5.731 -2.909 -2.045) 6.744 5.883 ( 5.731 -2.909 2.045) 6.744 6.325 ( 1.193 2.305 -5.061) 5.688 6.325 ( -1.193 2.305 5.061) 5.688 6.535 ( -4.559 1.814 -5.918) 7.688 6.535 ( 4.559 1.814 5.918) 7.688 7.032 ( 1.658 -5.389 -7.589) 9.454 7.032 ( -1.658 -5.389 7.589) 9.454 7.128 ( 4.378 -2.912 -5.051) 7.291 7.128 ( -4.378 -2.912 5.051) 7.291 7.596 ( -5.812 0.626 -3.519) 6.823 7.596 ( 5.812 0.626 3.519) 6.823 7.812 ( 2.028 -4.373 -1.615) 5.083 7.812 ( -2.028 -4.373 1.615) 5.083 8.452 ( -2.261 9.450 -4.855) 10.862 8.452 ( 2.261 9.450 4.855) 10.862 8.997 ( -3.273 -6.301 -4.964) 8.663 8.997 ( 3.273 -6.301 4.964) 8.663 11.033 ( -2.533 -2.543 -4.299) 5.601 11.033 ( 2.533 -2.543 4.299) 5.601 11.636 ( -3.321 -0.294 -0.664) 3.400 11.636 ( 3.321 -0.294 0.664) 3.400 13.756 ( -1.736 1.504 -3.162) 3.909 13.756 ( 1.736 1.504 3.162) 3.909 13.965 ( 4.190 -3.437 -6.629) 8.562 13.965 ( -4.190 -3.437 6.629) 8.562 15.456 ( -0.079 5.702 -2.968) 6.428 15.456 ( 0.079 5.702 2.968) 6.428 15.831 ( 0.277 -1.072 -2.372) 2.617 15.831 ( -0.277 -1.072 2.372) 2.617 16.035 ( -1.122 -1.043 -0.838) 1.746 16.035 ( 1.122 -1.043 0.838) 1.746 16.659 ( 1.007 -0.564 -3.901) 4.068 16.659 ( -1.007 -0.564 3.901) 4.068 18.421 ( 1.294 -1.515 -3.734) 4.232 18.421 ( -1.294 -1.515 3.734) 4.232 18.675 ( -0.680 0.711 -2.549) 2.732 18.675 ( 0.680 0.711 2.549) 2.732 27.764 ( 1.092 0.944 -0.890) 1.695 27.764 ( -1.092 0.944 0.890) 1.695 27.989 ( -0.789 -3.627 -1.467) 3.991 27.989 ( 0.789 -3.627 1.467) 3.991 29.179 ( -1.104 4.504 -1.284) 4.811 29.179 ( 1.104 4.504 1.284) 4.811 29.484 ( 0.719 3.130 -4.476) 5.509 29.484 ( -0.719 3.130 4.476) 5.509 30.105 ( -4.270 4.485 -6.755) 9.164 30.105 ( 4.270 4.485 6.755) 9.164 30.603 ( 2.743 -2.920 -10.746) 11.469 30.603 ( -2.743 -2.920 10.746) 11.469 31.313 ( -2.926 2.138 -9.416) 10.089 31.313 ( 2.926 2.138 9.416) 10.089 32.995 ( 4.146 -7.042 -12.244) 14.721 32.995 ( -4.146 -7.042 12.244) 14.721 ======================= Grid point 323 (163/168) ======================= q-point: ( 0.00 0.43 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 148 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.843 ( -0.750 4.669 -1.951) 5.115 1.843 ( 0.750 4.669 1.951) 5.115 2.926 ( -2.220 1.454 -4.795) 5.480 2.926 ( 2.220 1.454 4.795) 5.480 3.154 ( 2.837 3.407 -4.299) 6.175 3.154 ( -2.837 3.407 4.299) 6.175 3.291 ( 1.912 1.155 -7.760) 8.075 3.291 ( -1.912 1.155 7.760) 8.075 3.827 ( -1.137 -3.028 -7.157) 7.854 3.827 ( 1.137 -3.028 7.157) 7.854 4.144 ( -0.577 2.279 -2.382) 3.347 4.144 ( 0.577 2.280 2.382) 3.347 4.596 ( -4.250 -2.302 -1.292) 5.003 4.596 ( 4.250 -2.302 1.292) 5.003 4.897 ( 1.335 3.214 -2.584) 4.335 4.897 ( -1.335 3.214 2.584) 4.335 5.609 ( -0.445 2.045 -1.676) 2.682 5.609 ( 0.445 2.045 1.676) 2.682 5.924 ( -2.867 -2.117 -1.346) 3.809 5.924 ( 2.867 -2.117 1.346) 3.809 6.236 ( -1.027 0.327 -2.502) 2.725 6.236 ( 1.027 0.327 2.502) 2.725 6.519 ( -0.964 -2.203 -3.106) 3.928 6.519 ( 0.964 -2.203 3.106) 3.928 6.799 ( 0.748 2.156 -2.362) 3.284 6.799 ( -0.748 2.156 2.362) 3.284 7.266 ( -3.915 1.647 -1.230) 4.423 7.266 ( 3.915 1.647 1.230) 4.423 7.523 ( -4.395 1.462 -1.601) 4.900 7.523 ( 4.395 1.462 1.601) 4.900 8.042 ( -0.047 -0.317 -1.973) 1.999 8.042 ( 0.047 -0.317 1.973) 1.999 8.301 ( -2.603 -3.266 -3.344) 5.350 8.301 ( 2.603 -3.266 3.344) 5.350 8.845 ( -1.609 -0.501 -2.674) 3.161 8.845 ( 1.609 -0.501 2.674) 3.161 11.320 ( 0.887 4.635 -3.864) 6.099 11.320 ( -0.887 4.635 3.864) 6.099 11.566 ( 1.111 -4.838 -3.796) 6.249 11.566 ( -1.111 -4.838 3.796) 6.249 14.015 ( 0.920 2.908 -2.774) 4.123 14.015 ( -0.920 2.908 2.774) 4.123 14.342 ( 1.182 -2.805 -2.262) 3.792 14.342 ( -1.182 -2.805 2.262) 3.792 15.405 ( 1.479 5.793 -3.110) 6.739 15.405 ( -1.479 5.793 3.110) 6.739 15.520 ( 0.747 -5.233 -3.982) 6.618 15.520 ( -0.747 -5.233 3.982) 6.618 16.411 ( -2.092 0.247 -0.676) 2.213 16.411 ( 2.092 0.247 0.676) 2.213 16.568 ( -1.518 -1.572 -0.480) 2.237 16.568 ( 1.518 -1.572 0.480) 2.237 17.965 ( -0.060 1.753 -1.552) 2.342 17.965 ( 0.060 1.753 1.552) 2.342 18.087 ( 0.587 -1.802 -1.086) 2.184 18.087 ( -0.587 -1.802 1.086) 2.184 27.684 ( -0.115 0.366 -0.355) 0.523 27.684 ( 0.115 0.366 0.355) 0.523 27.845 ( -0.270 -0.340 -0.869) 0.972 27.845 ( 0.270 -0.340 0.869) 0.972 29.110 ( 1.484 4.034 -2.764) 5.110 29.110 ( -1.484 4.034 2.764) 5.110 29.297 ( 0.993 -2.836 -3.615) 4.701 29.297 ( -0.993 -2.836 3.615) 4.701 30.480 ( -1.246 1.662 -2.394) 3.170 30.480 ( 1.246 1.662 2.394) 3.170 31.064 ( -2.885 -1.111 -1.098) 3.281 31.064 ( 2.885 -1.111 1.098) 3.281 31.716 ( -13.417 10.348 -4.804) 17.612 31.716 ( 13.417 10.348 4.804) 17.612 32.106 ( -12.832 -10.774 -4.394) 17.322 32.106 ( 12.832 -10.774 4.394) 17.322 ======================= Grid point 325 (164/168) ======================= q-point: ( 0.10 0.43 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.985 ( 20.800 7.089 -2.980) 22.176 2.044 ( 21.249 1.151 0.363) 21.284 2.849 ( 0.453 7.137 -6.088) 9.392 2.992 ( -0.430 -7.407 0.376) 7.429 3.121 ( 1.760 5.317 -4.071) 6.924 3.180 ( 2.347 3.093 -0.460) 3.909 3.262 ( 3.911 4.155 -3.835) 6.875 3.353 ( 3.098 -3.619 2.117) 5.213 3.780 ( 2.787 2.592 -4.365) 5.791 3.905 ( 1.077 -7.997 0.003) 8.069 4.102 ( 2.234 7.239 -4.908) 9.027 4.213 ( 6.858 -2.587 1.078) 7.408 4.496 ( -1.708 4.977 -5.131) 7.349 4.631 ( 3.699 -5.439 -4.796) 8.141 4.875 ( -0.780 2.022 -1.986) 2.939 4.887 ( -3.426 1.823 2.188) 4.455 5.606 ( 0.463 4.949 -0.044) 4.970 5.685 ( 5.178 -1.615 0.427) 5.441 5.851 ( -3.815 3.246 -1.319) 5.179 5.954 ( 0.560 -4.671 -0.084) 4.705 6.165 ( -1.564 3.817 -4.412) 6.040 6.280 ( 5.909 -4.798 -3.715) 8.470 6.581 ( 5.079 1.827 6.117) 8.158 6.643 ( -3.116 2.611 5.281) 6.664 6.681 ( -0.433 -4.383 1.376) 4.615 6.708 ( -8.951 -0.496 -1.560) 9.100 7.237 ( -2.338 4.114 2.879) 5.539 7.286 ( -8.088 0.010 1.988) 8.328 7.473 ( 6.771 4.088 -4.296) 9.001 7.561 ( 5.209 -3.660 -7.344) 9.720 8.046 ( 0.750 2.856 -1.427) 3.280 8.095 ( 2.624 -1.241 1.091) 3.101 8.277 ( 1.249 3.696 0.727) 3.968 8.432 ( 6.602 -10.665 5.161) 13.563 8.809 ( 0.629 4.928 -1.875) 5.311 8.918 ( 4.053 -5.565 1.862) 7.132 11.269 ( -0.691 6.009 -5.521) 8.190 11.331 ( -1.391 1.684 0.850) 2.343 11.535 ( -0.260 -2.367 -2.295) 3.307 11.586 ( -1.687 -5.803 3.900) 7.193 13.963 ( -5.144 4.271 -0.251) 6.691 14.002 ( -6.028 1.071 4.606) 7.662 14.297 ( -5.492 -1.262 1.249) 5.772 14.328 ( -4.821 -3.660 2.493) 6.546 15.392 ( -0.020 5.292 0.094) 5.293 15.450 ( 2.197 6.261 2.566) 7.114 15.496 ( 0.531 -4.822 -1.354) 5.037 15.575 ( 1.464 -5.660 4.325) 7.272 16.310 ( -6.770 1.004 -1.873) 7.096 16.343 ( -6.944 -2.134 -2.616) 7.721 16.605 ( 2.206 0.442 3.573) 4.222 16.628 ( 1.852 -1.700 2.175) 3.324 17.957 ( 2.001 2.408 1.350) 3.409 18.011 ( 2.250 -2.535 1.205) 3.597 18.152 ( 10.974 2.725 -0.508) 11.319 18.211 ( 12.535 -2.823 -2.119) 13.022 27.690 ( 0.143 1.017 1.401) 1.737 27.707 ( 1.033 -0.517 1.541) 1.926 27.840 ( 0.288 0.968 -0.131) 1.018 27.867 ( 0.764 -1.700 1.420) 2.343 29.113 ( 0.992 4.423 0.323) 4.544 29.145 ( 1.162 2.850 3.026) 4.317 29.290 ( 0.534 -0.182 0.792) 0.972 29.349 ( -0.019 -4.143 6.437) 7.655 30.390 ( -6.606 4.173 -1.109) 7.892 30.462 ( -7.180 -2.650 3.323) 8.344 31.061 ( 4.100 5.933 -0.174) 7.214 31.154 ( 3.971 -2.258 -1.352) 4.764 31.384 ( -16.291 9.620 -5.698) 19.758 31.657 ( -17.069 -15.548 -6.351) 23.946 32.113 ( 16.951 14.516 0.049) 22.317 32.407 ( 19.824 -13.844 -3.050) 24.371 ======================= Grid point 326 (165/168) ======================= q-point: ( 0.20 0.43 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.328 ( 25.950 8.698 -5.377) 27.892 2.431 ( 25.890 -1.158 -0.815) 25.929 2.790 ( 2.959 7.553 -9.326) 12.360 2.930 ( -0.399 -5.639 -6.166) 8.365 3.158 ( 3.275 2.915 0.356) 4.399 3.171 ( 4.873 1.169 -5.469) 7.418 3.362 ( 3.918 4.419 7.072) 9.213 3.441 ( 9.260 -6.003 -3.671) 11.630 3.751 ( 0.486 0.448 -4.425) 4.474 3.854 ( -5.037 -6.912 -0.724) 8.584 4.181 ( 13.429 10.595 -4.606) 17.715 4.351 ( 8.799 -5.411 -2.609) 10.654 4.474 ( 6.406 9.994 -3.437) 12.358 4.648 ( 6.581 -3.671 -4.358) 8.705 4.835 ( -1.440 1.223 -0.707) 2.017 4.861 ( -2.967 -2.771 3.069) 5.089 5.574 ( -2.524 6.859 -2.690) 7.788 5.698 ( -1.302 -4.683 -3.216) 5.828 5.814 ( 0.875 7.703 -0.634) 7.779 5.981 ( 2.064 -7.814 -0.501) 8.098 6.135 ( 2.559 9.157 0.652) 9.530 6.332 ( 6.137 -6.232 -5.444) 10.302 6.501 ( -5.984 4.239 -2.601) 7.781 6.563 ( -5.065 -4.088 1.679) 6.722 6.771 ( 6.368 4.221 6.516) 10.041 6.887 ( 5.560 -6.057 10.831) 13.598 7.183 ( -4.725 4.004 -0.031) 6.193 7.214 ( -2.964 1.485 0.268) 3.326 7.505 ( 3.780 1.203 -5.876) 7.090 7.576 ( 5.600 -5.735 -5.140) 9.522 8.006 ( -3.000 4.667 -2.143) 5.948 8.093 ( -2.175 -3.515 -2.120) 4.646 8.338 ( 3.185 8.618 2.085) 9.421 8.561 ( 5.588 -12.095 -0.564) 13.335 8.828 ( 1.738 7.133 1.472) 7.488 9.000 ( 4.003 -8.786 0.696) 9.680 11.174 ( -2.643 6.243 -6.114) 9.129 11.283 ( -2.769 -3.168 -3.718) 5.615 11.523 ( -0.177 1.639 1.344) 2.127 11.606 ( -1.425 -5.443 3.909) 6.851 13.861 ( -7.818 5.426 1.080) 9.578 13.939 ( -8.979 -1.358 5.393) 10.562 14.204 ( -8.608 0.173 2.016) 8.843 14.251 ( -9.341 -3.579 3.655) 10.650 15.407 ( 1.262 4.938 0.834) 5.164 15.500 ( 2.072 -1.366 -0.584) 2.550 15.540 ( 2.887 3.155 5.060) 6.625 15.660 ( 2.697 -5.597 4.480) 7.659 16.186 ( -6.267 0.073 -1.733) 6.503 16.199 ( -6.528 -1.196 -2.695) 7.163 16.661 ( -1.011 -0.016 2.737) 2.918 16.668 ( 0.364 -0.643 3.198) 3.282 18.052 ( 7.228 1.633 1.790) 7.623 18.096 ( 6.763 -2.517 1.229) 7.320 18.346 ( 12.987 2.737 -0.160) 13.274 18.399 ( 13.397 -2.407 -1.592) 13.704 27.716 ( 0.446 1.324 2.235) 2.636 27.745 ( 0.800 -1.158 2.217) 2.626 27.851 ( 0.917 1.710 0.375) 1.976 27.897 ( 0.958 -2.792 1.351) 3.246 29.142 ( 1.540 4.530 0.992) 4.886 29.202 ( 1.276 -0.155 2.855) 3.131 29.335 ( 0.508 4.193 5.764) 7.146 29.438 ( -0.514 -4.321 9.489) 10.440 30.273 ( -7.133 5.268 -0.145) 8.869 30.373 ( -8.543 -4.490 4.133) 10.499 30.964 ( -13.357 9.582 -9.712) 19.093 31.126 ( -7.928 -5.445 -5.789) 11.226 31.163 ( -0.947 9.799 -1.131) 9.910 31.441 ( 3.872 -14.560 -6.950) 16.592 32.383 ( 16.339 11.701 0.419) 20.101 32.643 ( 16.568 -12.703 -5.291) 21.537 ======================= Grid point 327 (166/168) ======================= q-point: ( 0.30 0.43 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 280 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.617 ( 19.549 11.194 -6.434) 23.428 2.693 ( 10.702 4.098 -11.639) 16.334 2.775 ( 4.289 1.352 -0.302) 4.508 2.904 ( 7.955 -6.533 -4.124) 11.089 3.173 ( 2.966 0.817 -2.819) 4.173 3.248 ( 2.559 -0.011 2.294) 3.437 3.508 ( 6.042 0.092 1.631) 6.258 3.551 ( 8.007 -2.804 -3.945) 9.356 3.740 ( 3.369 1.351 1.132) 3.802 3.830 ( 1.891 -5.241 5.350) 7.724 4.276 ( 4.747 7.555 -6.534) 11.059 4.414 ( 7.273 -4.365 -5.265) 9.983 4.626 ( 14.547 10.087 -1.789) 17.792 4.727 ( 5.579 0.694 -0.174) 5.625 4.844 ( 0.299 0.800 3.173) 3.286 4.904 ( 5.816 -6.638 2.160) 9.086 5.516 ( -0.390 7.532 -1.467) 7.684 5.654 ( -0.143 -4.205 -0.737) 4.271 5.820 ( 0.892 7.878 -2.209) 8.231 5.962 ( -0.327 -4.427 -4.019) 5.988 6.242 ( 6.381 3.591 1.449) 7.464 6.327 ( 1.751 -1.170 -4.076) 4.588 6.448 ( 3.326 6.390 -2.313) 7.566 6.594 ( 1.545 -8.988 6.513) 11.207 6.885 ( -0.236 6.104 3.040) 6.823 7.031 ( -1.002 -6.230 6.267) 8.894 7.132 ( -3.325 3.297 0.939) 4.775 7.164 ( -1.210 0.286 -1.887) 2.260 7.492 ( 3.585 1.582 -5.635) 6.864 7.598 ( 4.998 -8.607 -5.223) 11.240 7.910 ( -6.005 4.365 -2.061) 7.704 7.993 ( -6.007 -3.678 -3.513) 7.871 8.409 ( 3.309 9.580 2.203) 10.372 8.616 ( 4.740 -8.194 -1.985) 9.673 8.856 ( -1.245 5.591 0.955) 5.807 9.036 ( 0.848 -9.401 -1.819) 9.613 11.064 ( -2.907 5.002 -4.834) 7.539 11.174 ( -4.003 -5.206 -5.261) 8.414 11.554 ( 0.744 2.917 2.803) 4.113 11.629 ( -1.167 -4.051 3.424) 5.431 13.769 ( -5.384 5.463 1.828) 7.884 13.862 ( -7.766 -2.897 4.904) 9.631 14.080 ( -9.430 0.795 1.266) 9.548 14.128 ( -11.123 -3.185 3.307) 12.034 15.451 ( 2.435 5.206 1.718) 5.999 15.534 ( 2.563 -0.749 -0.065) 2.671 15.650 ( 3.095 2.253 5.074) 6.356 15.747 ( 2.351 -5.001 3.195) 6.383 16.080 ( -4.059 0.538 -1.702) 4.434 16.099 ( -3.963 -1.179 -0.878) 4.227 16.663 ( -2.278 0.925 2.281) 3.354 16.686 ( -1.289 -1.345 1.452) 2.362 18.201 ( 7.970 0.832 2.540) 8.406 18.232 ( 8.062 -2.016 1.264) 8.405 18.525 ( 9.707 2.289 -0.188) 9.975 18.569 ( 9.707 -2.006 -0.943) 9.956 27.749 ( 0.355 1.344 2.185) 2.590 27.775 ( 0.113 -0.668 1.715) 1.844 27.875 ( 1.297 1.004 0.776) 1.814 27.923 ( 0.737 -3.286 0.615) 3.423 29.179 ( 1.637 4.260 1.009) 4.674 29.241 ( 0.458 -1.532 1.708) 2.339 29.422 ( -0.453 6.357 8.197) 10.383 29.532 ( -2.440 -3.700 10.114) 11.042 30.173 ( -5.527 7.216 0.448) 9.100 30.308 ( -6.749 -5.677 5.077) 10.176 30.686 ( -6.462 6.104 -9.953) 13.345 30.812 ( -9.871 -6.138 -11.094) 16.068 31.239 ( 4.195 10.134 0.357) 10.974 31.452 ( 4.256 -9.428 -6.152) 12.035 32.620 ( 12.167 6.420 1.638) 13.854 32.803 ( 11.934 -10.304 -5.640) 16.745 ======================= Grid point 328 (167/168) ======================= q-point: ( 0.40 0.43 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 282 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.686 ( 7.469 6.120 -8.842) 13.093 2.760 ( -0.877 -0.969 -0.713) 1.488 2.843 ( 12.629 11.375 -2.767) 17.220 3.010 ( 3.091 2.528 0.313) 4.005 3.195 ( 2.054 -6.173 0.619) 6.535 3.277 ( 0.025 -6.041 -0.538) 6.065 3.522 ( -1.922 -0.419 -0.674) 2.080 3.544 ( 0.510 -1.701 -5.319) 5.607 3.930 ( 8.503 4.984 8.412) 12.958 4.035 ( 11.634 -6.077 6.767) 14.767 4.238 ( 0.492 8.737 -5.009) 10.083 4.430 ( 1.369 -9.081 -5.349) 10.628 4.810 ( 9.785 7.609 -1.645) 12.504 4.833 ( 6.454 5.180 2.082) 8.534 4.911 ( 2.921 1.518 3.952) 5.143 5.018 ( 4.775 -5.665 -0.618) 7.435 5.549 ( 4.286 7.574 1.963) 8.921 5.683 ( 1.732 -2.541 3.015) 4.307 5.780 ( -0.406 5.388 -4.997) 7.360 5.894 ( -1.126 -4.103 -5.987) 7.345 6.319 ( 5.021 1.375 -2.563) 5.803 6.338 ( 4.195 0.600 -2.745) 5.049 6.529 ( 3.056 7.790 5.435) 9.978 6.715 ( 1.917 -10.097 8.765) 13.507 6.820 ( -8.034 7.736 -1.203) 11.218 6.990 ( -5.180 -7.224 -2.299) 9.182 7.112 ( -1.847 1.477 2.034) 3.120 7.129 ( -0.722 -1.122 -2.031) 2.430 7.509 ( 5.417 1.870 -3.072) 6.502 7.612 ( 5.727 -8.210 -7.492) 12.503 7.788 ( -7.179 2.631 0.012) 7.646 7.847 ( -7.135 -3.102 -2.819) 8.275 8.511 ( 5.007 9.568 4.428) 11.672 8.695 ( 5.266 -3.961 1.989) 6.883 8.799 ( -4.725 4.197 -1.869) 6.590 8.978 ( -3.077 -8.697 -4.984) 10.486 10.991 ( -1.053 2.268 -1.897) 3.139 11.060 ( -3.353 -4.155 -3.904) 6.614 11.599 ( 1.215 1.893 2.043) 3.038 11.642 ( -1.211 -2.202 1.937) 3.173 13.747 ( -0.071 4.141 1.904) 4.559 13.822 ( -3.539 -2.351 3.648) 5.600 13.951 ( -7.285 0.358 -0.349) 7.302 13.992 ( -9.216 -2.950 1.436) 9.783 15.514 ( 2.471 5.071 2.104) 6.021 15.566 ( 1.682 1.513 -0.598) 2.340 15.740 ( 2.065 -0.078 3.459) 4.029 15.795 ( 0.734 -3.779 0.834) 3.939 16.029 ( -1.269 0.756 -0.251) 1.499 16.047 ( -2.020 -0.996 -0.198) 2.261 16.650 ( -1.965 0.682 1.732) 2.706 16.669 ( -1.296 -1.148 -0.391) 1.775 18.336 ( 4.962 0.181 2.644) 5.626 18.354 ( 5.579 -1.468 0.529) 5.793 18.637 ( 5.011 1.631 -0.174) 5.272 18.667 ( 4.129 -1.311 -0.865) 4.417 27.774 ( 0.183 1.242 1.445) 1.915 27.788 ( -0.145 0.400 0.663) 0.788 27.904 ( 0.968 -0.655 0.971) 1.520 27.932 ( 0.230 -3.032 -0.267) 3.053 29.215 ( 1.790 3.418 0.583) 3.902 29.256 ( -0.642 -0.430 1.075) 1.324 29.491 ( -0.460 5.160 5.278) 7.396 29.570 ( -4.511 -1.950 5.749) 7.563 30.130 ( -1.652 6.855 2.384) 7.443 30.252 ( -5.647 -4.184 1.091) 7.112 30.556 ( -0.596 2.144 -3.483) 4.133 30.618 ( -1.149 -3.874 -8.089) 9.042 31.296 ( 2.139 6.769 1.541) 7.264 31.418 ( 0.775 -4.419 -6.156) 7.617 32.792 ( 6.458 1.270 2.880) 7.184 32.885 ( 6.207 -7.040 -4.920) 10.597 ======================= Grid point 329 (168/168) ======================= q-point: (-0.50 0.43 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 147 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.720 ( 5.851 3.292 -5.213) 8.500 2.720 ( -5.851 3.292 5.213) 8.500 2.981 ( -0.633 9.026 -1.811) 9.227 2.981 ( 0.633 9.026 1.811) 9.227 3.246 ( 1.031 -9.281 -4.375) 10.312 3.246 ( -1.031 -9.281 4.375) 10.312 3.505 ( 1.564 -1.318 -3.249) 3.839 3.505 ( -1.564 -1.318 3.249) 3.839 4.108 ( -3.975 6.308 -4.876) 8.909 4.108 ( 3.975 6.308 4.876) 8.909 4.318 ( -6.894 -6.482 -6.215) 11.321 4.318 ( 6.894 -6.482 6.215) 11.321 4.893 ( 3.417 7.367 -3.871) 8.996 4.893 ( -3.417 7.367 3.871) 8.996 5.007 ( -1.543 -2.765 -4.118) 5.195 5.007 ( 1.543 -2.765 4.118) 5.195 5.666 ( -4.155 7.867 -4.089) 9.791 5.666 ( 4.155 7.867 4.089) 9.791 5.793 ( -3.464 -5.141 -4.351) 7.573 5.793 ( 3.464 -5.141 4.351) 7.573 6.355 ( 1.105 1.118 -1.841) 2.421 6.355 ( -1.105 1.118 1.841) 2.421 6.653 ( -5.256 7.756 -5.904) 11.074 6.653 ( 5.256 7.756 5.904) 11.074 6.861 ( -2.638 -9.506 -8.324) 12.908 6.861 ( 2.638 -9.506 8.324) 12.908 7.109 ( 2.821 0.081 -3.952) 4.857 7.109 ( -2.821 0.081 3.952) 4.857 7.581 ( -2.217 -1.504 -3.387) 4.318 7.581 ( 2.217 -1.504 3.387) 4.318 7.742 ( -2.037 -1.700 -1.074) 2.862 7.742 ( 2.037 -1.700 1.074) 2.862 8.654 ( -4.486 9.895 -5.963) 12.393 8.654 ( 4.486 9.895 5.963) 12.393 8.845 ( -4.617 -8.495 -6.384) 11.586 8.845 ( 4.617 -8.495 6.384) 11.586 10.991 ( -1.090 -1.223 -1.526) 2.239 10.991 ( 1.090 -1.223 1.526) 2.239 11.633 ( -1.256 -0.083 -0.226) 1.279 11.633 ( 1.256 -0.083 0.226) 1.279 13.798 ( 0.839 2.137 -3.495) 4.181 13.798 ( -0.839 2.137 3.495) 4.181 13.897 ( 2.830 -2.781 -4.732) 6.175 13.897 ( -2.830 -2.781 4.732) 6.175 15.562 ( -0.095 3.810 -2.078) 4.340 15.562 ( 0.095 3.810 2.078) 4.340 15.790 ( -0.453 -2.146 -1.663) 2.753 15.790 ( 0.453 -2.146 1.663) 2.753 16.025 ( -0.324 -0.082 -0.383) 0.508 16.025 ( 0.324 -0.082 0.383) 0.508 16.649 ( 0.433 -0.286 -1.488) 1.576 16.649 ( -0.433 -0.286 1.488) 1.576 18.398 ( 0.518 -0.628 -1.519) 1.724 18.398 ( -0.518 -0.628 1.519) 1.724 18.684 ( -0.068 0.172 -1.043) 1.059 18.684 ( 0.068 0.172 1.043) 1.059 27.787 ( 0.191 1.018 -0.687) 1.243 27.787 ( -0.191 1.018 0.687) 1.243 27.925 ( -0.184 -2.114 -0.955) 2.327 27.925 ( 0.184 -2.114 0.955) 2.327 29.245 ( -0.500 1.718 -0.421) 1.839 29.245 ( 0.500 1.718 0.421) 1.839 29.539 ( -0.755 1.701 -1.598) 2.453 29.539 ( 0.755 1.701 1.598) 2.453 30.171 ( -1.943 1.661 -3.536) 4.363 30.171 ( 1.943 1.661 3.536) 4.363 30.555 ( 1.201 -1.384 -4.241) 4.620 30.555 ( -1.201 -1.384 4.241) 4.620 31.353 ( -1.044 1.302 -4.231) 4.548 31.353 ( 1.044 1.302 4.231) 4.548 32.883 ( 1.111 -3.163 -5.011) 6.029 32.883 ( -1.111 -3.163 5.011) 6.029 =================== 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 3/40320 10.0 3949.582 2551.112 3155.401 0.000 -633.088 0.000 3/40320 20.0 518.930 367.286 333.372 0.000 -69.178 0.000 3/40320 30.0 172.820 118.057 104.583 0.000 -24.996 0.000 3/40320 40.0 85.223 56.483 50.444 0.000 -12.424 0.000 3/40320 50.0 51.681 33.597 30.284 0.000 -7.400 0.000 3/40320 60.0 35.557 22.859 20.745 0.000 -4.983 0.000 3/40320 70.0 26.582 16.989 15.492 0.000 -3.655 0.000 3/40320 80.0 21.046 13.413 12.274 0.000 -2.849 0.000 3/40320 90.0 17.359 11.052 10.141 0.000 -2.321 0.000 3/40320 100.0 14.758 9.395 8.639 0.000 -1.953 0.000 3/40320 110.0 12.837 8.175 7.531 0.000 -1.685 0.000 3/40320 120.0 11.367 7.242 6.683 0.000 -1.481 0.000 3/40320 130.0 10.208 6.508 6.013 0.000 -1.322 0.000 3/40320 140.0 9.273 5.914 5.473 0.000 -1.195 0.000 3/40320 150.0 8.504 5.425 5.027 0.000 -1.091 0.000 3/40320 160.0 7.860 5.016 4.654 0.000 -1.004 0.000 3/40320 170.0 7.314 4.668 4.336 0.000 -0.930 0.000 3/40320 180.0 6.845 4.368 4.064 0.000 -0.867 0.000 3/40320 190.0 6.438 4.108 3.828 0.000 -0.813 0.000 3/40320 200.0 6.082 3.881 3.620 0.000 -0.765 0.000 3/40320 210.0 5.767 3.679 3.438 0.000 -0.722 0.000 3/40320 220.0 5.488 3.500 3.275 0.000 -0.684 0.000 3/40320 230.0 5.238 3.340 3.130 0.000 -0.650 0.000 3/40320 240.0 5.012 3.196 3.000 0.000 -0.620 0.000 3/40320 250.0 4.809 3.065 2.881 0.000 -0.592 0.000 3/40320 260.0 4.623 2.946 2.774 0.000 -0.566 0.000 3/40320 270.0 4.454 2.838 2.676 0.000 -0.543 0.000 3/40320 280.0 4.299 2.738 2.586 0.000 -0.521 0.000 3/40320 290.0 4.155 2.647 2.503 0.000 -0.501 0.000 3/40320 300.0 4.023 2.562 2.427 0.000 -0.483 0.000 3/40320 310.0 3.900 2.483 2.356 0.000 -0.466 0.000 3/40320 320.0 3.786 2.410 2.289 0.000 -0.450 0.000 3/40320 330.0 3.679 2.342 2.228 0.000 -0.435 0.000 3/40320 340.0 3.579 2.278 2.170 0.000 -0.421 0.000 3/40320 350.0 3.485 2.218 2.115 0.000 -0.408 0.000 3/40320 360.0 3.397 2.162 2.064 0.000 -0.395 0.000 3/40320 370.0 3.313 2.108 2.015 0.000 -0.384 0.000 3/40320 380.0 3.234 2.058 1.970 0.000 -0.373 0.000 3/40320 390.0 3.159 2.010 1.926 0.000 -0.362 0.000 3/40320 400.0 3.088 1.965 1.885 0.000 -0.353 0.000 3/40320 410.0 3.021 1.922 1.845 0.000 -0.343 0.000 3/40320 420.0 2.956 1.881 1.808 0.000 -0.334 0.000 3/40320 430.0 2.895 1.842 1.772 0.000 -0.326 0.000 3/40320 440.0 2.836 1.805 1.738 0.000 -0.318 0.000 3/40320 450.0 2.780 1.769 1.705 0.000 -0.310 0.000 3/40320 460.0 2.726 1.735 1.673 0.000 -0.303 0.000 3/40320 470.0 2.675 1.702 1.643 0.000 -0.296 0.000 3/40320 480.0 2.625 1.670 1.613 0.000 -0.290 0.000 3/40320 490.0 2.577 1.640 1.585 0.000 -0.283 0.000 3/40320 500.0 2.531 1.611 1.558 0.000 -0.277 0.000 3/40320 510.0 2.487 1.583 1.532 0.000 -0.271 0.000 3/40320 520.0 2.445 1.556 1.507 0.000 -0.266 0.000 3/40320 530.0 2.403 1.530 1.482 0.000 -0.260 0.000 3/40320 540.0 2.364 1.504 1.459 0.000 -0.255 0.000 3/40320 550.0 2.325 1.480 1.436 0.000 -0.250 0.000 3/40320 560.0 2.288 1.456 1.414 0.000 -0.246 0.000 3/40320 570.0 2.252 1.433 1.392 0.000 -0.241 0.000 3/40320 580.0 2.217 1.411 1.371 0.000 -0.237 0.000 3/40320 590.0 2.184 1.390 1.351 0.000 -0.232 0.000 3/40320 600.0 2.151 1.369 1.332 0.000 -0.228 0.000 3/40320 610.0 2.119 1.349 1.313 0.000 -0.224 0.000 3/40320 620.0 2.088 1.329 1.294 0.000 -0.220 0.000 3/40320 630.0 2.058 1.310 1.276 0.000 -0.217 0.000 3/40320 640.0 2.029 1.292 1.259 0.000 -0.213 0.000 3/40320 650.0 2.001 1.274 1.242 0.000 -0.210 0.000 3/40320 660.0 1.974 1.256 1.225 0.000 -0.206 0.000 3/40320 670.0 1.947 1.239 1.209 0.000 -0.203 0.000 3/40320 680.0 1.921 1.223 1.193 0.000 -0.200 0.000 3/40320 690.0 1.896 1.207 1.178 0.000 -0.197 0.000 3/40320 700.0 1.871 1.191 1.163 0.000 -0.194 0.000 3/40320 710.0 1.847 1.176 1.148 0.000 -0.191 0.000 3/40320 720.0 1.823 1.161 1.134 0.000 -0.188 0.000 3/40320 730.0 1.800 1.146 1.120 0.000 -0.186 0.000 3/40320 740.0 1.778 1.132 1.107 0.000 -0.183 0.000 3/40320 750.0 1.756 1.118 1.093 0.000 -0.180 0.000 3/40320 760.0 1.735 1.105 1.080 0.000 -0.178 0.000 3/40320 770.0 1.714 1.092 1.068 0.000 -0.175 0.000 3/40320 780.0 1.694 1.079 1.055 0.000 -0.173 0.000 3/40320 790.0 1.674 1.066 1.043 0.000 -0.171 0.000 3/40320 800.0 1.655 1.054 1.032 0.000 -0.169 0.000 3/40320 810.0 1.636 1.042 1.020 0.000 -0.166 0.000 3/40320 820.0 1.618 1.030 1.009 0.000 -0.164 0.000 3/40320 830.0 1.599 1.018 0.998 0.000 -0.162 0.000 3/40320 840.0 1.582 1.007 0.987 0.000 -0.160 0.000 3/40320 850.0 1.564 0.996 0.976 0.000 -0.158 0.000 3/40320 860.0 1.547 0.985 0.966 0.000 -0.156 0.000 3/40320 870.0 1.531 0.975 0.956 0.000 -0.154 0.000 3/40320 880.0 1.515 0.965 0.946 0.000 -0.153 0.000 3/40320 890.0 1.499 0.954 0.936 0.000 -0.151 0.000 3/40320 900.0 1.483 0.945 0.926 0.000 -0.149 0.000 3/40320 910.0 1.468 0.935 0.917 0.000 -0.147 0.000 3/40320 920.0 1.453 0.925 0.908 0.000 -0.146 0.000 3/40320 930.0 1.438 0.916 0.899 0.000 -0.144 0.000 3/40320 940.0 1.424 0.907 0.890 0.000 -0.143 0.000 3/40320 950.0 1.410 0.898 0.881 0.000 -0.141 0.000 3/40320 960.0 1.396 0.889 0.873 0.000 -0.139 0.000 3/40320 970.0 1.382 0.881 0.864 0.000 -0.138 0.000 3/40320 980.0 1.369 0.872 0.856 0.000 -0.137 0.000 3/40320 990.0 1.356 0.864 0.848 0.000 -0.135 0.000 3/40320 1000.0 1.343 0.856 0.840 0.000 -0.134 0.000 3/40320 Thermal conductivity related properties were written into "kappa-m1078.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 20:25:01]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|