----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 21:43:04]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.139273685081686 -2.544731979999999 0.000000000000000 b 6.139273685081686 2.544731979999999 0.000000000000000 c -4.450922832399752 0.000000000000000 15.322467989714841 Atomic positions (fractional): *1 Y 0.13249925902394 0.62900312970547 0.46307725941536 88.906 2 Y 0.37099687029453 0.86750074097606 0.03692274058464 88.906 3 Y 0.62900312970547 0.13249925902394 0.96307725941536 88.906 4 Y 0.86750074097606 0.37099687029453 0.53692274058464 88.906 *5 Te 0.83951318600466 0.40815459289094 0.87127935616380 127.600 *6 Te 0.15267112440615 0.59660044920202 0.79829748336160 127.600 7 Te 0.40339955079798 0.84732887559385 0.70170251663840 127.600 8 Te 0.59184540710906 0.16048681399534 0.62872064383620 127.600 9 Te 0.40815459289094 0.83951318600466 0.37127935616380 127.600 10 Te 0.59660044920202 0.15267112440615 0.29829748336160 127.600 11 Te 0.16048681399534 0.59184540710906 0.12872064383620 127.600 12 Te 0.84732887559384 0.40339955079798 0.20170251663840 127.600 *13 O 0.13607001937568 0.86392998062432 0.75000000000000 15.999 *14 O 0.96037111867663 0.17507834050682 0.95435939836164 15.999 *15 O 0.08968278246367 0.21517256828194 0.66997055753270 15.999 *16 O 0.31543753257259 0.18810082295795 0.37000968225421 15.999 17 O 0.03962888132337 0.82492165949318 0.04564060163836 15.999 18 O 0.21517256828194 0.08968278246367 0.16997055753270 15.999 19 O 0.86392998062432 0.13607001937568 0.25000000000000 15.999 20 O 0.91031721753633 0.78482743171806 0.33002944246730 15.999 21 O 0.68456246742741 0.81189917704205 0.62999031774579 15.999 22 O 0.17507834050682 0.96037111867663 0.45435939836164 15.999 *23 O 0.24682883452548 0.33750249192690 0.55317497010309 15.999 24 O 0.81189917704205 0.68456246742741 0.12999031774579 15.999 *25 O 0.60168883193688 0.44611446409547 0.09695100458096 15.999 26 O 0.75317116547452 0.66249750807310 0.44682502989691 15.999 27 O 0.18810082295795 0.31543753257259 0.87000968225421 15.999 28 O 0.66249750807310 0.75317116547452 0.94682502989691 15.999 29 O 0.33750249192690 0.24682883452548 0.05317497010309 15.999 30 O 0.78482743171806 0.91031721753633 0.83002944246730 15.999 31 O 0.44611446409547 0.60168883193688 0.59695100458096 15.999 32 O 0.39831116806312 0.55388553590453 0.90304899541904 15.999 33 O 0.82492165949318 0.03962888132337 0.54564060163836 15.999 34 O 0.55388553590453 0.39831116806312 0.40304899541904 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 12.278547370163372 0.000000000000000 0.000000000000000 b 0.000000000000000 5.089463959999999 0.000000000000000 c -4.450922832399752 0.000000000000000 15.322467989714841 Atomic positions (fractional): *1 Y 0.88075119436471 0.74825193534077 0.46307725941536 88.906 > 1 2 Y 0.61924880563529 0.24825193534077 0.03692274058464 88.906 > 2 3 Y 0.38075119436471 0.75174806465923 0.96307725941536 88.906 > 3 4 Y 0.11924880563529 0.25174806465923 0.53692274058464 88.906 > 4 5 Y 0.38075119436471 0.24825193534077 0.46307725941536 88.906 > 1 6 Y 0.11924880563529 0.74825193534077 0.03692274058464 88.906 > 2 7 Y 0.88075119436471 0.25174806465923 0.96307725941536 88.906 > 3 8 Y 0.61924880563529 0.75174806465923 0.53692274058464 88.906 > 4 *9 Te 0.12383388944780 0.28432070344314 0.87127935616380 127.600 > 5 *10 Te 0.37463578680409 0.22196466239793 0.79829748336160 127.600 > 6 11 Te 0.12536421319591 0.72196466239793 0.70170251663840 127.600 > 7 12 Te 0.87616611055220 0.28432070344314 0.62872064383620 127.600 > 8 13 Te 0.12383388944780 0.71567929655686 0.37127935616380 127.600 > 9 14 Te 0.87463578680409 0.27803533760207 0.29829748336160 127.600 > 10 15 Te 0.87616611055220 0.71567929655686 0.12872064383620 127.600 > 11 16 Te 0.62536421319591 0.77803533760207 0.20170251663840 127.600 > 12 17 Te 0.62383388944780 0.78432070344314 0.87127935616380 127.600 > 5 18 Te 0.87463578680409 0.72196466239793 0.79829748336160 127.600 > 6 19 Te 0.62536421319591 0.22196466239793 0.70170251663840 127.600 > 7 20 Te 0.37616611055220 0.78432070344314 0.62872064383620 127.600 > 8 21 Te 0.62383388944780 0.21567929655686 0.37127935616380 127.600 > 9 22 Te 0.37463578680409 0.77803533760207 0.29829748336160 127.600 > 10 23 Te 0.37616611055220 0.21567929655686 0.12872064383620 127.600 > 11 24 Te 0.12536421319591 0.27803533760207 0.20170251663840 127.600 > 12 *25 O 0.00000000000000 0.86392998062432 0.75000000000000 15.999 > 13 *26 O 0.06772472959173 0.10735361091510 0.95435939836164 15.999 > 14 *27 O 0.15242767537281 0.06274489290914 0.66997055753270 15.999 > 15 *28 O 0.75176917776527 0.43633164519268 0.37000968225421 15.999 > 16 29 O 0.93227527040827 0.89264638908490 0.04564060163836 15.999 > 17 30 O 0.65242767537281 0.43725510709086 0.16997055753270 15.999 > 18 31 O 0.00000000000000 0.13607001937568 0.25000000000000 15.999 > 19 32 O 0.84757232462719 0.93725510709086 0.33002944246730 15.999 > 20 33 O 0.24823082223473 0.56366835480732 0.62999031774579 15.999 > 21 34 O 0.06772472959173 0.89264638908490 0.45435939836164 15.999 > 22 *35 O 0.79216566322619 0.54533682870071 0.55317497010309 15.999 > 23 36 O 0.74823082223473 0.93633164519268 0.12999031774579 15.999 > 24 *37 O 0.02390164801617 0.42221281607929 0.09695100458096 15.999 > 25 38 O 0.20783433677381 0.45466317129929 0.44682502989691 15.999 > 26 39 O 0.25176917776527 0.06366835480732 0.87000968225421 15.999 > 27 40 O 0.20783433677381 0.54533682870071 0.94682502989691 15.999 > 28 41 O 0.79216566322619 0.45466317129929 0.05317497010309 15.999 > 29 42 O 0.34757232462719 0.56274489290914 0.83002944246730 15.999 > 30 43 O 0.02390164801617 0.57778718392071 0.59695100458096 15.999 > 31 44 O 0.97609835198382 0.57778718392071 0.90304899541904 15.999 > 32 45 O 0.93227527040827 0.10735361091510 0.54564060163836 15.999 > 33 46 O 0.97609835198382 0.42221281607929 0.40304899541904 15.999 > 34 47 O 0.50000000000000 0.36392998062432 0.75000000000000 15.999 > 13 48 O 0.56772472959173 0.60735361091510 0.95435939836164 15.999 > 14 49 O 0.65242767537281 0.56274489290914 0.66997055753270 15.999 > 15 50 O 0.25176917776527 0.93633164519268 0.37000968225421 15.999 > 16 51 O 0.43227527040827 0.39264638908490 0.04564060163836 15.999 > 17 52 O 0.15242767537281 0.93725510709086 0.16997055753270 15.999 > 18 53 O 0.50000000000000 0.63607001937568 0.25000000000000 15.999 > 19 54 O 0.34757232462719 0.43725510709086 0.33002944246730 15.999 > 20 55 O 0.74823082223473 0.06366835480732 0.62999031774579 15.999 > 21 56 O 0.56772472959173 0.39264638908490 0.45435939836164 15.999 > 22 57 O 0.29216566322619 0.04533682870071 0.55317497010309 15.999 > 23 58 O 0.24823082223473 0.43633164519268 0.12999031774579 15.999 > 24 59 O 0.52390164801618 0.92221281607929 0.09695100458096 15.999 > 25 60 O 0.70783433677381 0.95466317129929 0.44682502989691 15.999 > 26 61 O 0.75176917776527 0.56366835480732 0.87000968225421 15.999 > 27 62 O 0.70783433677381 0.04533682870071 0.94682502989691 15.999 > 28 63 O 0.29216566322619 0.95466317129929 0.05317497010309 15.999 > 29 64 O 0.84757232462719 0.06274489290914 0.83002944246730 15.999 > 30 65 O 0.52390164801618 0.07778718392071 0.59695100458096 15.999 > 31 66 O 0.47609835198382 0.07778718392071 0.90304899541904 15.999 > 32 67 O 0.43227527040827 0.60735361091510 0.54564060163836 15.999 > 33 68 O 0.47609835198382 0.92221281607929 0.40304899541904 15.999 > 34 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.278547370163372 0.000000000000000 0.000000000000000 b 0.000000000000000 10.178927919999998 0.000000000000000 c -4.450922832399752 0.000000000000000 15.322467989714841 Atomic positions (fractional): *1 Y 0.88075119436471 0.37412596767038 0.46307725941536 88.906 > 1 2 Y 0.88075119436471 0.87412596767038 0.46307725941536 88.906 > 1 3 Y 0.61924880563529 0.12412596767038 0.03692274058464 88.906 > 2 4 Y 0.61924880563529 0.62412596767038 0.03692274058464 88.906 > 2 5 Y 0.38075119436471 0.37587403232962 0.96307725941536 88.906 > 3 6 Y 0.38075119436471 0.87587403232962 0.96307725941536 88.906 > 3 7 Y 0.11924880563529 0.12587403232962 0.53692274058464 88.906 > 4 8 Y 0.11924880563529 0.62587403232962 0.53692274058464 88.906 > 4 9 Y 0.38075119436471 0.12412596767038 0.46307725941536 88.906 > 1 10 Y 0.38075119436471 0.62412596767038 0.46307725941536 88.906 > 1 11 Y 0.11924880563529 0.37412596767038 0.03692274058464 88.906 > 2 12 Y 0.11924880563529 0.87412596767038 0.03692274058464 88.906 > 2 13 Y 0.88075119436471 0.12587403232962 0.96307725941536 88.906 > 3 14 Y 0.88075119436471 0.62587403232962 0.96307725941536 88.906 > 3 15 Y 0.61924880563529 0.37587403232962 0.53692274058464 88.906 > 4 16 Y 0.61924880563529 0.87587403232962 0.53692274058464 88.906 > 4 *17 Te 0.12383388944780 0.14216035172157 0.87127935616380 127.600 > 5 18 Te 0.12383388944780 0.64216035172157 0.87127935616380 127.600 > 5 *19 Te 0.37463578680409 0.11098233119897 0.79829748336160 127.600 > 6 20 Te 0.37463578680409 0.61098233119897 0.79829748336160 127.600 > 6 21 Te 0.12536421319591 0.36098233119897 0.70170251663840 127.600 > 7 22 Te 0.12536421319591 0.86098233119897 0.70170251663840 127.600 > 7 23 Te 0.87616611055220 0.14216035172157 0.62872064383620 127.600 > 8 24 Te 0.87616611055220 0.64216035172157 0.62872064383620 127.600 > 8 25 Te 0.12383388944780 0.35783964827843 0.37127935616380 127.600 > 9 26 Te 0.12383388944780 0.85783964827843 0.37127935616380 127.600 > 9 27 Te 0.87463578680409 0.13901766880103 0.29829748336160 127.600 > 10 28 Te 0.87463578680409 0.63901766880103 0.29829748336160 127.600 > 10 29 Te 0.87616611055220 0.35783964827843 0.12872064383620 127.600 > 11 30 Te 0.87616611055220 0.85783964827843 0.12872064383620 127.600 > 11 31 Te 0.62536421319591 0.38901766880103 0.20170251663840 127.600 > 12 32 Te 0.62536421319591 0.88901766880103 0.20170251663840 127.600 > 12 33 Te 0.62383388944780 0.39216035172157 0.87127935616380 127.600 > 5 34 Te 0.62383388944780 0.89216035172157 0.87127935616380 127.600 > 5 35 Te 0.87463578680409 0.36098233119897 0.79829748336160 127.600 > 6 36 Te 0.87463578680409 0.86098233119897 0.79829748336160 127.600 > 6 37 Te 0.62536421319591 0.11098233119897 0.70170251663840 127.600 > 7 38 Te 0.62536421319591 0.61098233119897 0.70170251663840 127.600 > 7 39 Te 0.37616611055220 0.39216035172157 0.62872064383620 127.600 > 8 40 Te 0.37616611055220 0.89216035172157 0.62872064383620 127.600 > 8 41 Te 0.62383388944780 0.10783964827843 0.37127935616380 127.600 > 9 42 Te 0.62383388944780 0.60783964827843 0.37127935616380 127.600 > 9 43 Te 0.37463578680409 0.38901766880103 0.29829748336160 127.600 > 10 44 Te 0.37463578680409 0.88901766880103 0.29829748336160 127.600 > 10 45 Te 0.37616611055220 0.10783964827843 0.12872064383620 127.600 > 11 46 Te 0.37616611055220 0.60783964827843 0.12872064383620 127.600 > 11 47 Te 0.12536421319591 0.13901766880103 0.20170251663840 127.600 > 12 48 Te 0.12536421319591 0.63901766880103 0.20170251663840 127.600 > 12 *49 O 0.00000000000000 0.43196499031216 0.75000000000000 15.999 > 13 50 O 0.00000000000000 0.93196499031216 0.75000000000000 15.999 > 13 *51 O 0.06772472959173 0.05367680545755 0.95435939836164 15.999 > 14 52 O 0.06772472959173 0.55367680545755 0.95435939836164 15.999 > 14 *53 O 0.15242767537281 0.03137244645457 0.66997055753270 15.999 > 15 54 O 0.15242767537281 0.53137244645457 0.66997055753270 15.999 > 15 *55 O 0.75176917776527 0.21816582259634 0.37000968225421 15.999 > 16 56 O 0.75176917776527 0.71816582259634 0.37000968225421 15.999 > 16 57 O 0.93227527040827 0.44632319454245 0.04564060163836 15.999 > 17 58 O 0.93227527040827 0.94632319454245 0.04564060163836 15.999 > 17 59 O 0.65242767537281 0.21862755354543 0.16997055753270 15.999 > 18 60 O 0.65242767537281 0.71862755354543 0.16997055753270 15.999 > 18 61 O 0.00000000000000 0.06803500968784 0.25000000000000 15.999 > 19 62 O 0.00000000000000 0.56803500968784 0.25000000000000 15.999 > 19 63 O 0.84757232462719 0.46862755354543 0.33002944246730 15.999 > 20 64 O 0.84757232462719 0.96862755354543 0.33002944246730 15.999 > 20 65 O 0.24823082223473 0.28183417740366 0.62999031774579 15.999 > 21 66 O 0.24823082223473 0.78183417740366 0.62999031774579 15.999 > 21 67 O 0.06772472959173 0.44632319454245 0.45435939836164 15.999 > 22 68 O 0.06772472959173 0.94632319454245 0.45435939836164 15.999 > 22 *69 O 0.79216566322619 0.27266841435035 0.55317497010309 15.999 > 23 70 O 0.79216566322619 0.77266841435036 0.55317497010309 15.999 > 23 71 O 0.74823082223473 0.46816582259634 0.12999031774579 15.999 > 24 72 O 0.74823082223473 0.96816582259634 0.12999031774579 15.999 > 24 *73 O 0.02390164801617 0.21110640803965 0.09695100458096 15.999 > 25 74 O 0.02390164801617 0.71110640803965 0.09695100458096 15.999 > 25 75 O 0.20783433677381 0.22733158564965 0.44682502989691 15.999 > 26 76 O 0.20783433677381 0.72733158564964 0.44682502989691 15.999 > 26 77 O 0.25176917776527 0.03183417740366 0.87000968225421 15.999 > 27 78 O 0.25176917776527 0.53183417740366 0.87000968225421 15.999 > 27 79 O 0.20783433677381 0.27266841435035 0.94682502989691 15.999 > 28 80 O 0.20783433677381 0.77266841435036 0.94682502989691 15.999 > 28 81 O 0.79216566322619 0.22733158564965 0.05317497010309 15.999 > 29 82 O 0.79216566322619 0.72733158564964 0.05317497010309 15.999 > 29 83 O 0.34757232462719 0.28137244645457 0.83002944246730 15.999 > 30 84 O 0.34757232462719 0.78137244645457 0.83002944246730 15.999 > 30 85 O 0.02390164801617 0.28889359196035 0.59695100458096 15.999 > 31 86 O 0.02390164801617 0.78889359196035 0.59695100458096 15.999 > 31 87 O 0.97609835198382 0.28889359196035 0.90304899541904 15.999 > 32 88 O 0.97609835198382 0.78889359196035 0.90304899541904 15.999 > 32 89 O 0.93227527040827 0.05367680545755 0.54564060163836 15.999 > 33 90 O 0.93227527040827 0.55367680545755 0.54564060163836 15.999 > 33 91 O 0.97609835198382 0.21110640803965 0.40304899541904 15.999 > 34 92 O 0.97609835198382 0.71110640803965 0.40304899541904 15.999 > 34 93 O 0.50000000000000 0.18196499031216 0.75000000000000 15.999 > 13 94 O 0.50000000000000 0.68196499031216 0.75000000000000 15.999 > 13 95 O 0.56772472959173 0.30367680545755 0.95435939836164 15.999 > 14 96 O 0.56772472959173 0.80367680545755 0.95435939836164 15.999 > 14 97 O 0.65242767537281 0.28137244645457 0.66997055753270 15.999 > 15 98 O 0.65242767537281 0.78137244645457 0.66997055753270 15.999 > 15 99 O 0.25176917776527 0.46816582259634 0.37000968225421 15.999 > 16 100 O 0.25176917776527 0.96816582259634 0.37000968225421 15.999 > 16 101 O 0.43227527040827 0.19632319454245 0.04564060163836 15.999 > 17 102 O 0.43227527040827 0.69632319454245 0.04564060163836 15.999 > 17 103 O 0.15242767537281 0.46862755354543 0.16997055753270 15.999 > 18 104 O 0.15242767537281 0.96862755354543 0.16997055753270 15.999 > 18 105 O 0.50000000000000 0.31803500968784 0.25000000000000 15.999 > 19 106 O 0.50000000000000 0.81803500968784 0.25000000000000 15.999 > 19 107 O 0.34757232462719 0.21862755354543 0.33002944246730 15.999 > 20 108 O 0.34757232462719 0.71862755354543 0.33002944246730 15.999 > 20 109 O 0.74823082223473 0.03183417740366 0.62999031774579 15.999 > 21 110 O 0.74823082223473 0.53183417740366 0.62999031774579 15.999 > 21 111 O 0.56772472959173 0.19632319454245 0.45435939836164 15.999 > 22 112 O 0.56772472959173 0.69632319454245 0.45435939836164 15.999 > 22 113 O 0.29216566322619 0.02266841435035 0.55317497010309 15.999 > 23 114 O 0.29216566322619 0.52266841435036 0.55317497010309 15.999 > 23 115 O 0.24823082223473 0.21816582259634 0.12999031774579 15.999 > 24 116 O 0.24823082223473 0.71816582259634 0.12999031774579 15.999 > 24 117 O 0.52390164801618 0.46110640803965 0.09695100458096 15.999 > 25 118 O 0.52390164801618 0.96110640803965 0.09695100458096 15.999 > 25 119 O 0.70783433677381 0.47733158564965 0.44682502989691 15.999 > 26 120 O 0.70783433677381 0.97733158564964 0.44682502989691 15.999 > 26 121 O 0.75176917776527 0.28183417740366 0.87000968225421 15.999 > 27 122 O 0.75176917776527 0.78183417740366 0.87000968225421 15.999 > 27 123 O 0.70783433677381 0.02266841435035 0.94682502989691 15.999 > 28 124 O 0.70783433677381 0.52266841435036 0.94682502989691 15.999 > 28 125 O 0.29216566322619 0.47733158564965 0.05317497010309 15.999 > 29 126 O 0.29216566322619 0.97733158564964 0.05317497010309 15.999 > 29 127 O 0.84757232462719 0.03137244645457 0.83002944246730 15.999 > 30 128 O 0.84757232462719 0.53137244645457 0.83002944246730 15.999 > 30 129 O 0.52390164801618 0.03889359196035 0.59695100458096 15.999 > 31 130 O 0.52390164801618 0.53889359196035 0.59695100458096 15.999 > 31 131 O 0.47609835198382 0.03889359196035 0.90304899541904 15.999 > 32 132 O 0.47609835198382 0.53889359196035 0.90304899541904 15.999 > 32 133 O 0.43227527040827 0.30367680545755 0.54564060163836 15.999 > 33 134 O 0.43227527040827 0.80367680545755 0.54564060163836 15.999 > 33 135 O 0.47609835198382 0.46110640803965 0.40304899541904 15.999 > 34 136 O 0.47609835198382 0.96110640803965 0.40304899541904 15.999 > 34 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.5269124 0.0000000 -0.5398857 0.0000000 4.9521581 0.0000000 -0.5398908 0.0000000 4.6854194 -------------------------- Born effective charges -------------------------- 1 Y 3.9687604 -0.1293788 -0.4290904 0.0101265 4.4310370 -0.2281421 -0.2591512 0.1033440 4.6392233 2 Y 3.9687604 0.1293788 -0.4290904 -0.0101265 4.4310370 0.2281421 -0.2591512 -0.1033440 4.6392233 3 Y 3.9687604 0.1293788 -0.4290904 -0.0101265 4.4310370 0.2281421 -0.2591512 -0.1033440 4.6392233 4 Y 3.9687604 -0.1293788 -0.4290904 0.0101265 4.4310370 -0.2281421 -0.2591512 0.1033440 4.6392233 5 Te 4.9179684 -1.0087816 -0.3452248 -0.5082446 4.1203706 0.6299098 -0.3921561 0.6368296 3.0360482 6 Te 5.8306034 0.7907078 -0.9713903 0.1685388 3.5529036 -0.6781641 -1.0247276 -0.9385304 3.6712133 7 Te 5.8306034 -0.7907078 -0.9713903 -0.1685388 3.5529036 0.6781641 -1.0247276 0.9385304 3.6712133 8 Te 4.9179684 1.0087816 -0.3452248 0.5082446 4.1203706 -0.6299098 -0.3921561 -0.6368296 3.0360482 9 Te 4.9179684 1.0087816 -0.3452248 0.5082446 4.1203706 -0.6299098 -0.3921561 -0.6368296 3.0360482 10 Te 5.8306034 -0.7907078 -0.9713903 -0.1685388 3.5529036 0.6781641 -1.0247276 0.9385304 3.6712133 11 Te 4.9179684 -1.0087816 -0.3452248 -0.5082446 4.1203706 0.6299098 -0.3921561 0.6368296 3.0360482 12 Te 5.8306034 0.7907078 -0.9713903 0.1685388 3.5529036 -0.6781641 -1.0247276 -0.9385304 3.6712133 13 O -4.5398844 0.0000000 0.9623109 0.0000000 -1.7937303 0.0000000 1.6103325 0.0000000 -1.6834834 14 O -2.3123736 -0.2865888 0.9101782 -0.3967823 -2.1805728 1.0648029 0.4944081 0.9260933 -2.2347828 15 O -1.7319654 -0.7326604 0.3703392 -0.3259177 -2.7130539 0.8552899 0.0879582 0.4564846 -1.9428759 16 O -3.8873903 -0.7372881 0.4138366 -0.9632203 -1.9851491 -0.2787636 0.7741969 0.0051975 -1.6605954 17 O -2.3123736 -0.2865888 0.9101782 -0.3967823 -2.1805728 1.0648029 0.4944081 0.9260933 -2.2347828 18 O -1.7319654 0.7326604 0.3703392 0.3259177 -2.7130539 -0.8552899 0.0879582 -0.4564846 -1.9428759 19 O -4.5398844 0.0000000 0.9623109 0.0000000 -1.7937303 0.0000000 1.6103325 0.0000000 -1.6834834 20 O -1.7319654 -0.7326604 0.3703392 -0.3259177 -2.7130539 0.8552899 0.0879582 0.4564846 -1.9428759 21 O -3.8873903 -0.7372881 0.4138366 -0.9632203 -1.9851491 -0.2787636 0.7741969 0.0051975 -1.6605954 22 O -2.3123736 0.2865888 0.9101782 0.3967823 -2.1805728 -1.0648029 0.4944081 -0.9260933 -2.2347828 23 O -2.0986929 0.3514020 -0.0630918 0.3203964 -2.3316722 1.2438478 -0.1283239 0.8839613 -2.0731431 24 O -3.8873903 0.7372881 0.4138366 0.9632203 -1.9851491 0.2787636 0.7741969 -0.0051975 -1.6605954 25 O -2.4169678 0.4880287 -0.3667123 0.4899541 -1.9969980 0.6747595 -0.3573707 0.4779252 -2.5933457 26 O -2.0986929 0.3514020 -0.0630918 0.3203964 -2.3316722 1.2438478 -0.1283239 0.8839613 -2.0731431 27 O -3.8873903 0.7372881 0.4138366 0.9632203 -1.9851491 0.2787636 0.7741969 -0.0051975 -1.6605954 28 O -2.0986929 -0.3514020 -0.0630918 -0.3203964 -2.3316722 -1.2438478 -0.1283239 -0.8839613 -2.0731431 29 O -2.0986929 -0.3514020 -0.0630918 -0.3203964 -2.3316722 -1.2438478 -0.1283239 -0.8839613 -2.0731431 30 O -1.7319654 0.7326604 0.3703392 0.3259177 -2.7130539 -0.8552899 0.0879582 -0.4564846 -1.9428759 31 O -2.4169678 -0.4880287 -0.3667123 -0.4899541 -1.9969980 -0.6747595 -0.3573707 -0.4779252 -2.5933457 32 O -2.4169678 0.4880287 -0.3667123 0.4899541 -1.9969980 0.6747595 -0.3573707 0.4779252 -2.5933457 33 O -2.3123736 0.2865888 0.9101782 0.3967823 -2.1805728 -1.0648029 0.4944081 -0.9260933 -2.2347828 34 O -2.4169678 -0.4880287 -0.3667123 -0.4899541 -1.9969980 -0.6747595 -0.3573707 -0.4779252 -2.5933457 ---------------------------------------------------------------------------- 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: 408/408 Permutation basis: 25986/25986 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 5357 Number of blocks in projector: 5357 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: 1160 Use submatrix version of eigh solver. (1) Block: 500 / 1160 (2) Block: 250 / 500 (2) 233 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 483 eigenvectors found. (1) Block: 1000 / 1160 (2) Block: 250 / 500 (2) 237 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 487 eigenvectors found. (1) Block: 1160 / 1160 (1) 152 eigenvectors found. (1) Complementary block size: 38 (1) Compute compressed projector. (1) Use standard solver. (1) 21 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1152 Use submatrix version of eigh solver. (1) Block: 500 / 1152 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1000 / 1152 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1152 / 1152 (1) 142 eigenvectors found. (1) Complementary block size: 42 (1) Compute compressed projector. (1) Use standard solver. (1) 26 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1152 Use submatrix version of eigh solver. (1) Block: 500 / 1152 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1000 / 1152 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1152 / 1152 (1) 142 eigenvectors found. (1) Complementary block size: 42 (1) Compute compressed projector. (1) Use standard solver. (1) 26 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 631 Use submatrix version of eigh solver. (1) Block: 500 / 631 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 243 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 631 / 631 (1) 122 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 631 Use submatrix version of eigh solver. (1) Block: 500 / 631 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 243 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 631 / 631 (1) 122 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 631 Use submatrix version of eigh solver. (1) Block: 500 / 631 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 243 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 631 / 631 (1) 122 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. Tree of FC basis block matrices: - (5357, 5281), data: False |-- (631, 622), data: False |-- (631, 9), data: (631, 18) @ (18, 9) |-- (131, 122), data: True |-- (500, 491), data: False |-- (500, 7), data: (500, 16) @ (16, 7) |-- (250, 243), data: True |-- (250, 241), data: True |-- (631, 622), data: False |-- (631, 9), data: (631, 18) @ (18, 9) |-- (131, 122), data: True |-- (500, 491), data: False |-- (500, 7), data: (500, 16) @ (16, 7) |-- (250, 243), data: True |-- (250, 241), data: True |-- (631, 622), data: False |-- (631, 9), data: (631, 18) @ (18, 9) |-- (131, 122), data: True |-- (500, 491), data: False |-- (500, 7), data: (500, 16) @ (16, 7) |-- (250, 243), data: True |-- (250, 241), data: True |-- (1152, 1136), data: False |-- (1152, 26), data: (1152, 42) @ (42, 26) |-- (152, 142), data: True |-- (500, 484), data: False |-- (500, 13), data: (500, 29) @ (29, 13) |-- (250, 236), data: True |-- (250, 235), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (1152, 1136), data: False |-- (1152, 26), data: (1152, 42) @ (42, 26) |-- (152, 142), data: True |-- (500, 484), data: False |-- (500, 13), data: (500, 29) @ (29, 13) |-- (250, 236), data: True |-- (250, 235), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (1160, 1143), data: False |-- (1160, 21), data: (1160, 38) @ (38, 21) |-- (160, 152), data: True |-- (500, 487), data: False |-- (500, 11), data: (500, 24) @ (24, 11) |-- (250, 239), data: True |-- (250, 237), data: True |-- (500, 483), data: False |-- (500, 17), data: (500, 34) @ (34, 17) |-- (250, 233), data: True |-- (250, 233), data: True ----- Solver_atoms: 1 -- 136 / 136 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 1040 - Time: 1.576 Solver_block: 200 / 1040 - Time: 1.397 Solver_block: 300 / 1040 - Time: 1.395 Solver_block: 400 / 1040 - Time: 1.400 Solver_block: 500 / 1040 - Time: 1.399 Solver_block: 600 / 1040 - Time: 1.398 Solver_block: 700 / 1040 - Time: 1.393 Solver_block: 800 / 1040 - Time: 1.402 Solver_block: 900 / 1040 - Time: 1.392 Solver_block: 1000 / 1040 - Time: 1.396 Solver_block: 1040 / 1040 - Time: 0.752 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 15.316 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) Permutation basis: 408/408 Permutation basis: 25986/25986 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 5357 Number of blocks in projector: 5357 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: 1160 Use submatrix version of eigh solver. (1) Block: 500 / 1160 (2) Block: 250 / 500 (2) 233 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 483 eigenvectors found. (1) Block: 1000 / 1160 (2) Block: 250 / 500 (2) 237 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 487 eigenvectors found. (1) Block: 1160 / 1160 (1) 152 eigenvectors found. (1) Complementary block size: 38 (1) Compute compressed projector. (1) Use standard solver. (1) 21 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1152 Use submatrix version of eigh solver. (1) Block: 500 / 1152 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1000 / 1152 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1152 / 1152 (1) 142 eigenvectors found. (1) Complementary block size: 42 (1) Compute compressed projector. (1) Use standard solver. (1) 26 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1152 Use submatrix version of eigh solver. (1) Block: 500 / 1152 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1000 / 1152 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1152 / 1152 (1) 142 eigenvectors found. (1) Complementary block size: 42 (1) Compute compressed projector. (1) Use standard solver. (1) 26 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 631 Use submatrix version of eigh solver. (1) Block: 500 / 631 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 243 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 631 / 631 (1) 122 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 631 Use submatrix version of eigh solver. (1) Block: 500 / 631 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 243 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 631 / 631 (1) 122 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 631 Use submatrix version of eigh solver. (1) Block: 500 / 631 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 243 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 631 / 631 (1) 122 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. Tree of FC basis block matrices: - (5357, 5281), data: False |-- (631, 622), data: False |-- (631, 9), data: (631, 18) @ (18, 9) |-- (131, 122), data: True |-- (500, 491), data: False |-- (500, 7), data: (500, 16) @ (16, 7) |-- (250, 243), data: True |-- (250, 241), data: True |-- (631, 622), data: False |-- (631, 9), data: (631, 18) @ (18, 9) |-- (131, 122), data: True |-- (500, 491), data: False |-- (500, 7), data: (500, 16) @ (16, 7) |-- (250, 243), data: True |-- (250, 241), data: True |-- (631, 622), data: False |-- (631, 9), data: (631, 18) @ (18, 9) |-- (131, 122), data: True |-- (500, 491), data: False |-- (500, 7), data: (500, 16) @ (16, 7) |-- (250, 243), data: True |-- (250, 241), data: True |-- (1152, 1136), data: False |-- (1152, 26), data: (1152, 42) @ (42, 26) |-- (152, 142), data: True |-- (500, 484), data: False |-- (500, 13), data: (500, 29) @ (29, 13) |-- (250, 236), data: True |-- (250, 235), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (1152, 1136), data: False |-- (1152, 26), data: (1152, 42) @ (42, 26) |-- (152, 142), data: True |-- (500, 484), data: False |-- (500, 13), data: (500, 29) @ (29, 13) |-- (250, 236), data: True |-- (250, 235), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (1160, 1143), data: False |-- (1160, 21), data: (1160, 38) @ (38, 21) |-- (160, 152), data: True |-- (500, 487), data: False |-- (500, 11), data: (500, 24) @ (24, 11) |-- (250, 239), data: True |-- (250, 237), data: True |-- (500, 483), data: False |-- (500, 17), data: (500, 34) @ (34, 17) |-- (250, 233), data: True |-- (250, 233), 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 2026-01-08 21:44:13]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 21:44:14]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.139273685081686 -2.544731979999999 0.000000000000000 b 6.139273685081686 2.544731979999999 0.000000000000000 c -4.450922832399752 0.000000000000000 15.322467989714841 Atomic positions (fractional): 1 Y 0.13249925902394 0.62900312970547 0.46307725941536 88.906 2 Y 0.37099687029453 0.86750074097606 0.03692274058464 88.906 3 Y 0.62900312970547 0.13249925902394 0.96307725941536 88.906 4 Y 0.86750074097606 0.37099687029453 0.53692274058464 88.906 5 Te 0.83951318600466 0.40815459289094 0.87127935616380 127.600 6 Te 0.15267112440615 0.59660044920202 0.79829748336160 127.600 7 Te 0.40339955079798 0.84732887559385 0.70170251663840 127.600 8 Te 0.59184540710906 0.16048681399534 0.62872064383620 127.600 9 Te 0.40815459289094 0.83951318600466 0.37127935616380 127.600 10 Te 0.59660044920202 0.15267112440615 0.29829748336160 127.600 11 Te 0.16048681399534 0.59184540710906 0.12872064383620 127.600 12 Te 0.84732887559384 0.40339955079798 0.20170251663840 127.600 13 O 0.13607001937568 0.86392998062432 0.75000000000000 15.999 14 O 0.96037111867663 0.17507834050682 0.95435939836164 15.999 15 O 0.08968278246367 0.21517256828194 0.66997055753270 15.999 16 O 0.31543753257259 0.18810082295795 0.37000968225421 15.999 17 O 0.03962888132337 0.82492165949318 0.04564060163836 15.999 18 O 0.21517256828194 0.08968278246367 0.16997055753270 15.999 19 O 0.86392998062432 0.13607001937568 0.25000000000000 15.999 20 O 0.91031721753633 0.78482743171806 0.33002944246730 15.999 21 O 0.68456246742741 0.81189917704205 0.62999031774579 15.999 22 O 0.17507834050682 0.96037111867663 0.45435939836164 15.999 23 O 0.24682883452548 0.33750249192690 0.55317497010309 15.999 24 O 0.81189917704205 0.68456246742741 0.12999031774579 15.999 25 O 0.60168883193688 0.44611446409547 0.09695100458096 15.999 26 O 0.75317116547452 0.66249750807310 0.44682502989691 15.999 27 O 0.18810082295795 0.31543753257259 0.87000968225421 15.999 28 O 0.66249750807310 0.75317116547452 0.94682502989691 15.999 29 O 0.33750249192690 0.24682883452548 0.05317497010309 15.999 30 O 0.78482743171806 0.91031721753633 0.83002944246730 15.999 31 O 0.44611446409547 0.60168883193688 0.59695100458096 15.999 32 O 0.39831116806312 0.55388553590453 0.90304899541904 15.999 33 O 0.82492165949318 0.03962888132337 0.54564060163836 15.999 34 O 0.55388553590453 0.39831116806312 0.40304899541904 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.278547370163372 0.000000000000000 0.000000000000000 b 0.000000000000000 10.178927919999998 0.000000000000000 c -4.450922832399752 0.000000000000000 15.322467989714841 Atomic positions (fractional): 1 Y 0.88075119436471 0.37412596767038 0.46307725941536 88.906 > 1 2 Y 0.88075119436471 0.87412596767038 0.46307725941536 88.906 > 1 3 Y 0.61924880563529 0.12412596767038 0.03692274058464 88.906 > 3 4 Y 0.61924880563529 0.62412596767038 0.03692274058464 88.906 > 3 5 Y 0.38075119436471 0.37587403232962 0.96307725941536 88.906 > 5 6 Y 0.38075119436471 0.87587403232962 0.96307725941536 88.906 > 5 7 Y 0.11924880563529 0.12587403232962 0.53692274058464 88.906 > 7 8 Y 0.11924880563529 0.62587403232962 0.53692274058464 88.906 > 7 9 Y 0.38075119436471 0.12412596767038 0.46307725941536 88.906 > 1 10 Y 0.38075119436471 0.62412596767038 0.46307725941536 88.906 > 1 11 Y 0.11924880563529 0.37412596767038 0.03692274058464 88.906 > 3 12 Y 0.11924880563529 0.87412596767038 0.03692274058464 88.906 > 3 13 Y 0.88075119436471 0.12587403232962 0.96307725941536 88.906 > 5 14 Y 0.88075119436471 0.62587403232962 0.96307725941536 88.906 > 5 15 Y 0.61924880563529 0.37587403232962 0.53692274058464 88.906 > 7 16 Y 0.61924880563529 0.87587403232962 0.53692274058464 88.906 > 7 17 Te 0.12383388944780 0.14216035172157 0.87127935616380 127.600 > 17 18 Te 0.12383388944780 0.64216035172157 0.87127935616380 127.600 > 17 19 Te 0.37463578680409 0.11098233119897 0.79829748336160 127.600 > 19 20 Te 0.37463578680409 0.61098233119897 0.79829748336160 127.600 > 19 21 Te 0.12536421319591 0.36098233119897 0.70170251663840 127.600 > 21 22 Te 0.12536421319591 0.86098233119897 0.70170251663840 127.600 > 21 23 Te 0.87616611055220 0.14216035172157 0.62872064383620 127.600 > 23 24 Te 0.87616611055220 0.64216035172157 0.62872064383620 127.600 > 23 25 Te 0.12383388944780 0.35783964827843 0.37127935616380 127.600 > 25 26 Te 0.12383388944780 0.85783964827843 0.37127935616380 127.600 > 25 27 Te 0.87463578680409 0.13901766880103 0.29829748336160 127.600 > 27 28 Te 0.87463578680409 0.63901766880103 0.29829748336160 127.600 > 27 29 Te 0.87616611055220 0.35783964827843 0.12872064383620 127.600 > 29 30 Te 0.87616611055220 0.85783964827843 0.12872064383620 127.600 > 29 31 Te 0.62536421319591 0.38901766880103 0.20170251663840 127.600 > 31 32 Te 0.62536421319591 0.88901766880103 0.20170251663840 127.600 > 31 33 Te 0.62383388944780 0.39216035172157 0.87127935616380 127.600 > 17 34 Te 0.62383388944780 0.89216035172157 0.87127935616380 127.600 > 17 35 Te 0.87463578680409 0.36098233119897 0.79829748336160 127.600 > 19 36 Te 0.87463578680409 0.86098233119897 0.79829748336160 127.600 > 19 37 Te 0.62536421319591 0.11098233119897 0.70170251663840 127.600 > 21 38 Te 0.62536421319591 0.61098233119897 0.70170251663840 127.600 > 21 39 Te 0.37616611055220 0.39216035172157 0.62872064383620 127.600 > 23 40 Te 0.37616611055220 0.89216035172157 0.62872064383620 127.600 > 23 41 Te 0.62383388944780 0.10783964827843 0.37127935616380 127.600 > 25 42 Te 0.62383388944780 0.60783964827843 0.37127935616380 127.600 > 25 43 Te 0.37463578680409 0.38901766880103 0.29829748336160 127.600 > 27 44 Te 0.37463578680409 0.88901766880103 0.29829748336160 127.600 > 27 45 Te 0.37616611055220 0.10783964827843 0.12872064383620 127.600 > 29 46 Te 0.37616611055220 0.60783964827843 0.12872064383620 127.600 > 29 47 Te 0.12536421319591 0.13901766880103 0.20170251663840 127.600 > 31 48 Te 0.12536421319591 0.63901766880103 0.20170251663840 127.600 > 31 49 O 0.00000000000000 0.43196499031216 0.75000000000000 15.999 > 49 50 O 0.00000000000000 0.93196499031216 0.75000000000000 15.999 > 49 51 O 0.06772472959173 0.05367680545755 0.95435939836164 15.999 > 51 52 O 0.06772472959173 0.55367680545755 0.95435939836164 15.999 > 51 53 O 0.15242767537281 0.03137244645457 0.66997055753270 15.999 > 53 54 O 0.15242767537281 0.53137244645457 0.66997055753270 15.999 > 53 55 O 0.75176917776527 0.21816582259634 0.37000968225421 15.999 > 55 56 O 0.75176917776527 0.71816582259634 0.37000968225421 15.999 > 55 57 O 0.93227527040827 0.44632319454245 0.04564060163836 15.999 > 57 58 O 0.93227527040827 0.94632319454245 0.04564060163836 15.999 > 57 59 O 0.65242767537281 0.21862755354543 0.16997055753270 15.999 > 59 60 O 0.65242767537281 0.71862755354543 0.16997055753270 15.999 > 59 61 O 0.00000000000000 0.06803500968784 0.25000000000000 15.999 > 61 62 O 0.00000000000000 0.56803500968784 0.25000000000000 15.999 > 61 63 O 0.84757232462719 0.46862755354543 0.33002944246730 15.999 > 63 64 O 0.84757232462719 0.96862755354543 0.33002944246730 15.999 > 63 65 O 0.24823082223473 0.28183417740366 0.62999031774579 15.999 > 65 66 O 0.24823082223473 0.78183417740366 0.62999031774579 15.999 > 65 67 O 0.06772472959173 0.44632319454245 0.45435939836164 15.999 > 67 68 O 0.06772472959173 0.94632319454245 0.45435939836164 15.999 > 67 69 O 0.79216566322619 0.27266841435035 0.55317497010309 15.999 > 69 70 O 0.79216566322619 0.77266841435036 0.55317497010309 15.999 > 69 71 O 0.74823082223473 0.46816582259634 0.12999031774579 15.999 > 71 72 O 0.74823082223473 0.96816582259634 0.12999031774579 15.999 > 71 73 O 0.02390164801617 0.21110640803965 0.09695100458096 15.999 > 73 74 O 0.02390164801617 0.71110640803965 0.09695100458096 15.999 > 73 75 O 0.20783433677381 0.22733158564965 0.44682502989691 15.999 > 75 76 O 0.20783433677381 0.72733158564964 0.44682502989691 15.999 > 75 77 O 0.25176917776527 0.03183417740366 0.87000968225421 15.999 > 77 78 O 0.25176917776527 0.53183417740366 0.87000968225421 15.999 > 77 79 O 0.20783433677381 0.27266841435035 0.94682502989691 15.999 > 79 80 O 0.20783433677381 0.77266841435036 0.94682502989691 15.999 > 79 81 O 0.79216566322619 0.22733158564965 0.05317497010309 15.999 > 81 82 O 0.79216566322619 0.72733158564964 0.05317497010309 15.999 > 81 83 O 0.34757232462719 0.28137244645457 0.83002944246730 15.999 > 83 84 O 0.34757232462719 0.78137244645457 0.83002944246730 15.999 > 83 85 O 0.02390164801617 0.28889359196035 0.59695100458096 15.999 > 85 86 O 0.02390164801617 0.78889359196035 0.59695100458096 15.999 > 85 87 O 0.97609835198382 0.28889359196035 0.90304899541904 15.999 > 87 88 O 0.97609835198382 0.78889359196035 0.90304899541904 15.999 > 87 89 O 0.93227527040827 0.05367680545755 0.54564060163836 15.999 > 89 90 O 0.93227527040827 0.55367680545755 0.54564060163836 15.999 > 89 91 O 0.97609835198382 0.21110640803965 0.40304899541904 15.999 > 91 92 O 0.97609835198382 0.71110640803965 0.40304899541904 15.999 > 91 93 O 0.50000000000000 0.18196499031216 0.75000000000000 15.999 > 49 94 O 0.50000000000000 0.68196499031216 0.75000000000000 15.999 > 49 95 O 0.56772472959173 0.30367680545755 0.95435939836164 15.999 > 51 96 O 0.56772472959173 0.80367680545755 0.95435939836164 15.999 > 51 97 O 0.65242767537281 0.28137244645457 0.66997055753270 15.999 > 53 98 O 0.65242767537281 0.78137244645457 0.66997055753270 15.999 > 53 99 O 0.25176917776527 0.46816582259634 0.37000968225421 15.999 > 55 100 O 0.25176917776527 0.96816582259634 0.37000968225421 15.999 > 55 101 O 0.43227527040827 0.19632319454245 0.04564060163836 15.999 > 57 102 O 0.43227527040827 0.69632319454245 0.04564060163836 15.999 > 57 103 O 0.15242767537281 0.46862755354543 0.16997055753270 15.999 > 59 104 O 0.15242767537281 0.96862755354543 0.16997055753270 15.999 > 59 105 O 0.50000000000000 0.31803500968784 0.25000000000000 15.999 > 61 106 O 0.50000000000000 0.81803500968784 0.25000000000000 15.999 > 61 107 O 0.34757232462719 0.21862755354543 0.33002944246730 15.999 > 63 108 O 0.34757232462719 0.71862755354543 0.33002944246730 15.999 > 63 109 O 0.74823082223473 0.03183417740366 0.62999031774579 15.999 > 65 110 O 0.74823082223473 0.53183417740366 0.62999031774579 15.999 > 65 111 O 0.56772472959173 0.19632319454245 0.45435939836164 15.999 > 67 112 O 0.56772472959173 0.69632319454245 0.45435939836164 15.999 > 67 113 O 0.29216566322619 0.02266841435035 0.55317497010309 15.999 > 69 114 O 0.29216566322619 0.52266841435036 0.55317497010309 15.999 > 69 115 O 0.24823082223473 0.21816582259634 0.12999031774579 15.999 > 71 116 O 0.24823082223473 0.71816582259634 0.12999031774579 15.999 > 71 117 O 0.52390164801618 0.46110640803965 0.09695100458096 15.999 > 73 118 O 0.52390164801618 0.96110640803965 0.09695100458096 15.999 > 73 119 O 0.70783433677381 0.47733158564965 0.44682502989691 15.999 > 75 120 O 0.70783433677381 0.97733158564964 0.44682502989691 15.999 > 75 121 O 0.75176917776527 0.28183417740366 0.87000968225421 15.999 > 77 122 O 0.75176917776527 0.78183417740366 0.87000968225421 15.999 > 77 123 O 0.70783433677381 0.02266841435035 0.94682502989691 15.999 > 79 124 O 0.70783433677381 0.52266841435036 0.94682502989691 15.999 > 79 125 O 0.29216566322619 0.47733158564965 0.05317497010309 15.999 > 81 126 O 0.29216566322619 0.97733158564964 0.05317497010309 15.999 > 81 127 O 0.84757232462719 0.03137244645457 0.83002944246730 15.999 > 83 128 O 0.84757232462719 0.53137244645457 0.83002944246730 15.999 > 83 129 O 0.52390164801618 0.03889359196035 0.59695100458096 15.999 > 85 130 O 0.52390164801618 0.53889359196035 0.59695100458096 15.999 > 85 131 O 0.47609835198382 0.03889359196035 0.90304899541904 15.999 > 87 132 O 0.47609835198382 0.53889359196035 0.90304899541904 15.999 > 87 133 O 0.43227527040827 0.30367680545755 0.54564060163836 15.999 > 89 134 O 0.43227527040827 0.80367680545755 0.54564060163836 15.999 > 89 135 O 0.47609835198382 0.46110640803965 0.40304899541904 15.999 > 91 136 O 0.47609835198382 0.96110640803965 0.40304899541904 15.999 > 91 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.5269124 0.0000000 -0.5398857 0.0000000 4.9521581 0.0000000 -0.5398908 0.0000000 4.6854194 -------------------------- Born effective charges -------------------------- 1 Y 3.9687604 -0.1293788 -0.4290904 0.0101265 4.4310370 -0.2281421 -0.2591512 0.1033440 4.6392233 2 Y 3.9687604 0.1293788 -0.4290904 -0.0101265 4.4310370 0.2281421 -0.2591512 -0.1033440 4.6392233 3 Y 3.9687604 0.1293788 -0.4290904 -0.0101265 4.4310370 0.2281421 -0.2591512 -0.1033440 4.6392233 4 Y 3.9687604 -0.1293788 -0.4290904 0.0101265 4.4310370 -0.2281421 -0.2591512 0.1033440 4.6392233 5 Te 4.9179684 -1.0087816 -0.3452248 -0.5082446 4.1203706 0.6299098 -0.3921561 0.6368296 3.0360482 6 Te 5.8306034 0.7907078 -0.9713903 0.1685388 3.5529036 -0.6781641 -1.0247276 -0.9385304 3.6712133 7 Te 5.8306034 -0.7907078 -0.9713903 -0.1685388 3.5529036 0.6781641 -1.0247276 0.9385304 3.6712133 8 Te 4.9179684 1.0087816 -0.3452248 0.5082446 4.1203706 -0.6299098 -0.3921561 -0.6368296 3.0360482 9 Te 4.9179684 1.0087816 -0.3452248 0.5082446 4.1203706 -0.6299098 -0.3921561 -0.6368296 3.0360482 10 Te 5.8306034 -0.7907078 -0.9713903 -0.1685388 3.5529036 0.6781641 -1.0247276 0.9385304 3.6712133 11 Te 4.9179684 -1.0087816 -0.3452248 -0.5082446 4.1203706 0.6299098 -0.3921561 0.6368296 3.0360482 12 Te 5.8306034 0.7907078 -0.9713903 0.1685388 3.5529036 -0.6781641 -1.0247276 -0.9385304 3.6712133 13 O -4.5398844 0.0000000 0.9623109 0.0000000 -1.7937303 0.0000000 1.6103325 0.0000000 -1.6834834 14 O -2.3123736 -0.2865888 0.9101782 -0.3967823 -2.1805728 1.0648029 0.4944081 0.9260933 -2.2347828 15 O -1.7319654 -0.7326604 0.3703392 -0.3259177 -2.7130539 0.8552899 0.0879582 0.4564846 -1.9428759 16 O -3.8873903 -0.7372881 0.4138366 -0.9632203 -1.9851491 -0.2787636 0.7741969 0.0051975 -1.6605954 17 O -2.3123736 -0.2865888 0.9101782 -0.3967823 -2.1805728 1.0648029 0.4944081 0.9260933 -2.2347828 18 O -1.7319654 0.7326604 0.3703392 0.3259177 -2.7130539 -0.8552899 0.0879582 -0.4564846 -1.9428759 19 O -4.5398844 0.0000000 0.9623109 0.0000000 -1.7937303 0.0000000 1.6103325 0.0000000 -1.6834834 20 O -1.7319654 -0.7326604 0.3703392 -0.3259177 -2.7130539 0.8552899 0.0879582 0.4564846 -1.9428759 21 O -3.8873903 -0.7372881 0.4138366 -0.9632203 -1.9851491 -0.2787636 0.7741969 0.0051975 -1.6605954 22 O -2.3123736 0.2865888 0.9101782 0.3967823 -2.1805728 -1.0648029 0.4944081 -0.9260933 -2.2347828 23 O -2.0986929 0.3514020 -0.0630918 0.3203964 -2.3316722 1.2438478 -0.1283239 0.8839613 -2.0731431 24 O -3.8873903 0.7372881 0.4138366 0.9632203 -1.9851491 0.2787636 0.7741969 -0.0051975 -1.6605954 25 O -2.4169678 0.4880287 -0.3667123 0.4899541 -1.9969980 0.6747595 -0.3573707 0.4779252 -2.5933457 26 O -2.0986929 0.3514020 -0.0630918 0.3203964 -2.3316722 1.2438478 -0.1283239 0.8839613 -2.0731431 27 O -3.8873903 0.7372881 0.4138366 0.9632203 -1.9851491 0.2787636 0.7741969 -0.0051975 -1.6605954 28 O -2.0986929 -0.3514020 -0.0630918 -0.3203964 -2.3316722 -1.2438478 -0.1283239 -0.8839613 -2.0731431 29 O -2.0986929 -0.3514020 -0.0630918 -0.3203964 -2.3316722 -1.2438478 -0.1283239 -0.8839613 -2.0731431 30 O -1.7319654 0.7326604 0.3703392 0.3259177 -2.7130539 -0.8552899 0.0879582 -0.4564846 -1.9428759 31 O -2.4169678 -0.4880287 -0.3667123 -0.4899541 -1.9969980 -0.6747595 -0.3573707 -0.4779252 -2.5933457 32 O -2.4169678 0.4880287 -0.3667123 0.4899541 -1.9969980 0.6747595 -0.3573707 0.4779252 -2.5933457 33 O -2.3123736 0.2865888 0.9101782 0.3967823 -2.1805728 -1.0648029 0.4944081 -0.9260933 -2.2347828 34 O -2.4169678 -0.4880287 -0.3667123 -0.4899541 -1.9969980 -0.6747595 -0.3573707 -0.4779252 -2.5933457 ---------------------------------------------------------------------------- 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] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] 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] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] Computing fc3[ 19, 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] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] Computing fc3[ 51, 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] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] Computing fc3[ 53, 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] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] Computing fc3[ 55, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] Computing fc3[ 69, 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] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000000 (zxz) 0.00000000 (zxz) 0.00000000 (zzx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (xz) 0.00000000 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 21:45:09]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 21:45:10]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.139273685081686 -2.544731979999999 0.000000000000000 b 6.139273685081686 2.544731979999999 0.000000000000000 c -4.450922832399752 0.000000000000000 15.322467989714841 Atomic positions (fractional): 1 Y 0.13249925902394 0.62900312970547 0.46307725941536 88.906 2 Y 0.37099687029453 0.86750074097606 0.03692274058464 88.906 3 Y 0.62900312970547 0.13249925902394 0.96307725941536 88.906 4 Y 0.86750074097606 0.37099687029453 0.53692274058464 88.906 5 Te 0.83951318600466 0.40815459289094 0.87127935616380 127.600 6 Te 0.15267112440615 0.59660044920202 0.79829748336160 127.600 7 Te 0.40339955079798 0.84732887559385 0.70170251663840 127.600 8 Te 0.59184540710906 0.16048681399534 0.62872064383620 127.600 9 Te 0.40815459289094 0.83951318600466 0.37127935616380 127.600 10 Te 0.59660044920202 0.15267112440615 0.29829748336160 127.600 11 Te 0.16048681399534 0.59184540710906 0.12872064383620 127.600 12 Te 0.84732887559384 0.40339955079798 0.20170251663840 127.600 13 O 0.13607001937568 0.86392998062432 0.75000000000000 15.999 14 O 0.96037111867663 0.17507834050682 0.95435939836164 15.999 15 O 0.08968278246367 0.21517256828194 0.66997055753270 15.999 16 O 0.31543753257259 0.18810082295795 0.37000968225421 15.999 17 O 0.03962888132337 0.82492165949318 0.04564060163836 15.999 18 O 0.21517256828194 0.08968278246367 0.16997055753270 15.999 19 O 0.86392998062432 0.13607001937568 0.25000000000000 15.999 20 O 0.91031721753633 0.78482743171806 0.33002944246730 15.999 21 O 0.68456246742741 0.81189917704205 0.62999031774579 15.999 22 O 0.17507834050682 0.96037111867663 0.45435939836164 15.999 23 O 0.24682883452548 0.33750249192690 0.55317497010309 15.999 24 O 0.81189917704205 0.68456246742741 0.12999031774579 15.999 25 O 0.60168883193688 0.44611446409547 0.09695100458096 15.999 26 O 0.75317116547452 0.66249750807310 0.44682502989691 15.999 27 O 0.18810082295795 0.31543753257259 0.87000968225421 15.999 28 O 0.66249750807310 0.75317116547452 0.94682502989691 15.999 29 O 0.33750249192690 0.24682883452548 0.05317497010309 15.999 30 O 0.78482743171806 0.91031721753633 0.83002944246730 15.999 31 O 0.44611446409547 0.60168883193688 0.59695100458096 15.999 32 O 0.39831116806312 0.55388553590453 0.90304899541904 15.999 33 O 0.82492165949318 0.03962888132337 0.54564060163836 15.999 34 O 0.55388553590453 0.39831116806312 0.40304899541904 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.278547370163372 0.000000000000000 0.000000000000000 b 0.000000000000000 10.178927919999998 0.000000000000000 c -4.450922832399752 0.000000000000000 15.322467989714841 Atomic positions (fractional): 1 Y 0.88075119436471 0.37412596767038 0.46307725941536 88.906 > 1 2 Y 0.88075119436471 0.87412596767038 0.46307725941536 88.906 > 1 3 Y 0.61924880563529 0.12412596767038 0.03692274058464 88.906 > 3 4 Y 0.61924880563529 0.62412596767038 0.03692274058464 88.906 > 3 5 Y 0.38075119436471 0.37587403232962 0.96307725941536 88.906 > 5 6 Y 0.38075119436471 0.87587403232962 0.96307725941536 88.906 > 5 7 Y 0.11924880563529 0.12587403232962 0.53692274058464 88.906 > 7 8 Y 0.11924880563529 0.62587403232962 0.53692274058464 88.906 > 7 9 Y 0.38075119436471 0.12412596767038 0.46307725941536 88.906 > 1 10 Y 0.38075119436471 0.62412596767038 0.46307725941536 88.906 > 1 11 Y 0.11924880563529 0.37412596767038 0.03692274058464 88.906 > 3 12 Y 0.11924880563529 0.87412596767038 0.03692274058464 88.906 > 3 13 Y 0.88075119436471 0.12587403232962 0.96307725941536 88.906 > 5 14 Y 0.88075119436471 0.62587403232962 0.96307725941536 88.906 > 5 15 Y 0.61924880563529 0.37587403232962 0.53692274058464 88.906 > 7 16 Y 0.61924880563529 0.87587403232962 0.53692274058464 88.906 > 7 17 Te 0.12383388944780 0.14216035172157 0.87127935616380 127.600 > 17 18 Te 0.12383388944780 0.64216035172157 0.87127935616380 127.600 > 17 19 Te 0.37463578680409 0.11098233119897 0.79829748336160 127.600 > 19 20 Te 0.37463578680409 0.61098233119897 0.79829748336160 127.600 > 19 21 Te 0.12536421319591 0.36098233119897 0.70170251663840 127.600 > 21 22 Te 0.12536421319591 0.86098233119897 0.70170251663840 127.600 > 21 23 Te 0.87616611055220 0.14216035172157 0.62872064383620 127.600 > 23 24 Te 0.87616611055220 0.64216035172157 0.62872064383620 127.600 > 23 25 Te 0.12383388944780 0.35783964827843 0.37127935616380 127.600 > 25 26 Te 0.12383388944780 0.85783964827843 0.37127935616380 127.600 > 25 27 Te 0.87463578680409 0.13901766880103 0.29829748336160 127.600 > 27 28 Te 0.87463578680409 0.63901766880103 0.29829748336160 127.600 > 27 29 Te 0.87616611055220 0.35783964827843 0.12872064383620 127.600 > 29 30 Te 0.87616611055220 0.85783964827843 0.12872064383620 127.600 > 29 31 Te 0.62536421319591 0.38901766880103 0.20170251663840 127.600 > 31 32 Te 0.62536421319591 0.88901766880103 0.20170251663840 127.600 > 31 33 Te 0.62383388944780 0.39216035172157 0.87127935616380 127.600 > 17 34 Te 0.62383388944780 0.89216035172157 0.87127935616380 127.600 > 17 35 Te 0.87463578680409 0.36098233119897 0.79829748336160 127.600 > 19 36 Te 0.87463578680409 0.86098233119897 0.79829748336160 127.600 > 19 37 Te 0.62536421319591 0.11098233119897 0.70170251663840 127.600 > 21 38 Te 0.62536421319591 0.61098233119897 0.70170251663840 127.600 > 21 39 Te 0.37616611055220 0.39216035172157 0.62872064383620 127.600 > 23 40 Te 0.37616611055220 0.89216035172157 0.62872064383620 127.600 > 23 41 Te 0.62383388944780 0.10783964827843 0.37127935616380 127.600 > 25 42 Te 0.62383388944780 0.60783964827843 0.37127935616380 127.600 > 25 43 Te 0.37463578680409 0.38901766880103 0.29829748336160 127.600 > 27 44 Te 0.37463578680409 0.88901766880103 0.29829748336160 127.600 > 27 45 Te 0.37616611055220 0.10783964827843 0.12872064383620 127.600 > 29 46 Te 0.37616611055220 0.60783964827843 0.12872064383620 127.600 > 29 47 Te 0.12536421319591 0.13901766880103 0.20170251663840 127.600 > 31 48 Te 0.12536421319591 0.63901766880103 0.20170251663840 127.600 > 31 49 O 0.00000000000000 0.43196499031216 0.75000000000000 15.999 > 49 50 O 0.00000000000000 0.93196499031216 0.75000000000000 15.999 > 49 51 O 0.06772472959173 0.05367680545755 0.95435939836164 15.999 > 51 52 O 0.06772472959173 0.55367680545755 0.95435939836164 15.999 > 51 53 O 0.15242767537281 0.03137244645457 0.66997055753270 15.999 > 53 54 O 0.15242767537281 0.53137244645457 0.66997055753270 15.999 > 53 55 O 0.75176917776527 0.21816582259634 0.37000968225421 15.999 > 55 56 O 0.75176917776527 0.71816582259634 0.37000968225421 15.999 > 55 57 O 0.93227527040827 0.44632319454245 0.04564060163836 15.999 > 57 58 O 0.93227527040827 0.94632319454245 0.04564060163836 15.999 > 57 59 O 0.65242767537281 0.21862755354543 0.16997055753270 15.999 > 59 60 O 0.65242767537281 0.71862755354543 0.16997055753270 15.999 > 59 61 O 0.00000000000000 0.06803500968784 0.25000000000000 15.999 > 61 62 O 0.00000000000000 0.56803500968784 0.25000000000000 15.999 > 61 63 O 0.84757232462719 0.46862755354543 0.33002944246730 15.999 > 63 64 O 0.84757232462719 0.96862755354543 0.33002944246730 15.999 > 63 65 O 0.24823082223473 0.28183417740366 0.62999031774579 15.999 > 65 66 O 0.24823082223473 0.78183417740366 0.62999031774579 15.999 > 65 67 O 0.06772472959173 0.44632319454245 0.45435939836164 15.999 > 67 68 O 0.06772472959173 0.94632319454245 0.45435939836164 15.999 > 67 69 O 0.79216566322619 0.27266841435035 0.55317497010309 15.999 > 69 70 O 0.79216566322619 0.77266841435036 0.55317497010309 15.999 > 69 71 O 0.74823082223473 0.46816582259634 0.12999031774579 15.999 > 71 72 O 0.74823082223473 0.96816582259634 0.12999031774579 15.999 > 71 73 O 0.02390164801617 0.21110640803965 0.09695100458096 15.999 > 73 74 O 0.02390164801617 0.71110640803965 0.09695100458096 15.999 > 73 75 O 0.20783433677381 0.22733158564965 0.44682502989691 15.999 > 75 76 O 0.20783433677381 0.72733158564964 0.44682502989691 15.999 > 75 77 O 0.25176917776527 0.03183417740366 0.87000968225421 15.999 > 77 78 O 0.25176917776527 0.53183417740366 0.87000968225421 15.999 > 77 79 O 0.20783433677381 0.27266841435035 0.94682502989691 15.999 > 79 80 O 0.20783433677381 0.77266841435036 0.94682502989691 15.999 > 79 81 O 0.79216566322619 0.22733158564965 0.05317497010309 15.999 > 81 82 O 0.79216566322619 0.72733158564964 0.05317497010309 15.999 > 81 83 O 0.34757232462719 0.28137244645457 0.83002944246730 15.999 > 83 84 O 0.34757232462719 0.78137244645457 0.83002944246730 15.999 > 83 85 O 0.02390164801617 0.28889359196035 0.59695100458096 15.999 > 85 86 O 0.02390164801617 0.78889359196035 0.59695100458096 15.999 > 85 87 O 0.97609835198382 0.28889359196035 0.90304899541904 15.999 > 87 88 O 0.97609835198382 0.78889359196035 0.90304899541904 15.999 > 87 89 O 0.93227527040827 0.05367680545755 0.54564060163836 15.999 > 89 90 O 0.93227527040827 0.55367680545755 0.54564060163836 15.999 > 89 91 O 0.97609835198382 0.21110640803965 0.40304899541904 15.999 > 91 92 O 0.97609835198382 0.71110640803965 0.40304899541904 15.999 > 91 93 O 0.50000000000000 0.18196499031216 0.75000000000000 15.999 > 49 94 O 0.50000000000000 0.68196499031216 0.75000000000000 15.999 > 49 95 O 0.56772472959173 0.30367680545755 0.95435939836164 15.999 > 51 96 O 0.56772472959173 0.80367680545755 0.95435939836164 15.999 > 51 97 O 0.65242767537281 0.28137244645457 0.66997055753270 15.999 > 53 98 O 0.65242767537281 0.78137244645457 0.66997055753270 15.999 > 53 99 O 0.25176917776527 0.46816582259634 0.37000968225421 15.999 > 55 100 O 0.25176917776527 0.96816582259634 0.37000968225421 15.999 > 55 101 O 0.43227527040827 0.19632319454245 0.04564060163836 15.999 > 57 102 O 0.43227527040827 0.69632319454245 0.04564060163836 15.999 > 57 103 O 0.15242767537281 0.46862755354543 0.16997055753270 15.999 > 59 104 O 0.15242767537281 0.96862755354543 0.16997055753270 15.999 > 59 105 O 0.50000000000000 0.31803500968784 0.25000000000000 15.999 > 61 106 O 0.50000000000000 0.81803500968784 0.25000000000000 15.999 > 61 107 O 0.34757232462719 0.21862755354543 0.33002944246730 15.999 > 63 108 O 0.34757232462719 0.71862755354543 0.33002944246730 15.999 > 63 109 O 0.74823082223473 0.03183417740366 0.62999031774579 15.999 > 65 110 O 0.74823082223473 0.53183417740366 0.62999031774579 15.999 > 65 111 O 0.56772472959173 0.19632319454245 0.45435939836164 15.999 > 67 112 O 0.56772472959173 0.69632319454245 0.45435939836164 15.999 > 67 113 O 0.29216566322619 0.02266841435035 0.55317497010309 15.999 > 69 114 O 0.29216566322619 0.52266841435036 0.55317497010309 15.999 > 69 115 O 0.24823082223473 0.21816582259634 0.12999031774579 15.999 > 71 116 O 0.24823082223473 0.71816582259634 0.12999031774579 15.999 > 71 117 O 0.52390164801618 0.46110640803965 0.09695100458096 15.999 > 73 118 O 0.52390164801618 0.96110640803965 0.09695100458096 15.999 > 73 119 O 0.70783433677381 0.47733158564965 0.44682502989691 15.999 > 75 120 O 0.70783433677381 0.97733158564964 0.44682502989691 15.999 > 75 121 O 0.75176917776527 0.28183417740366 0.87000968225421 15.999 > 77 122 O 0.75176917776527 0.78183417740366 0.87000968225421 15.999 > 77 123 O 0.70783433677381 0.02266841435035 0.94682502989691 15.999 > 79 124 O 0.70783433677381 0.52266841435036 0.94682502989691 15.999 > 79 125 O 0.29216566322619 0.47733158564965 0.05317497010309 15.999 > 81 126 O 0.29216566322619 0.97733158564964 0.05317497010309 15.999 > 81 127 O 0.84757232462719 0.03137244645457 0.83002944246730 15.999 > 83 128 O 0.84757232462719 0.53137244645457 0.83002944246730 15.999 > 83 129 O 0.52390164801618 0.03889359196035 0.59695100458096 15.999 > 85 130 O 0.52390164801618 0.53889359196035 0.59695100458096 15.999 > 85 131 O 0.47609835198382 0.03889359196035 0.90304899541904 15.999 > 87 132 O 0.47609835198382 0.53889359196035 0.90304899541904 15.999 > 87 133 O 0.43227527040827 0.30367680545755 0.54564060163836 15.999 > 89 134 O 0.43227527040827 0.80367680545755 0.54564060163836 15.999 > 89 135 O 0.47609835198382 0.46110640803965 0.40304899541904 15.999 > 91 136 O 0.47609835198382 0.96110640803965 0.40304899541904 15.999 > 91 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 5.5269124 0.0000000 -0.5398857 0.0000000 4.9521581 0.0000000 -0.5398908 0.0000000 4.6854194 -------------------------- Born effective charges -------------------------- 1 Y 3.9687604 -0.1293788 -0.4290904 0.0101265 4.4310370 -0.2281421 -0.2591512 0.1033440 4.6392233 2 Y 3.9687604 0.1293788 -0.4290904 -0.0101265 4.4310370 0.2281421 -0.2591512 -0.1033440 4.6392233 3 Y 3.9687604 0.1293788 -0.4290904 -0.0101265 4.4310370 0.2281421 -0.2591512 -0.1033440 4.6392233 4 Y 3.9687604 -0.1293788 -0.4290904 0.0101265 4.4310370 -0.2281421 -0.2591512 0.1033440 4.6392233 5 Te 4.9179684 -1.0087816 -0.3452248 -0.5082446 4.1203706 0.6299098 -0.3921561 0.6368296 3.0360482 6 Te 5.8306034 0.7907078 -0.9713903 0.1685388 3.5529036 -0.6781641 -1.0247276 -0.9385304 3.6712133 7 Te 5.8306034 -0.7907078 -0.9713903 -0.1685388 3.5529036 0.6781641 -1.0247276 0.9385304 3.6712133 8 Te 4.9179684 1.0087816 -0.3452248 0.5082446 4.1203706 -0.6299098 -0.3921561 -0.6368296 3.0360482 9 Te 4.9179684 1.0087816 -0.3452248 0.5082446 4.1203706 -0.6299098 -0.3921561 -0.6368296 3.0360482 10 Te 5.8306034 -0.7907078 -0.9713903 -0.1685388 3.5529036 0.6781641 -1.0247276 0.9385304 3.6712133 11 Te 4.9179684 -1.0087816 -0.3452248 -0.5082446 4.1203706 0.6299098 -0.3921561 0.6368296 3.0360482 12 Te 5.8306034 0.7907078 -0.9713903 0.1685388 3.5529036 -0.6781641 -1.0247276 -0.9385304 3.6712133 13 O -4.5398844 0.0000000 0.9623109 0.0000000 -1.7937303 0.0000000 1.6103325 0.0000000 -1.6834834 14 O -2.3123736 -0.2865888 0.9101782 -0.3967823 -2.1805728 1.0648029 0.4944081 0.9260933 -2.2347828 15 O -1.7319654 -0.7326604 0.3703392 -0.3259177 -2.7130539 0.8552899 0.0879582 0.4564846 -1.9428759 16 O -3.8873903 -0.7372881 0.4138366 -0.9632203 -1.9851491 -0.2787636 0.7741969 0.0051975 -1.6605954 17 O -2.3123736 -0.2865888 0.9101782 -0.3967823 -2.1805728 1.0648029 0.4944081 0.9260933 -2.2347828 18 O -1.7319654 0.7326604 0.3703392 0.3259177 -2.7130539 -0.8552899 0.0879582 -0.4564846 -1.9428759 19 O -4.5398844 0.0000000 0.9623109 0.0000000 -1.7937303 0.0000000 1.6103325 0.0000000 -1.6834834 20 O -1.7319654 -0.7326604 0.3703392 -0.3259177 -2.7130539 0.8552899 0.0879582 0.4564846 -1.9428759 21 O -3.8873903 -0.7372881 0.4138366 -0.9632203 -1.9851491 -0.2787636 0.7741969 0.0051975 -1.6605954 22 O -2.3123736 0.2865888 0.9101782 0.3967823 -2.1805728 -1.0648029 0.4944081 -0.9260933 -2.2347828 23 O -2.0986929 0.3514020 -0.0630918 0.3203964 -2.3316722 1.2438478 -0.1283239 0.8839613 -2.0731431 24 O -3.8873903 0.7372881 0.4138366 0.9632203 -1.9851491 0.2787636 0.7741969 -0.0051975 -1.6605954 25 O -2.4169678 0.4880287 -0.3667123 0.4899541 -1.9969980 0.6747595 -0.3573707 0.4779252 -2.5933457 26 O -2.0986929 0.3514020 -0.0630918 0.3203964 -2.3316722 1.2438478 -0.1283239 0.8839613 -2.0731431 27 O -3.8873903 0.7372881 0.4138366 0.9632203 -1.9851491 0.2787636 0.7741969 -0.0051975 -1.6605954 28 O -2.0986929 -0.3514020 -0.0630918 -0.3203964 -2.3316722 -1.2438478 -0.1283239 -0.8839613 -2.0731431 29 O -2.0986929 -0.3514020 -0.0630918 -0.3203964 -2.3316722 -1.2438478 -0.1283239 -0.8839613 -2.0731431 30 O -1.7319654 0.7326604 0.3703392 0.3259177 -2.7130539 -0.8552899 0.0879582 -0.4564846 -1.9428759 31 O -2.4169678 -0.4880287 -0.3667123 -0.4899541 -1.9969980 -0.6747595 -0.3573707 -0.4779252 -2.5933457 32 O -2.4169678 0.4880287 -0.3667123 0.4899541 -1.9969980 0.6747595 -0.3573707 0.4779252 -2.5933457 33 O -2.3123736 0.2865888 0.9101782 0.3967823 -2.1805728 -1.0648029 0.4944081 -0.9260933 -2.2347828 34 O -2.4169678 -0.4880287 -0.3667123 -0.4899541 -1.9969980 -0.6747595 -0.3573707 -0.4779252 -2.5933457 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000000 (zxz) 0.00000000 (zxz) 0.00000000 (zzx) 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 ... [ 11 11 3 ] 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: 0.53, Number of G-points: 313, Lambda: 0.12 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/102) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 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 1.199 ( 0.000 0.000 0.000) 0.000 1.356 ( 0.000 0.000 0.000) 0.000 1.684 ( 0.000 0.000 0.000) 0.000 1.960 ( 0.000 0.000 0.000) 0.000 2.268 ( 0.000 0.000 0.000) 0.000 2.291 ( 0.000 0.000 0.000) 0.000 2.469 ( 0.000 0.000 0.000) 0.000 2.664 ( 0.000 0.000 0.000) 0.000 2.916 ( 0.000 0.000 0.000) 0.000 3.218 ( 0.000 0.000 0.000) 0.000 3.221 ( 0.000 0.000 0.000) 0.000 3.227 ( 0.000 0.000 0.000) 0.000 3.634 ( 0.000 0.000 0.000) 0.000 3.708 ( 0.000 0.000 0.000) 0.000 3.711 ( 0.000 0.000 0.000) 0.000 3.750 ( 0.000 0.000 0.000) 0.000 3.831 ( 0.000 0.000 0.000) 0.000 3.855 ( 0.000 0.000 0.000) 0.000 4.087 ( 0.000 0.000 0.000) 0.000 4.123 ( 0.000 0.000 0.000) 0.000 4.309 ( 0.000 0.000 0.000) 0.000 4.372 ( 0.000 0.000 0.000) 0.000 4.560 ( 0.000 0.000 0.000) 0.000 4.649 ( 0.000 0.000 0.000) 0.000 4.986 ( 0.000 0.000 0.000) 0.000 5.241 ( 0.000 0.000 0.000) 0.000 5.429 ( 0.000 0.000 0.000) 0.000 5.487 ( 0.000 0.000 0.000) 0.000 5.535 ( 0.000 0.000 0.000) 0.000 5.601 ( 0.000 0.000 0.000) 0.000 5.610 ( 0.000 0.000 0.000) 0.000 5.750 ( 0.000 0.000 0.000) 0.000 5.771 ( 0.000 0.000 0.000) 0.000 5.862 ( 0.000 0.000 0.000) 0.000 5.957 ( 0.000 0.000 0.000) 0.000 6.076 ( 0.000 0.000 0.000) 0.000 6.139 ( 0.000 0.000 0.000) 0.000 6.289 ( 0.000 0.000 0.000) 0.000 6.335 ( 0.000 0.000 0.000) 0.000 6.636 ( 0.000 0.000 0.000) 0.000 6.645 ( 0.000 0.000 0.000) 0.000 6.729 ( 0.000 0.000 0.000) 0.000 6.861 ( 0.000 0.000 0.000) 0.000 6.977 ( 0.000 0.000 0.000) 0.000 7.092 ( 0.000 0.000 0.000) 0.000 7.132 ( 0.000 0.000 0.000) 0.000 7.577 ( 0.000 0.000 0.000) 0.000 7.758 ( 0.000 0.000 0.000) 0.000 8.147 ( 0.000 0.000 0.000) 0.000 8.260 ( 0.000 0.000 0.000) 0.000 8.443 ( 0.000 0.000 0.000) 0.000 8.592 ( 0.000 0.000 0.000) 0.000 8.760 ( 0.000 0.000 0.000) 0.000 9.052 ( 0.000 0.000 0.000) 0.000 9.062 ( 0.000 0.000 0.000) 0.000 9.100 ( 0.000 0.000 0.000) 0.000 9.394 ( 0.000 0.000 0.000) 0.000 9.672 ( 0.000 0.000 0.000) 0.000 9.743 ( 0.000 0.000 0.000) 0.000 10.444 ( 0.000 0.000 0.000) 0.000 10.682 ( 0.000 0.000 0.000) 0.000 10.735 ( 0.000 0.000 0.000) 0.000 10.816 ( 0.000 0.000 0.000) 0.000 10.930 ( 0.000 0.000 0.000) 0.000 10.940 ( 0.000 0.000 0.000) 0.000 10.943 ( 0.000 0.000 0.000) 0.000 11.281 ( 0.000 0.000 0.000) 0.000 11.303 ( 0.000 0.000 0.000) 0.000 11.378 ( 0.000 0.000 0.000) 0.000 12.277 ( 0.000 0.000 0.000) 0.000 12.322 ( 0.000 0.000 0.000) 0.000 12.350 ( 0.000 0.000 0.000) 0.000 12.504 ( 0.000 0.000 0.000) 0.000 12.947 ( 0.000 0.000 0.000) 0.000 12.965 ( 0.000 0.000 0.000) 0.000 13.837 ( 0.000 0.000 0.000) 0.000 13.852 ( 0.000 0.000 0.000) 0.000 15.807 ( 0.000 0.000 0.000) 0.000 16.181 ( 0.000 0.000 0.000) 0.000 17.243 ( 0.000 0.000 0.000) 0.000 17.295 ( 0.000 0.000 0.000) 0.000 17.456 ( 0.000 0.000 0.000) 0.000 17.860 ( 0.000 0.000 0.000) 0.000 19.093 ( 0.000 0.000 0.000) 0.000 19.523 ( 0.000 0.000 0.000) 0.000 19.533 ( 0.000 0.000 0.000) 0.000 19.668 ( 0.000 0.000 0.000) 0.000 19.853 ( 0.000 0.000 0.000) 0.000 20.042 ( 0.000 0.000 0.000) 0.000 20.560 ( 0.000 0.000 0.000) 0.000 20.593 ( 0.000 0.000 0.000) 0.000 21.567 ( 0.000 0.000 0.000) 0.000 21.803 ( 0.000 0.000 0.000) 0.000 21.829 ( 0.000 0.000 0.000) 0.000 22.316 ( 0.000 0.000 0.000) 0.000 22.375 ( 0.000 0.000 0.000) 0.000 22.925 ( 0.000 0.000 0.000) 0.000 22.999 ( 0.000 0.000 0.000) 0.000 23.049 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/102) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.379 ( 15.273 -16.189 -2.116) 22.356 0.596 ( 5.460 -29.178 8.553) 30.892 0.850 ( 25.599 -35.054 -2.641) 43.486 1.333 ( -2.675 0.945 -7.775) 8.276 1.366 ( 4.116 -14.576 0.622) 15.159 1.770 ( 9.978 -0.579 0.512) 10.008 1.892 ( 2.838 1.950 8.494) 9.166 2.186 ( 12.158 6.794 -8.239) 16.182 2.504 ( 0.749 -12.580 -2.982) 12.951 2.607 ( 2.890 -8.762 1.905) 9.421 2.750 ( 0.609 -9.748 1.731) 9.919 2.934 ( -2.110 -1.562 -1.948) 3.269 3.058 ( 5.087 9.331 -0.046) 10.628 3.200 ( 2.208 3.451 -1.499) 4.363 3.385 ( 11.966 2.113 -6.266) 13.672 3.504 ( 1.097 7.641 -2.900) 8.246 3.660 ( -1.135 2.075 2.335) 3.324 3.745 ( -2.223 4.388 0.254) 4.925 3.836 ( 0.789 -6.053 -1.701) 6.336 3.892 ( 2.793 -8.338 -2.774) 9.220 4.051 ( -7.043 -2.949 3.723) 8.495 4.085 ( -1.879 2.912 1.948) 3.976 4.107 ( -2.308 -1.497 -5.006) 5.712 4.277 ( -4.427 2.002 -1.211) 5.007 4.390 ( 3.024 -2.514 1.818) 4.332 4.585 ( -2.611 1.436 10.577) 10.989 4.645 ( 9.688 2.606 -11.039) 14.916 4.993 ( -1.179 1.593 -2.393) 3.106 5.210 ( 7.893 11.842 -1.769) 14.341 5.375 ( -11.063 4.737 -1.135) 12.088 5.487 ( -8.533 -1.335 -3.003) 9.144 5.507 ( 1.676 6.054 5.288) 8.211 5.551 ( 3.891 4.519 0.055) 5.964 5.594 ( 4.695 12.053 -1.051) 12.978 5.684 ( -11.365 -1.234 0.280) 11.435 5.772 ( 5.758 -5.266 -0.359) 7.811 5.939 ( 13.034 1.954 0.061) 13.179 6.033 ( 2.131 3.004 0.197) 3.689 6.216 ( -1.875 -4.459 -0.513) 4.864 6.242 ( -6.891 -1.378 0.845) 7.078 6.377 ( -5.445 5.514 1.401) 7.875 6.514 ( 7.644 1.336 1.345) 7.875 6.623 ( -1.415 -2.159 -5.933) 6.470 6.694 ( 4.366 -4.203 2.176) 6.439 6.749 ( -0.758 -0.492 -3.840) 3.945 6.861 ( 1.203 0.209 0.087) 1.224 7.001 ( 2.617 -1.366 -0.384) 2.977 7.136 ( 3.444 0.623 1.898) 3.982 7.391 ( -10.373 -8.887 -2.304) 13.852 7.793 ( 8.473 0.095 -4.509) 9.598 7.859 ( 29.652 18.407 0.964) 34.914 8.162 ( 0.307 -1.007 1.191) 1.590 8.363 ( -2.069 7.048 3.199) 8.011 8.427 ( -0.010 5.256 10.142) 11.423 8.620 ( 5.064 0.318 -5.330) 7.359 8.863 ( 0.664 -6.425 8.496) 10.673 8.990 ( -4.769 3.386 1.507) 6.040 9.072 ( -1.123 -1.226 -2.609) 3.094 9.188 ( 8.868 -4.815 -7.371) 12.496 9.522 ( 28.812 10.272 -19.016) 36.018 9.700 ( 0.064 -0.817 7.649) 7.693 9.738 ( 10.432 2.920 -7.665) 13.271 10.399 ( 0.424 4.331 0.384) 4.369 10.653 ( -3.326 4.129 -1.381) 5.478 10.677 ( -0.905 3.910 1.208) 4.191 10.833 ( -5.623 1.052 6.157) 8.404 10.928 ( -3.138 -0.035 -2.492) 4.008 11.056 ( -3.592 -3.496 -6.519) 8.223 11.148 ( 1.110 -1.878 1.802) 2.829 11.288 ( 1.297 0.270 1.168) 1.766 11.478 ( 14.747 -1.576 3.037) 15.139 11.597 ( -6.978 -4.334 -11.603) 14.216 12.275 ( -4.026 -0.536 2.355) 4.695 12.332 ( 3.058 2.145 -0.050) 3.736 12.404 ( 15.805 6.400 3.114) 17.334 12.533 ( 3.836 7.864 0.359) 8.757 12.931 ( 0.394 1.784 0.069) 1.828 12.974 ( 0.236 -0.659 0.207) 0.730 13.811 ( 0.297 3.223 -0.134) 3.240 13.970 ( -5.762 1.685 0.020) 6.003 15.884 ( 21.089 6.851 -14.359) 26.417 16.173 ( 2.661 2.660 4.287) 5.704 17.297 ( -1.188 -5.411 1.744) 5.808 17.500 ( 2.246 -3.901 -1.190) 4.656 17.782 ( -14.922 -0.478 -0.713) 14.946 18.304 ( 22.892 3.932 -6.157) 24.029 19.099 ( -1.049 3.297 8.177) 8.879 19.401 ( 10.667 14.619 0.491) 18.104 19.557 ( -2.127 9.954 -1.131) 10.241 19.694 ( 4.189 9.405 1.624) 10.423 20.017 ( -17.856 -17.691 3.973) 25.448 20.448 ( -3.716 9.306 1.296) 10.103 20.615 ( 17.556 0.785 -4.791) 18.214 20.718 ( 9.330 -7.967 -6.493) 13.881 21.631 ( 0.522 -5.948 3.994) 7.183 21.816 ( 0.819 -1.203 -0.455) 1.525 22.310 ( 0.212 0.854 -0.369) 0.954 22.385 ( 0.149 -1.154 0.422) 1.237 22.793 ( -4.148 1.680 -0.019) 4.475 23.024 ( -1.815 -2.916 -1.070) 3.597 23.079 ( -1.280 -3.367 1.330) 3.840 23.504 ( -32.404 -12.596 -8.345) 35.754 ======================= Grid point 2 (3/102) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.795 ( 14.162 -18.141 -1.837) 23.087 1.117 ( 2.950 -16.177 10.213) 19.357 1.234 ( 7.350 -4.333 -0.293) 8.537 1.648 ( 12.132 -25.781 -2.889) 28.639 1.706 ( 9.497 -19.467 -3.697) 21.973 1.804 ( 7.938 -3.246 -10.038) 13.203 2.066 ( 11.014 -7.096 12.511) 18.116 2.212 ( 11.118 -2.961 -4.672) 12.418 2.659 ( -1.281 -4.584 -3.447) 5.877 2.763 ( 6.049 -5.091 1.312) 8.014 2.931 ( -5.784 -2.378 3.169) 7.011 2.981 ( 0.426 -11.749 -1.587) 11.863 3.052 ( 1.149 -1.684 4.320) 4.777 3.156 ( 8.283 0.452 -1.132) 8.373 3.404 ( 2.654 -0.331 -2.074) 3.385 3.422 ( 1.309 2.234 -1.890) 3.205 3.613 ( -0.490 2.963 1.512) 3.362 3.633 ( -1.147 6.234 -1.528) 6.520 3.923 ( 0.014 -1.402 -0.924) 1.679 3.967 ( 0.215 1.507 -1.640) 2.237 3.996 ( -1.321 4.305 1.516) 4.752 4.046 ( -1.015 -1.285 -1.628) 2.309 4.099 ( -8.104 -1.568 1.472) 8.385 4.226 ( -7.026 -2.807 -1.760) 7.768 4.468 ( 2.973 0.287 4.529) 5.425 4.523 ( -4.654 3.934 5.204) 8.014 4.653 ( 6.444 1.398 -5.580) 8.638 4.923 ( -2.204 3.364 -2.204) 4.586 5.099 ( 2.910 3.525 -0.362) 4.586 5.198 ( -5.214 6.540 -2.369) 8.693 5.385 ( -3.558 5.141 -4.636) 7.783 5.421 ( 2.191 5.429 1.922) 6.162 5.473 ( -7.209 0.686 3.957) 8.252 5.504 ( -7.746 -1.654 0.917) 7.973 5.658 ( -1.604 -0.560 0.907) 1.926 5.866 ( 3.387 2.151 -4.865) 6.307 5.968 ( -2.325 0.562 2.270) 3.298 6.041 ( 8.181 -0.650 2.195) 8.496 6.112 ( 2.829 3.740 -1.941) 5.075 6.275 ( -0.835 2.457 3.696) 4.516 6.356 ( 0.186 -6.250 0.434) 6.267 6.494 ( 7.285 5.668 -1.486) 9.349 6.619 ( -6.087 2.425 -0.984) 6.626 6.708 ( -7.876 -2.290 1.467) 8.332 6.803 ( 5.852 -1.666 -1.135) 6.190 6.917 ( 4.618 -2.263 -1.348) 5.316 7.045 ( 4.561 -0.768 0.237) 4.631 7.159 ( 7.256 2.130 1.812) 7.776 7.436 ( 2.617 0.406 1.274) 2.938 7.678 ( 16.367 16.637 -3.587) 23.613 7.899 ( 3.926 -3.158 0.393) 5.054 8.180 ( 0.220 1.151 -4.027) 4.194 8.242 ( 1.434 4.593 2.846) 5.591 8.392 ( 0.922 1.017 4.701) 4.898 8.605 ( 1.608 2.666 -6.154) 6.897 8.846 ( -5.461 4.121 0.694) 6.877 9.008 ( -5.461 -5.323 7.848) 10.943 9.112 ( 4.133 -0.968 -3.213) 5.324 9.302 ( 4.324 -3.684 -3.334) 6.587 9.490 ( 2.851 3.700 -3.488) 5.830 9.707 ( 5.828 3.145 2.436) 7.057 9.804 ( 6.543 -3.724 -4.480) 8.761 10.331 ( 0.524 3.632 0.370) 3.688 10.480 ( -3.216 8.132 0.707) 8.774 10.654 ( -1.286 -0.491 1.113) 1.770 10.830 ( -3.228 -2.493 6.386) 7.577 10.900 ( -4.173 -0.748 -4.031) 5.850 11.019 ( -2.859 0.718 -5.916) 6.609 11.218 ( 4.700 -0.425 -0.011) 4.719 11.304 ( 4.047 0.510 1.504) 4.347 11.589 ( 6.471 2.336 3.702) 7.812 11.606 ( 2.028 -2.580 -1.424) 3.577 12.240 ( -3.167 1.688 1.419) 3.858 12.316 ( -1.495 1.756 -2.058) 3.091 12.400 ( 12.211 8.128 0.555) 14.679 12.427 ( 2.321 2.574 0.189) 3.471 12.904 ( 0.035 0.902 -0.117) 0.910 12.987 ( -0.622 -0.952 0.082) 1.140 13.726 ( 0.214 6.358 0.067) 6.362 13.873 ( -5.011 4.514 0.380) 6.755 15.889 ( 9.471 2.798 -5.943) 11.526 16.140 ( 1.950 4.002 4.384) 6.248 17.405 ( -5.637 -7.820 2.243) 9.897 17.608 ( 2.129 -6.069 -1.436) 6.590 17.723 ( -6.502 -3.315 -1.579) 7.467 18.342 ( 18.070 7.778 -3.245) 19.939 19.006 ( -8.150 5.640 2.796) 10.298 19.210 ( 5.811 14.253 0.631) 15.405 19.338 ( 4.358 12.001 1.415) 12.846 19.535 ( 3.516 10.513 -2.255) 11.312 20.147 ( -10.322 -5.259 2.300) 11.811 20.215 ( -10.709 8.548 0.828) 13.727 20.756 ( 9.124 -4.921 -0.126) 10.368 20.987 ( 13.192 -13.118 -4.435) 19.125 21.780 ( 1.316 -8.177 3.952) 9.177 21.857 ( 1.160 -2.851 -1.363) 3.366 22.279 ( -0.145 2.620 -1.035) 2.821 22.430 ( 0.434 -3.602 1.349) 3.871 22.722 ( -3.337 2.982 -0.183) 4.479 23.053 ( -2.540 -2.192 -1.636) 3.733 23.139 ( -2.566 -4.137 1.987) 5.258 23.461 ( -16.798 -4.566 -3.284) 17.714 ======================= Grid point 3 (4/102) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.199 ( 10.491 -15.137 -0.379) 18.421 1.239 ( 9.216 -7.369 0.804) 11.828 1.602 ( 7.912 -14.669 4.612) 17.293 1.806 ( 3.753 -4.200 -7.467) 9.353 2.013 ( 7.098 -11.060 0.256) 13.144 2.193 ( 3.687 -14.405 0.298) 14.872 2.351 ( 10.871 -15.305 1.324) 18.819 2.465 ( 15.092 -13.651 -2.727) 20.532 2.689 ( -2.256 0.835 -0.502) 2.457 2.808 ( 4.019 3.949 1.222) 5.766 2.927 ( -1.891 -3.513 3.116) 5.062 3.102 ( 1.829 -3.419 -1.903) 4.319 3.141 ( 1.594 -4.868 0.917) 5.204 3.331 ( 3.060 -9.022 0.309) 9.531 3.402 ( -1.972 -0.634 1.012) 2.305 3.456 ( 3.186 -2.899 -1.868) 4.695 3.499 ( -3.883 5.495 1.640) 6.925 3.589 ( 3.631 0.340 -0.121) 3.649 3.844 ( 1.880 7.248 -1.778) 7.696 3.878 ( -4.220 4.649 0.627) 6.310 3.988 ( -2.985 0.004 1.098) 3.180 4.040 ( 1.445 0.761 -1.700) 2.358 4.093 ( -1.533 -2.132 -2.465) 3.602 4.221 ( -5.614 -0.044 2.221) 6.038 4.395 ( -6.911 3.728 7.456) 10.828 4.455 ( -3.370 -0.142 -4.131) 5.333 4.648 ( 1.780 2.474 -0.680) 3.122 4.868 ( 1.463 2.833 -0.126) 3.191 5.072 ( -2.436 4.002 -0.230) 4.690 5.094 ( -2.553 -0.453 -0.741) 2.697 5.285 ( -3.868 2.711 -4.260) 6.361 5.357 ( 0.453 2.612 0.860) 2.787 5.451 ( -4.248 -2.834 1.834) 5.426 5.510 ( -8.177 -5.524 -0.902) 9.910 5.649 ( 1.121 1.165 -0.479) 1.686 5.800 ( -4.896 -0.069 -0.531) 4.925 5.937 ( 1.415 2.834 0.592) 3.223 6.129 ( 7.550 -0.849 0.299) 7.603 6.160 ( 10.474 -0.997 1.955) 10.702 6.280 ( 6.167 -0.670 1.513) 6.385 6.432 ( -0.707 0.912 -1.625) 1.993 6.453 ( 3.664 0.497 0.390) 3.718 6.507 ( -4.492 3.631 -0.423) 5.792 6.678 ( -6.071 -0.258 0.547) 6.101 6.853 ( 4.801 0.033 -0.396) 4.817 6.972 ( 2.526 -1.084 -0.988) 2.921 7.067 ( 6.762 3.809 -0.166) 7.762 7.188 ( 4.418 -0.351 3.857) 5.876 7.435 ( 8.075 4.087 0.758) 9.082 7.500 ( 8.306 12.043 -3.908) 15.143 7.949 ( 2.618 0.684 -0.549) 2.761 8.135 ( 4.260 2.459 -2.183) 5.381 8.203 ( -0.557 2.543 2.522) 3.624 8.392 ( 1.992 2.809 2.705) 4.379 8.528 ( -0.713 5.043 -4.478) 6.782 8.758 ( -4.511 1.003 1.048) 4.738 9.041 ( -7.142 -2.250 2.832) 8.006 9.115 ( -0.796 0.733 -0.942) 1.435 9.363 ( 0.286 1.096 -5.794) 5.904 9.430 ( -0.061 1.158 3.864) 4.034 9.675 ( -0.301 3.559 0.978) 3.703 9.912 ( 5.728 -3.223 -3.938) 7.662 10.239 ( -2.619 4.498 2.397) 5.730 10.445 ( 4.573 -3.211 -0.171) 5.590 10.679 ( -2.004 -3.355 1.630) 4.234 10.859 ( -4.714 -0.471 -3.419) 5.842 10.892 ( 0.728 -2.373 2.210) 3.323 11.003 ( 1.790 -1.002 -2.040) 2.893 11.237 ( 3.452 0.987 -0.534) 3.630 11.314 ( 5.408 2.918 0.819) 6.199 11.554 ( 3.970 6.115 2.312) 7.648 11.638 ( -0.314 0.374 0.463) 0.673 12.180 ( -2.739 2.703 0.484) 3.879 12.216 ( -1.570 6.016 -0.615) 6.248 12.372 ( 7.893 2.861 -1.163) 8.475 12.443 ( 3.746 0.174 0.783) 3.831 12.911 ( 0.341 -1.768 -0.057) 1.801 13.006 ( -0.973 -2.130 -0.233) 2.353 13.592 ( -0.668 8.324 0.530) 8.367 13.748 ( -4.538 5.295 0.005) 6.974 15.897 ( 5.477 1.391 -3.129) 6.459 16.083 ( 0.044 3.850 2.896) 4.818 17.467 ( -8.899 -4.862 1.179) 10.209 17.728 ( 1.299 -6.580 -2.046) 7.012 17.809 ( 1.298 -7.207 0.064) 7.323 18.296 ( 12.643 8.930 -0.104) 15.479 18.767 ( -8.871 12.546 -0.635) 15.379 19.039 ( 2.438 7.520 0.685) 7.935 19.218 ( 5.508 7.825 2.845) 9.983 19.384 ( 2.668 7.639 -3.143) 8.681 19.923 ( -5.700 13.027 0.235) 14.222 20.172 ( -8.170 -1.857 0.740) 8.411 20.900 ( 3.897 -5.449 0.471) 6.716 21.307 ( 10.594 -12.396 -1.627) 16.387 21.913 ( 1.342 -4.303 -1.130) 4.647 21.945 ( 1.416 -5.928 2.238) 6.493 22.215 ( -0.727 3.659 -1.055) 3.877 22.521 ( -0.786 -5.352 5.252) 7.539 22.643 ( -1.053 2.967 -4.062) 5.139 23.051 ( -2.924 -0.075 -0.676) 3.003 23.192 ( -2.164 -3.402 1.020) 4.159 23.409 ( -11.100 -1.800 -1.318) 11.322 ======================= Grid point 4 (5/102) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.490 ( 7.553 -8.019 -2.581) 11.315 1.508 ( 9.143 -14.634 -2.801) 17.482 1.816 ( 5.911 -7.790 -0.258) 9.782 1.968 ( 5.406 -7.443 1.565) 9.331 2.238 ( 7.371 -6.762 0.563) 10.018 2.406 ( -3.821 -10.601 3.227) 11.721 2.542 ( -0.469 9.549 2.353) 9.846 2.626 ( 0.043 -8.399 -2.045) 8.644 2.762 ( 9.839 -7.896 0.648) 12.633 2.884 ( 3.636 -0.381 -0.746) 3.731 2.949 ( -0.989 -5.287 -0.322) 5.388 3.150 ( 3.729 -1.161 -0.148) 3.908 3.217 ( -2.029 -2.042 -2.380) 3.735 3.393 ( -3.062 -1.353 0.664) 3.413 3.424 ( 1.611 -1.690 0.836) 2.480 3.482 ( -2.439 0.473 0.249) 2.496 3.520 ( 2.874 -4.960 -0.503) 5.754 3.632 ( 2.229 0.073 3.491) 4.142 3.740 ( 2.406 5.545 0.187) 6.048 3.801 ( 1.827 -0.150 -6.322) 6.582 3.888 ( -6.982 7.418 3.986) 10.939 4.001 ( 2.396 3.800 1.512) 4.740 4.134 ( 3.688 -0.949 -3.725) 5.327 4.217 ( -1.000 -2.551 1.678) 3.213 4.355 ( -3.796 -2.100 3.007) 5.278 4.453 ( -5.642 -4.151 -4.665) 8.416 4.615 ( 0.161 1.181 0.790) 1.429 4.815 ( -1.443 3.768 0.656) 4.088 4.999 ( -8.416 0.675 1.770) 8.626 5.026 ( -2.193 2.805 -0.586) 3.609 5.220 ( -2.676 2.626 1.140) 3.918 5.339 ( 0.909 -0.007 -0.308) 0.960 5.500 ( -2.487 -4.239 -2.229) 5.396 5.581 ( -1.835 -6.344 -2.170) 6.952 5.660 ( 3.229 -0.381 0.234) 3.260 5.810 ( -5.419 -5.185 -0.308) 7.506 5.860 ( -1.530 5.229 1.602) 5.679 6.165 ( 5.888 3.531 0.407) 6.878 6.239 ( 5.478 2.973 1.151) 6.339 6.363 ( 5.681 -0.105 0.571) 5.710 6.401 ( 5.437 -1.353 -1.277) 5.747 6.452 ( -0.252 -1.918 1.152) 2.251 6.495 ( -0.673 -3.149 -1.388) 3.507 6.673 ( 1.974 -1.422 -1.114) 2.676 6.877 ( 4.189 0.910 -1.210) 4.454 6.933 ( -2.232 5.848 3.236) 7.047 7.069 ( 5.387 0.176 -0.776) 5.445 7.230 ( 1.425 0.903 4.334) 4.651 7.360 ( 6.438 7.083 -5.002) 10.800 7.430 ( 6.024 3.021 0.755) 6.782 7.933 ( 0.052 1.009 -1.337) 1.675 8.145 ( 9.924 2.257 -3.779) 10.856 8.165 ( -1.696 1.120 5.119) 5.507 8.311 ( -2.640 5.706 0.999) 6.366 8.403 ( -1.280 6.583 -3.159) 7.413 8.741 ( -4.166 -0.915 4.984) 6.560 8.995 ( -1.795 2.512 -4.539) 5.490 9.113 ( -4.915 -2.872 1.761) 5.959 9.239 ( -9.013 4.986 -0.280) 10.304 9.459 ( 6.625 1.710 -0.515) 6.862 9.603 ( -5.493 1.109 0.537) 5.630 9.964 ( 3.663 0.485 -1.123) 3.862 10.202 ( -0.331 -0.750 0.675) 1.061 10.580 ( 5.447 -5.809 -0.235) 7.967 10.748 ( -3.268 -6.050 1.576) 7.054 10.818 ( 0.517 1.523 -5.212) 5.454 10.943 ( 0.288 -1.992 2.916) 3.543 11.069 ( 2.543 -3.767 1.043) 4.663 11.241 ( 1.921 0.586 -0.300) 2.030 11.290 ( 4.303 3.467 0.631) 5.562 11.441 ( 2.520 8.752 -0.055) 9.107 11.602 ( -2.232 2.289 0.014) 3.197 12.103 ( -0.658 4.993 1.457) 5.243 12.116 ( -0.856 3.088 -0.701) 3.280 12.392 ( 4.476 0.037 -1.586) 4.749 12.464 ( 1.771 0.056 0.800) 1.944 12.973 ( 1.609 -4.036 0.331) 4.358 13.053 ( -0.279 -3.730 -0.734) 3.812 13.430 ( -2.218 8.567 0.825) 8.888 13.624 ( -3.214 5.036 -0.265) 5.980 15.905 ( 3.281 0.744 -1.870) 3.849 16.023 ( -1.184 2.823 1.799) 3.551 17.475 ( -5.712 -2.431 0.285) 6.214 17.835 ( -0.137 -4.712 -2.767) 5.466 17.956 ( 0.181 -7.792 1.479) 7.933 18.237 ( 9.955 6.805 3.069) 12.443 18.498 ( -6.498 9.697 -3.029) 12.060 18.963 ( 2.314 3.627 2.734) 5.098 19.119 ( 2.330 6.528 -1.879) 7.182 19.304 ( 2.958 3.403 -0.363) 4.523 19.672 ( -5.344 9.933 0.179) 11.281 20.131 ( -3.977 1.018 -0.064) 4.106 21.006 ( 1.891 -3.762 0.423) 4.231 21.562 ( 6.600 -9.133 -0.042) 11.269 21.989 ( 1.310 -3.248 -2.393) 4.242 22.023 ( 0.405 -0.555 0.612) 0.920 22.155 ( -0.614 1.223 0.339) 1.410 22.532 ( -4.593 2.641 6.645) 8.498 22.680 ( 4.122 -6.192 -5.700) 9.371 23.011 ( -3.006 2.047 0.297) 3.649 23.231 ( -0.767 -2.014 0.358) 2.185 23.360 ( -7.236 -0.705 -0.483) 7.286 ======================= Grid point 5 (6/102) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.581 ( 3.335 -0.709 -2.157) 4.034 1.821 ( 3.714 -10.758 -2.460) 11.644 2.019 ( 1.624 -10.553 -1.179) 10.742 2.101 ( 5.020 -3.168 4.821) 7.647 2.308 ( 1.411 2.776 1.329) 3.385 2.324 ( -1.257 10.567 -1.766) 10.787 2.581 ( -0.593 -6.194 1.151) 6.328 2.675 ( -3.209 -1.375 0.590) 3.541 2.859 ( -1.773 0.156 4.929) 5.240 2.909 ( 2.449 -0.568 -4.670) 5.304 3.066 ( 4.274 -5.838 -0.021) 7.236 3.194 ( -0.706 0.927 -2.016) 2.328 3.271 ( 3.772 -6.689 -0.300) 7.685 3.390 ( -2.328 2.692 -0.841) 3.657 3.411 ( -1.608 0.147 2.051) 2.611 3.463 ( -2.158 -0.352 0.020) 2.187 3.574 ( 3.660 3.339 -1.966) 5.330 3.600 ( 0.598 2.933 1.076) 3.181 3.682 ( -0.390 2.382 1.322) 2.751 3.721 ( -5.992 1.912 4.296) 7.617 3.932 ( 6.272 -8.494 -7.121) 12.736 3.999 ( 4.673 -0.305 -0.232) 4.689 4.129 ( -0.092 3.453 0.389) 3.476 4.192 ( -2.200 4.123 2.983) 5.545 4.422 ( -1.029 -5.011 -0.073) 5.117 4.489 ( -2.138 -3.303 -3.007) 4.952 4.608 ( 0.253 0.450 0.902) 1.039 4.723 ( -3.763 2.815 0.680) 4.748 4.970 ( -2.673 -1.768 2.072) 3.816 4.998 ( 1.483 0.913 -0.711) 1.881 5.139 ( -3.174 3.057 0.673) 4.458 5.368 ( 1.710 -1.383 -0.120) 2.202 5.536 ( -3.496 -2.825 -1.548) 4.754 5.631 ( 1.936 1.293 1.711) 2.890 5.668 ( 0.085 1.233 -1.628) 2.044 5.807 ( 1.125 -0.155 -0.160) 1.147 5.911 ( -4.490 -9.330 0.156) 10.355 6.099 ( 1.003 5.373 0.273) 5.473 6.150 ( 1.750 6.623 0.138) 6.851 6.368 ( 0.573 0.055 -0.625) 0.850 6.511 ( 3.644 -1.824 0.556) 4.113 6.524 ( 3.620 -3.417 0.449) 4.998 6.579 ( -0.463 -5.082 -0.980) 5.197 6.734 ( 5.787 0.239 -1.355) 5.949 6.791 ( -2.450 3.910 0.992) 4.720 6.898 ( 0.241 -0.014 1.023) 1.051 7.098 ( 0.588 -0.806 -0.835) 1.301 7.151 ( 0.442 6.125 1.540) 6.331 7.349 ( 0.795 -1.113 -0.957) 1.669 7.425 ( 3.399 1.620 0.165) 3.769 7.927 ( 0.071 -0.411 -0.773) 0.878 8.161 ( -1.160 -0.189 4.734) 4.877 8.171 ( 10.291 2.580 -5.891) 12.135 8.209 ( -5.175 0.814 1.954) 5.591 8.280 ( -2.165 4.382 -1.096) 5.009 8.727 ( -2.649 0.391 3.784) 4.636 8.950 ( 1.021 0.573 -4.477) 4.628 9.104 ( -5.725 2.782 1.076) 6.455 9.135 ( -2.005 -1.549 0.839) 2.669 9.456 ( 2.704 1.587 -0.634) 3.199 9.573 ( -2.409 -0.493 0.184) 2.466 9.966 ( 1.036 0.698 0.458) 1.330 10.226 ( 0.383 -1.054 -0.576) 1.261 10.683 ( 1.849 -2.287 -0.016) 2.941 10.789 ( -0.256 0.308 -2.656) 2.686 10.839 ( 0.003 -3.312 1.354) 3.578 10.981 ( 0.634 -1.120 1.335) 1.854 11.142 ( 0.359 -2.334 0.791) 2.490 11.240 ( 0.439 0.699 0.382) 0.910 11.271 ( -0.133 0.813 1.261) 1.506 11.322 ( 2.980 4.836 -2.220) 6.098 11.543 ( -1.086 2.029 -0.083) 2.303 12.034 ( 0.115 2.270 0.598) 2.350 12.073 ( -0.566 1.011 -0.212) 1.178 12.416 ( 1.616 -0.229 -0.680) 1.768 12.472 ( 0.343 -0.035 0.371) 0.507 13.056 ( 1.292 -2.767 0.308) 3.070 13.134 ( 1.517 -5.392 -0.908) 5.675 13.267 ( -2.920 7.456 0.798) 8.047 13.533 ( -1.293 2.582 -0.142) 2.891 15.911 ( 1.336 0.214 -0.825) 1.584 15.981 ( -0.892 1.106 0.806) 1.633 17.476 ( -1.810 -0.784 0.043) 1.973 17.877 ( -0.772 -1.230 -1.539) 2.116 18.073 ( -0.794 -4.451 1.166) 4.670 18.219 ( 5.956 2.951 4.086) 7.802 18.331 ( -3.494 3.540 -4.175) 6.494 18.954 ( 1.042 -0.253 3.929) 4.072 19.026 ( 0.955 4.038 -3.920) 5.708 19.285 ( 1.403 0.971 0.325) 1.737 19.514 ( -2.619 3.754 0.067) 4.578 20.093 ( -1.298 0.741 -0.132) 1.500 21.061 ( 0.607 -1.329 0.176) 1.471 21.726 ( 2.743 -4.710 0.505) 5.474 21.970 ( -0.825 2.813 -0.849) 3.052 22.049 ( 0.766 -1.515 -1.118) 2.033 22.159 ( -0.033 -0.572 0.619) 0.843 22.475 ( -1.655 1.477 2.048) 3.019 22.809 ( 2.927 -5.319 -2.281) 6.485 22.939 ( -2.639 3.494 1.029) 4.498 23.253 ( 0.147 -0.596 0.102) 0.622 23.329 ( -2.848 -0.244 -0.138) 2.862 ======================= Grid point 12 (7/102) ======================= q-point: ( 0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.352 ( 24.869 0.000 -2.300) 24.975 0.427 ( 28.135 0.000 1.528) 28.176 0.818 ( 52.808 0.000 4.622) 53.010 1.270 ( 8.291 0.000 -0.706) 8.321 1.279 ( 0.750 0.000 -14.285) 14.304 1.892 ( 17.093 0.000 13.794) 21.965 1.982 ( 1.559 0.000 5.865) 6.069 2.375 ( 4.266 0.000 -12.717) 13.413 2.390 ( 11.974 0.000 -0.583) 11.989 2.519 ( 5.133 0.000 0.147) 5.135 2.702 ( 3.684 0.000 4.186) 5.577 2.895 ( -1.930 -0.000 -3.879) 4.333 3.195 ( -3.675 -0.000 -0.870) 3.777 3.204 ( -0.455 -0.000 -0.369) 0.586 3.555 ( -4.233 -0.000 -3.090) 5.241 3.605 ( -8.300 -0.000 0.436) 8.311 3.637 ( -1.526 -0.000 -7.516) 7.669 3.767 ( 4.124 0.000 -5.862) 7.168 3.783 ( 1.677 0.000 1.818) 2.474 3.856 ( 1.299 0.000 -1.742) 2.173 3.875 ( 5.181 0.000 -4.700) 6.995 4.089 ( -2.387 -0.000 2.384) 3.373 4.126 ( 3.079 0.000 -1.038) 3.249 4.320 ( -4.269 -0.000 -2.297) 4.848 4.323 ( 1.249 0.000 2.606) 2.890 4.612 ( -4.407 -0.000 7.777) 8.939 4.732 ( 9.877 0.000 -6.984) 12.097 4.993 ( 1.950 0.000 -3.340) 3.868 5.279 ( -15.970 -0.000 4.196) 16.512 5.387 ( -12.820 -0.000 -4.464) 13.574 5.404 ( -9.260 -0.000 2.706) 9.648 5.497 ( -10.022 -0.000 -5.673) 11.517 5.660 ( -0.868 -0.000 3.318) 3.430 5.680 ( 5.127 0.000 -4.481) 6.809 5.803 ( 4.754 0.000 1.281) 4.923 5.898 ( 10.453 0.000 -2.603) 10.772 5.913 ( -3.742 -0.000 1.551) 4.051 6.099 ( 1.722 0.000 -0.901) 1.943 6.149 ( -3.050 -0.000 0.415) 3.078 6.191 ( -4.975 -0.000 -1.841) 5.305 6.268 ( -8.390 -0.000 2.250) 8.687 6.469 ( -8.549 -0.000 -2.743) 8.979 6.704 ( 4.892 0.000 0.832) 4.962 6.707 ( 3.173 0.000 -11.237) 11.677 6.713 ( 0.648 0.000 1.875) 1.984 6.892 ( 6.616 0.000 -2.737) 7.160 7.066 ( 11.064 0.000 -3.414) 11.579 7.089 ( -2.269 -0.000 6.128) 6.535 7.262 ( 17.745 0.000 -7.553) 19.285 7.785 ( 4.175 0.000 -1.609) 4.475 8.137 ( 5.184 0.000 -12.445) 13.482 8.269 ( 1.124 0.000 0.308) 1.165 8.397 ( -5.133 -0.000 3.335) 6.121 8.547 ( -20.286 -0.000 39.487) 44.393 8.673 ( 10.617 0.000 -7.253) 12.858 8.858 ( 3.266 0.000 13.678) 14.063 8.954 ( -7.178 -0.000 4.025) 8.230 9.034 ( -6.412 -0.000 -2.848) 7.016 9.196 ( 9.431 0.000 -7.846) 12.268 9.723 ( 3.852 0.000 6.156) 7.262 9.783 ( 6.786 0.000 -4.478) 8.131 10.436 ( 5.790 0.000 -18.453) 19.340 10.585 ( -3.960 -0.000 -18.004) 18.434 10.621 ( -18.179 -0.000 5.602) 19.022 10.676 ( 1.704 0.000 -9.556) 9.707 10.704 ( -6.914 -0.000 1.246) 7.025 10.977 ( 4.393 0.000 -1.646) 4.691 10.995 ( 4.261 0.000 -0.751) 4.327 11.114 ( 13.593 0.000 -49.255) 51.096 11.263 ( 0.261 0.000 4.593) 4.601 11.340 ( 7.859 0.000 -2.445) 8.231 11.610 ( 16.207 0.000 7.193) 17.731 12.226 ( -6.632 -0.000 1.924) 6.905 12.355 ( -3.360 -0.000 1.154) 3.552 12.525 ( 8.026 0.000 -3.754) 8.861 12.887 ( -4.534 -0.000 -0.878) 4.619 12.958 ( 2.238 0.000 -1.109) 2.498 13.153 ( 12.205 0.000 -3.105) 12.594 13.829 ( -2.821 -0.000 0.117) 2.823 13.854 ( -1.502 -0.000 -1.110) 1.868 16.227 ( 1.421 0.000 10.105) 10.205 16.281 ( 10.189 0.000 -59.174) 60.045 17.283 ( 0.557 0.000 -2.034) 2.109 17.484 ( 4.268 0.000 -2.232) 4.817 17.915 ( 6.788 0.000 -0.399) 6.800 18.312 ( 7.161 0.000 -19.596) 20.863 19.243 ( -21.788 -0.000 22.640) 31.421 19.314 ( -13.887 -0.000 -2.125) 14.049 19.706 ( 9.866 0.000 -1.545) 9.986 19.784 ( 6.801 0.000 10.471) 12.486 20.093 ( 5.964 0.000 1.222) 6.088 20.573 ( 2.111 0.000 -0.454) 2.160 20.596 ( 1.006 0.000 -0.823) 1.299 21.321 ( 36.629 0.000 -111.154) 117.033 21.799 ( -6.200 -0.000 18.491) 19.503 21.845 ( -16.073 -0.000 57.188) 59.404 21.851 ( 2.989 0.000 -0.210) 2.996 22.328 ( 1.453 0.000 -2.698) 3.064 22.377 ( 0.104 0.000 0.452) 0.464 22.873 ( -6.960 -0.000 2.222) 7.306 22.983 ( -2.093 -0.000 -0.145) 2.098 23.033 ( -2.753 -0.000 0.778) 2.861 ======================= Grid point 13 (8/102) ======================= q-point: ( 0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.657 ( 21.527 -11.668 -1.929) 24.561 0.819 ( 18.096 -18.545 6.571) 26.732 1.280 ( 6.448 -0.756 -4.323) 7.800 1.403 ( 38.978 -18.349 -1.029) 43.094 1.480 ( 11.866 -13.301 -3.477) 18.161 1.912 ( 8.844 7.956 -0.711) 11.917 2.090 ( 14.300 -4.107 14.588) 20.837 2.328 ( 11.208 5.023 -10.518) 16.170 2.545 ( 6.007 -6.659 -2.368) 9.276 2.685 ( 4.522 -10.200 3.787) 11.782 2.783 ( 0.358 -5.427 7.229) 9.047 2.879 ( 0.286 -1.041 -8.337) 8.406 3.096 ( 0.196 3.401 0.774) 3.493 3.220 ( 0.939 0.804 -0.643) 1.394 3.447 ( 0.208 3.656 -1.603) 3.998 3.497 ( -2.163 4.656 -0.543) 5.162 3.640 ( -5.109 -0.190 0.266) 5.120 3.703 ( -1.590 3.557 -0.203) 3.902 3.837 ( 0.187 -2.202 -3.427) 4.078 3.916 ( -2.195 -7.235 1.406) 7.691 3.957 ( 0.869 -2.922 -4.541) 5.470 4.049 ( -4.412 2.226 -0.863) 5.017 4.124 ( 4.251 4.090 1.415) 6.066 4.208 ( -2.866 4.131 -0.795) 5.091 4.447 ( 3.008 -6.295 3.086) 7.629 4.558 ( -5.980 2.940 7.801) 10.260 4.749 ( 7.613 3.919 -6.889) 10.990 4.971 ( -0.221 3.572 -3.581) 5.063 5.184 ( -11.215 3.829 1.631) 11.963 5.216 ( -4.951 3.065 1.370) 5.982 5.272 ( -13.929 -0.527 -2.468) 14.156 5.475 ( -10.831 1.666 0.410) 10.966 5.574 ( 0.147 5.824 -1.662) 6.058 5.609 ( 2.098 9.649 0.126) 9.876 5.692 ( 4.209 5.163 -1.145) 6.759 5.859 ( 2.850 -1.148 -1.201) 3.299 5.992 ( -8.390 4.514 1.733) 9.684 6.066 ( 4.770 -1.300 -0.249) 4.951 6.125 ( -0.597 -1.542 -2.316) 2.845 6.221 ( -1.275 -7.328 2.204) 7.758 6.301 ( -7.218 0.298 4.996) 8.783 6.485 ( -6.546 -7.970 -3.714) 10.962 6.652 ( 2.150 3.794 -1.576) 4.637 6.673 ( -4.803 1.652 -0.367) 5.093 6.800 ( 7.390 -2.540 0.494) 7.830 6.945 ( 9.993 0.081 -3.399) 10.556 7.049 ( 1.787 0.129 2.176) 2.819 7.230 ( 5.258 -2.973 2.845) 6.677 7.423 ( 13.085 -3.643 -5.883) 14.801 7.861 ( 5.966 -4.170 -1.233) 7.383 8.108 ( 8.093 12.883 -6.851) 16.686 8.178 ( 0.526 2.346 3.203) 4.005 8.338 ( -3.127 3.571 4.293) 6.400 8.432 ( -5.865 2.815 12.231) 13.853 8.680 ( 4.710 4.619 -7.286) 9.829 8.878 ( -6.432 4.017 2.226) 7.904 8.923 ( -2.326 -3.520 9.660) 10.541 9.076 ( 2.030 -5.392 1.058) 5.858 9.276 ( 7.977 -2.875 -6.232) 10.523 9.709 ( 5.339 10.430 0.311) 11.721 9.797 ( 10.315 1.181 -6.672) 12.342 10.008 ( 19.234 23.506 -16.032) 34.344 10.418 ( 1.413 4.651 2.241) 5.352 10.525 ( -14.034 2.568 1.342) 14.330 10.650 ( -3.561 0.567 1.828) 4.042 10.719 ( -8.775 -3.810 1.148) 9.635 10.898 ( 1.272 2.603 -1.065) 3.087 11.023 ( 5.528 3.241 -9.979) 11.859 11.206 ( 4.565 -6.888 0.319) 8.269 11.373 ( 7.612 1.349 2.311) 8.069 11.476 ( -0.737 -9.190 -8.367) 12.450 11.719 ( 10.209 1.217 7.883) 12.956 12.194 ( -7.089 -1.452 1.581) 7.407 12.304 ( -6.725 0.979 -0.320) 6.803 12.564 ( 13.213 4.186 -1.395) 13.930 12.740 ( 10.829 14.181 -1.280) 17.889 12.940 ( 1.492 2.627 -0.448) 3.054 13.034 ( 9.219 8.208 0.878) 12.374 13.807 ( -1.081 2.805 -0.138) 3.010 13.864 ( -7.347 -0.915 0.025) 7.404 16.053 ( 6.760 9.528 -15.334) 19.278 16.252 ( 1.543 3.929 5.736) 7.122 17.275 ( -0.016 -1.233 0.081) 1.236 17.555 ( 6.071 -3.616 -2.890) 7.635 17.716 ( 5.117 7.817 1.568) 9.474 18.500 ( 8.484 -3.171 -8.475) 12.404 19.028 ( -10.706 4.483 4.981) 12.631 19.429 ( -14.845 -7.496 -1.160) 16.671 19.637 ( 11.332 15.209 -1.272) 19.009 19.814 ( -2.861 9.550 -2.083) 10.184 19.857 ( 10.307 9.468 12.440) 18.725 20.412 ( -0.545 12.407 -0.290) 12.422 20.744 ( 6.186 -7.806 0.393) 9.968 20.977 ( 24.380 6.230 -16.880) 30.300 21.672 ( 0.640 -5.470 9.266) 10.779 21.836 ( 2.258 -0.596 -0.911) 2.507 22.314 ( 0.685 1.359 -1.181) 1.926 22.392 ( 0.237 -1.517 1.286) 2.003 22.668 ( -11.677 -11.668 -2.611) 16.713 22.943 ( -12.476 -12.173 -3.668) 17.813 23.023 ( -12.030 -10.958 -0.850) 16.295 23.053 ( -6.844 -7.681 2.174) 10.515 ======================= Grid point 14 (9/102) ======================= q-point: ( 0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.034 ( 17.793 -13.848 -0.850) 22.563 1.259 ( 9.245 -5.661 8.354) 13.686 1.345 ( 7.491 -13.945 4.734) 16.523 1.769 ( 12.461 -6.825 -12.944) 19.220 1.920 ( 13.934 -6.237 -1.618) 15.351 1.999 ( 20.567 -14.078 -1.736) 24.984 2.283 ( 10.631 -3.504 6.759) 13.076 2.385 ( 14.594 -6.391 -5.205) 16.761 2.646 ( 2.488 -2.732 -3.973) 5.425 2.842 ( -3.209 -4.133 5.190) 7.370 2.895 ( 3.085 -3.613 5.269) 7.095 3.001 ( 4.662 -8.981 -3.923) 10.852 3.067 ( -1.896 -0.456 5.389) 5.731 3.243 ( 3.751 -3.368 -1.681) 5.314 3.397 ( -2.484 1.438 -1.301) 3.152 3.473 ( 7.325 0.169 -0.979) 7.392 3.561 ( -7.448 3.959 0.840) 8.476 3.623 ( -0.432 2.777 -0.616) 2.877 3.873 ( -4.502 -1.800 -1.175) 4.989 3.937 ( -3.382 1.740 -1.175) 3.981 3.952 ( -7.481 -0.566 1.713) 7.696 4.047 ( 3.237 0.394 -3.273) 4.620 4.069 ( 4.721 0.744 -0.851) 4.855 4.150 ( -1.829 0.017 -0.392) 1.871 4.450 ( -8.359 4.796 9.271) 13.373 4.504 ( -0.367 4.578 0.187) 4.596 4.703 ( 2.807 2.236 -3.179) 4.795 4.907 ( -0.036 1.685 -1.676) 2.377 5.039 ( -9.589 3.387 0.156) 10.171 5.131 ( -5.486 1.811 -1.490) 5.966 5.286 ( -3.990 -6.190 -0.429) 7.377 5.325 ( -5.479 4.941 0.892) 7.431 5.466 ( 1.824 5.214 0.212) 5.528 5.483 ( -0.819 5.384 -3.449) 6.446 5.679 ( 1.635 1.127 0.946) 2.200 5.799 ( -7.921 4.579 -1.928) 9.351 5.920 ( -4.683 -3.525 0.746) 5.908 6.145 ( 2.885 -1.756 2.619) 4.274 6.173 ( 4.409 -3.040 -2.680) 5.988 6.286 ( 0.405 -2.266 3.436) 4.136 6.344 ( 0.043 -5.853 0.688) 5.894 6.508 ( -5.230 -0.249 -2.103) 5.643 6.588 ( -0.653 4.554 -0.904) 4.689 6.629 ( -0.602 -0.029 0.861) 1.051 6.872 ( 3.868 -0.511 0.725) 3.969 7.009 ( 8.612 0.453 -3.599) 9.344 7.085 ( 1.333 -1.905 1.661) 2.858 7.280 ( 5.100 1.776 3.431) 6.398 7.514 ( 7.575 1.092 -0.659) 7.681 7.850 ( 5.615 16.370 2.143) 17.438 7.972 ( 5.890 -0.516 -2.601) 6.459 8.171 ( 0.585 1.311 -4.207) 4.445 8.284 ( 2.445 2.578 3.958) 5.318 8.426 ( 0.996 -1.592 3.701) 4.150 8.597 ( 0.328 4.569 -6.023) 7.567 8.763 ( -6.009 3.687 0.828) 7.099 8.953 ( -4.984 -0.791 7.024) 8.649 9.148 ( 0.429 -0.510 0.163) 0.687 9.371 ( 7.152 -1.517 -6.956) 10.092 9.524 ( 4.999 10.205 -3.614) 11.924 9.795 ( 3.389 7.276 2.648) 8.452 9.913 ( 10.176 -0.184 -6.559) 12.108 10.322 ( -5.545 5.771 4.973) 9.422 10.423 ( -2.359 -0.949 0.111) 2.546 10.630 ( -2.577 -0.271 3.608) 4.442 10.737 ( -7.360 -4.676 -2.613) 9.103 10.884 ( 2.379 0.103 0.039) 2.382 11.019 ( 5.639 0.445 -5.751) 8.066 11.317 ( 8.701 0.212 -0.894) 8.749 11.402 ( 7.109 1.827 2.068) 7.626 11.574 ( 0.263 -3.851 -1.699) 4.217 11.734 ( 4.067 4.978 5.433) 8.416 12.167 ( -5.679 -0.468 0.254) 5.704 12.236 ( -6.045 0.961 -0.586) 6.149 12.552 ( 13.374 8.231 -0.470) 15.711 12.619 ( 13.916 9.426 -0.108) 16.808 12.908 ( 0.626 1.411 -0.105) 1.548 12.982 ( 0.315 1.799 0.205) 1.838 13.717 ( -1.750 6.187 0.219) 6.434 13.783 ( -6.846 3.186 0.151) 7.553 15.961 ( 2.335 3.074 -5.754) 6.929 16.172 ( -1.772 5.374 4.604) 7.295 17.322 ( -3.223 -4.524 0.306) 5.563 17.665 ( 6.524 -3.670 -2.651) 7.941 17.730 ( 5.199 -2.815 1.538) 6.108 18.505 ( 6.279 5.649 -2.908) 8.933 18.872 ( -10.169 6.292 1.843) 12.099 19.301 ( 3.001 14.824 -0.419) 15.131 19.432 ( 6.542 11.256 1.335) 13.087 19.559 ( 0.915 12.003 -2.853) 12.371 19.932 ( -14.272 -9.288 3.254) 17.336 20.162 ( 0.424 14.810 0.864) 14.841 20.918 ( 11.707 -3.281 0.769) 12.183 21.166 ( 13.458 -10.258 -5.899) 17.920 21.827 ( 1.366 -7.841 7.083) 10.655 21.873 ( 2.179 -2.355 -2.681) 4.182 22.269 ( -0.247 3.260 -1.990) 3.827 22.446 ( 0.525 -3.807 2.825) 4.769 22.659 ( -4.367 1.070 -1.208) 4.655 22.995 ( -3.894 -3.195 -2.579) 5.659 23.086 ( -6.454 -5.995 0.908) 8.856 23.183 ( -16.372 -11.578 -0.751) 20.066 ======================= Grid point 15 (10/102) ======================= q-point: ( 0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.347 ( 8.521 -8.369 1.437) 12.029 1.418 ( 14.173 -9.810 -0.830) 17.257 1.751 ( 7.963 -14.579 7.711) 18.314 1.862 ( 8.467 -2.186 -8.575) 12.248 2.137 ( 9.304 -7.984 -1.650) 12.371 2.253 ( 3.890 -7.259 -0.725) 8.267 2.488 ( 6.634 -8.458 -1.079) 10.803 2.623 ( 3.479 -2.241 -2.448) 4.808 2.725 ( 9.403 -6.686 0.985) 11.580 2.870 ( -6.418 -1.674 6.014) 8.954 2.913 ( 8.668 2.161 0.380) 8.941 3.127 ( 3.366 -4.696 -3.275) 6.641 3.157 ( -1.411 -3.960 4.124) 5.889 3.336 ( -1.890 -2.725 0.162) 3.320 3.412 ( 1.708 -5.243 1.298) 5.665 3.437 ( -3.990 3.028 -0.263) 5.015 3.503 ( 2.391 0.563 -2.551) 3.542 3.634 ( 2.574 -1.996 0.896) 3.378 3.805 ( -3.555 2.750 -0.979) 4.600 3.850 ( -2.481 3.980 -0.077) 4.691 3.963 ( 0.235 1.318 -0.594) 1.465 4.039 ( -1.274 -1.178 0.449) 1.792 4.109 ( 4.689 -1.754 -5.638) 7.540 4.185 ( 2.031 -1.584 1.442) 2.952 4.328 ( -5.929 3.048 8.005) 10.417 4.387 ( -3.379 3.234 -2.993) 5.552 4.653 ( -2.064 3.263 1.009) 3.991 4.871 ( -2.962 4.286 -1.239) 5.355 4.915 ( -9.972 -0.028 1.634) 10.105 5.065 ( -6.313 1.002 -0.816) 6.444 5.241 ( 1.399 2.819 -1.550) 3.508 5.347 ( -5.661 -0.057 4.350) 7.139 5.437 ( 0.084 -0.760 -3.184) 3.274 5.456 ( 5.699 -5.235 -5.144) 9.292 5.645 ( -3.056 0.119 0.556) 3.109 5.740 ( -1.794 -1.056 0.878) 2.259 5.918 ( -4.803 0.847 1.162) 5.014 6.189 ( -2.181 -2.283 1.885) 3.678 6.281 ( 8.790 -3.238 -1.700) 9.520 6.346 ( -1.715 -2.618 0.201) 3.136 6.445 ( 3.457 -3.438 1.393) 5.071 6.459 ( -0.724 1.345 -2.145) 2.634 6.498 ( 2.803 4.820 -0.064) 5.576 6.651 ( 2.482 -1.657 -0.736) 3.073 6.890 ( 0.394 0.335 1.931) 1.999 7.022 ( 4.662 3.272 -3.544) 6.708 7.118 ( 1.608 0.035 0.235) 1.626 7.278 ( 3.319 2.539 6.231) 7.502 7.507 ( 2.684 3.742 1.602) 4.876 7.619 ( 6.352 13.836 -3.176) 15.552 7.960 ( 0.317 2.736 -2.220) 3.538 8.137 ( -3.859 0.864 0.420) 3.977 8.287 ( 8.450 2.537 3.139) 9.364 8.428 ( -0.096 5.406 -0.743) 5.458 8.501 ( 0.944 4.993 -2.364) 5.605 8.700 ( -2.943 -1.052 0.760) 3.216 8.934 ( -7.415 -1.958 3.982) 8.641 9.121 ( 0.879 2.831 -1.995) 3.573 9.282 ( -5.019 7.624 -3.898) 9.925 9.523 ( 8.431 -1.103 -0.654) 8.527 9.647 ( -3.380 8.118 0.531) 8.810 9.994 ( 7.318 -0.941 -3.627) 8.222 10.225 ( -1.648 2.471 4.324) 5.246 10.503 ( 3.085 -6.648 -0.297) 7.334 10.639 ( -3.468 -2.309 2.464) 4.841 10.757 ( -4.876 -3.546 -4.000) 7.235 10.921 ( 1.698 -1.587 3.345) 4.073 11.062 ( 6.329 -1.383 -3.672) 7.447 11.336 ( 10.098 4.636 -1.287) 11.186 11.405 ( 5.442 4.197 1.943) 7.142 11.609 ( -2.438 0.638 -0.008) 2.520 11.639 ( 5.121 7.634 2.057) 9.420 12.130 ( -3.644 0.899 0.127) 3.756 12.175 ( -3.023 2.419 0.160) 3.875 12.495 ( 8.971 6.284 -1.039) 11.002 12.565 ( 10.970 7.798 0.448) 13.466 12.919 ( 0.505 -2.578 0.564) 2.687 12.985 ( -1.598 -2.700 -0.703) 3.215 13.563 ( -3.678 8.430 0.278) 9.202 13.674 ( -5.145 3.894 0.231) 6.456 15.930 ( 0.179 0.745 -2.863) 2.964 16.073 ( -3.583 4.079 2.566) 6.005 17.378 ( -2.599 -4.099 0.103) 4.854 17.764 ( 3.280 -3.459 -2.505) 5.385 17.847 ( 3.878 -5.305 2.063) 6.888 18.426 ( 5.064 6.550 -0.200) 8.282 18.648 ( -6.511 11.178 0.261) 12.938 19.100 ( 4.532 9.869 0.913) 10.898 19.285 ( 2.341 9.336 -1.026) 9.680 19.404 ( 1.751 6.019 -0.441) 6.284 19.856 ( -4.493 11.699 -1.864) 12.670 20.006 ( -11.761 -3.658 2.357) 12.540 21.041 ( 13.019 -0.245 0.525) 13.032 21.430 ( 7.161 -10.624 -1.634) 12.916 21.933 ( 2.388 -3.443 -2.937) 5.117 21.977 ( 0.767 -5.458 4.432) 7.072 22.193 ( -1.348 3.701 -1.591) 4.248 22.525 ( -3.340 -2.271 9.595) 10.410 22.618 ( 1.857 -1.287 -8.053) 8.364 22.998 ( -3.452 -0.740 -1.121) 3.704 23.154 ( -3.636 -5.388 0.501) 6.519 23.229 ( -11.756 -6.096 -0.211) 13.244 ======================= Grid point 16 (11/102) ======================= q-point: ( 0.45 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.576 ( 5.463 -8.096 -3.044) 10.230 1.654 ( 12.037 -7.353 -4.614) 14.841 1.909 ( 6.633 -4.542 -0.593) 8.061 2.059 ( 4.006 -7.459 4.687) 9.677 2.345 ( 2.436 -0.392 1.106) 2.704 2.355 ( -0.987 -11.033 2.755) 11.414 2.526 ( -3.058 5.257 2.926) 6.749 2.651 ( 6.336 -1.126 -5.641) 8.558 2.815 ( -7.327 -0.973 5.817) 9.406 2.898 ( 4.975 -4.309 1.871) 6.843 3.023 ( 5.740 -2.747 -4.278) 7.668 3.185 ( 0.094 -1.184 -2.316) 2.603 3.204 ( 4.971 -2.862 0.135) 5.738 3.346 ( -2.178 -1.745 0.026) 2.791 3.408 ( -3.893 -1.533 -0.271) 4.193 3.469 ( -0.749 0.793 -0.628) 1.259 3.564 ( 2.588 -3.997 -0.173) 4.764 3.668 ( -0.201 0.415 2.770) 2.808 3.730 ( -2.514 2.869 1.945) 4.282 3.792 ( -0.108 6.621 -2.407) 7.046 3.868 ( 1.824 1.378 -0.897) 2.456 4.030 ( -1.378 2.207 1.452) 2.980 4.204 ( 1.031 -5.255 -3.455) 6.373 4.219 ( 6.835 3.245 0.108) 7.567 4.301 ( -5.331 -2.860 3.006) 6.755 4.377 ( 0.154 -5.108 -3.660) 6.286 4.606 ( -3.195 -0.347 1.542) 3.565 4.731 ( -6.461 4.216 0.167) 7.716 4.909 ( -2.146 -2.416 2.109) 3.858 5.003 ( -6.024 0.317 0.124) 6.034 5.202 ( 2.790 3.482 -0.201) 4.466 5.329 ( -3.501 -2.080 1.720) 4.421 5.452 ( -1.951 -1.933 -2.111) 3.464 5.595 ( 2.147 -4.562 -2.692) 5.716 5.693 ( 0.578 -7.033 -1.265) 7.169 5.752 ( -1.318 -0.113 2.059) 2.447 5.851 ( -0.067 2.831 0.918) 2.976 6.185 ( -2.980 1.320 0.862) 3.372 6.269 ( -0.500 6.398 -0.820) 6.470 6.380 ( 1.569 -0.652 -0.565) 1.791 6.472 ( 1.586 -3.308 0.499) 3.702 6.508 ( 3.684 -3.236 -2.003) 5.297 6.538 ( 6.724 -0.353 1.240) 6.846 6.722 ( 5.433 -3.303 -3.453) 7.236 6.871 ( -5.030 2.248 5.047) 7.472 6.938 ( 2.278 6.358 -1.416) 6.900 7.115 ( 1.332 1.218 -1.447) 2.313 7.264 ( 0.271 3.030 5.613) 6.384 7.400 ( 2.020 9.091 -4.223) 10.225 7.483 ( -0.360 3.396 1.317) 3.661 7.916 ( -0.353 0.982 -3.355) 3.514 8.091 ( -8.880 -0.636 5.501) 10.465 8.277 ( -3.776 6.583 -1.674) 7.772 8.309 ( 7.846 2.898 -1.652) 8.526 8.402 ( 5.509 8.747 -0.924) 10.379 8.718 ( -1.719 -1.262 4.292) 4.792 8.942 ( -2.186 -2.046 -1.739) 3.462 9.087 ( 0.342 0.265 -0.629) 0.764 9.117 ( -6.104 4.148 0.451) 7.394 9.502 ( -5.103 3.776 -0.812) 6.400 9.595 ( 9.248 0.537 -1.600) 9.401 10.015 ( 3.364 2.332 0.396) 4.112 10.222 ( 2.167 -0.552 0.441) 2.279 10.654 ( 4.174 -3.597 0.346) 5.521 10.666 ( -5.787 -6.362 -2.652) 9.000 10.786 ( -2.390 -3.628 0.371) 4.360 10.966 ( 0.779 -1.507 3.380) 3.782 11.135 ( 4.596 -2.050 -1.255) 5.187 11.293 ( 4.316 6.795 -1.885) 8.268 11.342 ( 2.932 4.810 2.231) 6.058 11.505 ( 4.871 7.457 0.711) 8.936 11.603 ( 3.953 4.143 -0.681) 5.766 12.085 ( -2.128 1.354 -0.882) 2.672 12.097 ( -1.562 4.189 1.253) 4.643 12.466 ( 6.129 3.162 -1.525) 7.064 12.511 ( 3.668 4.092 0.990) 5.584 12.999 ( 0.929 -4.671 0.584) 4.798 13.047 ( 0.630 -4.885 -0.922) 5.011 13.382 ( -4.166 8.181 0.081) 9.181 13.572 ( -4.031 3.629 0.542) 5.451 15.917 ( -0.646 0.121 -2.226) 2.321 15.993 ( -3.894 2.009 2.008) 4.820 17.431 ( -0.318 -3.020 0.030) 3.037 17.817 ( -1.876 -2.626 -1.860) 3.725 17.972 ( 1.688 -5.497 2.277) 6.185 18.361 ( 2.663 4.137 -0.978) 5.017 18.424 ( 0.690 10.445 0.321) 10.473 19.006 ( 2.271 4.278 3.111) 5.757 19.148 ( 2.623 7.553 -3.395) 8.686 19.345 ( 2.796 2.997 0.587) 4.141 19.611 ( -3.158 10.565 -0.614) 11.044 19.993 ( -13.191 -4.705 0.175) 14.006 21.121 ( 11.965 1.781 0.506) 12.107 21.632 ( 2.985 -7.821 0.198) 8.374 21.999 ( 1.389 -1.363 -3.182) 3.730 22.026 ( -0.144 0.162 -0.047) 0.222 22.145 ( -1.294 -0.346 1.333) 1.890 22.494 ( -3.932 1.922 5.598) 7.105 22.721 ( 4.346 -6.377 -4.630) 8.999 22.967 ( -2.787 1.511 0.083) 3.172 23.213 ( -2.617 -3.033 1.108) 4.156 23.251 ( -6.294 -4.837 -0.784) 7.977 ======================= Grid point 17 (12/102) ======================= q-point: ( 0.55 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.614 ( 2.574 2.884 -3.558) 5.254 1.881 ( 5.759 -5.569 -2.344) 8.347 2.033 ( 1.298 -4.935 -3.382) 6.122 2.167 ( -1.171 -3.028 9.548) 10.085 2.260 ( -4.805 10.516 -0.546) 11.575 2.350 ( 3.701 6.386 0.034) 7.381 2.537 ( -6.207 -7.096 5.811) 11.075 2.713 ( 7.520 -1.024 -4.616) 8.883 2.836 ( -3.477 -2.740 7.594) 8.790 2.932 ( 3.900 2.082 -8.318) 9.420 3.086 ( -2.633 -3.104 1.205) 4.245 3.200 ( 4.096 1.525 -4.223) 6.077 3.304 ( -2.012 -3.314 1.499) 4.157 3.367 ( 2.177 0.860 -2.616) 3.510 3.413 ( 1.409 -2.252 0.863) 2.793 3.449 ( -1.291 -1.927 1.461) 2.741 3.544 ( -4.570 5.252 2.923) 7.551 3.613 ( -0.380 4.522 -0.629) 4.582 3.650 ( -3.764 0.417 0.280) 3.797 3.738 ( 5.761 -0.601 -1.748) 6.051 3.930 ( -6.354 -2.563 0.160) 6.854 3.997 ( -1.732 -0.696 -0.412) 1.912 4.153 ( 0.083 3.974 0.549) 4.013 4.179 ( 0.127 3.620 1.334) 3.860 4.416 ( 0.609 -6.190 0.151) 6.221 4.502 ( 6.186 -4.359 -4.490) 8.799 4.612 ( -1.207 -0.835 1.525) 2.117 4.654 ( -3.979 -1.150 -0.487) 4.171 4.965 ( 0.051 -3.410 2.494) 4.225 4.974 ( -2.101 -0.667 0.506) 2.262 5.166 ( 3.983 2.601 -0.911) 4.843 5.351 ( -3.595 -1.108 -0.446) 3.788 5.468 ( -3.502 -3.612 0.251) 5.037 5.645 ( -0.545 -1.991 -0.467) 2.116 5.722 ( 3.912 3.119 4.374) 6.645 5.804 ( -0.895 -2.278 -4.630) 5.237 5.911 ( 5.466 -7.012 0.961) 8.943 6.097 ( -1.851 4.703 0.086) 5.055 6.164 ( 1.261 5.767 -1.367) 6.059 6.387 ( 2.433 1.423 0.733) 2.912 6.522 ( -2.559 -1.586 0.414) 3.040 6.539 ( -0.765 3.736 1.082) 3.964 6.601 ( 2.215 -4.518 -3.288) 6.011 6.718 ( -7.280 6.784 4.694) 11.002 6.799 ( 2.627 -0.663 -2.600) 3.755 6.898 ( -0.600 1.573 1.103) 2.012 7.096 ( 0.498 0.258 -1.860) 1.943 7.162 ( 0.242 6.589 -0.189) 6.596 7.314 ( -4.349 -0.523 -1.224) 4.548 7.429 ( -2.753 2.757 2.608) 4.688 7.907 ( -1.107 -0.853 -2.844) 3.169 8.057 ( -10.125 -2.190 5.882) 11.912 8.182 ( -0.569 0.745 -2.998) 3.141 8.252 ( -2.055 5.432 5.096) 7.726 8.331 ( 10.066 4.128 -6.604) 12.727 8.735 ( 2.172 -0.634 -1.553) 2.744 8.946 ( -2.101 0.045 4.279) 4.767 9.091 ( 5.107 -2.499 -2.016) 6.032 9.119 ( -0.963 -2.663 2.753) 3.950 9.431 ( -3.180 0.751 -1.796) 3.729 9.634 ( 8.468 1.866 -1.501) 8.800 9.984 ( 1.192 2.618 0.255) 2.888 10.248 ( 2.349 0.130 0.569) 2.420 10.678 ( -3.453 -2.198 -1.288) 4.291 10.727 ( -2.849 -1.305 -1.689) 3.560 10.855 ( 0.041 -3.314 2.230) 3.995 10.992 ( -0.186 0.079 1.599) 1.611 11.164 ( 1.993 1.779 -0.854) 2.804 11.197 ( -5.332 0.985 0.332) 5.433 11.317 ( 5.997 2.419 1.176) 6.573 11.419 ( 8.550 8.450 -0.863) 12.052 11.557 ( 2.974 2.341 -0.510) 3.819 12.026 ( -1.135 1.805 -0.493) 2.188 12.062 ( -0.981 -0.059 0.318) 1.033 12.445 ( 2.270 2.731 -0.062) 3.552 12.486 ( 1.285 1.200 0.136) 1.763 13.067 ( -0.039 -1.611 -0.076) 1.614 13.159 ( 1.952 -6.210 -0.353) 6.519 13.222 ( -2.817 6.330 -0.271) 6.934 13.508 ( -2.322 0.202 0.843) 2.478 15.899 ( -2.230 0.331 -1.079) 2.500 15.962 ( -2.002 -0.620 0.929) 2.293 17.481 ( 2.425 -1.810 0.013) 3.026 17.840 ( -3.956 -3.191 -0.211) 5.087 18.062 ( -0.578 -3.009 1.805) 3.556 18.253 ( -1.609 5.778 -4.775) 7.666 18.354 ( 6.547 2.627 2.921) 7.635 18.975 ( -0.745 2.709 4.589) 5.381 19.040 ( 3.283 4.306 -4.268) 6.895 19.313 ( 2.227 3.827 -0.002) 4.427 19.486 ( -1.081 0.094 -0.211) 1.105 19.991 ( -11.152 -5.486 -0.005) 12.429 21.155 ( 10.611 3.969 0.297) 11.333 21.738 ( -1.410 -1.914 0.245) 2.390 21.952 ( -1.169 1.367 -0.257) 1.817 22.056 ( 1.087 -0.878 -2.232) 2.633 22.157 ( -0.807 -0.636 1.377) 1.718 22.462 ( -1.253 -0.025 1.899) 2.275 22.843 ( 2.806 -3.189 -2.514) 4.936 22.911 ( -1.482 1.584 0.996) 2.387 23.232 ( -3.083 -1.808 0.747) 3.651 23.307 ( -0.074 -3.725 -0.421) 3.749 ======================= Grid point 18 (13/102) ======================= q-point: (-0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.544 ( -2.044 4.547 0.276) 4.993 1.783 ( -3.269 16.523 2.542) 17.034 1.968 ( -4.720 10.915 -3.446) 12.381 2.043 ( -0.609 5.806 1.649) 6.066 2.288 ( -0.961 3.598 -1.282) 3.939 2.312 ( -2.510 -10.587 2.233) 11.107 2.595 ( 1.362 1.675 2.461) 3.274 2.729 ( 1.923 0.907 -3.985) 4.516 2.839 ( -1.016 2.003 4.111) 4.684 2.908 ( 0.861 7.540 -4.376) 8.760 3.003 ( -2.296 3.336 -2.351) 4.683 3.169 ( -6.344 2.878 3.595) 7.840 3.260 ( 2.415 1.736 -0.644) 3.043 3.399 ( -0.384 -2.805 0.999) 3.002 3.429 ( -0.922 2.272 -2.044) 3.192 3.514 ( 3.838 -1.840 -0.453) 4.281 3.524 ( -2.593 -0.753 2.535) 3.704 3.576 ( -1.223 -2.463 -2.007) 3.405 3.657 ( -2.714 -3.837 -0.854) 4.777 3.813 ( 0.086 -1.861 -1.076) 2.152 3.829 ( 1.017 1.961 2.106) 3.052 3.981 ( 0.786 2.574 -0.473) 2.733 4.125 ( -1.652 -0.837 0.551) 1.932 4.189 ( -0.991 -2.970 -0.317) 3.147 4.434 ( 0.169 3.893 1.066) 4.040 4.544 ( 1.931 0.130 1.592) 2.506 4.607 ( -0.139 0.419 1.454) 1.520 4.741 ( 1.757 -5.231 -3.174) 6.366 4.992 ( 1.378 -0.168 0.218) 1.405 5.038 ( 6.985 -4.258 -2.910) 8.683 5.179 ( -0.823 -1.239 0.612) 1.609 5.321 ( -2.357 -1.127 -0.948) 2.779 5.529 ( -3.527 -3.989 2.974) 6.099 5.647 ( 1.743 3.114 -0.237) 3.577 5.729 ( 7.140 3.308 2.068) 8.136 5.794 ( -0.828 -1.035 -0.805) 1.551 5.988 ( 4.145 5.935 1.380) 7.370 6.071 ( -3.049 -0.514 -0.700) 3.171 6.109 ( -1.102 -4.459 -3.395) 5.712 6.344 ( -3.708 3.754 0.766) 5.332 6.431 ( -5.169 4.081 1.087) 6.675 6.493 ( 0.589 2.202 -1.286) 2.617 6.580 ( -2.770 4.680 3.280) 6.351 6.662 ( -2.923 -0.593 -1.231) 3.227 6.791 ( -1.443 -2.589 -0.175) 2.969 6.864 ( -4.593 -0.690 -0.866) 4.725 7.079 ( -1.565 3.124 -0.982) 3.629 7.138 ( -0.846 -4.155 -1.048) 4.368 7.310 ( -4.315 -2.450 0.489) 4.986 7.348 ( -5.099 2.982 1.828) 6.183 7.904 ( -2.350 -1.115 -1.387) 2.948 8.060 ( -5.362 -3.462 2.903) 7.012 8.143 ( -0.991 2.893 -0.407) 3.085 8.264 ( 0.220 -6.251 3.161) 7.009 8.340 ( 5.538 0.169 -3.732) 6.680 8.767 ( 4.402 -0.410 -6.327) 7.718 8.963 ( -0.215 -2.273 5.721) 6.159 9.163 ( 1.308 -1.449 1.736) 2.612 9.218 ( 8.501 -4.715 0.792) 9.753 9.408 ( -1.752 -0.338 -2.258) 2.879 9.654 ( 6.811 1.831 -1.193) 7.153 9.948 ( -1.292 1.319 -0.206) 1.858 10.248 ( 2.984 2.120 1.147) 3.836 10.643 ( -3.614 4.691 0.139) 5.923 10.714 ( -7.221 -3.518 -0.281) 8.037 10.870 ( 1.674 2.658 1.597) 3.524 10.968 ( -0.059 1.584 -1.553) 2.219 11.132 ( -1.707 3.499 -1.262) 4.093 11.164 ( -6.091 -3.154 1.304) 6.982 11.325 ( 5.074 6.341 -1.353) 8.233 11.360 ( 5.630 -1.744 1.375) 6.053 11.580 ( 3.253 -1.617 -0.006) 3.633 12.024 ( -0.882 -2.424 -0.111) 2.582 12.077 ( 0.050 -1.983 -0.690) 2.100 12.406 ( -0.295 2.561 0.915) 2.735 12.473 ( 0.538 1.108 -0.329) 1.275 13.034 ( -1.480 3.858 0.157) 4.135 13.121 ( -0.628 3.865 -0.019) 3.916 13.293 ( 0.945 -7.622 -0.928) 7.736 13.549 ( 0.676 -4.873 0.816) 4.986 15.874 ( -3.496 -0.086 0.387) 3.518 15.980 ( -0.449 -2.096 -0.457) 2.191 17.533 ( 5.818 -0.673 -0.210) 5.861 17.872 ( -3.486 -2.618 2.362) 4.959 18.054 ( -2.269 3.145 0.213) 3.883 18.140 ( -1.512 4.413 -5.081) 6.897 18.421 ( 5.879 -4.645 3.498) 8.269 18.899 ( -4.418 1.111 -2.215) 5.065 19.058 ( 3.387 -1.550 1.863) 4.165 19.258 ( -2.496 1.171 -0.112) 2.759 19.571 ( 5.603 -6.530 -0.451) 8.617 20.028 ( -9.026 -6.891 0.220) 11.357 21.138 ( 9.809 6.391 -0.059) 11.708 21.653 ( -6.812 6.568 -0.344) 9.469 21.984 ( 0.497 -3.311 0.941) 3.478 22.044 ( -0.159 2.147 -0.028) 2.154 22.153 ( -0.672 0.482 0.017) 0.827 22.491 ( 1.454 -2.978 -1.557) 3.661 22.781 ( -1.936 6.192 1.647) 6.693 22.974 ( 2.451 -4.052 -0.957) 4.831 23.240 ( -1.262 -0.733 0.300) 1.490 23.376 ( 2.900 -2.878 0.022) 4.086 ======================= Grid point 19 (14/102) ======================= q-point: (-0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.396 ( -5.607 11.262 2.738) 12.875 1.411 ( -4.909 17.937 -0.709) 18.610 1.742 ( -4.013 9.863 0.509) 10.660 1.910 ( -1.994 7.799 0.718) 8.082 2.148 ( -4.139 8.245 0.117) 9.226 2.421 ( -0.008 9.620 -3.096) 10.106 2.544 ( 0.673 -7.999 -0.664) 8.054 2.598 ( -5.299 16.187 -3.728) 17.435 2.650 ( -2.776 13.168 3.232) 13.840 2.826 ( -2.794 1.266 3.338) 4.533 2.983 ( 1.648 1.701 -1.979) 3.086 3.082 ( -4.898 1.567 0.347) 5.154 3.243 ( 0.164 4.493 1.654) 4.790 3.382 ( -4.584 -0.432 0.944) 4.700 3.405 ( 1.198 -0.070 -2.066) 2.390 3.493 ( -2.068 0.106 0.533) 2.138 3.517 ( 1.594 2.552 0.295) 3.023 3.616 ( 3.071 6.502 -4.716) 8.599 3.693 ( -2.805 -7.244 2.237) 8.084 3.817 ( 0.002 -4.428 4.088) 6.026 3.970 ( 4.694 -6.331 -4.716) 9.185 3.982 ( 1.546 -2.050 -1.385) 2.917 4.125 ( -0.379 0.441 2.283) 2.356 4.218 ( 0.323 -1.491 -0.937) 1.791 4.393 ( 2.143 0.102 -0.686) 2.252 4.547 ( 3.827 2.795 3.733) 6.032 4.609 ( -0.644 -1.047 0.950) 1.553 4.806 ( 1.269 -2.746 -1.856) 3.549 4.994 ( -3.464 -1.529 0.157) 3.790 5.143 ( -2.749 2.360 0.327) 3.637 5.224 ( 10.570 -7.393 -6.001) 14.227 5.381 ( 3.995 -2.186 4.167) 6.172 5.528 ( -1.300 3.346 3.470) 4.992 5.605 ( -1.651 -0.466 -1.020) 1.996 5.681 ( 8.412 5.343 -1.623) 10.096 5.850 ( -2.133 -0.862 4.604) 5.147 5.903 ( 2.947 3.395 -1.214) 4.657 6.049 ( -7.729 -1.483 0.984) 7.931 6.091 ( -8.267 1.859 -5.755) 10.244 6.237 ( -8.207 1.850 0.289) 8.417 6.369 ( -1.837 -0.562 -0.210) 1.933 6.504 ( 0.511 1.054 2.366) 2.640 6.512 ( 6.186 1.129 -0.840) 6.344 6.683 ( 2.583 -3.425 -1.301) 4.483 6.801 ( -6.838 -0.549 1.254) 6.973 6.893 ( -7.178 -6.620 -0.203) 9.767 7.010 ( -0.468 3.171 -0.938) 3.340 7.188 ( -3.236 -2.573 -0.485) 4.162 7.254 ( -6.931 0.598 2.360) 7.346 7.365 ( -2.260 -5.136 -0.233) 5.616 7.912 ( -2.394 -1.483 -0.356) 2.839 8.077 ( -1.072 -0.773 1.752) 2.195 8.147 ( -1.726 -4.132 -1.029) 4.595 8.352 ( 2.599 -0.862 -0.879) 2.876 8.427 ( 0.472 -7.450 1.397) 7.594 8.777 ( 2.531 0.463 -3.144) 4.063 9.032 ( 1.306 -3.023 2.848) 4.353 9.194 ( 5.673 1.201 -1.500) 5.989 9.345 ( 1.715 -2.691 4.728) 5.704 9.407 ( 1.780 -1.222 -3.949) 4.500 9.666 ( 3.418 0.851 -1.413) 3.795 9.917 ( -3.352 0.562 1.764) 3.830 10.238 ( 4.916 1.656 -0.582) 5.220 10.492 ( -6.909 6.561 0.511) 9.541 10.718 ( -4.240 -0.555 -0.422) 4.297 10.842 ( 0.651 0.136 3.989) 4.044 10.936 ( 0.798 2.293 -3.026) 3.879 11.052 ( 0.750 3.329 -1.979) 3.945 11.179 ( -6.350 -2.965 1.179) 7.107 11.281 ( 2.088 1.345 0.084) 2.485 11.451 ( 3.699 -3.437 -0.082) 5.050 11.625 ( 0.072 -1.279 -0.117) 1.286 12.086 ( -2.441 -5.209 0.026) 5.753 12.135 ( 2.022 -4.196 -0.897) 4.744 12.355 ( -1.388 2.466 1.102) 3.037 12.453 ( 0.380 1.357 -0.335) 1.448 12.955 ( -0.795 3.428 0.149) 3.522 13.057 ( 0.108 3.035 0.078) 3.038 13.440 ( -0.093 -8.559 -0.667) 8.585 13.667 ( 2.148 -6.380 0.375) 6.743 15.852 ( -3.983 -0.292 1.088) 4.139 16.021 ( -0.274 -2.754 -1.071) 2.968 17.588 ( 9.249 1.105 -1.038) 9.373 17.855 ( 0.401 4.711 3.404) 5.826 17.936 ( -2.492 7.117 0.515) 7.559 18.073 ( -9.077 -2.973 -3.707) 10.246 18.620 ( 7.983 -10.755 2.416) 13.611 18.899 ( -5.237 -5.577 -1.905) 7.884 19.109 ( 0.986 -1.533 -1.179) 2.171 19.258 ( -3.813 -4.150 2.020) 5.987 19.773 ( 8.275 -9.814 -0.502) 12.846 20.100 ( -6.990 -7.682 0.182) 10.388 21.072 ( 9.865 9.096 -0.391) 13.425 21.435 ( -10.457 10.421 0.299) 14.766 21.984 ( -0.348 3.862 1.203) 4.060 22.012 ( -0.568 2.056 -0.510) 2.193 22.160 ( 0.079 -2.481 -0.008) 2.482 22.568 ( 3.967 -3.561 -6.373) 8.309 22.649 ( -3.383 6.350 5.872) 9.287 23.047 ( 1.963 -2.416 -0.342) 3.132 23.237 ( 0.177 0.799 -0.119) 0.827 23.454 ( 4.676 -2.618 0.403) 5.374 ======================= Grid point 20 (15/102) ======================= q-point: (-0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.076 ( -5.075 19.615 0.402) 20.265 1.145 ( -2.897 5.766 -0.911) 6.517 1.500 ( -3.434 16.636 -1.341) 17.040 1.807 ( -0.355 2.338 4.436) 5.027 1.939 ( -2.402 12.687 -0.533) 12.923 2.152 ( -1.347 20.870 -1.408) 20.960 2.211 ( -5.510 23.090 -0.653) 23.747 2.298 ( -6.938 12.575 1.086) 14.404 2.730 ( 2.786 -3.732 -1.750) 4.975 2.766 ( -2.084 1.455 1.384) 2.894 2.921 ( -0.480 1.279 -0.501) 1.455 3.043 ( -4.449 -0.268 0.249) 4.464 3.162 ( 2.554 6.869 2.163) 7.641 3.272 ( -3.079 11.636 -2.901) 12.381 3.409 ( -0.589 2.360 0.291) 2.450 3.456 ( 1.268 4.892 0.153) 5.056 3.530 ( 0.876 -4.885 -0.440) 4.983 3.543 ( -1.909 -4.052 0.289) 4.488 3.827 ( -0.577 -7.178 0.215) 7.205 3.905 ( -0.315 -4.126 0.891) 4.232 4.033 ( 2.332 0.779 -1.617) 2.943 4.045 ( 1.349 -2.186 1.389) 2.920 4.127 ( 1.091 -1.393 0.633) 1.879 4.283 ( 2.859 -3.249 -1.598) 4.613 4.445 ( 2.592 -2.525 -3.318) 4.909 4.516 ( 2.178 3.274 3.144) 5.034 4.622 ( -1.598 -0.066 0.378) 1.643 4.885 ( 4.826 -4.073 0.326) 6.324 4.998 ( -8.642 -3.769 -0.025) 9.428 5.112 ( -0.110 -2.074 0.652) 2.177 5.349 ( 1.946 -2.144 -2.840) 4.056 5.428 ( 4.658 3.704 4.705) 7.586 5.462 ( 0.932 0.417 -0.528) 1.149 5.639 ( 3.136 2.606 -0.740) 4.144 5.691 ( 9.486 -3.264 -2.334) 10.300 5.827 ( 0.594 0.416 5.294) 5.343 5.896 ( -9.270 -3.573 -2.487) 10.241 5.989 ( -8.918 2.116 -3.227) 9.717 6.019 ( -1.281 -1.609 1.215) 2.388 6.225 ( -1.069 -4.171 0.385) 4.323 6.357 ( -4.814 0.060 -1.129) 4.945 6.465 ( 0.500 2.088 1.284) 2.501 6.603 ( 7.336 -3.069 -1.364) 8.068 6.761 ( -6.735 -1.351 3.292) 7.617 6.782 ( 7.284 -1.926 -4.056) 8.557 6.912 ( -8.613 -1.313 2.531) 9.073 6.977 ( -0.908 -0.327 -0.691) 1.187 7.140 ( -1.261 3.173 -0.825) 3.513 7.292 ( -6.934 -8.046 1.192) 10.689 7.452 ( -1.271 -5.663 0.316) 5.812 7.905 ( -2.173 0.421 -0.019) 2.214 8.114 ( -0.033 -3.854 0.407) 3.876 8.201 ( -0.338 -1.889 0.024) 1.919 8.365 ( -0.366 -0.340 -1.575) 1.652 8.549 ( 0.211 -4.926 1.673) 5.206 8.803 ( 1.708 -2.660 -0.465) 3.196 9.080 ( 0.374 -1.033 0.752) 1.331 9.170 ( 4.034 6.113 -1.752) 7.531 9.341 ( -1.376 1.700 1.537) 2.673 9.460 ( 1.468 -1.631 -0.458) 2.242 9.658 ( -0.981 0.622 -0.910) 1.475 9.866 ( -2.024 4.008 1.707) 4.804 10.289 ( 4.867 -2.617 -0.707) 5.571 10.370 ( -5.561 -0.820 0.317) 5.630 10.677 ( -0.684 1.861 -0.341) 2.012 10.876 ( -0.503 3.162 -0.468) 3.236 10.900 ( 0.289 -3.996 0.996) 4.128 11.038 ( 4.421 0.528 -0.361) 4.467 11.182 ( -5.102 -1.915 0.633) 5.486 11.289 ( 1.763 -0.175 0.030) 1.771 11.507 ( -1.011 -0.925 -1.479) 2.016 11.624 ( -1.436 -0.025 0.419) 1.496 12.157 ( -3.093 -5.070 -0.935) 6.012 12.247 ( 1.745 -5.965 0.873) 6.276 12.313 ( -1.214 0.947 0.343) 1.577 12.430 ( 0.726 1.506 -0.293) 1.697 12.909 ( -0.078 1.322 0.122) 1.330 13.016 ( 0.322 1.799 0.023) 1.828 13.589 ( -0.389 -8.295 -0.202) 8.307 13.798 ( 1.891 -6.306 -0.053) 6.584 15.830 ( -3.561 -0.090 1.333) 3.803 16.066 ( -0.567 -2.879 -1.209) 3.174 17.577 ( 4.762 7.118 -1.663) 8.724 17.738 ( 0.172 8.510 0.377) 8.520 17.848 ( 8.288 2.981 2.558) 9.171 18.073 ( -15.721 -6.911 -0.682) 17.186 18.902 ( 8.386 -11.529 0.133) 14.257 19.010 ( -3.320 -11.196 1.181) 11.737 19.127 ( -3.343 -2.900 -3.375) 5.565 19.354 ( -2.179 -7.977 1.949) 8.495 20.018 ( 5.852 -10.871 -0.239) 12.349 20.202 ( -2.324 -7.943 -0.193) 8.279 20.950 ( 9.733 13.391 -0.840) 16.575 21.135 ( -12.938 12.895 1.320) 18.314 21.907 ( 0.014 5.934 0.345) 5.944 21.920 ( -1.052 5.230 -0.756) 5.388 22.224 ( 0.219 -3.725 0.351) 3.748 22.512 ( 0.062 6.056 -1.483) 6.236 22.670 ( 0.748 -4.443 1.064) 4.629 23.085 ( 1.149 -0.384 0.233) 1.233 23.210 ( 0.730 2.577 -0.486) 2.722 23.538 ( 4.781 -2.681 0.717) 5.528 ======================= Grid point 21 (16/102) ======================= q-point: (-0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.679 ( 0.000 21.304 0.000) 21.304 1.088 ( 0.000 26.557 0.000) 26.557 1.156 ( -0.000 -3.979 -0.000) 3.979 1.547 ( 0.000 35.068 0.000) 35.068 1.655 ( 0.000 17.338 0.000) 17.338 1.791 ( 0.000 2.096 0.000) 2.096 1.932 ( 0.000 9.606 0.000) 9.606 2.129 ( 0.000 3.867 0.000) 3.867 2.686 ( 0.000 4.095 0.000) 4.095 2.713 ( 0.000 5.583 0.000) 5.583 2.978 ( 0.000 6.703 0.000) 6.703 2.984 ( 0.000 13.002 0.000) 13.002 3.034 ( 0.000 6.191 0.000) 6.191 3.061 ( -0.000 -9.660 -0.000) 9.660 3.387 ( 0.000 3.051 0.000) 3.051 3.407 ( -0.000 -2.660 -0.000) 2.660 3.618 ( -0.000 -3.415 -0.000) 3.415 3.640 ( -0.000 -6.442 -0.000) 6.442 3.913 ( -0.000 -0.613 -0.000) 0.613 3.964 ( -0.000 -1.522 -0.000) 1.522 4.013 ( -0.000 -0.592 -0.000) 0.592 4.063 ( -0.000 -0.075 -0.000) 0.075 4.177 ( -0.000 -0.461 -0.000) 0.461 4.310 ( 0.000 1.179 0.000) 1.179 4.412 ( 0.000 4.114 0.000) 4.114 4.549 ( -0.000 -4.251 -0.000) 4.251 4.596 ( 0.000 1.107 0.000) 1.107 4.962 ( -0.000 -1.783 -0.000) 1.783 5.059 ( -0.000 -5.997 -0.000) 5.997 5.236 ( -0.000 -11.434 -0.000) 11.434 5.387 ( -0.000 -3.141 -0.000) 3.141 5.431 ( -0.000 -3.535 -0.000) 3.535 5.484 ( -0.000 -1.627 -0.000) 1.627 5.600 ( 0.000 1.835 0.000) 1.835 5.797 ( 0.000 1.545 0.000) 1.545 5.812 ( 0.000 3.828 0.000) 3.828 5.853 ( 0.000 0.955 0.000) 0.955 5.946 ( -0.000 -5.292 -0.000) 5.292 6.168 ( -0.000 -12.516 -0.000) 12.516 6.297 ( -0.000 -0.737 -0.000) 0.737 6.300 ( 0.000 1.921 0.000) 1.921 6.439 ( 0.000 0.275 0.000) 0.275 6.686 ( -0.000 -1.597 -0.000) 1.597 6.741 ( 0.000 1.235 0.000) 1.235 6.828 ( 0.000 5.289 0.000) 5.289 6.839 ( 0.000 0.194 0.000) 0.194 6.987 ( -0.000 -1.502 -0.000) 1.502 7.106 ( -0.000 -0.231 -0.000) 0.231 7.414 ( -0.000 -7.965 -0.000) 7.965 7.533 ( -0.000 -3.988 -0.000) 3.988 7.866 ( 0.000 2.989 0.000) 2.989 8.195 ( 0.000 1.886 0.000) 1.886 8.218 ( -0.000 -7.485 -0.000) 7.485 8.373 ( -0.000 -1.327 -0.000) 1.327 8.607 ( -0.000 -1.367 -0.000) 1.367 8.895 ( -0.000 -6.262 -0.000) 6.262 9.025 ( 0.000 10.179 0.000) 10.179 9.086 ( 0.000 0.269 0.000) 0.269 9.280 ( 0.000 5.402 0.000) 5.402 9.465 ( 0.000 1.233 0.000) 1.233 9.655 ( -0.000 -1.707 -0.000) 1.707 9.766 ( 0.000 5.309 0.000) 5.309 10.326 ( -0.000 -2.747 -0.000) 2.747 10.501 ( -0.000 -10.895 -0.000) 10.895 10.658 ( -0.000 -0.014 -0.000) 0.014 10.831 ( 0.000 1.037 0.000) 1.037 10.954 ( -0.000 -0.564 -0.000) 0.564 11.083 ( -0.000 -3.363 -0.000) 3.363 11.166 ( 0.000 2.143 0.000) 2.143 11.300 ( 0.000 0.257 0.000) 0.257 11.460 ( 0.000 3.209 0.000) 3.209 11.633 ( -0.000 -0.877 -0.000) 0.877 12.221 ( -0.000 -3.946 -0.000) 3.946 12.313 ( -0.000 -1.439 -0.000) 1.439 12.326 ( -0.000 -0.398 -0.000) 0.398 12.440 ( -0.000 -3.660 -0.000) 3.660 12.905 ( -0.000 -0.748 -0.000) 0.748 12.992 ( 0.000 1.160 0.000) 1.160 13.722 ( -0.000 -6.466 -0.000) 6.466 13.912 ( -0.000 -5.483 -0.000) 5.483 15.813 ( 0.000 0.274 0.000) 0.274 16.112 ( -0.000 -2.802 -0.000) 2.802 17.435 ( 0.000 8.848 0.000) 8.848 17.594 ( 0.000 7.081 0.000) 7.081 17.887 ( 0.000 0.999 0.000) 0.999 18.104 ( -0.000 -6.022 -0.000) 6.022 19.059 ( -0.000 -3.254 -0.000) 3.254 19.178 ( -0.000 -7.997 -0.000) 7.997 19.297 ( -0.000 -17.267 -0.000) 17.267 19.506 ( -0.000 -9.573 -0.000) 9.573 20.200 ( -0.000 -5.737 -0.000) 5.737 20.353 ( -0.000 -8.170 -0.000) 8.170 20.677 ( 0.000 18.363 0.000) 18.363 20.875 ( 0.000 10.582 0.000) 10.582 21.761 ( 0.000 8.529 0.000) 8.529 21.851 ( 0.000 2.925 0.000) 2.925 22.282 ( -0.000 -2.418 -0.000) 2.418 22.424 ( 0.000 3.540 0.000) 3.540 22.749 ( -0.000 -3.788 -0.000) 3.788 23.077 ( 0.000 1.767 0.000) 1.767 23.153 ( 0.000 4.012 0.000) 4.012 23.612 ( -0.000 -2.731 -0.000) 2.731 ======================= Grid point 24 (17/102) ======================= q-point: ( 0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.718 ( 25.553 0.000 -1.943) 25.626 0.841 ( 27.029 0.000 -0.073) 27.029 1.328 ( 12.206 0.000 -9.324) 15.359 1.439 ( 14.524 0.000 0.482) 14.532 1.583 ( 46.729 0.000 3.031) 46.827 2.055 ( 4.077 0.000 8.241) 9.194 2.210 ( 16.988 0.000 10.094) 19.760 2.412 ( 6.627 0.000 -7.977) 10.371 2.552 ( 6.016 0.000 -0.530) 6.040 2.597 ( 5.839 0.000 -2.222) 6.247 2.784 ( 2.905 0.000 5.590) 6.300 2.868 ( 5.687 0.000 -9.322) 10.920 3.106 ( -6.737 -0.000 -0.041) 6.737 3.220 ( 1.475 0.000 1.114) 1.848 3.471 ( -9.465 -0.000 2.456) 9.779 3.505 ( -3.196 -0.000 5.676) 6.514 3.561 ( -4.165 -0.000 -6.184) 7.455 3.739 ( -7.638 -0.000 4.408) 8.818 3.794 ( 0.946 0.000 -1.742) 1.982 3.903 ( 6.043 0.000 -6.542) 8.906 3.903 ( 0.817 0.000 -4.564) 4.636 4.043 ( -3.251 -0.000 -1.141) 3.446 4.203 ( 6.237 0.000 1.005) 6.318 4.275 ( 0.184 0.000 -2.298) 2.306 4.369 ( 2.955 0.000 4.139) 5.086 4.557 ( -8.162 -0.000 8.343) 11.671 4.825 ( 4.247 0.000 -7.118) 8.289 5.009 ( 0.021 0.000 -2.830) 2.830 5.073 ( -11.519 -0.000 4.981) 12.550 5.210 ( -5.663 -0.000 -2.007) 6.008 5.271 ( -10.276 -0.000 4.293) 11.137 5.330 ( -9.080 -0.000 -4.535) 10.150 5.629 ( -4.458 -0.000 1.459) 4.691 5.672 ( -2.087 -0.000 -4.675) 5.119 5.791 ( -6.009 -0.000 -1.174) 6.123 5.916 ( -0.600 -0.000 2.081) 2.165 5.969 ( -3.843 -0.000 -1.585) 4.157 6.047 ( -1.931 -0.000 -1.600) 2.508 6.078 ( -9.221 -0.000 6.682) 11.387 6.192 ( 2.911 0.000 -2.214) 3.657 6.207 ( 1.593 0.000 3.801) 4.121 6.338 ( -5.032 -0.000 -6.142) 7.940 6.636 ( -6.911 -0.000 -2.109) 7.225 6.665 ( -3.101 -0.000 -0.463) 3.135 6.860 ( 9.582 0.000 3.445) 10.183 7.005 ( 8.648 0.000 -3.803) 9.447 7.081 ( -1.815 -0.000 6.061) 6.327 7.220 ( 10.076 0.000 -1.991) 10.270 7.516 ( 19.109 0.000 -8.975) 21.112 7.865 ( 7.506 0.000 -2.835) 8.023 8.162 ( 3.194 0.000 -6.231) 7.002 8.293 ( 2.262 0.000 -2.491) 3.365 8.343 ( -4.132 -0.000 4.547) 6.144 8.409 ( -15.850 -0.000 22.678) 27.668 8.772 ( 3.945 0.000 -9.778) 10.544 8.810 ( -8.701 -0.000 5.938) 10.534 8.959 ( 1.283 0.000 -1.450) 1.936 9.016 ( 3.592 0.000 9.390) 10.054 9.306 ( 10.231 0.000 -6.153) 11.939 9.812 ( 3.729 0.000 8.361) 9.155 9.902 ( 12.283 0.000 -7.748) 14.523 10.352 ( -9.114 -0.000 -16.617) 18.953 10.354 ( -20.750 -0.000 8.692) 22.497 10.516 ( 1.104 0.000 5.560) 5.669 10.616 ( -5.550 -0.000 2.435) 6.061 10.650 ( 1.211 0.000 -12.361) 12.420 11.044 ( 5.480 0.000 -2.007) 5.835 11.051 ( 3.906 0.000 -0.797) 3.986 11.124 ( 8.204 0.000 -19.371) 21.037 11.328 ( 4.626 0.000 5.544) 7.220 11.470 ( 9.539 0.000 0.635) 9.560 11.805 ( 5.597 0.000 5.911) 8.141 12.130 ( -6.379 -0.000 1.126) 6.478 12.254 ( -8.355 -0.000 0.098) 8.355 12.688 ( 9.754 0.000 0.664) 9.777 12.830 ( -2.947 -0.000 -1.047) 3.128 13.039 ( 11.022 0.000 -0.955) 11.063 13.315 ( 11.333 0.000 -4.140) 12.065 13.778 ( -3.789 -0.000 0.292) 3.800 13.815 ( -3.316 -0.000 -0.274) 3.327 16.138 ( -5.307 -0.000 -22.036) 22.666 16.240 ( -7.784 -0.000 12.254) 14.517 17.344 ( 9.218 0.000 -0.997) 9.272 17.556 ( 6.770 0.000 -2.984) 7.399 18.032 ( 8.443 0.000 0.417) 8.453 18.342 ( 5.365 0.000 -9.477) 10.891 19.016 ( -17.215 -0.000 8.795) 19.331 19.105 ( -12.954 -0.000 -2.521) 13.197 19.798 ( 4.344 0.000 -3.974) 5.887 19.887 ( 1.605 0.000 6.185) 6.390 20.192 ( 4.378 0.000 3.943) 5.892 20.632 ( 3.980 0.000 1.368) 4.208 20.633 ( 7.025 0.000 -1.906) 7.279 21.399 ( 21.019 0.000 -52.624) 56.667 21.774 ( -9.249 -0.000 23.415) 25.175 21.866 ( -1.421 -0.000 12.309) 12.391 21.914 ( 5.655 0.000 -0.276) 5.662 22.344 ( 1.910 0.000 -1.345) 2.336 22.380 ( -0.276 -0.000 1.041) 1.077 22.764 ( -8.633 -0.000 3.719) 9.400 22.936 ( -4.011 -0.000 -0.423) 4.033 22.973 ( -5.553 -0.000 0.446) 5.571 ======================= Grid point 25 (18/102) ======================= q-point: ( 0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.976 ( 21.090 -8.017 0.585) 22.570 1.141 ( 22.164 -11.105 1.325) 24.826 1.386 ( 10.438 1.823 -0.550) 10.610 1.675 ( 15.963 -10.811 -3.825) 19.655 1.983 ( 33.145 -6.042 -1.156) 33.711 2.054 ( 10.420 3.196 4.216) 11.686 2.343 ( 10.698 -0.681 6.971) 12.787 2.423 ( 8.381 1.459 -9.240) 12.560 2.613 ( 3.888 -3.610 -2.465) 5.850 2.742 ( 1.210 -10.418 4.253) 11.317 2.794 ( -1.137 -0.174 4.307) 4.458 2.947 ( 10.850 -3.376 -6.270) 12.978 3.077 ( -1.697 -0.373 1.664) 2.406 3.223 ( -1.773 -0.143 1.805) 2.534 3.399 ( -4.024 1.653 1.750) 4.689 3.517 ( 4.242 -1.536 1.750) 4.839 3.526 ( -7.717 -0.290 -2.765) 8.202 3.658 ( -6.085 2.972 2.012) 7.064 3.805 ( -3.245 -1.568 1.195) 3.797 3.877 ( -1.051 -0.193 -3.582) 3.738 3.974 ( -4.047 2.812 -2.712) 5.625 3.993 ( 5.232 -3.403 -6.882) 9.291 4.182 ( 0.996 5.487 3.289) 6.474 4.227 ( 6.279 4.018 -1.735) 7.654 4.470 ( -9.884 2.614 9.728) 14.112 4.502 ( 1.737 -5.159 1.610) 5.677 4.774 ( 0.844 4.460 -7.800) 9.024 4.947 ( -4.835 3.301 2.657) 6.429 5.012 ( -10.419 1.219 3.427) 11.036 5.110 ( -5.239 5.169 -2.654) 7.824 5.220 ( 2.609 -2.532 0.456) 3.664 5.333 ( -5.945 -1.088 -0.904) 6.111 5.541 ( -3.476 4.165 -4.008) 6.745 5.588 ( -4.126 5.835 1.464) 7.295 5.710 ( -1.321 0.540 -4.319) 4.549 5.812 ( -7.876 6.356 -0.064) 10.121 5.855 ( -8.804 2.593 2.492) 9.510 6.067 ( -7.092 -4.383 2.245) 8.634 6.148 ( 1.374 -6.258 -0.377) 6.419 6.207 ( 0.748 -2.401 3.768) 4.530 6.294 ( 4.473 -2.917 -0.340) 5.351 6.377 ( -5.033 -6.765 -4.684) 9.646 6.586 ( -5.834 -0.111 -0.621) 5.868 6.639 ( -1.932 0.091 -0.668) 2.046 6.926 ( 7.315 0.874 3.514) 8.162 7.056 ( 4.596 -0.254 -2.332) 5.160 7.095 ( 5.190 -0.380 0.934) 5.287 7.306 ( 4.081 -1.773 2.183) 4.956 7.611 ( 13.361 1.699 -7.036) 15.195 7.947 ( 4.991 -2.713 -0.566) 5.709 8.138 ( 0.326 6.476 -4.073) 7.657 8.202 ( 0.728 5.186 3.207) 6.141 8.306 ( -3.322 0.135 2.473) 4.143 8.400 ( -3.161 -2.112 8.887) 9.665 8.669 ( -2.414 5.331 -3.854) 7.008 8.771 ( -7.429 1.836 1.692) 7.838 8.974 ( 4.563 1.476 2.250) 5.298 9.095 ( -2.016 -3.598 3.660) 5.514 9.393 ( 11.359 -1.801 -6.584) 13.252 9.784 ( 2.825 9.950 2.499) 10.641 9.933 ( 11.842 3.607 -8.360) 14.937 10.066 ( -1.763 10.681 -3.097) 11.260 10.291 ( -16.873 -1.018 4.302) 17.443 10.454 ( 1.211 5.489 4.147) 6.985 10.618 ( -2.908 -0.888 5.134) 5.967 10.634 ( 1.086 -1.673 -10.411) 10.601 10.950 ( 5.351 4.368 -0.142) 6.909 11.091 ( 7.651 3.533 -7.744) 11.445 11.273 ( 4.715 -9.364 -0.392) 10.491 11.476 ( 4.114 -6.856 2.112) 8.270 11.522 ( 8.962 1.900 0.041) 9.162 11.821 ( 0.484 1.952 3.176) 3.759 12.104 ( -5.079 -1.339 0.031) 5.252 12.196 ( -6.361 0.039 0.322) 6.369 12.736 ( 5.683 0.649 1.401) 5.889 12.803 ( 1.212 1.588 -1.531) 2.517 13.020 ( 11.058 10.845 -0.190) 15.490 13.212 ( 12.796 14.595 -0.986) 19.435 13.759 ( -6.515 0.464 -0.085) 6.532 13.779 ( -2.889 1.961 0.016) 3.491 15.997 ( -5.868 3.575 -7.969) 10.523 16.204 ( -10.693 0.474 5.493) 12.031 17.350 ( 9.628 5.350 -0.070) 11.015 17.641 ( 6.755 -3.392 -2.239) 7.883 17.864 ( 12.281 10.289 0.907) 16.047 18.545 ( 2.675 -5.231 -4.750) 7.555 18.876 ( -11.130 2.938 3.004) 11.897 19.174 ( -17.306 -14.910 -0.412) 22.847 19.697 ( 0.283 11.565 -3.092) 11.975 19.781 ( -1.138 10.722 1.092) 10.837 20.055 ( 6.265 17.895 4.525) 19.493 20.468 ( 7.710 15.291 1.900) 17.230 20.844 ( 7.100 -10.581 -0.539) 12.754 21.231 ( 19.288 7.228 -15.302) 25.660 21.717 ( -0.434 -5.564 10.046) 11.492 21.873 ( 2.878 0.183 -0.032) 2.884 22.320 ( 1.106 2.041 -2.249) 3.232 22.401 ( 0.155 -2.234 1.997) 3.000 22.484 ( -8.790 -23.848 -4.822) 25.869 22.747 ( -10.374 -6.838 2.830) 12.743 22.924 ( -5.205 -2.446 -0.881) 5.818 22.979 ( -6.081 -5.019 1.670) 8.060 ======================= Grid point 26 (19/102) ======================= q-point: ( 0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.270 ( 11.172 -9.251 3.968) 15.038 1.423 ( 9.678 -0.398 4.489) 10.676 1.534 ( 15.522 -15.034 2.956) 21.811 1.924 ( 14.889 -3.304 -11.665) 19.201 2.119 ( 13.565 -3.915 -1.274) 14.176 2.204 ( 6.376 0.603 -4.892) 8.059 2.418 ( 5.526 -4.433 1.958) 7.350 2.574 ( 10.962 -7.569 -2.249) 13.510 2.708 ( 5.898 -1.902 -0.641) 6.230 2.804 ( -2.063 -2.521 6.083) 6.900 2.947 ( -1.946 -8.607 6.872) 11.184 3.070 ( 2.036 -0.649 2.167) 3.043 3.085 ( 6.817 -3.701 -2.942) 8.296 3.268 ( 1.238 -4.793 -1.347) 5.131 3.368 ( -1.776 -0.206 3.720) 4.127 3.441 ( -6.552 2.054 -1.891) 7.122 3.542 ( -2.091 3.855 -1.468) 4.625 3.629 ( 5.028 -2.878 -0.566) 5.821 3.811 ( -6.078 -1.946 4.052) 7.559 3.844 ( -4.198 4.300 -1.478) 6.188 3.896 ( -0.033 -2.745 -6.211) 6.791 4.103 ( -0.591 3.643 5.998) 7.043 4.113 ( 6.665 -3.278 -8.108) 10.996 4.195 ( 7.340 2.800 -1.740) 8.046 4.369 ( -6.101 2.837 7.408) 10.008 4.486 ( -0.544 7.187 -0.936) 7.268 4.696 ( -3.801 3.930 -0.682) 5.509 4.867 ( -6.072 0.422 2.074) 6.430 4.923 ( -3.731 3.405 2.684) 5.720 4.993 ( -9.485 1.744 -0.405) 9.653 5.256 ( -1.972 -1.450 -3.630) 4.378 5.361 ( 7.706 -1.108 3.344) 8.473 5.410 ( -4.582 4.667 -7.047) 9.615 5.490 ( -0.757 2.624 1.287) 3.019 5.650 ( -7.448 3.880 -1.377) 8.510 5.710 ( -1.211 -1.054 0.039) 1.606 5.812 ( -9.630 -4.606 1.233) 10.746 6.109 ( -4.258 -4.189 2.008) 6.302 6.231 ( -1.239 -3.686 -1.441) 4.147 6.303 ( 2.677 -5.386 1.183) 6.130 6.399 ( 4.976 -3.603 0.178) 6.146 6.415 ( -4.878 -3.437 -3.034) 6.695 6.550 ( -1.636 0.709 0.667) 1.904 6.643 ( 0.636 -1.406 -1.022) 1.851 6.945 ( 4.978 2.669 3.358) 6.571 7.076 ( 2.305 0.389 -2.787) 3.638 7.141 ( 5.427 0.573 -0.897) 5.530 7.343 ( 2.281 0.696 3.972) 4.633 7.609 ( 4.329 4.763 -1.777) 6.677 7.889 ( -1.307 11.722 4.030) 12.464 8.023 ( 2.807 3.905 -3.923) 6.206 8.154 ( -1.163 2.852 -0.217) 3.087 8.335 ( 2.185 -2.608 1.273) 3.632 8.455 ( 1.644 -2.515 0.776) 3.103 8.556 ( -3.797 4.548 0.396) 5.938 8.676 ( -6.287 1.708 0.556) 6.539 8.945 ( 0.997 4.041 3.087) 5.182 9.119 ( -3.838 -1.341 0.799) 4.143 9.432 ( 4.942 7.487 -8.589) 12.420 9.606 ( 6.477 6.166 -2.074) 9.180 9.806 ( -3.857 10.994 2.099) 11.838 10.041 ( 11.022 -0.106 -5.619) 12.372 10.226 ( -7.491 -0.761 6.710) 10.086 10.430 ( 1.176 -1.605 0.592) 2.076 10.608 ( -2.711 -0.540 4.272) 5.088 10.676 ( 2.273 -2.232 -5.107) 6.019 10.943 ( 4.730 1.206 1.084) 5.001 11.093 ( 5.926 0.876 -3.720) 7.052 11.441 ( 7.586 -4.160 -0.497) 8.666 11.525 ( 8.366 4.613 1.195) 9.628 11.596 ( 2.939 -1.743 0.174) 3.421 11.764 ( -0.873 3.694 1.104) 3.953 12.093 ( -4.042 -1.136 -0.473) 4.225 12.165 ( -3.473 -0.230 0.786) 3.568 12.752 ( 8.606 8.227 -1.850) 12.048 12.773 ( 9.405 3.249 1.971) 10.144 12.917 ( 0.540 2.127 0.086) 2.196 13.031 ( 7.136 13.452 -0.011) 15.227 13.666 ( -5.895 5.990 -0.304) 8.410 13.690 ( -4.674 2.842 0.460) 5.490 15.912 ( -5.535 0.168 -2.795) 6.203 16.102 ( -9.285 2.776 2.231) 9.945 17.348 ( 6.147 1.082 0.045) 6.241 17.732 ( 3.325 -2.452 -1.423) 4.369 17.874 ( 12.398 1.329 1.099) 12.518 18.543 ( 1.245 3.957 -1.655) 4.466 18.740 ( -8.300 5.114 1.516) 9.866 19.257 ( -8.908 -2.273 0.838) 9.232 19.461 ( -2.176 11.006 -2.330) 11.458 19.560 ( 0.140 10.948 0.284) 10.953 19.822 ( -1.764 8.632 -1.150) 8.885 20.220 ( 5.746 17.953 2.738) 19.048 21.085 ( 9.484 -7.809 1.125) 12.337 21.336 ( 13.073 -4.804 -5.776) 15.078 21.868 ( 0.235 -7.969 5.541) 9.709 21.901 ( 2.501 -1.509 -0.225) 2.930 22.254 ( -0.443 4.349 -2.506) 5.039 22.468 ( 0.240 -3.961 4.509) 6.007 22.596 ( -2.270 -0.914 -3.972) 4.665 22.901 ( -10.741 -14.785 -2.301) 18.419 22.934 ( -6.201 -3.521 -0.931) 7.191 23.047 ( -6.358 -6.406 2.827) 9.458 ======================= Grid point 27 (20/102) ======================= q-point: ( 0.45 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.449 ( 4.345 -7.380 0.355) 8.572 1.613 ( 9.997 -8.320 3.165) 13.386 1.901 ( 9.557 -12.719 5.463) 16.821 1.975 ( 11.551 3.165 -10.331) 15.817 2.223 ( 0.833 -4.184 -3.224) 5.347 2.304 ( 4.633 -5.351 0.038) 7.078 2.559 ( 5.613 -5.715 -2.902) 8.520 2.644 ( 1.419 3.048 1.036) 3.518 2.777 ( -5.100 -3.423 6.807) 9.168 2.868 ( 3.471 -1.787 2.360) 4.562 3.021 ( 0.482 -1.414 3.099) 3.440 3.154 ( 1.226 -2.392 -3.163) 4.151 3.196 ( 8.281 -5.497 0.440) 9.949 3.307 ( -1.125 -0.189 -0.205) 1.159 3.347 ( -6.649 -1.064 0.905) 6.795 3.457 ( 0.140 0.456 -0.673) 0.825 3.495 ( 1.806 -5.003 -2.324) 5.805 3.688 ( 4.264 0.439 -1.819) 4.657 3.750 ( -3.998 2.079 -0.567) 4.542 3.805 ( -4.264 -1.533 2.020) 4.961 3.971 ( 2.501 -3.303 -5.343) 6.761 4.007 ( -4.299 5.413 5.769) 9.004 4.132 ( -0.442 0.259 -1.977) 2.042 4.302 ( 1.374 0.240 1.518) 2.062 4.316 ( 10.304 0.157 -1.638) 10.435 4.348 ( 1.789 4.921 -0.380) 5.250 4.578 ( -7.890 2.715 1.192) 8.429 4.783 ( -4.016 4.543 3.642) 7.074 4.875 ( -2.855 -0.461 -1.677) 3.343 4.932 ( -5.997 -1.110 1.799) 6.358 5.260 ( -6.347 -1.722 2.140) 6.916 5.281 ( 0.522 3.720 -4.545) 5.897 5.429 ( 2.365 -0.241 -0.405) 2.412 5.521 ( 0.842 -4.272 -2.086) 4.829 5.592 ( -1.989 -2.387 -1.144) 3.311 5.736 ( -1.766 -2.256 2.713) 3.946 5.834 ( -4.062 -3.369 0.151) 5.280 6.144 ( -3.193 -1.973 2.088) 4.295 6.257 ( -6.468 -2.645 -2.440) 7.402 6.419 ( 7.220 -2.756 -1.996) 7.982 6.441 ( -1.273 -0.829 -0.805) 1.720 6.457 ( 0.428 -2.830 1.274) 3.133 6.565 ( 1.721 -1.445 0.904) 2.422 6.700 ( 4.936 -3.184 -2.613) 6.429 6.923 ( 3.286 4.159 3.531) 6.369 7.050 ( 1.448 3.679 -2.966) 4.942 7.138 ( 1.189 1.955 -0.913) 2.464 7.343 ( 2.629 2.671 4.786) 6.079 7.513 ( -3.312 5.435 1.633) 6.570 7.656 ( 0.752 13.562 -1.952) 13.722 7.957 ( 0.741 3.882 -2.361) 4.604 8.073 ( -4.856 3.549 3.168) 6.798 8.345 ( -5.255 5.463 -2.247) 7.906 8.400 ( 3.216 3.325 -0.696) 4.678 8.538 ( 1.617 -0.228 0.922) 1.875 8.663 ( -5.056 -2.806 4.530) 7.345 8.901 ( 1.452 0.945 1.665) 2.403 9.103 ( -0.771 0.800 -2.012) 2.299 9.229 ( 0.127 10.670 -4.502) 11.581 9.550 ( -5.224 7.042 0.284) 8.772 9.678 ( 8.243 0.972 -2.120) 8.566 10.088 ( 5.882 1.963 -0.250) 6.206 10.224 ( 0.081 -0.958 1.997) 2.216 10.510 ( -1.453 -6.065 -1.820) 6.497 10.633 ( 1.297 -2.206 3.107) 4.026 10.721 ( 1.715 -2.166 -1.906) 3.356 10.967 ( 2.510 -0.109 2.650) 3.652 11.123 ( 2.649 -1.120 -1.656) 3.319 11.473 ( 2.075 7.309 0.583) 7.620 11.498 ( 11.662 6.877 -3.004) 13.868 11.579 ( 0.465 0.298 1.064) 1.199 11.739 ( 6.823 3.144 1.513) 7.663 12.076 ( -3.175 -0.030 -0.811) 3.277 12.137 ( -2.745 1.562 0.961) 3.301 12.629 ( 8.906 10.057 -0.075) 13.434 12.727 ( 10.005 12.786 -0.237) 16.237 12.919 ( -1.500 -2.500 0.110) 2.918 12.965 ( -0.108 -4.615 0.080) 4.616 13.493 ( -5.216 7.940 -0.436) 9.510 13.602 ( -4.888 3.305 0.747) 5.948 15.884 ( -4.430 -1.342 -1.640) 4.911 15.998 ( -7.144 2.173 1.228) 7.568 17.394 ( 4.282 -1.582 0.045) 4.565 17.764 ( -2.172 -1.105 -0.913) 2.602 17.956 ( 8.953 -0.676 1.317) 9.074 18.452 ( -0.307 6.065 -2.518) 6.574 18.595 ( -1.257 6.658 2.236) 7.135 19.148 ( 0.351 7.444 2.422) 7.836 19.286 ( -0.406 7.422 -1.387) 7.561 19.439 ( 2.576 5.366 -0.172) 5.955 19.704 ( -11.865 -0.375 -4.549) 12.713 19.945 ( 0.250 14.812 3.269) 15.171 21.246 ( 13.073 -0.815 0.892) 13.129 21.512 ( 5.257 -7.443 -1.688) 9.268 21.956 ( 2.796 -3.117 -4.585) 6.209 22.000 ( -0.897 -4.407 6.207) 7.665 22.161 ( -2.097 3.889 -1.631) 4.710 22.506 ( -3.763 0.922 7.441) 8.389 22.633 ( 4.017 -5.448 -6.465) 9.360 22.943 ( -3.528 -1.765 -1.025) 4.076 23.056 ( -8.066 -10.574 -1.396) 13.372 23.113 ( -4.917 -5.335 2.199) 7.581 ======================= Grid point 28 (21/102) ======================= q-point: ( 0.55 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.619 ( 2.229 -6.169 -3.767) 7.564 1.802 ( 9.140 -5.813 -2.699) 11.163 1.991 ( 4.633 -1.284 -2.743) 5.535 2.118 ( 0.774 -4.565 8.604) 9.771 2.305 ( -1.950 -2.306 -1.558) 3.398 2.388 ( -1.079 -3.928 1.033) 4.203 2.533 ( 3.381 7.184 2.395) 8.293 2.734 ( 1.357 -5.661 -0.677) 5.860 2.768 ( 3.794 0.573 2.649) 4.663 2.938 ( -1.328 -4.141 1.004) 4.463 3.018 ( -2.671 0.578 -1.115) 2.952 3.207 ( 1.595 -4.182 -0.862) 4.558 3.286 ( 4.937 2.952 -2.850) 6.420 3.347 ( -3.335 -3.839 1.746) 5.377 3.363 ( 3.250 -4.878 -1.136) 5.970 3.415 ( -1.639 1.289 -2.161) 3.003 3.587 ( -0.245 -1.675 -0.234) 1.708 3.654 ( -1.913 4.269 -0.793) 4.745 3.723 ( 1.344 1.526 0.461) 2.085 3.816 ( 2.448 5.652 -0.413) 6.173 3.848 ( -4.503 0.828 2.349) 5.147 3.953 ( -8.567 1.019 3.544) 9.327 4.173 ( -8.820 0.011 -0.411) 8.830 4.219 ( 3.639 -1.669 -4.574) 6.078 4.350 ( 8.185 -0.372 -0.210) 8.197 4.471 ( 10.697 -3.941 -2.476) 11.665 4.516 ( -8.993 -2.578 2.828) 9.774 4.688 ( -1.282 3.731 -0.726) 4.012 4.906 ( -1.421 -3.709 3.953) 5.603 4.936 ( -0.011 -1.347 0.142) 1.355 5.213 ( -3.535 0.668 0.816) 3.689 5.293 ( 0.372 -2.186 -2.312) 3.203 5.429 ( -0.927 0.614 0.584) 1.256 5.579 ( -1.713 -4.022 -0.591) 4.412 5.672 ( -1.173 -6.206 -5.586) 8.432 5.752 ( -3.501 -1.652 5.793) 6.968 5.906 ( 8.031 -2.883 -0.340) 8.539 6.140 ( -3.092 0.873 1.229) 3.440 6.226 ( -2.405 0.898 -1.331) 2.891 6.431 ( 3.035 0.838 0.373) 3.171 6.493 ( 0.257 -0.294 0.612) 0.726 6.519 ( 0.497 -4.159 -3.735) 5.613 6.588 ( -0.904 -0.084 0.699) 1.146 6.787 ( 4.760 -1.599 -4.239) 6.571 6.830 ( -3.235 8.630 6.286) 11.156 6.976 ( 4.264 5.165 -0.474) 6.715 7.105 ( -1.482 0.894 -0.701) 1.867 7.272 ( -2.553 5.543 1.755) 6.350 7.397 ( 0.749 10.749 -3.628) 11.370 7.455 ( -3.291 3.005 3.083) 5.418 7.902 ( 0.444 1.776 -2.681) 3.246 7.992 ( -6.586 1.229 4.908) 8.305 8.180 ( -6.663 4.307 -2.592) 8.347 8.368 ( 2.641 4.439 -0.583) 5.198 8.485 ( 3.606 7.199 -2.192) 8.345 8.696 ( -3.981 -3.796 4.378) 7.030 8.925 ( -2.645 -1.170 3.364) 4.436 9.093 ( 5.478 -0.041 -2.235) 5.916 9.119 ( 3.168 1.903 -1.071) 3.848 9.420 ( -5.044 2.219 -1.183) 5.636 9.731 ( 9.145 1.091 -2.447) 9.529 10.061 ( 1.778 3.893 1.395) 4.501 10.259 ( 2.501 -1.120 0.456) 2.778 10.577 ( -3.318 -4.247 -3.403) 6.374 10.695 ( -0.192 -1.988 1.628) 2.576 10.788 ( 2.824 -3.909 0.579) 4.857 10.990 ( 0.572 -0.426 2.614) 2.709 11.148 ( -2.980 -1.328 0.108) 3.264 11.304 ( 0.978 9.943 -2.251) 10.242 11.446 ( 7.477 5.796 0.302) 9.465 11.593 ( 6.786 2.838 1.877) 7.591 11.697 ( 7.624 8.179 -1.132) 11.239 12.049 ( -1.535 0.548 -2.005) 2.584 12.068 ( -3.519 3.162 1.920) 5.106 12.547 ( 4.697 4.850 -0.332) 6.760 12.569 ( 3.763 8.763 0.219) 9.539 12.990 ( -1.246 -5.452 -1.412) 5.768 13.075 ( 2.236 -5.688 1.421) 6.275 13.320 ( -3.465 7.265 -0.752) 8.084 13.511 ( -4.313 2.676 0.995) 5.172 15.876 ( -3.024 -0.829 -2.155) 3.804 15.933 ( -4.799 0.052 1.850) 5.143 17.463 ( 4.301 -2.431 0.027) 4.941 17.753 ( -5.752 -1.768 -0.333) 6.027 18.029 ( 4.276 -1.668 1.935) 4.981 18.320 ( -2.568 5.865 -4.090) 7.597 18.504 ( 5.098 6.114 1.997) 8.208 19.063 ( 2.433 4.962 6.872) 8.818 19.162 ( 2.165 6.910 -5.695) 9.212 19.398 ( 4.179 1.292 -0.292) 4.384 19.556 ( -4.196 9.616 -1.617) 10.616 19.791 ( -12.874 -2.926 0.981) 13.239 21.322 ( 13.655 3.381 0.648) 14.082 21.654 ( -0.090 -5.994 0.031) 5.995 21.989 ( -1.607 3.168 -1.171) 3.741 22.027 ( 1.246 -2.413 -2.633) 3.783 22.130 ( -1.640 -1.670 2.264) 3.257 22.466 ( -2.492 1.367 3.767) 4.719 22.767 ( 4.065 -6.357 -3.495) 8.316 22.932 ( -2.018 0.816 0.192) 2.185 23.140 ( -5.724 -5.256 0.904) 7.824 23.202 ( -1.638 -6.818 -0.293) 7.018 ======================= Grid point 29 (22/102) ======================= q-point: (-0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.626 ( 1.035 4.079 -2.999) 5.168 1.959 ( 5.238 -0.872 -2.160) 5.733 2.020 ( -0.624 1.055 -3.335) 3.553 2.157 ( -4.893 -2.521 10.771) 12.096 2.208 ( -1.755 8.846 -1.617) 9.162 2.415 ( 4.367 8.912 0.536) 9.939 2.484 ( -2.959 -8.549 2.189) 9.308 2.766 ( 0.833 2.792 -2.766) 4.018 2.862 ( 2.501 -5.017 6.648) 8.696 2.963 ( 5.618 1.577 -7.458) 9.469 3.028 ( -4.537 -3.470 -0.533) 5.737 3.195 ( -5.767 5.954 2.330) 8.610 3.315 ( 6.356 -1.163 -4.480) 7.863 3.361 ( -1.617 -1.076 0.781) 2.093 3.437 ( -0.182 -3.502 2.275) 4.180 3.467 ( 3.518 -0.331 -3.078) 4.686 3.508 ( -2.590 5.208 1.669) 6.051 3.571 ( -6.143 -1.621 1.890) 6.629 3.605 ( -0.420 4.835 -1.240) 5.009 3.805 ( 0.553 0.886 -1.123) 1.534 3.842 ( 0.273 -2.134 2.749) 3.490 3.980 ( -2.139 -5.987 -2.979) 7.021 4.061 ( -7.127 2.695 1.270) 7.725 4.231 ( 2.489 3.709 0.024) 4.467 4.456 ( 4.760 -3.467 0.101) 5.890 4.521 ( -5.315 -1.505 3.829) 6.721 4.582 ( -0.658 -2.318 -1.009) 2.612 4.688 ( 9.195 -4.052 -5.432) 11.422 4.965 ( -3.015 -3.618 4.749) 6.689 4.983 ( 2.119 -2.761 -1.267) 3.704 5.177 ( -2.477 0.897 1.002) 2.818 5.298 ( 0.210 0.743 -4.953) 5.013 5.443 ( -2.418 -2.993 4.214) 5.706 5.639 ( -0.454 -3.175 0.360) 3.228 5.724 ( -1.739 -2.804 -2.909) 4.399 5.819 ( 2.354 -3.815 1.658) 4.779 6.016 ( 4.760 -1.947 1.192) 5.279 6.063 ( -1.100 4.213 -1.549) 4.621 6.201 ( 5.317 4.074 0.529) 6.719 6.432 ( 2.595 2.084 -1.357) 3.594 6.477 ( -3.052 0.203 -0.000) 3.059 6.505 ( -4.265 8.440 1.272) 9.541 6.585 ( -1.098 -4.856 -3.937) 6.347 6.641 ( -5.429 6.354 5.961) 10.266 6.795 ( -1.598 1.096 -2.123) 2.874 6.891 ( -0.707 7.449 1.383) 7.609 7.103 ( 1.159 -0.355 -3.361) 3.573 7.159 ( -0.104 5.663 1.624) 5.892 7.240 ( -3.859 1.630 -2.128) 4.699 7.402 ( -1.784 3.496 2.817) 4.831 7.878 ( -1.469 0.655 -1.475) 2.182 7.964 ( -4.522 -2.550 2.121) 5.608 8.144 ( -2.250 -4.815 -0.812) 5.376 8.256 ( -0.555 8.177 2.609) 8.601 8.407 ( 3.784 3.410 -4.023) 6.491 8.751 ( 0.950 -2.994 -2.277) 3.879 8.930 ( -2.005 -1.770 4.377) 5.130 9.126 ( 0.153 -1.937 2.033) 2.812 9.206 ( 8.499 -3.749 1.107) 9.354 9.380 ( -2.291 -0.845 -3.555) 4.312 9.753 ( 7.530 2.864 -1.590) 8.212 9.995 ( -0.208 4.074 0.080) 4.080 10.294 ( 2.832 -0.313 1.631) 3.283 10.612 ( -2.168 -2.847 -3.153) 4.769 10.684 ( -3.847 2.050 0.887) 4.449 10.873 ( 1.297 -2.686 1.959) 3.568 10.991 ( -0.355 1.035 0.285) 1.131 11.110 ( -5.596 1.117 0.175) 5.709 11.181 ( 0.690 4.235 -0.676) 4.343 11.418 ( 5.501 2.407 1.546) 6.200 11.532 ( 6.115 11.404 -1.567) 13.035 11.617 ( 5.012 2.545 0.060) 5.622 12.005 ( -1.604 0.914 0.476) 1.907 12.044 ( -1.124 -1.034 -0.799) 1.724 12.475 ( 1.343 4.586 0.499) 4.805 12.508 ( 1.557 2.408 -0.257) 2.879 13.059 ( -0.595 -1.733 -0.658) 1.947 13.167 ( -1.494 -0.971 1.272) 2.190 13.203 ( 1.051 1.165 -1.437) 2.128 13.478 ( -1.961 -2.237 0.937) 3.119 15.853 ( -2.784 0.250 -0.745) 2.893 15.935 ( -1.781 -2.111 0.584) 2.823 17.544 ( 5.775 -2.536 -0.065) 6.307 17.756 ( -7.103 -3.937 0.438) 8.133 18.080 ( 1.659 -0.509 1.584) 2.350 18.207 ( -1.880 4.116 -3.664) 5.823 18.456 ( 5.174 3.224 1.506) 6.280 18.961 ( -2.556 8.025 1.894) 8.632 19.096 ( 5.275 1.834 -1.296) 5.733 19.332 ( -0.459 8.707 -0.209) 8.722 19.502 ( 4.445 -5.488 -0.491) 7.080 19.802 ( -13.259 -8.082 0.222) 15.529 21.336 ( 12.443 5.796 0.364) 13.731 21.684 ( -5.799 1.671 -0.214) 6.039 21.938 ( -0.677 -0.949 0.232) 1.188 22.062 ( 0.974 -0.472 -2.092) 2.355 22.149 ( -1.034 -0.622 1.401) 1.848 22.455 ( -0.623 -1.078 1.132) 1.683 22.863 ( 0.973 2.192 -1.496) 2.826 22.907 ( 0.467 -3.518 0.360) 3.567 23.189 ( -2.608 -3.524 0.645) 4.431 23.309 ( 0.272 -5.689 -0.231) 5.700 ======================= Grid point 30 (23/102) ======================= q-point: (-0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.526 ( -0.471 6.601 -0.423) 6.632 1.748 ( -1.975 20.041 1.211) 20.174 1.905 ( -1.927 9.316 -0.976) 9.563 2.054 ( 0.575 8.362 0.695) 8.411 2.271 ( -0.696 7.762 1.360) 7.911 2.293 ( -0.637 -9.935 -1.120) 10.018 2.632 ( 1.638 -3.205 3.351) 4.918 2.688 ( -2.733 2.507 -3.151) 4.866 2.867 ( -1.253 8.901 4.905) 10.240 2.903 ( 2.668 12.418 -4.853) 13.597 2.997 ( 3.014 -0.584 -4.639) 5.563 3.079 ( -6.429 0.629 3.839) 7.514 3.293 ( 1.578 1.249 -0.240) 2.027 3.360 ( -3.719 2.146 0.632) 4.340 3.424 ( 1.778 -0.566 -0.494) 1.930 3.480 ( -3.815 1.029 0.376) 3.969 3.542 ( 0.289 -3.559 -0.438) 3.597 3.575 ( 1.546 1.000 -0.514) 1.912 3.614 ( -2.397 -7.618 0.220) 7.990 3.829 ( 3.566 -0.221 5.876) 6.877 3.891 ( 2.508 -2.232 -7.435) 8.158 3.994 ( 0.291 1.400 0.889) 1.684 4.069 ( -2.729 -5.925 -1.160) 6.625 4.191 ( -0.434 0.475 1.814) 1.924 4.436 ( -0.303 4.097 0.735) 4.174 4.567 ( 2.497 -2.380 -3.090) 4.631 4.593 ( -3.303 -1.198 5.481) 6.511 4.811 ( 8.937 -0.724 -3.834) 9.751 4.953 ( -8.545 0.888 2.125) 8.850 5.095 ( 1.404 -7.174 -2.333) 7.673 5.199 ( 5.293 -2.902 0.309) 6.045 5.311 ( 0.809 -3.965 -2.439) 4.725 5.478 ( -4.951 -2.514 4.230) 6.981 5.664 ( 0.717 1.111 -0.654) 1.475 5.778 ( -0.488 -4.234 0.029) 4.262 5.840 ( 5.515 5.429 0.233) 7.742 5.989 ( -2.868 2.217 0.509) 3.661 5.998 ( -4.829 3.318 0.583) 5.888 6.155 ( 6.135 6.513 -2.066) 9.183 6.288 ( -3.584 8.801 0.627) 9.523 6.381 ( -1.760 3.114 -0.480) 3.609 6.529 ( 3.910 -4.790 -2.271) 6.587 6.554 ( -1.579 2.542 4.105) 5.080 6.631 ( -0.326 -0.929 -0.678) 1.195 6.753 ( -7.643 0.050 -0.482) 7.658 6.776 ( -0.835 0.742 -0.230) 1.140 7.063 ( 0.057 2.927 -0.866) 3.053 7.115 ( -1.562 0.059 0.197) 1.575 7.260 ( -1.675 -4.699 0.026) 4.989 7.315 ( -0.929 5.188 0.920) 5.350 7.868 ( -1.407 -1.301 -0.414) 1.960 8.023 ( -0.947 -5.480 0.023) 5.561 8.131 ( -0.698 4.890 0.720) 4.992 8.272 ( -0.063 -8.991 1.012) 9.048 8.383 ( 1.767 1.335 -1.230) 2.534 8.787 ( 1.090 -0.550 -2.574) 2.848 8.987 ( 0.701 -3.659 1.904) 4.184 9.182 ( 0.261 -3.555 1.272) 3.784 9.324 ( 3.406 -2.867 3.663) 5.765 9.387 ( 0.466 -1.691 -4.379) 4.717 9.735 ( 3.953 3.504 -0.995) 5.375 9.924 ( -1.593 2.621 0.305) 3.083 10.317 ( 4.538 1.308 0.735) 4.780 10.565 ( -5.756 6.524 0.037) 8.700 10.641 ( -1.852 -2.589 -0.447) 3.215 10.894 ( 0.698 1.809 1.542) 2.477 10.964 ( 0.277 1.146 -1.971) 2.296 11.073 ( -3.356 -0.351 1.210) 3.585 11.125 ( -0.965 1.671 -0.506) 1.995 11.371 ( 1.702 7.696 -0.107) 7.883 11.453 ( 4.279 -1.212 -0.039) 4.447 11.619 ( 1.490 0.735 0.135) 1.667 12.009 ( -0.977 -2.079 0.320) 2.319 12.075 ( 0.312 -3.116 -0.766) 3.224 12.410 ( 0.186 3.658 0.470) 3.693 12.480 ( 0.431 1.467 -0.147) 1.536 13.018 ( -0.611 3.946 0.154) 3.996 13.115 ( -0.115 3.302 -0.231) 3.312 13.292 ( -0.242 -7.327 -0.320) 7.338 13.560 ( 0.347 -6.413 0.416) 6.435 15.831 ( -1.849 0.167 0.102) 1.859 15.970 ( -0.426 -2.530 -0.145) 2.569 17.638 ( 7.909 -2.160 -0.512) 8.215 17.784 ( -8.152 -5.144 1.303) 9.727 18.046 ( 0.587 5.855 0.303) 5.892 18.111 ( -0.750 5.451 -1.951) 5.838 18.513 ( 3.928 -6.059 1.503) 7.376 18.826 ( -3.431 3.029 -0.990) 4.683 19.128 ( 4.863 -0.461 0.415) 4.902 19.207 ( -4.243 2.781 0.134) 5.075 19.677 ( 8.160 -7.981 -0.490) 11.424 19.873 ( -10.260 -9.492 0.312) 13.981 21.304 ( 10.594 7.405 0.012) 12.925 21.530 ( -8.671 8.237 -0.122) 11.960 21.992 ( 0.180 -3.422 0.438) 3.454 22.044 ( 0.177 2.460 -0.252) 2.479 22.143 ( -0.525 0.430 0.120) 0.689 22.502 ( 0.582 -3.933 -0.581) 4.018 22.767 ( -0.639 6.687 0.616) 6.746 22.997 ( 1.012 -4.208 -0.433) 4.350 23.226 ( -0.631 -1.728 0.189) 1.850 23.407 ( 1.139 -4.697 0.018) 4.833 ======================= Grid point 31 (24/102) ======================= q-point: (-0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.361 ( 0.000 12.726 0.000) 12.726 1.368 ( 0.000 19.170 0.000) 19.170 1.712 ( 0.000 10.471 0.000) 10.471 1.902 ( 0.000 7.952 0.000) 7.952 2.119 ( 0.000 8.738 0.000) 8.738 2.404 ( 0.000 7.588 0.000) 7.588 2.531 ( 0.000 15.840 0.000) 15.840 2.560 ( -0.000 -4.290 -0.000) 4.290 2.642 ( 0.000 18.384 0.000) 18.384 2.818 ( -0.000 -1.177 -0.000) 1.177 2.986 ( 0.000 3.279 0.000) 3.279 3.039 ( 0.000 2.310 0.000) 2.310 3.252 ( 0.000 4.301 0.000) 4.301 3.331 ( -0.000 -1.060 -0.000) 1.060 3.422 ( -0.000 -1.194 -0.000) 1.194 3.469 ( -0.000 -1.969 -0.000) 1.969 3.528 ( 0.000 4.179 0.000) 4.179 3.637 ( 0.000 8.738 0.000) 8.738 3.680 ( -0.000 -9.065 -0.000) 9.065 3.828 ( -0.000 -3.370 -0.000) 3.370 3.976 ( -0.000 -5.343 -0.000) 5.343 4.015 ( -0.000 -2.528 -0.000) 2.528 4.126 ( -0.000 -0.477 -0.000) 0.477 4.221 ( -0.000 -3.263 -0.000) 3.263 4.406 ( -0.000 -1.417 -0.000) 1.417 4.587 ( 0.000 1.948 0.000) 1.948 4.604 ( -0.000 -1.551 -0.000) 1.551 4.862 ( -0.000 -1.557 -0.000) 1.557 4.900 ( -0.000 -1.235 -0.000) 1.235 5.125 ( 0.000 2.107 0.000) 2.107 5.311 ( -0.000 -4.150 -0.000) 4.150 5.462 ( -0.000 -8.779 -0.000) 8.779 5.482 ( -0.000 -0.000 -0.000) 0.000 5.601 ( 0.000 3.371 0.000) 3.371 5.764 ( 0.000 5.329 0.000) 5.329 5.827 ( 0.000 0.717 0.000) 0.717 5.871 ( 0.000 1.464 0.000) 1.464 5.990 ( 0.000 1.482 0.000) 1.482 6.054 ( 0.000 4.855 0.000) 4.855 6.163 ( 0.000 1.267 0.000) 1.267 6.350 ( 0.000 0.432 0.000) 0.432 6.500 ( 0.000 2.282 0.000) 2.282 6.630 ( 0.000 0.188 0.000) 0.188 6.677 ( -0.000 -3.133 -0.000) 3.133 6.714 ( -0.000 -5.793 -0.000) 5.793 6.828 ( -0.000 -3.665 -0.000) 3.665 7.013 ( 0.000 2.731 0.000) 2.731 7.146 ( -0.000 -4.601 -0.000) 4.601 7.218 ( 0.000 4.951 0.000) 4.951 7.348 ( -0.000 -5.593 -0.000) 5.593 7.889 ( -0.000 -1.248 -0.000) 1.248 8.081 ( 0.000 0.285 0.000) 0.285 8.127 ( -0.000 -5.672 -0.000) 5.672 8.370 ( 0.000 0.735 0.000) 0.735 8.432 ( -0.000 -8.125 -0.000) 8.125 8.788 ( 0.000 0.045 0.000) 0.045 9.051 ( -0.000 -2.607 -0.000) 2.607 9.238 ( -0.000 -0.899 -0.000) 0.899 9.352 ( 0.000 0.349 0.000) 0.349 9.431 ( -0.000 -2.425 -0.000) 2.425 9.689 ( 0.000 2.727 0.000) 2.727 9.893 ( 0.000 0.499 0.000) 0.499 10.307 ( 0.000 1.753 0.000) 1.753 10.408 ( 0.000 6.864 0.000) 6.864 10.681 ( -0.000 -1.856 -0.000) 1.856 10.856 ( 0.000 0.901 0.000) 0.901 10.933 ( 0.000 2.747 0.000) 2.747 11.070 ( 0.000 0.252 0.000) 0.252 11.116 ( -0.000 -1.683 -0.000) 1.683 11.298 ( 0.000 1.338 0.000) 1.338 11.500 ( -0.000 -1.271 -0.000) 1.271 11.612 ( 0.000 0.068 0.000) 0.068 12.061 ( -0.000 -4.138 -0.000) 4.138 12.153 ( -0.000 -5.171 -0.000) 5.171 12.349 ( 0.000 3.060 0.000) 3.060 12.458 ( 0.000 1.327 0.000) 1.327 12.949 ( 0.000 3.187 0.000) 3.187 13.058 ( 0.000 2.804 0.000) 2.804 13.435 ( -0.000 -8.529 -0.000) 8.529 13.685 ( -0.000 -6.902 -0.000) 6.902 15.821 ( 0.000 0.163 0.000) 0.163 16.015 ( -0.000 -2.601 -0.000) 2.601 17.686 ( 0.000 1.989 0.000) 1.989 17.851 ( -0.000 -5.749 -0.000) 5.749 17.908 ( 0.000 8.029 0.000) 8.029 17.991 ( 0.000 6.448 0.000) 6.448 18.715 ( -0.000 -13.327 -0.000) 13.327 18.825 ( -0.000 -4.627 -0.000) 4.627 19.122 ( 0.000 1.889 0.000) 1.889 19.227 ( -0.000 -5.457 -0.000) 5.457 19.869 ( -0.000 -9.200 -0.000) 9.200 20.007 ( -0.000 -10.301 -0.000) 10.301 21.219 ( 0.000 8.200 0.000) 8.200 21.290 ( 0.000 13.124 0.000) 13.124 21.986 ( 0.000 3.890 0.000) 3.890 22.005 ( 0.000 2.879 0.000) 2.879 22.160 ( -0.000 -3.009 -0.000) 3.009 22.587 ( -0.000 -4.967 -0.000) 4.967 22.635 ( 0.000 7.468 0.000) 7.468 23.062 ( -0.000 -2.543 -0.000) 2.543 23.238 ( 0.000 0.324 0.000) 0.324 23.491 ( -0.000 -4.023 -0.000) 4.023 ======================= Grid point 36 (25/102) ======================= q-point: ( 0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.082 ( 24.415 0.000 -2.360) 24.529 1.218 ( 24.368 0.000 -2.830) 24.532 1.515 ( 14.826 0.000 -3.055) 15.138 1.675 ( 15.597 0.000 2.769) 15.841 2.157 ( 4.166 0.000 8.436) 9.408 2.174 ( 27.710 0.000 2.491) 27.821 2.416 ( 4.020 0.000 1.193) 4.193 2.490 ( 6.358 0.000 -2.973) 7.019 2.564 ( 1.799 0.000 -0.941) 2.030 2.672 ( 7.138 0.000 -7.701) 10.500 2.810 ( 0.815 0.000 2.932) 3.043 2.991 ( 11.422 0.000 -6.781) 13.283 3.059 ( -0.212 -0.000 3.668) 3.674 3.205 ( -5.132 -0.000 5.582) 7.583 3.399 ( -3.537 -0.000 6.014) 6.977 3.464 ( -5.139 -0.000 -5.619) 7.615 3.506 ( -0.012 -0.000 4.718) 4.718 3.651 ( -2.485 -0.000 -1.721) 3.023 3.772 ( -4.293 -0.000 3.346) 5.443 3.880 ( 0.082 0.000 -3.727) 3.728 3.947 ( 2.186 0.000 -8.256) 8.540 4.006 ( 2.469 0.000 -5.541) 6.067 4.277 ( -0.321 -0.000 -2.854) 2.872 4.301 ( 5.828 0.000 2.125) 6.203 4.430 ( -14.303 -0.000 10.025) 17.467 4.445 ( 4.620 0.000 4.566) 6.496 4.803 ( 2.241 0.000 -10.503) 10.739 4.905 ( -9.974 -0.000 10.163) 14.240 5.043 ( -0.150 -0.000 -4.462) 4.465 5.156 ( -6.408 -0.000 4.203) 7.663 5.160 ( -8.207 -0.000 0.592) 8.229 5.277 ( 8.893 0.000 -3.883) 9.704 5.537 ( -8.760 -0.000 -0.286) 8.764 5.601 ( -6.427 -0.000 0.150) 6.429 5.667 ( -7.704 -0.000 -6.121) 9.840 5.831 ( -11.143 -0.000 2.759) 11.480 5.838 ( -9.385 -0.000 -2.387) 9.684 5.971 ( -6.641 -0.000 6.559) 9.334 6.033 ( -0.780 -0.000 1.461) 1.656 6.246 ( -0.815 -0.000 3.872) 3.957 6.267 ( -2.177 -0.000 -5.860) 6.251 6.275 ( 7.258 0.000 -3.194) 7.929 6.544 ( -1.633 -0.000 -2.155) 2.704 6.615 ( -3.890 -0.000 0.649) 3.944 6.996 ( 6.091 0.000 5.083) 7.933 7.095 ( 5.680 0.000 -3.946) 6.916 7.111 ( 3.934 0.000 1.669) 4.274 7.331 ( 5.121 0.000 1.046) 5.227 7.712 ( 12.210 0.000 -9.088) 15.221 7.944 ( 2.092 0.000 -2.483) 3.247 8.168 ( 0.264 0.000 0.445) 0.517 8.255 ( -4.544 -0.000 -6.402) 7.851 8.313 ( -6.300 -0.000 13.828) 15.196 8.359 ( 1.905 0.000 7.243) 7.489 8.712 ( -3.758 -0.000 -6.310) 7.345 8.718 ( -6.603 -0.000 4.065) 7.754 9.045 ( 8.043 0.000 -3.958) 8.964 9.052 ( -3.173 -0.000 6.626) 7.347 9.451 ( 12.356 0.000 -6.697) 14.055 9.871 ( -4.396 -0.000 7.102) 8.353 10.054 ( 10.239 0.000 -8.565) 13.349 10.124 ( -13.413 -0.000 -5.788) 14.608 10.147 ( -5.806 -0.000 9.649) 11.261 10.571 ( -2.379 -0.000 3.427) 4.172 10.572 ( -0.035 -0.000 5.132) 5.132 10.629 ( 5.777 0.000 -12.292) 13.582 11.103 ( 3.940 0.000 -4.615) 6.068 11.108 ( 4.257 0.000 -0.409) 4.276 11.210 ( 10.886 0.000 -5.650) 12.265 11.432 ( 6.047 0.000 5.268) 8.020 11.609 ( 7.432 0.000 3.006) 8.017 11.831 ( -3.448 -0.000 -0.300) 3.461 12.062 ( -2.566 -0.000 -0.844) 2.701 12.154 ( -4.620 -0.000 1.107) 4.751 12.759 ( 0.765 0.000 1.014) 1.270 12.780 ( -3.538 -0.000 -0.899) 3.650 13.254 ( 14.546 0.000 1.983) 14.681 13.445 ( 8.432 0.000 -4.053) 9.355 13.733 ( -2.074 -0.000 0.744) 2.203 13.757 ( -4.214 -0.000 -0.184) 4.218 15.951 ( -10.337 -0.000 -9.139) 13.798 16.105 ( -14.762 -0.000 7.611) 16.608 17.523 ( 13.308 0.000 1.515) 13.394 17.651 ( 7.333 0.000 -2.498) 7.747 18.160 ( 8.131 0.000 1.537) 8.275 18.385 ( 4.747 0.000 -6.084) 7.716 18.821 ( -13.027 -0.000 5.444) 14.119 18.910 ( -11.924 -0.000 -2.621) 12.209 19.812 ( 0.068 0.000 -3.304) 3.305 19.889 ( -3.157 -0.000 2.538) 4.051 20.240 ( 0.247 0.000 3.430) 3.439 20.720 ( 5.767 0.000 4.182) 7.124 20.749 ( 8.766 0.000 -2.339) 9.073 21.477 ( 14.187 0.000 -33.759) 36.619 21.735 ( -7.971 -0.000 18.624) 20.259 21.903 ( 1.588 0.000 3.927) 4.236 22.010 ( 7.158 0.000 -0.457) 7.173 22.373 ( 2.738 0.000 -0.894) 2.880 22.378 ( -0.739 -0.000 2.217) 2.337 22.667 ( -6.146 -0.000 3.221) 6.939 22.863 ( -5.411 -0.000 -0.742) 5.462 22.881 ( -6.681 -0.000 0.136) 6.683 ======================= Grid point 37 (26/102) ======================= q-point: ( 0.36 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.258 ( 15.421 -2.280 1.369) 15.648 1.470 ( 22.152 -7.933 -3.063) 23.728 1.552 ( 10.338 4.017 2.854) 11.452 1.892 ( 13.502 -8.246 -1.028) 15.854 2.188 ( 8.635 0.632 0.861) 8.701 2.305 ( 7.025 3.524 -3.759) 8.712 2.405 ( 0.874 -0.648 0.572) 1.229 2.540 ( 5.417 -2.723 -0.843) 6.122 2.663 ( 0.769 -6.846 1.785) 7.117 2.782 ( 6.750 -6.725 -4.844) 10.689 2.819 ( 4.456 1.607 3.939) 6.161 3.070 ( 4.454 -1.643 1.322) 4.928 3.085 ( 1.100 -1.838 1.866) 2.841 3.203 ( 0.178 -2.116 2.490) 3.272 3.374 ( -4.541 0.508 6.752) 8.153 3.410 ( -4.148 0.279 -5.105) 6.584 3.556 ( -2.781 -1.808 1.823) 3.784 3.617 ( 4.109 1.700 -3.978) 5.967 3.755 ( -4.512 -0.762 3.206) 5.587 3.873 ( 2.337 0.140 -3.984) 4.622 3.906 ( -1.721 3.774 -2.004) 4.606 4.064 ( 8.350 -4.166 -8.693) 12.753 4.192 ( -1.408 5.609 0.990) 5.867 4.305 ( -0.288 3.156 2.313) 3.923 4.358 ( -3.119 -0.432 4.076) 5.151 4.540 ( 2.363 -2.578 2.775) 4.464 4.756 ( 0.634 5.905 -5.777) 8.285 4.855 ( -8.020 1.993 9.363) 12.488 4.928 ( -2.643 3.169 -1.869) 4.530 5.063 ( -2.584 6.627 2.806) 7.647 5.188 ( -3.312 -4.461 -3.163) 6.394 5.357 ( -0.362 -0.357 -0.802) 0.950 5.448 ( -2.063 0.474 -2.974) 3.651 5.521 ( -7.610 2.711 4.827) 9.411 5.584 ( -8.708 0.103 -7.439) 11.453 5.703 ( -10.350 2.592 2.726) 11.012 5.753 ( -2.118 2.683 -0.675) 3.484 5.989 ( -4.417 -5.171 1.912) 7.065 6.127 ( -1.281 -7.490 0.246) 7.603 6.221 ( -4.575 -0.944 3.141) 5.629 6.292 ( -4.003 -4.572 -3.698) 7.113 6.367 ( 4.851 -4.141 -1.576) 6.570 6.554 ( 3.551 -0.055 -1.714) 3.944 6.603 ( -2.569 -1.873 0.630) 3.241 7.036 ( 5.443 1.537 5.027) 7.567 7.104 ( 3.771 1.199 -2.650) 4.763 7.173 ( 4.916 -1.284 -1.653) 5.343 7.367 ( 2.457 -0.289 2.806) 3.741 7.724 ( 5.495 4.537 -5.829) 9.206 7.947 ( -5.614 -0.877 1.597) 5.903 8.124 ( -0.560 4.942 -4.049) 6.414 8.232 ( 2.841 2.772 2.353) 4.614 8.271 ( -1.935 -1.904 3.216) 4.209 8.425 ( 1.746 -2.419 5.496) 6.253 8.606 ( -4.045 3.950 -0.914) 5.727 8.679 ( -5.442 2.978 -0.414) 6.217 9.048 ( 0.704 2.323 2.426) 3.432 9.055 ( -0.503 -0.337 -1.326) 1.458 9.528 ( 9.765 0.385 -7.281) 12.187 9.751 ( -8.877 6.727 2.879) 11.504 9.939 ( -8.893 7.705 0.092) 11.767 10.121 ( 10.248 -0.806 -6.814) 12.333 10.172 ( 1.800 0.160 6.144) 6.404 10.479 ( 0.790 5.069 0.587) 5.163 10.590 ( -2.121 -0.496 3.122) 3.807 10.675 ( 6.363 -0.986 -3.949) 7.553 11.034 ( 5.404 4.095 -0.506) 6.799 11.161 ( 4.443 2.171 -3.111) 5.842 11.362 ( 8.180 -7.913 -0.475) 11.391 11.562 ( 5.794 -5.741 2.339) 8.486 11.648 ( 6.339 1.744 2.442) 7.014 11.778 ( -5.547 1.216 -1.878) 5.981 12.053 ( -1.268 -0.497 -1.210) 1.822 12.136 ( -2.491 -0.465 1.250) 2.826 12.750 ( -1.934 -0.946 -0.535) 2.218 12.798 ( -1.122 -3.070 0.393) 3.293 13.206 ( 11.107 14.467 0.645) 18.251 13.387 ( 11.135 12.814 -0.686) 16.990 13.665 ( -5.922 2.042 -0.169) 6.266 13.735 ( -2.918 2.733 0.251) 4.006 15.851 ( -9.385 0.192 -3.492) 10.015 16.027 ( -14.074 -1.260 3.058) 14.457 17.517 ( 11.396 8.393 0.458) 14.160 17.728 ( 5.405 -1.488 -0.912) 5.680 18.060 ( 13.320 7.988 0.476) 15.538 18.552 ( 0.563 -4.295 -2.654) 5.080 18.740 ( -8.377 1.757 1.944) 8.778 18.935 ( -14.632 -14.233 -0.072) 20.412 19.655 ( -3.619 13.005 -1.982) 13.644 19.768 ( -1.450 10.261 1.621) 10.489 20.104 ( 0.817 14.669 -0.653) 14.706 20.608 ( 8.018 16.001 3.575) 18.251 20.939 ( 5.773 -11.516 -0.751) 12.904 21.418 ( 13.989 3.555 -12.311) 18.971 21.743 ( -1.406 -6.016 8.360) 10.395 21.916 ( 2.422 0.518 1.154) 2.733 22.322 ( 0.717 -1.163 -4.369) 4.577 22.384 ( -2.181 -14.299 -3.000) 14.772 22.419 ( 0.404 -4.847 3.430) 5.952 22.644 ( -5.735 -1.821 3.321) 6.873 22.841 ( -5.206 -2.393 -1.325) 5.881 22.892 ( -6.201 -5.821 1.215) 8.591 ======================= Grid point 38 (27/102) ======================= q-point: ( 0.45 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.375 ( 1.431 -3.312 4.717) 5.939 1.579 ( 7.775 -1.964 4.171) 9.039 1.810 ( 20.605 -10.600 -2.858) 23.347 2.076 ( 8.109 -3.469 -4.281) 9.803 2.197 ( 0.416 6.271 -8.984) 10.964 2.291 ( 9.450 -2.551 -1.529) 9.907 2.480 ( 2.859 -5.097 1.443) 6.019 2.636 ( -1.202 -5.775 1.722) 6.145 2.756 ( 0.889 -0.244 4.047) 4.151 2.834 ( -2.153 -2.709 4.058) 5.333 2.947 ( 2.157 -5.223 2.932) 6.366 3.100 ( -0.705 -2.554 -0.472) 2.692 3.167 ( 3.570 -3.725 -0.286) 5.167 3.250 ( -3.192 -1.872 1.358) 3.942 3.355 ( 1.795 0.571 0.993) 2.129 3.418 ( 0.730 -3.877 -2.791) 4.832 3.499 ( 1.641 3.284 -1.633) 4.018 3.656 ( -4.050 -3.530 0.170) 5.375 3.728 ( -3.699 0.299 -1.074) 3.863 3.796 ( -2.768 3.105 -2.138) 4.677 3.949 ( 8.960 -0.771 -0.184) 8.995 4.077 ( -2.125 4.135 -0.231) 4.655 4.132 ( -5.026 -0.545 1.983) 5.431 4.315 ( 9.550 -0.139 -3.471) 10.162 4.414 ( 10.452 -2.255 -0.636) 10.711 4.502 ( 2.498 10.120 1.668) 10.557 4.596 ( -8.079 4.973 0.275) 9.491 4.786 ( -6.035 -0.163 5.251) 8.001 4.879 ( -4.342 5.884 0.967) 7.376 4.950 ( 4.260 2.299 -0.206) 4.845 5.198 ( -6.154 -0.189 1.661) 6.377 5.286 ( -7.020 0.230 -7.511) 10.284 5.443 ( -4.891 -1.550 0.642) 5.171 5.486 ( 4.213 1.386 1.268) 4.613 5.526 ( -7.822 -1.731 -1.323) 8.119 5.638 ( -9.532 -2.974 3.383) 10.543 5.766 ( 6.260 -2.851 -1.800) 7.110 6.072 ( -2.057 -5.308 0.957) 5.772 6.171 ( -3.631 -1.285 -2.601) 4.647 6.284 ( -6.842 -7.260 2.215) 10.218 6.351 ( -2.337 -6.867 -1.294) 7.369 6.461 ( 2.417 -2.731 -0.705) 3.714 6.577 ( 5.087 0.892 -1.032) 5.267 6.655 ( 1.511 -4.158 -0.103) 4.425 7.043 ( 5.497 3.429 4.493) 7.885 7.092 ( 1.655 1.818 -2.198) 3.297 7.196 ( 3.115 1.765 -3.033) 4.692 7.389 ( 1.518 0.079 3.387) 3.713 7.618 ( -1.423 7.784 -1.577) 8.068 7.853 ( -4.723 7.994 1.674) 9.434 8.026 ( -0.145 3.720 -3.473) 5.091 8.161 ( 1.192 6.612 4.776) 8.243 8.356 ( 1.242 -2.789 -2.035) 3.669 8.474 ( 0.593 -0.753 -1.237) 1.565 8.504 ( -4.028 5.289 2.579) 7.131 8.583 ( -6.026 -1.469 1.465) 6.373 8.981 ( 0.374 4.991 2.161) 5.452 9.082 ( 1.216 -2.459 -2.045) 3.421 9.432 ( -1.163 11.605 -3.783) 12.261 9.654 ( -0.913 5.040 -2.453) 5.679 9.737 ( -2.844 4.291 1.599) 5.391 10.170 ( 3.709 2.635 2.447) 5.166 10.211 ( 6.593 -1.717 -2.751) 7.348 10.446 ( 1.261 -0.481 -0.900) 1.622 10.607 ( -0.572 -1.866 4.970) 5.339 10.725 ( 5.489 -0.548 -2.419) 6.023 11.015 ( 3.845 2.217 0.193) 4.442 11.142 ( 1.616 1.877 -0.448) 2.517 11.539 ( 6.083 -4.872 0.895) 7.844 11.606 ( 0.576 3.913 -0.593) 4.000 11.665 ( 6.658 3.500 -2.329) 7.875 11.772 ( 2.756 -3.459 1.888) 4.809 12.048 ( -1.502 -0.230 -0.605) 1.636 12.128 ( -2.378 -0.110 0.559) 2.445 12.779 ( -0.540 -3.281 -1.282) 3.564 12.866 ( 0.179 -4.837 1.088) 4.961 12.985 ( 8.292 16.868 0.552) 18.804 13.160 ( 8.653 19.652 0.130) 21.473 13.568 ( -6.144 4.714 -0.525) 7.761 13.634 ( -3.572 4.287 0.505) 5.602 15.804 ( -7.038 -2.138 -0.921) 7.413 15.953 ( -10.143 -0.314 0.583) 10.164 17.471 ( 9.264 4.696 0.080) 10.387 17.748 ( -0.809 0.859 -0.318) 1.222 18.073 ( 13.054 3.664 0.648) 13.574 18.544 ( 0.356 3.750 -2.550) 4.549 18.649 ( -4.790 2.209 2.146) 5.694 19.088 ( -12.534 -11.124 0.737) 16.775 19.404 ( -3.580 9.080 -0.924) 9.804 19.561 ( -0.757 10.805 2.885) 11.209 19.811 ( 0.989 16.375 -5.257) 17.226 20.324 ( 5.781 21.001 2.650) 21.943 21.195 ( 4.902 -11.503 0.715) 12.524 21.500 ( 11.440 -1.615 -4.461) 12.385 21.885 ( -0.127 -7.627 2.656) 8.077 21.936 ( 1.314 -1.189 2.442) 3.017 22.234 ( -0.878 5.850 -2.122) 6.285 22.492 ( -0.178 -3.100 5.902) 6.669 22.563 ( 1.375 -3.408 -7.926) 8.736 22.741 ( -9.754 -13.915 2.433) 17.166 22.872 ( -2.038 -4.879 -2.634) 5.908 22.969 ( -5.557 -6.597 2.331) 8.935 ======================= Grid point 39 (28/102) ======================= q-point: ( 0.55 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.477 ( -0.171 -7.933 0.004) 7.935 1.723 ( 3.285 -7.286 4.020) 8.946 2.072 ( 5.037 5.510 -7.937) 10.896 2.088 ( 9.612 -3.779 3.326) 10.851 2.193 ( 3.029 -7.858 -4.097) 9.366 2.356 ( 1.969 -0.775 -0.578) 2.194 2.630 ( 1.742 -6.988 2.202) 7.531 2.686 ( 2.690 3.755 0.154) 4.622 2.746 ( -2.136 -2.281 5.175) 6.045 2.868 ( -0.785 -2.118 -1.502) 2.713 3.001 ( -3.462 -2.036 3.760) 5.502 3.134 ( -4.198 -2.785 -0.205) 5.042 3.247 ( -3.611 -4.623 2.557) 6.399 3.283 ( 1.657 -3.243 -0.200) 3.647 3.379 ( 7.169 1.342 -2.762) 7.798 3.454 ( 4.629 0.834 -5.420) 7.176 3.544 ( 3.245 -3.207 -0.022) 4.562 3.667 ( -6.773 -2.494 1.771) 7.432 3.706 ( -1.021 -0.567 -4.071) 4.235 3.755 ( -2.153 -1.172 0.354) 2.477 3.952 ( -2.632 3.776 5.094) 6.865 4.007 ( -2.520 3.757 1.678) 4.825 4.119 ( 4.476 1.058 -4.281) 6.284 4.283 ( -2.509 8.954 0.407) 9.308 4.396 ( 4.166 -1.236 -2.106) 4.829 4.452 ( -3.185 2.316 1.928) 4.385 4.527 ( 7.200 1.760 1.257) 7.518 4.727 ( -6.620 3.403 -3.101) 8.063 4.841 ( 4.199 -3.197 4.984) 7.259 4.961 ( 4.493 1.631 -0.523) 4.808 5.153 ( -7.739 -1.543 2.593) 8.307 5.261 ( 0.306 -2.433 -4.369) 5.010 5.462 ( -0.470 2.770 1.589) 3.227 5.484 ( -2.313 -4.480 -3.178) 5.960 5.536 ( -5.066 -6.142 -1.852) 8.175 5.658 ( -7.626 -4.313 5.073) 10.124 5.902 ( 10.441 -4.570 -1.126) 11.452 6.119 ( -2.303 -1.371 1.887) 3.278 6.172 ( -2.227 -2.320 -2.332) 3.972 6.351 ( -7.821 -6.519 -0.494) 10.194 6.470 ( 0.712 -5.489 0.171) 5.538 6.510 ( 2.464 -1.170 0.125) 2.730 6.570 ( 0.906 1.980 -0.899) 2.356 6.758 ( 3.141 -4.298 -1.270) 5.473 7.001 ( 4.104 6.943 3.607) 8.835 7.063 ( 1.391 1.781 -0.663) 2.355 7.151 ( 2.350 4.168 -3.036) 5.667 7.388 ( 0.437 6.522 1.241) 6.653 7.440 ( -5.651 3.716 2.205) 7.114 7.639 ( -1.384 12.370 -1.471) 12.533 7.961 ( 0.736 3.571 -1.821) 4.076 8.047 ( -0.419 6.990 4.726) 8.448 8.239 ( -6.328 8.215 -3.136) 10.834 8.440 ( 2.776 1.868 -2.398) 4.117 8.542 ( -1.653 -3.431 3.588) 5.232 8.597 ( -4.636 -2.431 1.585) 5.469 8.915 ( -1.604 1.876 2.405) 3.446 9.144 ( 7.171 -1.362 -3.132) 7.943 9.219 ( 0.052 8.976 -2.016) 9.200 9.461 ( -6.459 7.722 1.089) 10.126 9.774 ( 5.273 -1.848 -2.494) 6.119 10.137 ( 0.115 3.123 2.266) 3.860 10.264 ( 4.409 -0.287 -0.856) 4.501 10.489 ( 0.729 -3.332 -2.648) 4.319 10.657 ( -0.914 -2.406 4.029) 4.781 10.776 ( 5.811 -1.388 -1.493) 6.159 11.006 ( 1.141 1.011 0.944) 1.793 11.116 ( -2.662 0.630 0.520) 2.784 11.480 ( 0.383 8.604 -1.240) 8.701 11.591 ( 3.193 3.990 0.106) 5.112 11.680 ( 9.517 0.800 -1.235) 9.630 11.840 ( 5.098 1.207 1.696) 5.506 12.035 ( -1.985 0.126 -0.011) 1.989 12.094 ( -3.046 1.945 -0.265) 3.624 12.742 ( 5.907 12.480 0.049) 13.808 12.840 ( 4.561 12.712 0.076) 13.506 12.884 ( -1.944 0.333 -1.063) 2.241 12.982 ( 1.545 -6.097 1.179) 6.399 13.418 ( -4.055 6.728 -0.567) 7.876 13.542 ( -3.284 3.653 0.617) 4.951 15.810 ( -4.074 -2.997 -0.803) 5.121 15.898 ( -5.778 -0.151 0.491) 5.801 17.486 ( 7.423 0.763 -0.025) 7.462 17.701 ( -5.774 0.898 -0.023) 5.844 18.090 ( 7.410 3.084 1.207) 8.116 18.423 ( -1.316 7.812 -2.652) 8.354 18.608 ( 1.182 2.335 0.836) 2.747 19.143 ( -1.917 -2.511 3.499) 4.715 19.276 ( -0.800 6.290 0.844) 6.397 19.449 ( -2.575 -0.101 0.226) 2.587 19.549 ( -3.731 9.350 -5.927) 11.682 19.978 ( 1.717 20.788 1.898) 20.945 21.403 ( 6.625 -6.367 1.072) 9.251 21.583 ( 5.269 -1.247 -1.612) 5.649 21.976 ( 2.720 -2.798 -5.193) 6.496 22.002 ( -2.388 -3.083 6.421) 7.512 22.121 ( -2.319 3.808 -0.963) 4.561 22.487 ( -1.907 1.787 3.498) 4.367 22.674 ( 4.289 -6.508 -3.817) 8.679 22.870 ( -6.079 -6.733 0.604) 9.091 22.981 ( -0.950 -7.491 -1.561) 7.711 23.054 ( -4.111 -7.188 1.642) 8.442 ======================= Grid point 40 (29/102) ======================= q-point: ( 0.64 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.619 ( -0.031 -5.765 -1.647) 5.996 1.885 ( 2.822 -7.885 -0.187) 8.377 2.019 ( 1.496 1.264 -3.366) 3.894 2.154 ( -1.177 -0.420 7.346) 7.452 2.290 ( 0.751 1.021 -1.991) 2.361 2.378 ( 0.495 -1.114 -1.408) 1.863 2.603 ( 3.496 7.362 0.616) 8.173 2.743 ( 2.068 -6.698 2.521) 7.450 2.825 ( -4.891 -4.882 2.624) 7.392 2.887 ( -0.461 -0.676 -1.200) 1.452 3.020 ( 5.273 0.316 -4.696) 7.068 3.158 ( -6.925 -4.903 3.429) 9.151 3.313 ( -1.722 -0.704 -0.254) 1.878 3.348 ( 2.669 -5.638 1.901) 6.521 3.394 ( 6.761 1.492 -3.351) 7.692 3.463 ( 0.589 -1.004 -2.455) 2.716 3.555 ( -0.701 2.802 1.187) 3.123 3.607 ( -3.915 3.902 -2.376) 6.017 3.756 ( 2.382 1.484 0.387) 2.832 3.784 ( -2.297 0.731 1.011) 2.614 3.817 ( -4.585 2.304 2.382) 5.658 3.912 ( 3.285 5.117 1.105) 6.181 4.039 ( -8.022 0.395 -0.580) 8.052 4.282 ( 7.682 -1.096 -6.327) 10.012 4.389 ( -9.295 -2.784 6.607) 11.738 4.465 ( 5.373 -2.746 -1.052) 6.125 4.573 ( 1.515 0.336 1.021) 1.858 4.668 ( 1.312 -2.058 -3.060) 3.914 4.914 ( -0.645 -1.136 2.462) 2.787 4.964 ( 2.592 -0.427 -0.408) 2.659 5.142 ( -4.575 -1.737 1.409) 5.092 5.320 ( 4.760 0.125 -4.440) 6.510 5.415 ( -3.406 0.549 4.360) 5.560 5.554 ( -1.143 -5.647 -0.948) 5.839 5.647 ( 3.399 -5.620 -9.065) 11.194 5.697 ( -7.010 -6.661 8.636) 12.965 6.034 ( 7.054 -1.774 0.466) 7.288 6.101 ( -2.601 1.263 -0.476) 2.931 6.224 ( 2.248 -3.798 -0.367) 4.429 6.409 ( -5.054 -5.663 1.042) 7.662 6.489 ( 0.035 3.625 -1.696) 4.003 6.528 ( 1.554 0.222 -0.262) 1.592 6.563 ( -1.291 -0.340 -0.403) 1.395 6.800 ( -0.788 1.108 1.174) 1.797 6.840 ( 1.025 13.411 0.303) 13.454 7.061 ( 6.395 4.902 -1.611) 8.217 7.084 ( -0.620 2.052 2.057) 2.971 7.198 ( -6.383 4.353 -1.015) 7.792 7.397 ( 0.515 12.448 -1.697) 12.574 7.438 ( -0.676 1.062 2.045) 2.401 7.910 ( 2.001 2.426 -2.342) 3.921 7.942 ( -3.095 4.082 3.878) 6.424 8.087 ( -3.637 1.938 -1.687) 4.453 8.392 ( 0.757 5.395 -0.051) 5.448 8.500 ( 0.447 5.781 -1.402) 5.965 8.661 ( -1.937 -6.161 1.589) 6.651 8.897 ( -1.773 -0.687 1.823) 2.634 9.131 ( 0.869 1.701 -0.202) 1.920 9.225 ( 8.560 -1.384 -0.143) 8.673 9.337 ( -5.787 0.878 -1.232) 5.981 9.825 ( 4.119 0.020 -1.360) 4.338 10.071 ( -0.479 4.321 0.662) 4.398 10.294 ( 1.320 -0.936 0.870) 1.837 10.550 ( 1.023 -3.253 -2.800) 4.412 10.677 ( -2.325 -0.262 1.994) 3.074 10.847 ( 3.551 -2.187 -0.013) 4.171 11.000 ( -0.371 0.231 0.689) 0.816 11.084 ( -3.639 0.284 0.326) 3.665 11.316 ( 0.928 9.313 -0.769) 9.390 11.522 ( 2.482 5.240 0.150) 5.800 11.703 ( 5.485 3.151 0.511) 6.346 11.784 ( 3.722 9.460 -0.457) 10.176 12.013 ( -3.423 0.921 1.201) 3.743 12.031 ( -0.405 1.419 -1.289) 1.959 12.589 ( 1.153 7.508 0.296) 7.602 12.618 ( 2.150 9.529 -0.222) 9.771 12.968 ( -0.741 -6.121 -0.876) 6.227 13.106 ( 0.837 -5.431 1.075) 5.599 13.283 ( -1.033 5.921 -0.636) 6.044 13.464 ( -2.107 2.296 0.512) 3.158 15.830 ( -1.679 -1.231 -0.957) 2.291 15.884 ( -2.122 -1.747 0.808) 2.865 17.547 ( 6.668 -1.682 -0.111) 6.877 17.655 ( -7.128 -1.440 0.195) 7.275 18.093 ( 2.533 0.691 1.347) 2.951 18.273 ( -1.474 6.294 -2.322) 6.868 18.565 ( 2.124 4.231 0.405) 4.751 19.116 ( -0.476 8.857 6.823) 11.191 19.184 ( 4.398 3.562 -5.433) 7.845 19.442 ( -0.716 -1.520 -0.984) 1.947 19.481 ( -1.573 -2.166 -1.228) 2.945 19.658 ( -5.059 11.031 1.238) 12.199 21.506 ( 10.188 2.509 0.734) 10.518 21.623 ( -4.405 -3.145 -0.481) 5.434 21.957 ( -1.512 3.678 -0.253) 3.985 22.034 ( 0.837 -2.620 -1.622) 3.193 22.118 ( -0.913 -2.304 1.328) 2.812 22.453 ( -0.829 1.092 1.324) 1.906 22.806 ( 2.306 -5.968 -1.679) 6.614 22.908 ( -1.310 -0.300 0.426) 1.410 23.083 ( -2.136 -6.027 0.369) 6.405 23.182 ( -0.760 -8.055 -0.049) 8.091 ======================= Grid point 41 (30/102) ======================= q-point: (-0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.625 ( 0.000 3.975 0.000) 3.975 1.998 ( 0.000 3.115 0.000) 3.115 2.005 ( 0.000 2.241 0.000) 2.241 2.139 ( -0.000 -2.512 -0.000) 2.512 2.193 ( 0.000 7.143 0.000) 7.143 2.454 ( 0.000 8.249 0.000) 8.249 2.469 ( -0.000 -6.703 -0.000) 6.703 2.760 ( 0.000 4.296 0.000) 4.296 2.910 ( -0.000 -5.559 -0.000) 5.559 2.959 ( -0.000 -5.095 -0.000) 5.095 3.027 ( 0.000 0.917 0.000) 0.917 3.131 ( 0.000 6.668 0.000) 6.668 3.349 ( -0.000 -3.112 -0.000) 3.112 3.397 ( 0.000 7.207 0.000) 7.207 3.447 ( -0.000 -2.857 -0.000) 2.857 3.447 ( 0.000 1.056 0.000) 1.056 3.477 ( 0.000 2.241 0.000) 2.241 3.533 ( -0.000 -1.368 -0.000) 1.368 3.601 ( 0.000 2.775 0.000) 2.775 3.815 ( -0.000 -1.828 -0.000) 1.828 3.858 ( -0.000 -2.668 -0.000) 2.668 3.950 ( -0.000 -5.008 -0.000) 5.008 3.999 ( 0.000 0.336 0.000) 0.336 4.249 ( 0.000 4.469 0.000) 4.469 4.480 ( -0.000 -5.732 -0.000) 5.732 4.527 ( 0.000 2.639 0.000) 2.639 4.547 ( -0.000 -2.555 -0.000) 2.555 4.790 ( -0.000 -7.923 -0.000) 7.923 4.916 ( 0.000 0.083 0.000) 0.083 4.991 ( -0.000 -2.359 -0.000) 2.359 5.164 ( -0.000 -2.211 -0.000) 2.211 5.303 ( 0.000 1.389 0.000) 1.389 5.420 ( -0.000 -1.846 -0.000) 1.846 5.635 ( -0.000 -3.520 -0.000) 3.520 5.708 ( -0.000 -3.300 -0.000) 3.300 5.840 ( -0.000 -6.858 -0.000) 6.858 6.036 ( 0.000 3.780 0.000) 3.780 6.059 ( 0.000 2.656 0.000) 2.656 6.286 ( 0.000 1.673 0.000) 1.673 6.437 ( -0.000 -1.190 -0.000) 1.190 6.439 ( 0.000 6.265 0.000) 6.265 6.467 ( 0.000 5.417 0.000) 5.417 6.561 ( -0.000 -3.427 -0.000) 3.427 6.624 ( 0.000 6.737 0.000) 6.737 6.765 ( 0.000 2.263 0.000) 2.263 6.892 ( 0.000 10.783 0.000) 10.783 7.097 ( 0.000 0.788 0.000) 0.788 7.180 ( -0.000 -3.013 -0.000) 3.013 7.194 ( 0.000 8.693 0.000) 8.693 7.397 ( 0.000 3.826 0.000) 3.826 7.861 ( 0.000 1.662 0.000) 1.662 7.938 ( -0.000 -3.136 -0.000) 3.136 8.124 ( -0.000 -6.572 -0.000) 6.572 8.256 ( 0.000 8.578 0.000) 8.578 8.424 ( 0.000 2.836 0.000) 2.836 8.751 ( -0.000 -3.806 -0.000) 3.806 8.926 ( -0.000 -3.041 -0.000) 3.041 9.133 ( -0.000 -1.472 -0.000) 1.472 9.301 ( -0.000 -2.238 -0.000) 2.238 9.332 ( -0.000 -2.924 -0.000) 2.924 9.814 ( 0.000 2.925 0.000) 2.925 9.987 ( 0.000 4.615 0.000) 4.615 10.325 ( -0.000 -1.558 -0.000) 1.558 10.601 ( -0.000 -2.058 -0.000) 2.058 10.639 ( 0.000 3.544 0.000) 3.544 10.895 ( -0.000 -1.670 -0.000) 1.670 10.986 ( 0.000 1.375 0.000) 1.375 11.063 ( 0.000 0.458 0.000) 0.458 11.184 ( 0.000 5.372 0.000) 5.372 11.466 ( 0.000 1.692 0.000) 1.692 11.572 ( 0.000 12.939 0.000) 12.939 11.668 ( 0.000 3.353 0.000) 3.353 11.990 ( 0.000 0.053 0.000) 0.053 12.033 ( -0.000 -1.426 -0.000) 1.426 12.486 ( 0.000 4.722 0.000) 4.722 12.521 ( 0.000 3.315 0.000) 3.315 13.051 ( -0.000 -1.917 -0.000) 1.917 13.155 ( 0.000 0.510 0.000) 0.510 13.211 ( 0.000 0.205 0.000) 0.205 13.464 ( -0.000 -3.536 -0.000) 3.536 15.828 ( 0.000 0.164 0.000) 0.164 15.922 ( -0.000 -2.664 -0.000) 2.664 17.633 ( -0.000 -2.933 -0.000) 2.933 17.658 ( -0.000 -3.740 -0.000) 3.740 18.103 ( 0.000 0.235 0.000) 0.235 18.179 ( 0.000 3.686 0.000) 3.686 18.501 ( 0.000 2.736 0.000) 2.736 18.941 ( 0.000 9.772 0.000) 9.772 19.144 ( 0.000 1.354 0.000) 1.354 19.315 ( 0.000 9.916 0.000) 9.916 19.596 ( -0.000 -5.474 -0.000) 5.474 19.643 ( -0.000 -10.019 -0.000) 10.019 21.467 ( 0.000 5.946 0.000) 5.946 21.604 ( 0.000 3.379 0.000) 3.379 21.934 ( -0.000 -1.996 -0.000) 1.996 22.065 ( -0.000 -0.355 -0.000) 0.355 22.143 ( -0.000 -0.588 -0.000) 0.588 22.453 ( -0.000 -1.450 -0.000) 1.450 22.865 ( 0.000 4.216 0.000) 4.216 22.914 ( -0.000 -5.364 -0.000) 5.364 23.170 ( -0.000 -4.233 -0.000) 4.233 23.311 ( -0.000 -6.427 -0.000) 6.427 ======================= Grid point 48 (31/102) ======================= q-point: ( 0.36 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.400 ( 19.347 0.000 -3.825) 19.721 1.519 ( 17.828 0.000 -6.151) 18.859 1.702 ( 9.525 0.000 3.950) 10.311 1.884 ( 8.402 0.000 6.716) 10.756 2.233 ( 2.415 0.000 2.524) 3.493 2.368 ( 0.616 0.000 4.937) 4.975 2.394 ( -0.471 -0.000 -5.177) 5.198 2.535 ( 3.174 0.000 -4.441) 5.459 2.591 ( -1.515 -0.000 1.868) 2.405 2.795 ( 13.394 0.000 -9.451) 16.393 2.895 ( 7.266 0.000 -0.698) 7.300 3.060 ( -2.276 -0.000 3.584) 4.246 3.077 ( -2.257 -0.000 6.523) 6.902 3.206 ( 2.906 0.000 4.898) 5.695 3.348 ( -5.040 -0.000 5.866) 7.734 3.359 ( -5.558 -0.000 -4.893) 7.405 3.549 ( 3.664 0.000 -1.697) 4.038 3.673 ( 4.592 0.000 -6.321) 7.813 3.716 ( -4.535 -0.000 3.760) 5.891 3.893 ( -3.490 -0.000 -4.988) 6.088 3.911 ( 3.539 0.000 4.339) 5.599 4.100 ( 14.110 0.000 -11.123) 17.967 4.227 ( -3.528 -0.000 -2.611) 4.389 4.271 ( -7.965 -0.000 6.530) 10.300 4.386 ( 4.488 0.000 0.619) 4.531 4.533 ( 3.678 0.000 4.894) 6.122 4.833 ( -5.695 -0.000 8.760) 10.448 4.858 ( 8.945 0.000 -6.998) 11.357 4.979 ( -5.812 -0.000 1.931) 6.124 5.019 ( -10.552 -0.000 -2.825) 10.924 5.136 ( 0.659 0.000 2.006) 2.112 5.320 ( -12.476 -0.000 0.975) 12.514 5.456 ( 7.089 0.000 -1.818) 7.318 5.464 ( -12.847 -0.000 6.350) 14.330 5.525 ( -7.178 -0.000 -10.671) 12.861 5.703 ( -5.458 -0.000 1.635) 5.698 5.722 ( -3.700 -0.000 -2.933) 4.722 5.920 ( -3.704 -0.000 3.408) 5.033 6.035 ( -0.787 -0.000 1.495) 1.690 6.188 ( -6.631 -0.000 4.793) 8.182 6.215 ( -2.556 -0.000 -4.008) 4.754 6.357 ( 6.017 0.000 -4.222) 7.350 6.554 ( -5.270 -0.000 2.998) 6.063 6.595 ( 7.950 0.000 -2.976) 8.489 7.101 ( 5.618 0.000 4.790) 7.383 7.142 ( 2.802 0.000 -3.130) 4.201 7.187 ( 5.176 0.000 -1.424) 5.368 7.386 ( 1.539 0.000 2.357) 2.815 7.804 ( 5.279 0.000 -6.811) 8.617 7.871 ( -9.396 -0.000 2.442) 9.708 8.131 ( -8.172 -0.000 -4.514) 9.335 8.215 ( 3.867 0.000 1.404) 4.114 8.336 ( 2.808 0.000 6.953) 7.498 8.429 ( 3.566 0.000 5.026) 6.163 8.646 ( -4.530 -0.000 0.237) 4.536 8.648 ( -1.778 -0.000 -4.247) 4.605 9.001 ( -5.981 -0.000 4.420) 7.437 9.123 ( 4.810 0.000 -4.214) 6.395 9.586 ( 9.304 0.000 -7.349) 11.856 9.714 ( -14.879 -0.000 5.486) 15.858 9.932 ( -10.222 -0.000 -0.633) 10.241 10.147 ( 7.202 0.000 0.282) 7.207 10.268 ( 10.556 0.000 0.869) 10.592 10.552 ( -1.308 -0.000 -2.349) 2.688 10.563 ( -0.798 -0.000 2.639) 2.757 10.712 ( 6.791 0.000 -1.543) 6.965 11.126 ( 1.506 0.000 -2.616) 3.019 11.172 ( 4.184 0.000 0.279) 4.193 11.379 ( 13.128 0.000 -1.630) 13.229 11.544 ( 5.908 0.000 3.894) 7.076 11.694 ( 1.785 0.000 3.067) 3.549 11.731 ( -7.490 -0.000 -3.330) 8.197 12.050 ( 1.413 0.000 -1.544) 2.093 12.121 ( -1.236 -0.000 1.185) 1.712 12.717 ( -4.314 -0.000 -0.813) 4.390 12.756 ( -1.022 -0.000 0.585) 1.178 13.421 ( 6.117 0.000 1.710) 6.352 13.531 ( 5.418 0.000 -3.030) 6.208 13.694 ( -3.995 -0.000 -0.156) 3.999 13.738 ( 2.089 0.000 1.426) 2.529 15.774 ( -9.284 -0.000 -3.433) 9.899 15.912 ( -13.186 -0.000 3.343) 13.603 17.711 ( 10.218 0.000 1.586) 10.340 17.743 ( 5.993 0.000 -1.532) 6.186 18.287 ( 8.022 0.000 2.160) 8.307 18.423 ( 3.104 0.000 -4.140) 5.174 18.683 ( -8.015 -0.000 3.916) 8.921 18.729 ( -10.907 -0.000 -2.526) 11.196 19.788 ( -1.458 -0.000 -1.216) 1.899 19.837 ( -4.105 -0.000 0.674) 4.160 20.241 ( -1.081 -0.000 1.131) 1.564 20.821 ( 4.721 0.000 4.653) 6.629 20.850 ( 5.739 0.000 -1.667) 5.976 21.523 ( 8.276 0.000 -22.094) 23.593 21.704 ( -5.322 -0.000 13.272) 14.300 21.942 ( 1.890 0.000 1.423) 2.366 22.108 ( 5.899 0.000 -0.961) 5.977 22.383 ( -0.088 -0.000 3.534) 3.535 22.415 ( 3.292 0.000 -0.626) 3.351 22.614 ( -2.321 -0.000 1.059) 2.551 22.776 ( -5.593 -0.000 -0.795) 5.649 22.784 ( -6.402 -0.000 0.328) 6.411 ======================= Grid point 49 (32/102) ======================= q-point: ( 0.45 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.418 ( 5.436 4.990 0.747) 7.417 1.682 ( 6.568 5.786 3.953) 9.604 1.760 ( 16.582 -10.458 -7.554) 21.010 2.030 ( 4.511 -5.414 5.525) 8.955 2.270 ( 0.405 -1.294 -2.070) 2.475 2.341 ( 5.829 2.620 -5.366) 8.345 2.413 ( -2.307 -2.831 2.975) 4.711 2.562 ( 0.557 -1.905 2.321) 3.054 2.648 ( 1.687 -5.740 -3.758) 7.066 2.854 ( 1.941 0.074 -1.355) 2.368 2.945 ( 6.271 -0.149 2.228) 6.657 3.048 ( -4.513 -1.421 3.355) 5.801 3.093 ( -3.606 -3.082 2.956) 5.590 3.246 ( 2.831 -0.101 2.073) 3.510 3.331 ( -1.969 -2.726 -1.415) 3.648 3.359 ( -0.477 -2.018 -0.083) 2.075 3.563 ( 1.826 0.253 -3.074) 3.585 3.620 ( -1.078 3.965 0.084) 4.110 3.706 ( -3.062 0.383 -0.838) 3.197 3.824 ( -2.440 2.749 -3.878) 5.343 3.981 ( -1.011 -3.549 6.274) 7.279 4.119 ( 5.349 4.119 -4.795) 8.281 4.162 ( 2.762 3.994 0.401) 4.872 4.365 ( 12.625 -4.164 -2.998) 13.628 4.414 ( 4.354 -1.849 -0.255) 4.737 4.571 ( -1.969 -0.227 2.485) 3.178 4.741 ( 0.320 10.808 -0.083) 10.813 4.792 ( -4.588 2.968 5.111) 7.482 4.914 ( -1.071 -0.745 -1.411) 1.921 5.052 ( -0.516 1.861 2.298) 3.002 5.139 ( -2.686 -3.022 -1.311) 4.251 5.192 ( -12.451 3.063 -0.528) 12.833 5.374 ( -10.403 -0.063 6.316) 12.170 5.420 ( -6.429 0.099 -7.275) 9.709 5.539 ( 2.860 -0.931 -1.455) 3.342 5.599 ( -4.232 3.814 0.917) 5.770 5.775 ( 6.129 -2.980 -1.629) 7.008 5.942 ( -2.697 -5.231 0.387) 5.898 6.100 ( -5.502 -6.921 2.218) 9.116 6.149 ( -3.318 0.605 1.807) 3.826 6.221 ( -2.949 -4.059 -2.182) 5.471 6.426 ( 4.373 -2.796 -3.368) 6.187 6.553 ( -3.693 -3.640 3.007) 5.994 6.653 ( 7.121 -0.161 -2.013) 7.402 7.124 ( 2.669 1.976 -0.002) 3.321 7.149 ( 4.345 1.292 2.650) 5.251 7.222 ( 2.788 -0.167 -2.984) 4.087 7.399 ( 0.417 -0.149 2.286) 2.329 7.731 ( -1.844 5.771 -1.448) 6.229 7.862 ( -4.491 -1.198 0.282) 4.657 8.054 ( -4.692 1.305 -3.447) 5.967 8.277 ( 0.806 -1.825 0.637) 2.095 8.324 ( 5.954 3.144 5.409) 8.636 8.479 ( 2.677 0.359 2.419) 3.626 8.545 ( -3.912 2.436 -0.613) 4.649 8.604 ( -3.785 5.722 -2.514) 7.306 8.992 ( -4.069 -2.342 2.329) 5.241 9.110 ( 4.297 3.158 -2.939) 6.089 9.561 ( -5.748 5.814 0.767) 8.211 9.664 ( 2.288 -1.909 -4.766) 5.621 9.807 ( -7.980 6.197 2.557) 10.422 10.208 ( 4.166 -0.594 1.029) 4.332 10.303 ( 9.176 3.459 -1.667) 9.947 10.490 ( 1.009 3.525 -1.313) 3.895 10.580 ( -1.326 -1.319 3.439) 3.914 10.756 ( 5.207 -0.184 -1.130) 5.331 11.089 ( 2.072 3.209 -0.699) 3.883 11.197 ( 1.634 1.894 0.120) 2.504 11.503 ( 9.928 -4.188 0.250) 10.778 11.629 ( 0.179 -1.319 0.116) 1.336 11.688 ( -3.153 -2.108 -1.886) 4.236 11.724 ( 2.872 -2.901 1.973) 4.534 12.055 ( 1.764 0.672 -0.710) 2.016 12.113 ( -1.593 0.200 0.482) 1.676 12.706 ( -2.942 -2.430 -0.780) 3.894 12.782 ( -1.038 -3.487 0.557) 3.680 13.332 ( 5.868 12.733 0.019) 14.021 13.521 ( 6.506 10.421 -0.051) 12.285 13.586 ( -4.355 3.604 -0.347) 5.663 13.702 ( -1.658 5.355 0.613) 5.639 15.717 ( -6.592 -1.273 -1.073) 6.799 15.854 ( -9.338 -2.048 1.012) 9.613 17.667 ( 8.442 8.195 0.079) 11.766 17.779 ( 1.435 2.076 -0.107) 2.526 18.255 ( 12.342 5.307 0.737) 13.455 18.541 ( -0.537 -3.747 -1.851) 4.213 18.637 ( -7.539 0.891 0.375) 7.601 18.756 ( -8.525 -12.761 0.864) 15.371 19.595 ( -3.066 14.051 -0.914) 14.411 19.755 ( -1.142 8.573 1.555) 8.788 20.099 ( -0.311 13.830 -1.775) 13.947 20.714 ( 4.243 15.445 2.442) 16.203 21.002 ( 3.012 -11.436 -0.454) 11.835 21.535 ( 7.451 -1.184 -7.610) 10.716 21.751 ( -1.340 -6.464 5.265) 8.444 21.951 ( 1.544 0.515 0.985) 1.903 22.305 ( -0.033 -8.554 -3.921) 9.410 22.372 ( 0.367 -0.169 0.586) 0.712 22.445 ( 1.231 -4.814 1.764) 5.272 22.599 ( -1.973 0.342 1.552) 2.534 22.768 ( -3.600 -3.531 -1.081) 5.157 22.814 ( -4.610 -6.664 0.821) 8.145 ======================= Grid point 50 (33/102) ======================= q-point: ( 0.55 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.386 ( -0.846 -0.907 1.753) 2.147 1.673 ( 2.943 -0.791 1.722) 3.501 2.027 ( 3.684 -8.866 -5.332) 10.982 2.128 ( 9.011 -1.099 4.570) 10.163 2.222 ( 3.433 3.909 -7.168) 8.857 2.365 ( 1.635 -0.085 -0.261) 1.658 2.480 ( -5.046 -7.022 2.895) 9.119 2.635 ( -0.616 -4.527 2.664) 5.289 2.775 ( 7.364 -5.731 -6.447) 11.342 2.860 ( 2.794 1.505 2.262) 3.897 2.919 ( -9.659 0.241 6.210) 11.485 3.059 ( -4.921 -1.881 0.713) 5.316 3.164 ( 1.729 -4.312 1.040) 4.761 3.260 ( 0.446 -0.520 -0.863) 1.101 3.392 ( 0.180 -3.196 -0.034) 3.202 3.438 ( 6.482 -5.550 -4.523) 9.659 3.559 ( 0.673 0.631 -0.796) 1.218 3.570 ( -2.714 -0.038 3.279) 4.257 3.674 ( -3.117 -0.406 -1.656) 3.552 3.757 ( -1.054 2.537 -1.649) 3.205 4.009 ( -2.505 0.489 4.938) 5.559 4.033 ( -2.445 2.676 -2.381) 4.338 4.177 ( 10.040 3.886 -0.703) 10.789 4.381 ( -0.676 0.335 -2.494) 2.606 4.491 ( -1.791 2.712 0.528) 3.292 4.500 ( -1.147 8.672 1.905) 8.952 4.634 ( 10.091 4.159 0.976) 10.958 4.725 ( -2.830 3.168 -2.842) 5.112 4.907 ( 5.753 2.512 5.676) 8.464 5.030 ( 6.967 0.486 -0.981) 7.053 5.062 ( -11.085 -1.490 -1.027) 11.232 5.160 ( -8.026 -3.445 -1.702) 8.898 5.378 ( -2.409 -4.811 -0.905) 5.456 5.389 ( -6.923 -2.196 1.242) 7.368 5.527 ( 1.337 2.660 -0.967) 3.130 5.559 ( -3.057 -2.153 1.627) 4.077 5.901 ( 9.977 -4.079 -0.790) 10.807 6.039 ( -2.268 -5.649 -1.091) 6.184 6.137 ( -1.167 -0.832 1.745) 2.258 6.161 ( -7.845 -6.818 -0.489) 10.405 6.331 ( -0.433 -8.747 -0.082) 8.758 6.472 ( 0.298 -1.872 -0.780) 2.049 6.632 ( 1.721 -1.604 -0.358) 2.380 6.686 ( 1.973 -2.296 0.158) 3.031 7.094 ( 0.757 2.336 -0.630) 2.535 7.147 ( 3.734 3.827 4.520) 7.001 7.208 ( 0.673 1.841 -4.554) 4.958 7.409 ( -0.201 -0.523 1.600) 1.696 7.583 ( -1.606 9.677 -0.643) 9.830 7.794 ( -2.731 6.163 0.333) 6.749 8.005 ( -0.626 1.733 -1.309) 2.261 8.213 ( 2.223 7.613 3.634) 8.724 8.356 ( -0.526 7.293 -1.183) 7.407 8.452 ( -0.868 -0.951 -4.791) 4.961 8.466 ( -2.059 -1.086 3.433) 4.148 8.539 ( -1.193 -0.982 1.310) 2.026 8.968 ( -1.375 3.533 0.955) 3.909 9.131 ( 3.961 -2.797 -1.847) 5.189 9.386 ( -2.889 9.406 0.359) 9.846 9.593 ( -3.054 10.202 -0.663) 10.670 9.742 ( 0.871 -3.207 -0.451) 3.354 10.195 ( 0.368 3.181 1.291) 3.453 10.314 ( 4.951 1.550 -1.656) 5.446 10.463 ( 1.397 -0.096 -1.217) 1.855 10.615 ( -0.799 -2.354 3.088) 3.964 10.794 ( 3.735 -0.789 -1.046) 3.958 11.042 ( -0.010 2.637 -0.159) 2.642 11.147 ( -0.223 3.562 0.581) 3.616 11.588 ( -0.608 3.482 -0.983) 3.669 11.627 ( 3.473 -1.622 1.608) 4.157 11.719 ( 1.973 -2.357 -2.398) 3.899 11.837 ( 2.941 -4.113 1.332) 5.229 12.044 ( 0.564 1.545 0.660) 1.773 12.093 ( -2.029 0.385 -0.643) 2.163 12.757 ( -1.109 -4.821 -0.635) 4.987 12.864 ( -0.330 -5.905 0.505) 5.936 13.084 ( 3.860 18.066 0.132) 18.474 13.256 ( 3.446 20.611 0.249) 20.898 13.495 ( -2.898 5.049 -0.357) 5.832 13.595 ( -1.564 4.188 0.251) 4.477 15.722 ( -3.080 -3.257 -0.148) 4.485 15.842 ( -4.232 -1.870 0.028) 4.627 17.603 ( 8.150 5.381 -0.081) 9.766 17.703 ( -5.083 3.886 0.068) 6.398 18.235 ( 6.819 6.275 0.646) 9.289 18.532 ( -0.300 4.013 -2.238) 4.605 18.615 ( -1.177 -1.495 1.387) 2.354 18.938 ( -6.453 -13.139 0.533) 14.647 19.362 ( -1.495 7.830 -0.237) 7.975 19.563 ( -0.416 11.238 1.874) 11.401 19.801 ( 0.275 17.278 -2.913) 17.524 20.394 ( 2.244 22.098 1.018) 22.235 21.242 ( 1.432 -12.527 0.215) 12.611 21.612 ( 4.822 -1.814 -1.933) 5.503 21.890 ( -0.325 -7.747 1.365) 7.873 21.959 ( 0.599 -0.504 1.079) 1.333 22.214 ( -0.680 7.396 -0.851) 7.476 22.509 ( -0.384 -0.004 3.473) 3.495 22.570 ( 4.156 -9.808 -8.096) 13.379 22.635 ( -6.541 -9.153 4.819) 12.239 22.853 ( 0.525 -7.550 -1.764) 7.771 22.909 ( -3.296 -6.192 1.528) 7.179 ======================= Grid point 51 (34/102) ======================= q-point: ( 0.64 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.471 ( -0.000 -8.165 -0.000) 8.165 1.757 ( -0.000 -6.634 -0.000) 6.634 2.060 ( 0.000 1.711 0.000) 1.711 2.160 ( 0.000 1.412 0.000) 1.412 2.265 ( -0.000 -3.520 -0.000) 3.520 2.383 ( -0.000 -0.850 -0.000) 0.850 2.602 ( -0.000 -9.387 -0.000) 9.387 2.689 ( -0.000 -1.679 -0.000) 1.679 2.763 ( 0.000 6.403 0.000) 6.403 2.897 ( -0.000 -1.782 -0.000) 1.782 2.981 ( -0.000 -9.173 -0.000) 9.173 3.057 ( -0.000 -0.011 -0.000) 0.011 3.250 ( -0.000 -4.923 -0.000) 4.923 3.284 ( -0.000 -1.977 -0.000) 1.977 3.427 ( -0.000 -0.881 -0.000) 0.881 3.503 ( 0.000 3.958 0.000) 3.958 3.562 ( -0.000 -1.805 -0.000) 1.805 3.639 ( -0.000 -8.225 -0.000) 8.225 3.653 ( 0.000 2.110 0.000) 2.110 3.739 ( -0.000 -1.711 -0.000) 1.711 3.950 ( 0.000 7.553 0.000) 7.553 3.974 ( 0.000 0.014 0.000) 0.014 4.168 ( 0.000 6.311 0.000) 6.311 4.262 ( 0.000 6.979 0.000) 6.979 4.374 ( 0.000 1.422 0.000) 1.422 4.463 ( 0.000 0.474 0.000) 0.474 4.619 ( 0.000 2.985 0.000) 2.985 4.636 ( 0.000 0.787 0.000) 0.787 4.924 ( 0.000 1.047 0.000) 1.047 4.986 ( 0.000 1.117 0.000) 1.117 5.097 ( -0.000 -0.408 -0.000) 0.408 5.281 ( -0.000 -10.202 -0.000) 10.202 5.388 ( -0.000 -1.140 -0.000) 1.140 5.457 ( -0.000 -2.724 -0.000) 2.724 5.522 ( -0.000 -4.755 -0.000) 4.755 5.605 ( -0.000 -3.358 -0.000) 3.358 6.025 ( -0.000 -3.964 -0.000) 3.964 6.080 ( -0.000 -1.459 -0.000) 1.459 6.168 ( -0.000 -2.691 -0.000) 2.691 6.260 ( -0.000 -7.354 -0.000) 7.354 6.475 ( -0.000 -6.416 -0.000) 6.416 6.520 ( -0.000 -3.122 -0.000) 3.122 6.581 ( 0.000 5.091 0.000) 5.091 6.777 ( -0.000 -3.902 -0.000) 3.902 7.054 ( 0.000 8.699 0.000) 8.699 7.061 ( 0.000 1.004 0.000) 1.004 7.180 ( 0.000 1.287 0.000) 1.287 7.352 ( 0.000 14.333 0.000) 14.333 7.426 ( -0.000 -0.965 -0.000) 0.965 7.622 ( 0.000 11.383 0.000) 11.383 7.961 ( 0.000 2.964 0.000) 2.964 8.077 ( 0.000 8.942 0.000) 8.942 8.164 ( 0.000 8.687 0.000) 8.687 8.458 ( 0.000 1.940 0.000) 1.940 8.538 ( -0.000 -6.139 -0.000) 6.139 8.560 ( -0.000 -0.252 -0.000) 0.252 8.904 ( 0.000 2.258 0.000) 2.258 9.212 ( -0.000 -3.887 -0.000) 3.887 9.214 ( 0.000 7.690 0.000) 7.690 9.400 ( 0.000 8.712 0.000) 8.712 9.807 ( -0.000 -3.008 -0.000) 3.008 10.139 ( 0.000 3.350 0.000) 3.350 10.301 ( 0.000 1.022 0.000) 1.022 10.497 ( -0.000 -2.705 -0.000) 2.705 10.653 ( -0.000 -1.698 -0.000) 1.698 10.831 ( -0.000 -1.599 -0.000) 1.599 11.006 ( 0.000 1.045 0.000) 1.045 11.092 ( 0.000 2.123 0.000) 2.123 11.482 ( 0.000 8.015 0.000) 8.015 11.617 ( 0.000 3.592 0.000) 3.592 11.761 ( 0.000 0.084 0.000) 0.084 11.884 ( 0.000 0.568 0.000) 0.568 12.018 ( 0.000 1.234 0.000) 1.234 12.065 ( 0.000 2.010 0.000) 2.010 12.789 ( 0.000 13.409 0.000) 13.409 12.856 ( -0.000 -4.850 -0.000) 4.850 12.878 ( 0.000 16.616 0.000) 16.616 13.002 ( -0.000 -4.550 -0.000) 4.550 13.384 ( 0.000 5.894 0.000) 5.894 13.518 ( 0.000 4.003 0.000) 4.003 15.775 ( -0.000 -3.567 -0.000) 3.567 15.853 ( -0.000 -1.105 -0.000) 1.105 17.590 ( 0.000 1.788 0.000) 1.788 17.610 ( 0.000 1.436 0.000) 1.436 18.154 ( 0.000 4.624 0.000) 4.624 18.405 ( 0.000 8.640 0.000) 8.640 18.620 ( 0.000 1.139 0.000) 1.139 19.136 ( -0.000 -10.205 -0.000) 10.205 19.271 ( 0.000 5.508 0.000) 5.508 19.409 ( 0.000 3.316 0.000) 3.316 19.526 ( 0.000 11.586 0.000) 11.586 19.997 ( 0.000 22.466 0.000) 22.466 21.451 ( -0.000 -9.779 -0.000) 9.779 21.628 ( 0.000 2.069 0.000) 2.069 21.988 ( -0.000 -2.373 -0.000) 2.373 21.994 ( -0.000 -2.242 -0.000) 2.242 22.098 ( 0.000 3.371 0.000) 3.371 22.480 ( 0.000 1.982 0.000) 1.982 22.709 ( -0.000 -5.750 -0.000) 5.750 22.811 ( -0.000 -9.912 -0.000) 9.912 22.982 ( -0.000 -4.253 -0.000) 4.253 23.018 ( -0.000 -9.534 -0.000) 9.534 ======================= Grid point 61 (35/102) ======================= q-point: ( 0.45 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.588 ( 7.119 0.000 -2.867) 7.675 1.658 ( 4.062 0.000 -3.054) 5.083 1.834 ( 5.467 0.000 3.143) 6.306 1.979 ( 2.068 0.000 5.266) 5.658 2.236 ( -1.567 -0.000 -0.573) 1.669 2.337 ( -4.193 -0.000 1.645) 4.504 2.432 ( 8.287 0.000 -5.874) 10.158 2.538 ( -6.771 -0.000 3.484) 7.615 2.647 ( 13.596 0.000 -3.588) 14.062 2.828 ( -6.974 -0.000 -2.238) 7.324 2.997 ( 0.670 0.000 2.010) 2.119 2.997 ( -3.190 -0.000 3.779) 4.946 3.070 ( 3.445 0.000 0.432) 3.472 3.269 ( -4.474 -0.000 -1.716) 4.792 3.275 ( 2.294 0.000 2.344) 3.279 3.340 ( 1.040 0.000 0.637) 1.220 3.556 ( -1.075 -0.000 -1.299) 1.686 3.686 ( -0.726 -0.000 0.319) 0.793 3.686 ( 0.498 0.000 -2.372) 2.424 3.828 ( -2.246 -0.000 -2.582) 3.422 3.924 ( -3.446 -0.000 4.078) 5.339 4.172 ( -2.087 -0.000 -0.812) 2.239 4.294 ( 14.728 0.000 -6.550) 16.119 4.408 ( 20.571 0.000 4.495) 21.056 4.422 ( -0.565 -0.000 -1.191) 1.318 4.562 ( -2.373 -0.000 3.700) 4.395 4.774 ( -20.467 -0.000 -4.196) 20.893 4.793 ( -3.198 -0.000 3.675) 4.872 4.933 ( -1.279 -0.000 1.571) 2.026 4.960 ( 5.701 0.000 -2.812) 6.357 5.150 ( -7.081 -0.000 0.615) 7.107 5.177 ( 2.615 0.000 3.953) 4.740 5.337 ( -6.860 -0.000 8.280) 10.753 5.374 ( -5.115 -0.000 -12.173) 13.204 5.525 ( 0.985 0.000 0.809) 1.275 5.671 ( -0.718 -0.000 0.622) 0.950 5.716 ( 3.359 0.000 -3.674) 4.978 5.889 ( -1.503 -0.000 0.890) 1.747 6.004 ( -3.682 -0.000 3.518) 5.093 6.145 ( -1.102 -0.000 1.296) 1.701 6.169 ( -1.248 -0.000 -2.174) 2.507 6.423 ( 5.825 0.000 -5.194) 7.804 6.488 ( -5.841 -0.000 4.822) 7.574 6.691 ( 4.631 0.000 -1.428) 4.846 7.157 ( 0.772 0.000 -1.188) 1.416 7.193 ( 3.470 0.000 3.588) 4.991 7.233 ( 1.832 0.000 -2.595) 3.176 7.404 ( 0.156 0.000 1.173) 1.183 7.760 ( -5.170 -0.000 1.770) 5.465 7.825 ( 0.826 0.000 -2.402) 2.540 8.015 ( -4.218 -0.000 -1.794) 4.583 8.255 ( 1.133 0.000 0.130) 1.140 8.430 ( 4.614 0.000 4.895) 6.727 8.491 ( 2.039 0.000 2.199) 2.998 8.581 ( -3.267 -0.000 -2.870) 4.349 8.617 ( -0.644 -0.000 -1.962) 2.065 8.939 ( -3.238 -0.000 1.841) 3.725 9.158 ( 1.936 0.000 -2.109) 2.863 9.563 ( -6.562 -0.000 2.479) 7.014 9.659 ( 3.965 0.000 -4.316) 5.861 9.824 ( -4.374 -0.000 1.341) 4.575 10.232 ( 3.229 0.000 0.166) 3.233 10.394 ( 4.783 0.000 0.695) 4.833 10.531 ( -0.448 -0.000 -0.977) 1.075 10.562 ( -0.356 -0.000 0.627) 0.721 10.785 ( 2.908 0.000 -0.108) 2.910 11.130 ( 0.144 0.000 -0.720) 0.734 11.223 ( 2.065 0.000 0.468) 2.117 11.552 ( 9.487 0.000 -0.370) 9.494 11.608 ( -1.605 -0.000 0.079) 1.607 11.639 ( 0.316 0.000 -0.539) 0.624 11.686 ( -3.629 -0.000 1.108) 3.794 12.073 ( 1.530 0.000 -0.483) 1.604 12.113 ( -0.417 -0.000 0.331) 0.533 12.659 ( -2.373 -0.000 -0.409) 2.408 12.745 ( -0.539 -0.000 0.233) 0.587 13.468 ( 0.847 0.000 0.459) 0.964 13.583 ( 2.956 0.000 -1.382) 3.263 13.642 ( -2.728 -0.000 0.182) 2.735 13.781 ( 1.897 0.000 0.811) 2.063 15.665 ( -3.698 -0.000 -0.829) 3.790 15.778 ( -5.247 -0.000 0.859) 5.317 17.804 ( 2.433 0.000 -0.507) 2.485 17.822 ( 3.751 0.000 0.556) 3.792 18.419 ( 8.658 0.000 2.279) 8.953 18.437 ( 0.611 0.000 -1.587) 1.701 18.566 ( -9.774 -0.000 -2.351) 10.053 18.620 ( -2.305 -0.000 1.572) 2.790 19.768 ( -0.703 -0.000 -0.112) 0.712 19.791 ( -1.819 -0.000 0.070) 1.820 20.228 ( -0.627 -0.000 0.051) 0.629 20.886 ( 1.806 0.000 2.078) 2.753 20.901 ( 1.873 0.000 -0.596) 1.966 21.537 ( 2.556 0.000 -7.939) 8.340 21.691 ( -1.727 -0.000 4.825) 5.125 21.967 ( 0.801 0.000 0.379) 0.886 22.164 ( 2.061 0.000 -0.624) 2.154 22.401 ( 0.378 0.000 2.083) 2.117 22.457 ( 2.010 0.000 -0.242) 2.024 22.607 ( 0.906 0.000 -0.410) 0.995 22.703 ( -4.048 -0.000 0.458) 4.074 22.705 ( -2.937 -0.000 -0.360) 2.959 ======================= Grid point 62 (36/102) ======================= q-point: ( 0.55 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.452 ( 0.000 7.756 0.000) 7.756 1.744 ( 0.000 6.678 0.000) 6.678 1.858 ( -0.000 -11.392 -0.000) 11.392 2.126 ( -0.000 -8.341 -0.000) 8.341 2.215 ( 0.000 1.041 0.000) 1.041 2.349 ( -0.000 -2.054 -0.000) 2.054 2.446 ( 0.000 2.387 0.000) 2.387 2.533 ( -0.000 -4.323 -0.000) 4.323 2.772 ( -0.000 -3.767 -0.000) 3.767 2.775 ( -0.000 -1.421 -0.000) 1.421 2.963 ( 0.000 2.214 0.000) 2.214 3.010 ( -0.000 -0.830 -0.000) 0.830 3.114 ( -0.000 -2.570 -0.000) 2.570 3.252 ( -0.000 -0.440 -0.000) 0.440 3.316 ( -0.000 -3.460 -0.000) 3.460 3.376 ( -0.000 -3.126 -0.000) 3.126 3.542 ( 0.000 0.647 0.000) 0.647 3.644 ( 0.000 3.780 0.000) 3.780 3.663 ( 0.000 1.357 0.000) 1.357 3.798 ( 0.000 2.067 0.000) 2.067 3.947 ( -0.000 -3.111 -0.000) 3.111 4.114 ( 0.000 4.734 0.000) 4.734 4.351 ( 0.000 5.945 0.000) 5.945 4.355 ( 0.000 0.160 0.000) 0.160 4.518 ( 0.000 1.603 0.000) 1.603 4.560 ( -0.000 -0.239 -0.000) 0.239 4.750 ( -0.000 -2.263 -0.000) 2.263 4.785 ( -0.000 -7.183 -0.000) 7.183 4.823 ( 0.000 7.586 0.000) 7.586 5.065 ( -0.000 -4.255 -0.000) 4.255 5.100 ( 0.000 2.480 0.000) 2.480 5.115 ( 0.000 8.460 0.000) 8.460 5.312 ( -0.000 -0.387 -0.000) 0.387 5.335 ( -0.000 -1.348 -0.000) 1.348 5.556 ( -0.000 -0.866 -0.000) 0.866 5.567 ( 0.000 4.493 0.000) 4.493 5.852 ( -0.000 -6.882 -0.000) 6.882 5.920 ( -0.000 -4.727 -0.000) 4.727 6.029 ( -0.000 -3.579 -0.000) 3.579 6.135 ( 0.000 0.721 0.000) 0.721 6.197 ( -0.000 -4.992 -0.000) 4.992 6.457 ( -0.000 -0.270 -0.000) 0.270 6.524 ( -0.000 -6.590 -0.000) 6.590 6.709 ( 0.000 0.298 0.000) 0.298 7.136 ( 0.000 2.067 0.000) 2.067 7.214 ( 0.000 0.111 0.000) 0.111 7.223 ( 0.000 1.561 0.000) 1.561 7.405 ( -0.000 -0.011 -0.000) 0.011 7.703 ( 0.000 4.500 0.000) 4.500 7.830 ( 0.000 0.085 0.000) 0.085 8.006 ( -0.000 -0.673 -0.000) 0.673 8.286 ( -0.000 -1.482 -0.000) 1.482 8.408 ( 0.000 2.421 0.000) 2.421 8.480 ( 0.000 5.729 0.000) 5.729 8.528 ( -0.000 -1.168 -0.000) 1.168 8.557 ( 0.000 7.376 0.000) 7.376 8.965 ( -0.000 -2.903 -0.000) 2.903 9.141 ( 0.000 1.970 0.000) 1.970 9.499 ( 0.000 4.755 0.000) 4.755 9.691 ( -0.000 -2.280 -0.000) 2.280 9.745 ( 0.000 6.918 0.000) 6.918 10.242 ( 0.000 0.886 0.000) 0.886 10.373 ( 0.000 3.225 0.000) 3.225 10.496 ( 0.000 2.741 0.000) 2.741 10.578 ( -0.000 -1.722 -0.000) 1.722 10.796 ( -0.000 -0.230 -0.000) 0.230 11.098 ( 0.000 3.065 0.000) 3.065 11.211 ( 0.000 2.679 0.000) 2.679 11.604 ( -0.000 -0.480 -0.000) 0.480 11.617 ( -0.000 -1.769 -0.000) 1.769 11.647 ( -0.000 -3.085 -0.000) 3.085 11.755 ( -0.000 -6.115 -0.000) 6.115 12.082 ( -0.000 -0.241 -0.000) 0.241 12.090 ( 0.000 2.190 0.000) 2.190 12.678 ( -0.000 -3.049 -0.000) 3.049 12.775 ( -0.000 -3.549 -0.000) 3.549 13.379 ( 0.000 11.157 0.000) 11.157 13.544 ( 0.000 7.645 0.000) 7.645 13.572 ( 0.000 4.881 0.000) 4.881 13.692 ( 0.000 8.315 0.000) 8.315 15.663 ( -0.000 -1.659 -0.000) 1.659 15.784 ( -0.000 -2.325 -0.000) 2.325 17.756 ( 0.000 5.488 0.000) 5.488 17.766 ( 0.000 6.175 0.000) 6.175 18.389 ( 0.000 6.602 0.000) 6.602 18.528 ( -0.000 -2.546 -0.000) 2.546 18.538 ( -0.000 -6.217 -0.000) 6.217 18.703 ( -0.000 -8.974 -0.000) 8.974 19.568 ( 0.000 14.345 0.000) 14.345 19.749 ( 0.000 7.818 0.000) 7.818 20.091 ( 0.000 13.735 0.000) 13.735 20.751 ( 0.000 15.212 0.000) 15.212 21.024 ( -0.000 -11.291 -0.000) 11.291 21.573 ( -0.000 -3.380 -0.000) 3.380 21.752 ( -0.000 -6.605 -0.000) 6.605 21.965 ( 0.000 0.431 0.000) 0.431 22.296 ( -0.000 -8.873 -0.000) 8.873 22.379 ( 0.000 3.764 0.000) 3.764 22.460 ( -0.000 -5.082 -0.000) 5.082 22.590 ( 0.000 1.464 0.000) 1.464 22.737 ( -0.000 -4.560 -0.000) 4.560 22.777 ( -0.000 -7.238 -0.000) 7.238 ======================= Grid point 125 (37/102) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.503 ( -4.162 -0.000 22.926) 23.301 0.537 ( 15.821 0.000 24.184) 28.899 0.796 ( -19.720 -0.000 33.151) 38.573 0.981 ( 2.809 0.000 -15.680) 15.929 1.039 ( -14.541 -0.000 -21.210) 25.716 1.511 ( 18.819 0.000 -26.300) 32.340 2.004 ( 10.205 0.000 12.170) 15.882 2.278 ( -15.533 -0.000 -11.741) 19.471 2.358 ( -1.282 -0.000 4.884) 5.050 2.450 ( 2.182 0.000 -2.580) 3.379 2.862 ( -1.898 -0.000 11.135) 11.296 2.992 ( -2.065 -0.000 0.927) 2.264 3.245 ( -0.632 -0.000 3.201) 3.263 3.273 ( -4.844 -0.000 3.118) 5.761 3.469 ( -5.092 -0.000 -1.413) 5.284 3.588 ( 2.213 0.000 -9.445) 9.701 3.633 ( -20.638 -0.000 2.417) 20.779 3.710 ( 3.612 0.000 -2.164) 4.210 3.796 ( 0.144 0.000 -1.319) 1.326 3.800 ( -3.508 -0.000 0.210) 3.515 3.919 ( -4.995 -0.000 6.072) 7.863 4.034 ( 3.517 0.000 -4.001) 5.327 4.202 ( 1.140 0.000 4.843) 4.975 4.302 ( 0.619 0.000 0.883) 1.079 4.321 ( -0.907 -0.000 -4.889) 4.973 4.383 ( 3.889 0.000 -7.291) 8.263 4.860 ( -4.817 -0.000 10.014) 11.113 4.996 ( -2.552 -0.000 -1.497) 2.959 5.308 ( -12.344 -0.000 3.262) 12.768 5.405 ( 7.237 0.000 -5.566) 9.130 5.463 ( 4.410 0.000 2.776) 5.211 5.537 ( -6.301 -0.000 -3.909) 7.415 5.629 ( -8.086 -0.000 3.302) 8.734 5.725 ( 11.484 0.000 -3.249) 11.935 5.768 ( -9.411 -0.000 3.440) 10.020 5.769 ( 1.912 0.000 1.215) 2.266 5.819 ( -1.420 -0.000 -1.743) 2.248 5.891 ( 5.367 0.000 -4.855) 7.237 6.117 ( -5.065 -0.000 2.576) 5.682 6.163 ( 3.989 0.000 -1.483) 4.256 6.316 ( -3.809 -0.000 1.658) 4.154 6.337 ( 3.234 0.000 -0.213) 3.241 6.691 ( 3.133 0.000 4.750) 5.690 6.797 ( 0.187 0.000 5.212) 5.215 6.805 ( -6.121 -0.000 -4.726) 7.733 6.900 ( -3.140 -0.000 -2.821) 4.221 6.957 ( -1.102 -0.000 -0.036) 1.102 7.002 ( 2.184 0.000 -3.661) 4.263 7.269 ( -7.010 -0.000 7.871) 10.541 7.449 ( 10.941 0.000 -8.420) 13.806 7.925 ( -6.961 -0.000 10.596) 12.678 8.152 ( 6.072 0.000 -9.276) 11.086 8.423 ( -2.381 -0.000 1.861) 3.022 8.511 ( 12.769 0.000 -5.409) 13.867 8.725 ( -8.560 -0.000 7.655) 11.483 8.819 ( 4.169 0.000 1.142) 4.322 9.010 ( 11.127 0.000 -1.758) 11.265 9.054 ( -5.126 -0.000 -3.622) 6.276 9.343 ( -0.640 -0.000 6.103) 6.136 9.502 ( 4.104 0.000 -8.336) 9.292 9.930 ( 0.871 0.000 9.669) 9.708 10.114 ( -18.890 -0.000 -6.630) 20.020 10.699 ( -4.015 -0.000 1.311) 4.224 10.726 ( 3.400 0.000 -0.895) 3.516 10.808 ( -8.598 -0.000 0.657) 8.623 10.817 ( 6.139 0.000 -0.094) 6.140 10.942 ( -1.608 -0.000 0.186) 1.619 10.945 ( 0.524 0.000 0.030) 0.525 11.294 ( -4.220 -0.000 0.919) 4.319 11.303 ( 12.391 0.000 -0.019) 12.391 11.346 ( -67.413 -0.000 -0.111) 67.413 11.361 ( 12.375 0.000 -1.259) 12.439 12.292 ( -0.507 -0.000 1.272) 1.369 12.327 ( 0.858 0.000 -1.728) 1.929 12.522 ( -8.066 -0.000 1.261) 8.164 12.545 ( 22.667 0.000 -0.774) 22.680 12.952 ( -1.403 -0.000 0.374) 1.452 12.961 ( 1.305 0.000 -0.368) 1.356 13.842 ( -0.691 -0.000 0.262) 0.739 13.848 ( 0.277 0.000 -0.259) 0.379 16.184 ( 18.813 0.000 0.278) 18.815 16.191 ( -58.466 -0.000 -0.278) 58.467 17.325 ( -4.213 -0.000 2.686) 4.996 17.401 ( 7.075 0.000 -3.854) 8.057 17.746 ( 12.645 0.000 4.051) 13.278 17.827 ( -1.358 -0.000 -2.903) 3.205 19.516 ( 34.312 0.000 0.028) 34.312 19.517 ( -18.129 -0.000 -0.090) 18.129 19.570 ( 11.199 0.000 2.664) 11.511 19.634 ( -8.534 -0.000 -2.778) 8.975 20.036 ( -15.540 -0.000 0.261) 15.542 20.041 ( 1.818 0.000 -0.132) 1.823 20.569 ( -0.392 -0.000 0.719) 0.819 20.586 ( 0.442 0.000 -0.656) 0.791 21.809 ( -0.006 -0.000 0.527) 0.527 21.822 ( -0.094 -0.000 -0.558) 0.565 22.316 ( -0.580 -0.000 1.651) 1.750 22.355 ( 0.982 0.000 -1.656) 1.925 22.940 ( 2.836 0.000 1.240) 3.095 22.973 ( -6.243 -0.000 -1.604) 6.446 23.033 ( -7.630 -0.000 0.789) 7.670 23.046 ( 2.152 0.000 -0.351) 2.181 ======================= Grid point 126 (38/102) ======================= q-point: ( 0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.534 ( 4.332 -4.626 16.947) 18.093 0.928 ( 6.724 -3.279 -17.028) 18.599 0.935 ( 17.173 -15.360 19.138) 29.952 1.124 ( -0.970 -27.243 10.131) 29.082 1.165 ( 5.127 -16.155 -11.910) 20.715 1.636 ( 15.865 -5.392 -13.358) 21.429 2.080 ( -8.339 0.523 -2.492) 8.719 2.149 ( 9.607 -3.766 8.833) 13.583 2.468 ( -0.061 -8.990 0.163) 8.992 2.565 ( 7.006 -9.103 -3.248) 11.937 2.825 ( -2.516 6.348 8.863) 11.188 3.004 ( 2.047 -0.447 -3.008) 3.666 3.122 ( -2.572 5.138 5.807) 8.169 3.167 ( 0.342 5.698 -1.001) 5.795 3.396 ( -5.528 0.487 4.971) 7.450 3.448 ( -1.445 2.110 0.898) 2.711 3.670 ( 3.015 3.110 -2.501) 5.002 3.717 ( 1.316 1.089 -3.421) 3.824 3.800 ( -6.804 -8.368 2.037) 10.975 3.919 ( -3.120 -3.654 2.678) 5.501 3.981 ( -0.777 -7.748 -1.279) 7.891 4.066 ( 1.840 0.471 -1.194) 2.243 4.183 ( -4.210 1.064 4.673) 6.379 4.223 ( -1.559 5.031 -3.550) 6.351 4.396 ( 6.660 -4.414 -3.077) 8.562 4.423 ( 9.871 1.395 -6.246) 11.763 4.850 ( -4.845 0.085 12.324) 13.243 4.978 ( -2.423 0.515 0.021) 2.477 5.179 ( -2.516 7.008 0.307) 7.452 5.303 ( -5.756 6.103 -5.013) 9.772 5.473 ( 5.109 5.522 -1.289) 7.632 5.528 ( 3.252 2.813 -1.341) 4.504 5.535 ( -10.868 3.686 2.290) 11.702 5.633 ( -8.020 1.336 -1.416) 8.253 5.672 ( 0.870 6.406 2.801) 7.045 5.789 ( 0.457 -2.832 1.107) 3.074 5.889 ( 15.098 -0.305 -2.088) 15.244 5.958 ( 7.363 -1.034 -5.693) 9.365 6.198 ( -2.475 -5.979 0.091) 6.472 6.259 ( -0.730 0.554 -0.348) 0.981 6.289 ( -7.729 -5.181 -0.660) 9.328 6.476 ( 5.341 -5.616 -1.251) 7.851 6.612 ( -2.801 5.591 2.334) 6.675 6.720 ( 4.836 -0.273 -0.826) 4.913 6.816 ( -8.120 -0.179 5.129) 9.606 6.908 ( -2.436 0.719 3.339) 4.195 6.973 ( 2.466 -4.068 -1.382) 4.954 7.099 ( 9.940 -4.097 -6.873) 12.761 7.305 ( 0.181 -4.775 3.520) 5.935 7.504 ( 19.885 6.593 -10.447) 23.410 7.916 ( -2.737 -1.376 8.922) 9.433 8.164 ( 4.749 1.259 -6.889) 8.461 8.343 ( 0.097 6.762 -0.088) 6.763 8.483 ( 8.121 8.841 -5.411) 13.168 8.707 ( -8.688 -0.684 7.922) 11.777 8.943 ( 8.432 -6.658 -0.257) 10.747 8.961 ( -4.769 3.739 -1.746) 6.307 9.108 ( 6.277 -2.355 -4.458) 8.051 9.370 ( 0.230 -0.666 5.179) 5.226 9.524 ( 2.893 -0.599 -5.487) 6.232 9.709 ( -23.180 10.555 20.365) 32.611 9.898 ( 1.164 5.950 8.210) 10.206 10.445 ( -4.375 9.319 4.042) 11.060 10.623 ( -6.023 5.683 -1.228) 8.372 10.696 ( 2.688 3.789 0.339) 4.658 10.775 ( 5.401 4.546 -6.189) 9.388 10.985 ( -7.564 -3.395 -0.800) 8.329 11.006 ( -5.360 -2.624 5.152) 7.884 11.198 ( -6.734 -4.553 2.044) 8.381 11.314 ( 2.439 0.857 0.672) 2.671 11.408 ( -2.493 -9.439 -4.073) 10.578 11.601 ( 27.123 0.153 6.551) 27.904 12.306 ( -1.874 -1.637 1.112) 2.726 12.310 ( -0.690 3.517 -1.873) 4.044 12.431 ( -0.777 2.332 -1.697) 2.987 12.513 ( 12.011 12.335 -0.740) 17.233 12.948 ( -0.748 0.535 0.815) 1.229 12.973 ( 1.366 0.071 -0.311) 1.403 13.822 ( -1.071 2.025 1.291) 2.630 13.884 ( -0.721 -0.870 -4.144) 4.295 15.890 ( -11.049 1.713 8.003) 13.750 16.250 ( 17.184 8.641 2.402) 19.384 17.367 ( -6.220 -7.559 3.431) 10.373 17.476 ( 1.250 -5.570 -1.608) 5.931 17.720 ( -12.229 1.108 -2.642) 12.560 18.083 ( 26.387 -7.514 -5.948) 28.073 19.239 ( -11.192 8.445 1.159) 14.069 19.434 ( 16.063 16.121 1.348) 22.797 19.534 ( -3.867 6.636 0.067) 7.681 19.631 ( 5.832 10.231 -4.439) 12.585 20.104 ( -16.480 -12.322 -0.487) 20.583 20.365 ( 19.049 -9.581 -3.267) 21.571 20.513 ( -5.988 -3.098 2.070) 7.052 20.655 ( 6.918 -5.126 -0.658) 8.636 21.784 ( 2.049 0.338 4.266) 4.745 21.808 ( 0.192 -0.187 -0.705) 0.754 22.308 ( -0.972 1.085 0.540) 1.554 22.357 ( 1.731 -0.236 -1.934) 2.606 22.859 ( -5.495 0.924 4.732) 7.310 22.956 ( -2.184 -0.887 -4.256) 4.865 23.145 ( -1.942 -7.280 4.632) 8.845 23.215 ( -12.049 -15.883 -8.663) 21.737 ======================= Grid point 127 (39/102) ======================= q-point: ( 0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.803 ( 10.215 -15.285 3.198) 18.660 1.036 ( 13.484 -3.710 -11.021) 17.806 1.329 ( 9.004 -13.259 -3.652) 16.438 1.440 ( 10.001 -16.414 -0.109) 19.221 1.763 ( 9.960 -29.376 10.021) 32.597 1.888 ( 7.544 -11.941 4.473) 14.815 2.116 ( 1.897 -6.652 -1.996) 7.200 2.351 ( 9.970 -6.343 8.972) 14.837 2.593 ( -3.847 -1.517 -0.565) 4.173 2.703 ( 1.567 -3.176 -7.638) 8.419 2.805 ( 9.550 -8.936 -1.502) 13.165 2.938 ( 4.194 7.339 -8.154) 11.745 3.109 ( 2.673 -3.178 1.823) 4.535 3.221 ( 3.052 -5.225 2.705) 6.628 3.366 ( -1.096 0.888 -0.369) 1.458 3.460 ( -1.822 -2.784 4.331) 5.461 3.591 ( -0.157 5.342 -2.148) 5.759 3.649 ( -1.238 4.804 1.344) 5.140 3.885 ( -1.373 -1.840 -0.636) 2.383 3.949 ( -4.156 -2.444 -0.106) 4.822 4.010 ( -0.570 3.330 -0.785) 3.468 4.039 ( -3.008 1.033 2.370) 3.967 4.114 ( 0.587 4.443 -1.760) 4.815 4.201 ( -7.566 -6.271 1.179) 9.897 4.412 ( 5.895 3.079 -7.041) 9.686 4.538 ( 5.621 -4.032 -0.774) 6.961 4.820 ( -8.234 3.862 12.910) 15.791 4.905 ( -3.312 3.061 1.019) 4.624 5.059 ( 2.363 4.062 -3.653) 5.952 5.182 ( -10.433 0.063 -0.359) 10.439 5.287 ( 2.205 12.692 -2.078) 13.049 5.453 ( -1.240 3.054 1.683) 3.701 5.464 ( -2.038 3.083 -1.146) 3.869 5.586 ( -3.681 -0.675 1.023) 3.880 5.639 ( -5.114 -2.814 -2.534) 6.364 5.806 ( 0.643 1.913 1.219) 2.358 6.007 ( 15.060 -0.708 -2.086) 15.221 6.031 ( -0.951 -0.464 2.170) 2.415 6.101 ( -2.497 1.991 -1.969) 3.752 6.290 ( 0.049 -2.747 0.362) 2.771 6.366 ( -0.250 -3.036 -2.860) 4.178 6.454 ( 10.739 7.391 0.276) 13.040 6.601 ( -7.251 -1.026 0.300) 7.330 6.713 ( -3.439 0.918 -1.691) 3.940 6.806 ( -0.356 -1.237 2.040) 2.412 6.932 ( 1.526 -2.469 2.341) 3.729 7.059 ( 3.348 -2.476 0.719) 4.226 7.190 ( 15.182 3.441 -1.362) 15.627 7.397 ( 2.497 -2.745 -2.067) 4.248 7.457 ( 13.960 9.629 -7.527) 18.553 7.973 ( 1.829 -2.283 6.520) 7.147 8.151 ( -0.478 1.226 -0.963) 1.631 8.226 ( 6.081 7.376 -3.506) 10.183 8.380 ( 5.187 5.383 -4.591) 8.773 8.641 ( -9.125 1.947 6.988) 11.657 8.850 ( -3.496 4.557 -1.135) 5.855 9.091 ( 1.243 -3.598 1.646) 4.147 9.170 ( 2.288 -3.155 -4.076) 5.639 9.389 ( -6.259 -1.961 10.648) 12.506 9.536 ( -1.867 -0.537 7.254) 7.510 9.635 ( 5.401 -0.102 -0.929) 5.481 9.813 ( 0.916 4.540 0.870) 4.713 10.315 ( -0.158 5.160 -1.999) 5.536 10.456 ( -0.477 6.572 -1.727) 6.812 10.680 ( 1.364 0.100 0.643) 1.512 10.753 ( 0.088 0.067 -5.378) 5.379 10.943 ( -7.471 -0.205 0.401) 7.484 11.030 ( -4.383 -3.229 6.425) 8.421 11.244 ( 3.562 -0.231 1.801) 3.999 11.314 ( 4.810 2.148 -0.525) 5.294 11.527 ( 1.745 -4.421 -3.306) 5.790 11.701 ( 13.140 6.215 2.964) 14.835 12.215 ( -2.745 2.652 -2.970) 4.837 12.300 ( -5.809 0.712 1.141) 5.963 12.399 ( 9.315 7.194 -0.596) 11.785 12.430 ( 6.835 2.267 0.063) 7.201 12.929 ( -1.078 0.597 1.909) 2.273 12.975 ( 0.057 -0.019 -1.200) 1.202 13.751 ( -1.489 5.259 2.154) 5.875 13.829 ( -2.235 4.043 -3.554) 5.828 15.870 ( 0.261 -0.278 3.788) 3.807 16.182 ( 9.139 8.627 -1.055) 12.612 17.451 ( -11.161 -7.630 -0.050) 13.520 17.614 ( -1.783 -7.520 2.530) 8.132 17.664 ( 0.753 -2.941 -1.897) 3.580 18.288 ( 21.494 3.150 -0.304) 21.726 19.030 ( -10.145 9.115 -1.022) 13.677 19.206 ( 4.258 14.081 -0.632) 14.724 19.403 ( 4.191 10.655 2.108) 11.642 19.450 ( 4.598 9.877 -2.638) 11.210 20.163 ( -9.798 -4.685 -1.226) 10.930 20.217 ( -8.847 10.705 -0.735) 13.907 20.762 ( 7.617 -6.351 0.450) 9.928 20.940 ( 12.133 -17.536 1.562) 21.381 21.828 ( -0.169 -2.410 -1.260) 2.724 21.875 ( 3.726 -5.833 2.531) 7.370 22.269 ( -1.939 2.028 0.691) 2.890 22.380 ( 2.871 -0.868 -3.898) 4.919 22.819 ( -5.384 0.637 7.140) 8.965 22.959 ( -1.620 -2.022 -5.825) 6.375 23.237 ( -5.894 -4.789 6.222) 9.818 23.320 ( -9.606 -7.530 -7.078) 14.109 ======================= Grid point 128 (40/102) ======================= q-point: ( 0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.167 ( 9.507 -14.656 -1.890) 17.571 1.243 ( 10.136 -12.270 0.211) 15.917 1.594 ( 7.864 -11.795 -4.983) 15.027 1.782 ( 12.266 -8.994 3.996) 15.727 2.064 ( 0.946 -4.272 6.122) 7.525 2.282 ( -4.331 -16.795 4.856) 18.012 2.342 ( 14.887 -15.937 -2.962) 22.009 2.502 ( 3.204 -7.678 4.809) 9.610 2.632 ( 0.521 -2.166 -1.622) 2.756 2.760 ( 9.195 2.609 -5.254) 10.907 2.947 ( 5.962 -6.685 -4.407) 9.983 2.999 ( 2.697 -6.718 -2.402) 7.627 3.201 ( 4.614 -2.636 2.729) 5.973 3.307 ( -3.184 -3.621 -0.232) 4.827 3.377 ( 5.232 -1.926 -3.468) 6.565 3.450 ( -5.508 1.399 2.061) 6.046 3.497 ( -0.569 3.698 -1.990) 4.238 3.620 ( 1.745 -0.890 1.338) 2.372 3.831 ( -0.120 6.423 1.643) 6.631 3.890 ( -2.199 6.855 -0.437) 7.212 3.962 ( 0.523 -2.539 -1.643) 3.069 4.036 ( -4.886 -1.054 2.342) 5.520 4.095 ( 1.564 -1.279 -1.014) 2.261 4.237 ( -5.790 -2.484 0.425) 6.315 4.385 ( -0.781 0.599 -3.407) 3.546 4.551 ( -2.478 5.353 3.679) 6.952 4.668 ( -4.337 4.109 3.309) 6.829 4.892 ( -1.596 0.689 3.689) 4.078 5.036 ( 3.123 0.095 -7.171) 7.822 5.087 ( -0.066 6.781 0.147) 6.783 5.129 ( -11.324 -0.297 -1.196) 11.390 5.406 ( 1.205 3.179 1.042) 3.555 5.436 ( -4.831 -3.884 0.144) 6.201 5.610 ( 1.095 -2.610 0.508) 2.875 5.631 ( -9.065 -1.734 3.581) 9.899 5.774 ( -0.568 0.632 -1.043) 1.345 5.948 ( -0.821 3.218 0.106) 3.322 6.141 ( 13.311 -1.623 -0.030) 13.410 6.178 ( 4.239 -4.533 -1.753) 6.449 6.314 ( 8.066 2.342 2.560) 8.781 6.372 ( -0.513 0.494 -3.396) 3.470 6.462 ( 4.163 0.024 0.327) 4.176 6.511 ( -5.254 4.318 0.585) 6.826 6.664 ( -4.762 0.616 -1.433) 5.011 6.842 ( 3.337 -0.698 0.469) 3.441 6.996 ( -0.074 -3.513 2.637) 4.393 7.086 ( 5.906 4.611 1.250) 7.597 7.206 ( 14.934 5.174 -5.778) 16.827 7.369 ( 5.400 6.461 -0.017) 8.420 7.430 ( 5.201 1.194 -2.109) 5.738 7.997 ( -1.106 2.243 4.603) 5.238 8.097 ( 2.887 3.775 0.532) 4.782 8.192 ( 6.879 2.087 -3.847) 8.154 8.334 ( 4.054 4.147 -5.947) 8.307 8.549 ( -8.277 2.576 5.103) 10.059 8.758 ( -2.377 2.182 -1.400) 3.517 9.093 ( -4.172 1.985 3.929) 6.065 9.213 ( -1.554 -1.206 -4.310) 4.738 9.377 ( -8.816 0.031 12.207) 15.057 9.538 ( 0.486 1.426 6.486) 6.658 9.645 ( 0.093 2.585 -1.932) 3.229 9.779 ( 4.431 -0.317 -8.157) 9.288 10.247 ( 0.735 1.928 -1.455) 2.525 10.443 ( 4.715 -3.130 0.049) 5.660 10.695 ( -3.694 -1.488 -2.297) 4.597 10.741 ( 0.110 -1.319 -0.751) 1.522 10.929 ( -1.498 -1.636 -0.117) 2.221 11.087 ( -1.108 -3.758 6.240) 7.369 11.256 ( 2.797 1.634 1.970) 3.791 11.303 ( 8.010 4.304 -1.808) 9.271 11.547 ( 5.053 5.867 -2.798) 8.233 11.646 ( -0.025 2.999 -0.265) 3.011 12.170 ( -0.350 1.469 -0.992) 1.807 12.203 ( -2.508 5.507 -0.003) 6.051 12.374 ( 5.412 2.683 1.108) 6.141 12.448 ( 4.656 0.591 -0.391) 4.710 12.936 ( -0.122 -1.703 2.153) 2.747 12.981 ( -0.508 -1.549 -1.877) 2.486 13.621 ( -2.986 7.814 1.325) 8.470 13.721 ( -2.025 5.144 -1.769) 5.805 15.888 ( 1.285 -0.130 2.308) 2.645 16.097 ( 3.866 5.772 -1.853) 7.190 17.469 ( -10.483 -4.393 -1.058) 11.415 17.713 ( -0.331 -6.248 0.973) 6.332 17.812 ( 3.684 -7.783 0.367) 8.619 18.323 ( 15.473 7.377 1.652) 17.221 18.734 ( -9.382 13.528 -1.341) 16.518 19.068 ( 1.330 4.889 1.360) 5.246 19.205 ( 3.005 11.789 -4.285) 12.899 19.367 ( 4.968 5.475 2.517) 7.810 19.927 ( -6.970 12.862 0.010) 14.629 20.163 ( -6.999 -1.414 -1.193) 7.240 20.908 ( 4.046 -5.398 -0.044) 6.746 21.307 ( 10.288 -13.238 1.591) 16.841 21.884 ( -1.142 -4.499 -0.820) 4.713 22.005 ( 3.149 -3.865 1.527) 5.214 22.219 ( -2.127 1.592 1.965) 3.305 22.406 ( 3.969 -0.504 -7.766) 8.736 22.790 ( -5.381 -0.138 9.732) 11.122 22.972 ( -0.937 -1.702 -5.870) 6.183 23.265 ( -5.760 -2.222 4.927) 7.899 23.336 ( -7.140 -3.135 -4.574) 9.040 ======================= Grid point 129 (41/102) ======================= q-point: ( 0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.462 ( 4.627 -12.410 2.229) 13.431 1.546 ( 4.081 -12.938 3.692) 14.059 1.841 ( 4.177 -9.985 2.030) 11.013 1.936 ( 9.690 -3.148 -3.628) 10.815 2.204 ( 8.715 -6.315 -1.023) 10.811 2.468 ( -2.620 -6.968 0.056) 7.444 2.480 ( 5.025 7.696 -7.317) 11.748 2.689 ( -2.503 -8.419 4.531) 9.883 2.782 ( 9.888 -10.205 0.558) 14.220 2.806 ( 1.790 -2.378 0.075) 2.977 3.023 ( -1.593 -1.006 3.965) 4.390 3.093 ( 0.883 -5.511 -4.717) 7.308 3.252 ( -0.722 1.455 4.638) 4.914 3.359 ( 0.315 -3.334 -3.546) 4.878 3.442 ( -2.166 -1.340 1.109) 2.778 3.459 ( 2.009 -5.232 -1.388) 5.773 3.505 ( 3.760 -3.110 -1.706) 5.169 3.617 ( 3.151 1.124 -3.838) 5.091 3.705 ( 0.149 7.762 1.310) 7.873 3.776 ( 0.916 3.478 -0.948) 3.719 3.983 ( -5.962 4.374 4.572) 8.694 4.040 ( 4.617 -2.991 -2.561) 6.067 4.083 ( -3.948 3.533 3.729) 6.478 4.233 ( 0.635 -1.122 -1.992) 2.373 4.371 ( -4.893 -2.776 -1.752) 5.892 4.454 ( -1.168 3.052 5.126) 6.080 4.625 ( 1.161 0.511 -0.139) 1.276 4.847 ( -5.473 2.083 2.395) 6.327 4.948 ( -2.060 2.984 -5.544) 6.625 5.054 ( -10.071 -1.091 3.070) 10.585 5.113 ( 3.221 -1.922 -6.778) 7.746 5.380 ( 2.821 1.907 1.201) 3.611 5.495 ( -5.165 -5.962 1.518) 8.033 5.613 ( -7.374 -3.447 4.010) 9.074 5.672 ( 3.195 -1.070 0.253) 3.379 5.770 ( -0.469 -0.425 -1.447) 1.579 5.900 ( 0.374 1.468 0.498) 1.595 6.204 ( 5.752 4.624 2.161) 7.690 6.252 ( -0.078 1.477 -1.067) 1.824 6.375 ( 1.917 -1.326 -0.210) 2.340 6.386 ( 7.916 -2.373 0.109) 8.265 6.421 ( 1.058 -0.896 -1.075) 1.755 6.485 ( 2.943 -1.042 -0.053) 3.123 6.647 ( -0.310 -1.010 -0.713) 1.274 6.864 ( 3.394 1.451 0.481) 3.722 6.998 ( 4.433 7.100 0.494) 8.385 7.068 ( -0.025 -2.463 1.373) 2.820 7.201 ( 4.559 2.989 -7.425) 9.212 7.327 ( 5.699 3.034 4.225) 7.716 7.430 ( 6.201 3.025 -0.887) 6.956 7.944 ( -4.672 0.276 2.010) 5.093 8.067 ( 8.849 5.211 -1.449) 10.371 8.207 ( 6.417 1.923 -0.116) 6.700 8.247 ( -0.573 4.333 -5.445) 6.982 8.438 ( -8.378 3.826 4.380) 10.199 8.740 ( 0.999 -0.889 -4.651) 4.839 8.990 ( -7.845 5.383 4.739) 10.629 9.179 ( -3.986 0.788 -2.772) 4.919 9.301 ( -5.966 4.012 6.799) 9.895 9.536 ( -1.419 -0.177 8.604) 8.722 9.590 ( -3.926 0.239 -0.876) 4.029 9.825 ( 7.694 -0.850 -10.295) 12.880 10.231 ( -0.582 0.512 1.058) 1.312 10.584 ( 5.126 -6.764 0.604) 8.508 10.692 ( -3.577 -3.200 -2.924) 5.620 10.799 ( 2.173 -2.784 1.030) 3.679 10.955 ( -0.960 -1.842 -0.546) 2.148 11.162 ( 0.253 -2.972 4.901) 5.737 11.252 ( 1.259 0.142 0.581) 1.394 11.272 ( 9.967 6.001 -2.447) 11.889 11.412 ( 0.892 8.838 -1.670) 9.039 11.599 ( -2.326 2.274 -0.179) 3.257 12.088 ( -1.268 5.157 -1.016) 5.407 12.138 ( 0.573 2.201 0.600) 2.352 12.383 ( 2.722 0.071 1.006) 2.902 12.468 ( 2.589 0.210 -0.449) 2.636 12.997 ( 1.358 -3.637 1.542) 4.177 13.022 ( 0.290 -3.696 -1.558) 4.021 13.447 ( -4.329 8.275 0.166) 9.340 13.615 ( -1.254 4.972 -0.241) 5.133 15.901 ( 0.568 -0.145 1.492) 1.603 16.027 ( 1.326 3.717 -1.410) 4.191 17.469 ( -5.614 -2.573 -0.624) 6.207 17.818 ( -0.767 -5.129 1.423) 5.378 17.967 ( 0.766 -7.458 -0.536) 7.517 18.282 ( 12.430 9.214 -1.222) 15.521 18.465 ( -8.660 7.277 1.900) 11.470 19.024 ( -1.609 3.136 -2.860) 4.539 19.041 ( 6.211 6.834 1.149) 9.306 19.321 ( 2.960 3.581 1.177) 4.793 19.671 ( -5.997 9.861 -0.255) 11.544 20.124 ( -3.738 0.789 -0.341) 3.836 21.012 ( 2.254 -3.542 -0.073) 4.199 21.572 ( 7.412 -8.991 0.634) 11.670 21.960 ( -1.703 -4.988 -0.021) 5.271 22.024 ( -0.704 2.567 0.277) 2.676 22.210 ( -0.235 -0.323 4.068) 4.087 22.418 ( 3.960 0.457 -9.722) 10.508 22.797 ( -3.611 -2.192 8.934) 9.883 22.976 ( -0.863 -0.520 -3.738) 3.871 23.262 ( -3.314 -0.449 2.246) 4.028 23.323 ( -4.877 -1.533 -2.396) 5.646 ======================= Grid point 130 (42/102) ======================= q-point: ( 0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.639 ( -2.016 -6.084 7.231) 9.662 1.787 ( 1.103 -10.197 0.110) 10.258 1.932 ( 3.768 0.891 -7.162) 8.142 2.149 ( 8.810 -9.408 0.502) 12.899 2.309 ( 1.305 4.282 1.139) 4.619 2.361 ( 2.388 2.938 1.350) 4.020 2.491 ( 0.269 1.280 -5.044) 5.211 2.707 ( -1.327 2.711 -2.762) 4.091 2.796 ( -1.569 -0.551 0.880) 1.881 3.048 ( 0.245 -8.799 4.882) 10.065 3.071 ( 1.719 -4.463 0.335) 4.794 3.186 ( -3.901 3.446 4.186) 6.680 3.245 ( 3.370 -9.981 -2.814) 10.904 3.373 ( -1.114 1.076 -1.302) 2.023 3.439 ( -2.393 0.223 0.298) 2.422 3.472 ( -1.938 0.960 1.428) 2.592 3.508 ( 3.302 8.989 -2.211) 9.828 3.625 ( 0.479 -3.005 -0.762) 3.137 3.733 ( 1.201 0.552 -0.635) 1.466 3.757 ( 7.377 -3.453 -1.763) 8.334 3.832 ( -7.132 3.803 2.911) 8.590 3.996 ( -0.250 2.513 0.598) 2.596 4.091 ( 4.233 0.467 -1.847) 4.642 4.272 ( -0.443 0.299 1.736) 1.816 4.399 ( -3.257 -4.721 -3.035) 6.489 4.422 ( 0.619 1.033 0.565) 1.330 4.644 ( 1.048 -0.380 1.173) 1.618 4.774 ( -5.820 0.607 3.509) 6.823 4.903 ( 1.084 1.331 -6.248) 6.479 5.033 ( -3.422 -0.802 3.452) 4.927 5.120 ( -0.227 0.820 -3.184) 3.295 5.379 ( 1.608 0.067 0.735) 1.770 5.555 ( -6.801 -4.880 1.714) 8.544 5.648 ( 5.553 2.294 0.915) 6.078 5.678 ( 1.259 0.308 1.723) 2.156 5.777 ( -1.510 -1.675 -1.964) 2.991 5.938 ( -2.912 -6.381 1.407) 7.154 6.123 ( 0.784 5.231 1.414) 5.475 6.143 ( -1.192 6.733 -0.868) 6.892 6.353 ( 0.567 0.899 -0.289) 1.102 6.509 ( 4.435 -3.356 0.022) 5.561 6.527 ( 3.098 -3.731 -1.428) 5.055 6.560 ( 2.206 -1.986 0.634) 3.035 6.692 ( 3.086 -4.398 -1.815) 5.671 6.817 ( -0.572 5.732 1.496) 5.952 6.928 ( 1.861 2.709 0.185) 3.292 7.090 ( -1.601 -0.749 0.241) 1.784 7.146 ( -0.919 2.462 -1.725) 3.144 7.348 ( 1.618 -1.023 1.214) 2.267 7.416 ( 5.006 2.939 -0.878) 5.871 7.941 ( -5.914 -3.427 1.902) 7.094 8.039 ( 10.788 5.062 -4.103) 12.603 8.150 ( 0.338 3.022 -2.893) 4.197 8.244 ( 5.342 0.415 1.108) 5.472 8.337 ( -9.910 0.267 2.906) 10.331 8.769 ( 1.360 -0.485 -2.846) 3.192 8.834 ( -4.063 4.016 -0.252) 5.718 9.141 ( -2.938 0.246 1.099) 3.147 9.218 ( -1.037 2.814 2.421) 3.854 9.546 ( 1.332 1.315 7.437) 7.669 9.583 ( -6.857 -3.504 2.838) 8.206 9.856 ( 5.081 0.677 -9.806) 11.065 10.224 ( -0.110 -0.138 0.428) 0.463 10.708 ( 1.088 -3.062 2.097) 3.868 10.746 ( -1.675 -4.774 -1.201) 5.200 10.853 ( 2.890 -0.670 0.156) 2.970 10.957 ( -0.351 1.198 -2.246) 2.569 11.194 ( -1.279 -0.185 2.183) 2.537 11.231 ( 6.563 4.113 -1.561) 7.901 11.267 ( -0.881 1.246 -1.721) 2.300 11.310 ( 0.140 -0.104 2.022) 2.030 11.541 ( -1.309 1.731 -0.036) 2.170 12.008 ( -0.451 2.402 -1.241) 2.740 12.112 ( -0.168 0.975 1.554) 1.842 12.405 ( 1.351 -0.481 -0.012) 1.434 12.477 ( 0.624 0.085 -0.041) 0.631 13.063 ( 0.467 -2.152 0.007) 2.202 13.117 ( 2.749 -5.603 -0.056) 6.241 13.275 ( -4.261 7.099 -0.282) 8.285 13.536 ( -0.267 2.613 0.294) 2.643 15.912 ( -0.161 -0.840 0.919) 1.255 15.979 ( 0.472 2.115 -0.921) 2.355 17.474 ( -1.653 -0.920 -0.190) 1.901 17.891 ( -0.622 -3.383 2.657) 4.346 18.074 ( -2.711 -5.386 -1.541) 6.224 18.154 ( 5.393 9.895 -4.639) 12.186 18.395 ( -1.667 -0.906 4.884) 5.240 18.918 ( 2.289 4.931 -3.970) 6.732 19.051 ( 0.540 -1.241 3.242) 3.514 19.288 ( 0.905 1.727 -0.189) 1.959 19.510 ( -2.709 3.805 -0.311) 4.681 20.092 ( -1.246 0.442 0.088) 1.325 21.065 ( 0.804 -1.070 0.001) 1.338 21.738 ( 3.526 -4.250 0.158) 5.524 21.954 ( -1.342 2.615 -0.117) 2.941 22.028 ( -1.365 -3.287 0.014) 3.559 22.215 ( 0.004 0.519 3.509) 3.547 22.404 ( 2.146 1.738 -6.439) 7.007 22.847 ( -0.728 -3.298 3.924) 5.177 22.958 ( -1.398 1.205 -0.019) 1.846 23.249 ( -0.461 0.283 -0.278) 0.608 23.314 ( -1.899 -0.718 -0.777) 2.174 ======================= Grid point 132 (43/102) ======================= q-point: (-0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.707 ( -5.465 -1.795 7.729) 9.635 1.825 ( -0.412 9.335 -3.364) 9.931 1.896 ( 1.054 0.419 -9.138) 9.208 2.097 ( -6.517 9.883 4.349) 12.612 2.332 ( -3.427 2.827 1.917) 4.838 2.362 ( -1.237 -4.577 1.291) 4.914 2.447 ( 5.371 3.220 -4.873) 7.935 2.698 ( 5.167 -2.522 -1.815) 6.029 2.797 ( -2.398 -0.249 1.639) 2.915 3.024 ( -4.355 7.424 2.123) 8.865 3.099 ( -3.256 2.233 3.224) 5.097 3.206 ( -1.810 -0.939 -1.573) 2.575 3.277 ( -0.522 4.392 0.684) 4.476 3.372 ( 3.006 2.608 -2.899) 4.924 3.429 ( 1.580 -4.101 2.701) 5.158 3.462 ( 2.027 0.487 0.653) 2.185 3.508 ( 2.161 -5.786 -2.981) 6.859 3.601 ( -2.925 1.890 -0.570) 3.529 3.674 ( -3.281 0.713 0.930) 3.484 3.725 ( -3.942 2.406 3.222) 5.631 3.972 ( 6.470 -6.158 -6.389) 10.982 3.999 ( -0.776 -1.874 0.666) 2.135 4.115 ( -1.102 -2.706 -2.745) 4.009 4.178 ( -2.662 4.656 6.074) 8.102 4.401 ( 3.398 3.652 -1.533) 5.219 4.485 ( 0.322 -4.122 -3.288) 5.283 4.632 ( -2.370 1.196 2.027) 3.339 4.772 ( 1.675 -0.822 4.856) 5.202 4.878 ( 5.775 1.983 -5.573) 8.267 5.029 ( -2.220 -0.092 3.449) 4.103 5.106 ( 2.700 0.302 -2.503) 3.694 5.382 ( -0.595 0.730 0.599) 1.116 5.590 ( 0.158 -0.551 -1.955) 2.037 5.626 ( 2.507 2.203 5.221) 6.196 5.688 ( 2.228 -0.116 -0.586) 2.307 5.780 ( -3.132 -0.585 -1.869) 3.694 5.939 ( 2.268 7.989 1.522) 8.443 6.115 ( -0.212 -6.354 1.386) 6.507 6.142 ( -3.705 -7.122 -0.440) 8.040 6.364 ( 2.802 -0.527 -0.917) 2.995 6.500 ( -4.835 4.040 0.366) 6.311 6.522 ( -2.369 3.596 -0.383) 4.323 6.582 ( -3.054 2.492 -0.687) 4.001 6.690 ( 0.616 0.317 -2.490) 2.584 6.825 ( -1.762 -2.759 1.881) 3.776 6.901 ( -1.433 -0.655 1.060) 1.899 7.111 ( -1.802 -2.384 -1.349) 3.279 7.119 ( 1.029 -0.443 0.634) 1.287 7.365 ( -1.620 -0.481 0.334) 1.723 7.410 ( -1.647 -1.484 -0.812) 2.361 7.965 ( -6.401 -3.637 1.748) 7.567 8.028 ( 8.795 3.258 -4.365) 10.345 8.143 ( 0.758 -2.747 -2.940) 4.094 8.254 ( -9.309 -0.476 1.034) 9.378 8.340 ( 6.852 -3.654 2.374) 8.121 8.677 ( -6.388 1.834 1.367) 6.785 8.933 ( 12.743 -5.559 -5.096) 14.807 9.128 ( -0.806 0.065 2.221) 2.363 9.197 ( 1.870 0.734 3.319) 3.880 9.554 ( 3.517 0.826 3.342) 4.921 9.599 ( -8.775 -2.898 7.373) 11.822 9.839 ( 2.142 1.132 -10.410) 10.688 10.234 ( 1.084 -0.028 -0.143) 1.094 10.706 ( -2.074 2.972 1.787) 4.041 10.774 ( -1.021 2.328 -2.981) 3.918 10.863 ( 1.384 0.496 1.166) 1.876 10.920 ( 0.963 1.247 -1.165) 1.959 11.169 ( -3.861 0.248 2.219) 4.460 11.238 ( -0.628 -1.088 -0.091) 1.260 11.249 ( 0.979 -0.247 -0.509) 1.131 11.342 ( -1.639 -3.188 -0.466) 3.615 11.542 ( 0.977 -1.934 -0.120) 2.170 12.002 ( 0.476 -2.096 -0.851) 2.312 12.111 ( -0.883 -0.863 1.548) 1.980 12.417 ( -0.537 -0.600 -0.697) 1.065 12.471 ( -0.832 0.563 0.337) 1.059 13.056 ( -0.428 3.051 0.311) 3.097 13.134 ( -3.181 4.679 -0.964) 5.739 13.262 ( 3.637 -7.182 0.520) 8.067 13.539 ( 1.426 -2.337 0.152) 2.742 15.936 ( -0.531 -1.989 0.241) 2.072 15.956 ( 0.063 0.604 -0.263) 0.661 17.473 ( 1.662 0.980 -0.148) 1.934 17.934 ( 0.830 0.280 1.728) 1.937 18.028 ( 5.783 7.854 -1.316) 9.842 18.132 ( -9.695 -7.654 -1.825) 12.486 18.430 ( 2.572 -1.392 2.327) 3.738 18.884 ( -1.024 -1.503 -1.380) 2.284 19.084 ( -1.489 -2.008 0.647) 2.583 19.281 ( -0.949 -1.362 0.135) 1.666 19.509 ( 2.427 -3.867 -0.244) 4.572 20.094 ( 1.343 -0.597 -0.045) 1.470 21.061 ( -0.697 1.473 0.177) 1.639 21.729 ( -3.687 4.623 0.663) 5.951 21.970 ( 2.220 -3.380 -0.998) 4.165 22.041 ( 0.102 1.426 -0.906) 1.693 22.221 ( -1.426 -0.807 4.673) 4.952 22.364 ( 1.303 2.332 -5.244) 5.886 22.898 ( -1.193 -0.038 2.416) 2.695 22.922 ( 0.639 0.271 0.371) 0.787 23.248 ( 1.653 0.365 -0.167) 1.702 23.317 ( 1.882 0.188 -0.919) 2.102 ======================= Grid point 133 (44/102) ======================= q-point: (-0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.536 ( -7.571 16.979 -0.373) 18.594 1.573 ( -5.626 12.938 0.666) 14.124 1.832 ( -10.808 10.301 2.013) 15.065 1.922 ( -0.573 -1.742 -2.198) 2.863 2.211 ( -5.401 7.042 0.467) 8.886 2.403 ( -2.963 -5.563 -5.063) 8.085 2.414 ( 1.187 5.919 3.008) 6.744 2.747 ( -6.817 6.342 -1.652) 9.456 2.772 ( -2.583 10.206 6.563) 12.406 2.807 ( 1.489 -0.865 -1.645) 2.382 3.026 ( -2.440 3.840 0.805) 4.620 3.114 ( -0.465 6.876 -2.649) 7.384 3.285 ( 2.302 -0.026 2.647) 3.508 3.333 ( -0.355 0.850 -2.931) 3.072 3.418 ( -0.968 5.869 0.616) 5.980 3.472 ( -2.959 2.666 0.316) 3.995 3.517 ( -1.210 1.970 -3.572) 4.255 3.564 ( -0.341 -2.421 0.455) 2.487 3.732 ( -0.448 -6.320 0.964) 6.409 3.785 ( 3.747 -8.276 -4.501) 10.139 3.962 ( -3.737 2.546 5.541) 7.152 4.016 ( -2.159 -1.924 1.724) 3.367 4.134 ( -0.037 0.579 -1.135) 1.274 4.221 ( 1.683 -2.968 -1.142) 3.598 4.339 ( 3.937 5.128 1.479) 6.632 4.521 ( 2.694 -0.053 0.247) 2.706 4.612 ( 0.269 -0.778 0.685) 1.071 4.835 ( 1.840 -2.815 3.302) 4.713 4.930 ( 12.026 -2.129 -4.848) 13.141 5.025 ( -4.448 -2.321 1.381) 5.204 5.133 ( 6.325 0.279 -4.287) 7.645 5.369 ( 0.652 0.133 1.431) 1.579 5.533 ( 3.660 5.678 -0.897) 6.815 5.643 ( -1.838 -0.931 3.136) 3.752 5.697 ( 0.940 6.604 -1.335) 6.803 5.740 ( 2.718 -1.221 -0.305) 2.995 5.891 ( 0.817 -1.276 1.381) 2.050 6.195 ( -3.365 -0.904 2.784) 4.459 6.228 ( -9.491 -4.941 -0.058) 10.700 6.356 ( -5.757 2.950 0.108) 6.469 6.409 ( 0.327 0.151 -1.555) 1.596 6.427 ( -3.043 0.907 0.245) 3.185 6.492 ( -1.330 2.058 -1.041) 2.663 6.674 ( -1.129 1.834 -1.964) 2.915 6.864 ( -1.299 -1.891 0.292) 2.312 6.946 ( -5.422 -7.708 2.674) 9.796 7.100 ( -3.887 -0.002 1.913) 4.332 7.141 ( 2.271 2.091 -3.659) 4.788 7.389 ( -4.767 -5.028 -0.979) 6.997 7.421 ( -6.454 -3.251 -0.492) 7.243 7.999 ( -4.847 -4.976 1.545) 7.116 8.041 ( 4.339 -0.332 -2.110) 4.836 8.184 ( -6.306 0.144 -0.284) 6.314 8.231 ( -0.633 -5.269 -3.353) 6.278 8.490 ( 7.736 -5.162 1.527) 9.425 8.657 ( -1.087 -2.140 0.167) 2.406 9.084 ( 6.878 -0.333 1.466) 7.040 9.154 ( 5.712 -1.610 -3.579) 6.930 9.250 ( 2.093 -5.123 7.806) 9.568 9.573 ( -3.760 1.165 3.443) 5.229 9.590 ( -1.371 -1.959 5.601) 6.090 9.830 ( 2.475 -1.448 -12.547) 12.870 10.224 ( -0.353 1.738 1.639) 2.415 10.590 ( -4.803 6.922 0.382) 8.434 10.691 ( 2.789 4.508 -2.434) 5.833 10.838 ( 0.313 2.592 -3.041) 4.008 10.930 ( 2.605 0.872 2.166) 3.499 11.143 ( -10.411 -2.547 6.143) 12.354 11.253 ( 0.369 -0.514 -2.027) 2.124 11.261 ( -3.119 -2.615 0.398) 4.090 11.415 ( -2.069 -6.193 -1.695) 6.746 11.599 ( 2.250 -2.249 -0.165) 3.185 12.078 ( 1.982 -5.094 -0.299) 5.474 12.135 ( -1.581 -2.557 0.644) 3.074 12.415 ( -3.178 -0.919 -0.830) 3.411 12.450 ( -2.081 0.538 0.595) 2.230 12.983 ( -0.554 3.804 1.171) 4.019 13.042 ( -1.094 3.589 -1.590) 4.075 13.432 ( 3.385 -8.516 0.988) 9.218 13.620 ( 2.365 -4.639 -0.503) 5.232 15.953 ( 0.718 -0.196 -1.315) 1.512 15.977 ( -2.765 -3.494 1.327) 4.649 17.464 ( 5.278 2.752 -0.340) 5.962 17.874 ( 0.476 6.102 -2.082) 6.465 17.933 ( 1.914 7.020 1.688) 7.469 18.224 ( -12.609 -11.245 2.050) 17.018 18.524 ( 7.695 -5.911 -1.341) 9.796 18.944 ( -2.261 -6.066 1.594) 6.667 19.104 ( -4.107 -3.272 -2.441) 5.791 19.328 ( -1.674 -4.654 0.809) 5.011 19.667 ( 5.289 -10.067 -0.077) 11.372 20.125 ( 4.132 -0.322 -0.405) 4.164 21.004 ( -2.270 3.712 0.349) 4.365 21.573 ( -7.356 7.956 0.594) 10.852 21.981 ( 1.505 5.309 -1.849) 5.820 22.033 ( -0.091 -1.364 0.334) 1.407 22.228 ( -2.653 -0.354 6.797) 7.305 22.340 ( 2.761 0.061 -8.042) 8.503 22.848 ( -2.159 3.073 7.248) 8.163 22.958 ( 3.197 -1.166 -4.889) 5.957 23.252 ( 2.351 1.407 2.185) 3.505 23.336 ( 6.418 0.622 -2.462) 6.902 ======================= Grid point 134 (45/102) ======================= q-point: (-0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.174 ( -8.809 14.836 -2.056) 17.376 1.240 ( -9.576 16.508 0.675) 19.097 1.509 ( -7.911 16.502 -0.217) 18.302 1.907 ( -10.697 3.715 -5.701) 12.678 2.076 ( -4.638 3.901 9.607) 11.359 2.260 ( -1.346 11.722 5.047) 12.833 2.323 ( -11.837 12.632 -3.094) 17.585 2.596 ( -9.610 4.385 4.238) 11.382 2.616 ( 0.217 2.431 -0.780) 2.562 2.707 ( -3.117 7.929 -6.398) 10.654 2.912 ( -1.682 5.152 -0.763) 5.473 2.986 ( 0.640 7.179 -4.266) 8.375 3.205 ( -3.598 6.398 2.653) 7.805 3.321 ( -5.510 4.385 0.826) 7.090 3.377 ( 5.846 -1.125 -4.655) 7.557 3.440 ( -0.772 -4.331 1.643) 4.696 3.493 ( 1.145 -0.639 -0.635) 1.457 3.614 ( -1.315 -2.392 1.333) 3.038 3.854 ( 1.227 -6.754 0.856) 6.918 3.893 ( 1.416 -1.607 -0.855) 2.307 3.966 ( 2.055 -1.090 -1.246) 2.639 4.037 ( -3.531 -2.067 1.170) 4.256 4.129 ( 6.288 -0.064 -4.926) 7.988 4.217 ( -3.196 1.353 4.732) 5.868 4.311 ( 7.188 3.331 0.493) 7.937 4.546 ( 2.409 0.606 2.877) 3.801 4.689 ( 3.716 -5.896 2.411) 7.375 4.886 ( -2.877 -2.746 2.603) 4.753 5.056 ( 3.825 -3.098 -4.952) 6.982 5.099 ( 9.107 -5.521 -0.693) 10.672 5.160 ( 0.306 -2.493 -5.082) 5.668 5.396 ( 4.509 -0.180 0.667) 4.561 5.475 ( 2.059 2.545 -0.359) 3.294 5.555 ( -2.770 5.323 3.286) 6.842 5.658 ( 1.366 1.816 0.637) 2.360 5.812 ( 7.232 -4.129 -0.923) 8.379 5.929 ( -0.293 -1.468 0.698) 1.652 6.102 ( -11.521 2.688 0.171) 11.832 6.172 ( -10.051 1.453 0.478) 10.166 6.276 ( -3.932 0.860 2.384) 4.678 6.409 ( 2.039 1.114 -3.385) 4.106 6.452 ( -4.960 -2.641 0.468) 5.639 6.516 ( 1.231 -4.484 0.211) 4.654 6.660 ( 5.200 0.475 -0.800) 5.283 6.854 ( -2.526 0.350 0.018) 2.550 7.032 ( -4.672 -0.392 3.150) 5.648 7.079 ( -3.648 1.008 0.367) 3.802 7.108 ( -5.630 -5.993 -1.824) 8.423 7.402 ( -4.569 -1.238 -0.859) 4.811 7.468 ( -6.932 -6.964 -5.226) 11.129 8.045 ( -7.907 -2.910 7.212) 11.090 8.107 ( -0.494 -4.343 -3.674) 5.710 8.154 ( 1.523 -1.883 -2.573) 3.534 8.284 ( -3.368 -2.079 -3.379) 5.205 8.627 ( 6.029 -4.582 1.179) 7.664 8.719 ( 1.835 -3.828 -0.510) 4.275 9.094 ( 4.278 3.624 5.221) 7.662 9.189 ( 3.662 1.397 -1.384) 4.157 9.419 ( -0.398 -9.020 5.665) 10.659 9.506 ( -5.924 2.034 6.058) 8.714 9.639 ( -0.113 -2.587 0.252) 2.602 9.860 ( 1.901 -1.796 -11.066) 11.370 10.202 ( 1.280 -0.420 1.218) 1.816 10.446 ( -4.442 3.665 -0.122) 5.760 10.657 ( 4.071 2.423 0.075) 4.738 10.779 ( 0.120 3.077 -3.118) 4.382 10.926 ( 2.910 1.405 0.272) 3.243 11.138 ( -5.898 -1.944 4.722) 7.801 11.261 ( -4.238 -2.049 0.760) 4.769 11.285 ( -4.109 -2.556 -0.637) 4.881 11.497 ( -4.132 -5.079 -0.718) 6.587 11.636 ( 1.020 -0.770 0.258) 1.304 12.166 ( 0.447 -2.171 -0.482) 2.269 12.210 ( 2.932 -6.540 -0.655) 7.197 12.397 ( -7.056 -1.544 -0.197) 7.226 12.431 ( -3.650 -0.733 0.545) 3.762 12.936 ( -0.166 1.437 1.937) 2.418 12.986 ( 0.708 1.942 -1.951) 2.843 13.609 ( 2.178 -8.258 1.764) 8.720 13.723 ( 3.068 -4.664 -1.673) 5.828 15.965 ( 0.449 -1.036 -1.996) 2.294 16.024 ( -5.835 -4.999 2.219) 7.998 17.449 ( 8.558 4.899 0.124) 9.862 17.751 ( 0.427 6.729 -1.290) 6.865 17.808 ( -1.320 7.131 0.647) 7.281 18.326 ( -16.329 -10.958 1.548) 19.726 18.744 ( 10.271 -10.387 -1.978) 14.741 19.058 ( 0.223 -6.510 2.192) 6.872 19.159 ( -7.106 -9.375 -1.457) 11.854 19.416 ( -3.191 -7.002 -0.760) 7.733 19.923 ( 6.306 -13.049 0.244) 14.495 20.151 ( 8.237 2.914 -0.451) 8.749 20.899 ( -4.346 5.254 0.427) 6.832 21.337 ( -11.047 11.084 -0.039) 15.649 21.878 ( 1.819 6.948 -0.829) 7.230 21.991 ( -3.913 3.982 2.656) 6.182 22.253 ( 0.199 -2.379 2.150) 3.213 22.350 ( 1.799 -0.313 -6.103) 6.370 22.808 ( -0.435 1.939 7.958) 8.202 22.982 ( 3.686 -0.044 -6.404) 7.389 23.236 ( 3.210 3.525 4.116) 6.298 23.375 ( 10.021 1.350 -4.149) 10.930 ======================= Grid point 135 (46/102) ======================= q-point: (-0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.846 ( -12.539 14.651 2.109) 19.399 0.960 ( -5.717 5.823 -4.773) 9.454 1.150 ( -5.991 16.617 0.707) 17.678 1.668 ( -9.236 9.930 -10.946) 17.428 1.799 ( -17.403 21.831 7.915) 29.019 1.885 ( -14.226 22.514 1.905) 26.700 2.082 ( 1.939 10.635 5.334) 12.055 2.340 ( -13.866 3.175 6.176) 15.508 2.645 ( 0.512 2.690 -4.220) 5.030 2.720 ( 6.362 -2.578 -5.518) 8.807 2.787 ( -5.328 10.176 1.530) 11.588 2.867 ( -1.827 -5.131 -6.981) 8.854 3.102 ( 0.330 4.304 2.520) 4.998 3.209 ( -7.861 1.668 2.641) 8.459 3.398 ( 2.518 -0.372 -2.260) 3.404 3.490 ( -2.424 -2.742 2.438) 4.397 3.586 ( 3.911 -4.040 -1.331) 5.778 3.653 ( -0.628 -2.487 0.342) 2.588 3.921 ( 4.362 1.305 -2.281) 5.093 3.959 ( -0.008 1.189 -0.469) 1.278 3.986 ( -0.583 -6.414 2.414) 6.878 4.045 ( 6.456 1.203 -2.968) 7.207 4.163 ( -3.602 3.230 5.754) 7.518 4.194 ( 2.991 -3.165 -4.642) 6.364 4.323 ( 5.645 0.905 -2.682) 6.315 4.511 ( -3.766 2.981 1.535) 5.042 4.851 ( -1.732 -5.359 9.608) 11.137 4.940 ( 4.270 -6.232 -1.237) 7.655 5.101 ( 1.165 -0.783 -2.590) 2.946 5.187 ( 2.106 -2.786 -4.915) 6.029 5.306 ( 4.259 -9.253 -2.242) 10.430 5.444 ( 4.209 -1.875 0.968) 4.708 5.476 ( 3.104 -1.298 -0.094) 3.366 5.523 ( -2.448 -3.805 4.038) 6.065 5.623 ( 2.662 2.694 -1.441) 4.052 5.896 ( 0.305 1.758 -4.041) 4.417 5.983 ( -8.710 0.457 1.527) 8.855 6.001 ( -2.222 -1.574 2.082) 3.428 6.096 ( 0.934 -5.010 -2.253) 5.572 6.264 ( 0.928 1.603 3.387) 3.861 6.335 ( 1.615 6.696 -1.644) 7.081 6.486 ( -8.984 -6.717 -1.652) 11.338 6.616 ( 5.338 -1.993 -0.709) 5.742 6.688 ( 5.265 1.151 -0.014) 5.389 6.831 ( -2.696 -0.206 0.667) 2.784 6.990 ( -2.632 1.785 2.782) 4.226 7.008 ( -3.230 2.916 -1.048) 4.476 7.154 ( -10.355 -3.088 0.626) 10.823 7.385 ( -5.253 -1.236 -1.056) 5.499 7.510 ( -6.763 -4.578 -10.169) 13.042 8.010 ( -8.676 0.439 7.917) 11.754 8.145 ( -0.716 -1.592 -6.630) 6.856 8.262 ( 4.426 -5.351 -3.614) 7.829 8.275 ( -5.468 -3.784 2.789) 7.211 8.759 ( 2.125 -5.459 3.392) 6.770 8.796 ( 4.724 -2.302 -2.538) 5.835 9.034 ( 1.201 6.539 6.404) 9.231 9.144 ( 0.675 4.946 -1.623) 5.249 9.427 ( -4.778 2.086 6.040) 7.979 9.547 ( -0.945 -1.442 -2.916) 3.388 9.726 ( -7.740 -12.442 7.251) 16.349 9.854 ( -2.734 -0.984 -3.963) 4.914 10.301 ( 6.971 -6.392 -2.011) 9.670 10.436 ( -0.840 -5.316 -0.774) 5.437 10.649 ( 1.653 0.908 1.204) 2.237 10.733 ( -0.333 1.132 -1.986) 2.310 10.942 ( 5.575 0.476 0.514) 5.618 11.135 ( 1.019 0.815 -0.719) 1.490 11.246 ( -4.111 1.346 1.837) 4.700 11.289 ( -5.708 -2.235 1.664) 6.351 11.494 ( -6.750 0.645 -1.875) 7.035 11.685 ( -4.002 -6.048 3.674) 8.130 12.197 ( 1.689 -0.866 -1.568) 2.462 12.329 ( 5.916 -0.154 -0.920) 5.989 12.390 ( -9.968 -6.025 -0.035) 11.648 12.426 ( -6.805 -4.064 0.267) 7.931 12.933 ( -0.260 -0.592 1.974) 2.077 12.971 ( 0.928 0.376 -1.301) 1.642 13.752 ( 0.464 -5.761 2.403) 6.260 13.821 ( 4.135 -3.697 -3.357) 6.483 15.990 ( 2.291 -1.700 -4.871) 5.645 16.089 ( -13.453 -9.829 6.047) 17.725 17.403 ( 7.739 7.469 2.177) 10.974 17.645 ( -4.068 5.163 1.149) 6.673 17.698 ( 8.511 5.262 -3.512) 10.605 18.340 ( -24.082 -6.022 -3.593) 25.082 18.982 ( 10.401 -6.473 1.825) 12.386 19.198 ( -3.791 -11.885 -0.039) 12.475 19.347 ( -3.397 -14.628 2.114) 15.165 19.517 ( -4.430 -7.695 -3.450) 9.526 20.120 ( 14.837 9.581 1.010) 17.690 20.209 ( 5.372 -12.467 0.151) 13.576 20.762 ( -7.275 5.032 0.302) 8.851 21.014 ( -14.400 14.003 -2.849) 20.287 21.770 ( 0.924 5.840 2.907) 6.589 21.890 ( -3.237 3.890 0.949) 5.148 22.302 ( 0.056 -2.201 0.557) 2.272 22.345 ( 0.806 0.596 -3.522) 3.661 22.808 ( 2.015 0.424 6.041) 6.382 22.987 ( 3.130 0.797 -6.000) 6.814 23.188 ( 4.055 5.954 4.701) 8.602 23.401 ( 12.376 4.311 -7.307) 15.005 ======================= Grid point 136 (47/102) ======================= q-point: (-0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.538 ( -15.285 8.176 14.135) 22.367 0.717 ( -4.422 17.532 16.082) 24.199 0.985 ( -1.638 -0.308 -18.458) 18.533 1.206 ( -20.531 26.137 20.639) 39.124 1.370 ( -19.009 13.083 -17.358) 28.876 1.500 ( 8.740 9.226 -11.058) 16.846 1.967 ( 6.550 5.802 5.749) 10.469 2.279 ( -9.888 -4.547 -1.132) 10.942 2.514 ( -5.007 9.587 -2.237) 11.045 2.532 ( -0.260 9.094 -2.179) 9.355 2.821 ( -2.789 -3.863 10.217) 11.273 3.004 ( -0.754 -4.323 -4.309) 6.150 3.090 ( 1.979 -5.902 4.587) 7.732 3.214 ( -2.303 -6.079 -1.232) 6.616 3.437 ( 1.640 -2.100 -0.467) 2.705 3.533 ( -5.001 -5.480 -2.075) 7.704 3.645 ( -0.782 -1.740 1.514) 2.435 3.693 ( 3.828 -1.525 -4.392) 6.022 3.868 ( 0.435 5.084 0.558) 5.133 3.914 ( 1.175 6.139 -2.319) 6.666 4.016 ( -2.461 5.537 2.595) 6.591 4.050 ( 0.624 -0.827 -1.658) 1.955 4.153 ( 4.367 -1.850 1.423) 4.951 4.261 ( -1.605 -4.235 -1.487) 4.766 4.328 ( 3.378 1.245 -3.212) 4.825 4.433 ( -5.732 1.193 -3.256) 6.699 4.874 ( -4.346 -0.274 8.803) 9.821 5.038 ( -4.461 0.092 -0.813) 4.535 5.206 ( 2.979 -10.907 -0.848) 11.338 5.275 ( 8.602 -4.808 -6.671) 11.900 5.443 ( 2.071 -2.667 1.090) 3.548 5.517 ( -1.390 -5.030 -0.887) 5.293 5.595 ( 4.248 -7.027 0.794) 8.250 5.610 ( 2.189 -2.915 -1.182) 3.832 5.680 ( 5.192 -8.020 2.467) 9.867 5.788 ( -7.940 5.029 0.836) 9.436 5.897 ( -9.884 2.038 -1.490) 10.201 5.944 ( -4.070 0.619 -6.235) 7.471 6.215 ( 2.200 6.835 -0.415) 7.192 6.225 ( 0.204 3.876 0.764) 3.956 6.309 ( 12.484 -3.631 -0.998) 13.040 6.465 ( -7.578 5.516 -0.791) 9.406 6.638 ( 1.783 -0.781 0.111) 1.950 6.696 ( -3.897 -1.990 0.717) 4.434 6.875 ( 4.074 -4.426 1.262) 6.147 6.913 ( -3.752 3.404 4.166) 6.559 6.975 ( -0.212 0.888 -2.236) 2.415 7.064 ( -4.115 4.973 -4.732) 8.004 7.349 ( -7.689 0.865 2.141) 8.029 7.467 ( -9.764 -0.792 -10.755) 14.547 7.961 ( -8.799 -0.126 9.822) 13.187 8.132 ( 3.577 0.335 -9.527) 10.181 8.362 ( -2.527 -6.857 3.548) 8.124 8.389 ( 5.352 -4.999 -1.254) 7.430 8.800 ( -6.975 0.491 7.672) 10.380 8.839 ( 4.576 3.239 -1.264) 5.747 8.967 ( 4.539 2.516 1.077) 5.301 9.069 ( 0.281 1.025 -1.844) 2.128 9.370 ( -3.702 2.192 6.599) 7.877 9.515 ( 1.116 1.713 -7.592) 7.863 9.866 ( -0.590 -3.821 3.402) 5.150 9.995 ( -15.670 -21.660 3.424) 26.953 10.497 ( 0.182 -13.112 7.248) 14.983 10.609 ( 7.304 -10.962 -4.943) 14.069 10.675 ( 1.967 -2.631 0.648) 3.349 10.720 ( -0.464 -0.242 -1.300) 1.402 10.971 ( 5.495 1.998 1.065) 5.943 11.089 ( -4.434 4.604 -2.560) 6.885 11.199 ( 9.793 3.656 2.753) 10.809 11.287 ( -3.046 -0.988 1.597) 3.578 11.409 ( -6.791 1.659 -2.787) 7.526 11.750 ( -30.177 -10.564 -3.724) 32.189 12.248 ( 8.046 -2.325 2.805) 8.833 12.331 ( 0.194 -0.107 -0.576) 0.617 12.373 ( -4.961 -0.191 1.368) 5.150 12.516 ( -5.058 -6.887 -0.549) 8.563 12.951 ( -0.318 -0.853 0.981) 1.338 12.968 ( -0.141 0.409 -0.229) 0.489 13.827 ( -0.243 -2.160 1.457) 2.617 13.879 ( 3.724 0.523 -4.364) 5.761 16.052 ( 9.031 -2.430 -6.143) 11.189 16.228 ( -33.793 -23.673 6.965) 41.844 17.330 ( 5.927 5.962 4.407) 9.492 17.513 ( -3.811 5.840 -1.985) 7.250 17.729 ( 17.837 2.834 -3.598) 18.415 18.104 ( -29.887 9.565 -9.507) 32.789 19.165 ( 12.398 -6.307 7.393) 15.753 19.418 ( -9.844 -16.144 1.707) 18.986 19.573 ( -0.115 -9.586 0.744) 9.615 19.593 ( 0.277 -2.703 -4.519) 5.273 20.033 ( 16.157 11.404 3.549) 20.092 20.402 ( -9.208 -3.781 -2.984) 10.392 20.608 ( -1.699 12.289 -6.430) 13.973 20.651 ( -13.230 5.103 -1.107) 14.223 21.738 ( 0.529 -1.986 6.078) 6.416 21.826 ( -1.964 1.078 -0.073) 2.242 22.323 ( -1.506 -0.224 1.009) 1.827 22.342 ( 1.565 -0.407 -2.368) 2.867 22.848 ( 3.619 -1.537 3.911) 5.546 22.979 ( 1.660 0.524 -4.216) 4.561 23.106 ( 3.814 7.098 2.921) 8.571 23.320 ( 9.214 13.829 -12.609) 20.860 ======================= Grid point 138 (48/102) ======================= q-point: ( 0.09 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.678 ( 12.885 0.000 17.570) 21.788 0.758 ( -2.984 -0.000 26.767) 26.933 0.916 ( 9.904 0.000 -17.237) 19.880 1.049 ( 18.800 0.000 -10.489) 21.528 1.097 ( 36.131 0.000 12.615) 38.270 1.708 ( 22.930 0.000 -24.262) 33.383 2.033 ( 0.681 0.000 -10.187) 10.209 2.218 ( 10.854 0.000 11.903) 16.109 2.411 ( 5.325 0.000 2.400) 5.841 2.543 ( 10.270 0.000 -2.846) 10.657 2.904 ( 0.849 0.000 10.413) 10.447 2.957 ( -5.660 -0.000 3.902) 6.875 3.201 ( -4.766 -0.000 1.437) 4.978 3.212 ( -5.519 -0.000 0.756) 5.571 3.397 ( 4.607 0.000 7.412) 8.727 3.515 ( -2.983 -0.000 -2.518) 3.904 3.546 ( -2.225 -0.000 -6.799) 7.154 3.740 ( 2.469 0.000 -2.180) 3.294 3.805 ( 2.836 0.000 -0.720) 2.926 3.823 ( 1.754 0.000 -0.597) 1.853 3.892 ( -3.955 -0.000 8.009) 8.932 4.079 ( 3.512 0.000 -3.320) 4.833 4.182 ( -5.036 -0.000 5.725) 7.625 4.269 ( -1.836 -0.000 -3.972) 4.376 4.373 ( 5.026 0.000 2.248) 5.506 4.512 ( 9.588 0.000 -9.440) 13.456 4.858 ( -0.123 -0.000 10.828) 10.828 4.968 ( -0.630 -0.000 -0.418) 0.756 5.202 ( -9.043 -0.000 -4.325) 10.024 5.380 ( -7.848 -0.000 0.678) 7.877 5.394 ( -7.351 -0.000 -3.446) 8.118 5.416 ( -7.746 -0.000 3.403) 8.461 5.595 ( -0.706 -0.000 -1.903) 2.030 5.719 ( -2.183 -0.000 1.525) 2.663 5.837 ( 6.752 0.000 -0.584) 6.777 5.838 ( 5.883 0.000 2.142) 6.261 5.924 ( 10.566 0.000 -10.169) 14.664 5.929 ( -1.622 -0.000 0.029) 1.622 6.115 ( 3.676 0.000 1.922) 4.148 6.172 ( -5.100 -0.000 0.663) 5.143 6.304 ( 4.358 0.000 -3.005) 5.294 6.323 ( -4.987 -0.000 2.168) 5.438 6.678 ( -7.450 -0.000 -0.090) 7.451 6.763 ( -7.507 -0.000 4.253) 8.628 6.801 ( 7.988 0.000 5.237) 9.552 6.883 ( 0.143 0.000 -0.597) 0.614 6.964 ( 7.051 0.000 -4.248) 8.232 7.079 ( 10.966 0.000 -4.876) 12.001 7.310 ( 4.597 0.000 10.170) 11.161 7.726 ( 22.956 0.000 -13.189) 26.475 7.912 ( -0.004 -0.000 6.886) 6.886 8.198 ( 3.611 0.000 -5.639) 6.696 8.406 ( 0.797 0.000 -3.448) 3.539 8.634 ( 6.699 0.000 -9.314) 11.473 8.668 ( -3.599 -0.000 6.406) 7.348 8.928 ( 5.686 0.000 -0.790) 5.741 8.949 ( -4.744 -0.000 -4.783) 6.737 9.136 ( 6.307 0.000 -0.797) 6.357 9.450 ( 16.356 0.000 -7.295) 17.909 9.555 ( 8.215 0.000 -9.349) 12.445 9.656 ( -32.106 -0.000 21.794) 38.805 9.990 ( 0.595 0.000 11.951) 11.966 10.535 ( -8.140 -0.000 -3.102) 8.711 10.653 ( -6.132 -0.000 1.458) 6.303 10.698 ( -8.357 -0.000 1.085) 8.427 10.748 ( -7.995 -0.000 2.406) 8.350 10.962 ( 0.138 0.000 3.460) 3.463 10.977 ( 3.920 0.000 -0.534) 3.957 11.017 ( 0.580 0.000 3.467) 3.516 11.317 ( 3.071 0.000 0.442) 3.103 11.391 ( 8.195 0.000 3.681) 8.984 11.824 ( 17.994 0.000 12.634) 21.986 12.267 ( -5.131 -0.000 2.057) 5.528 12.349 ( -7.129 -0.000 -2.396) 7.521 12.471 ( 16.279 0.000 -0.185) 16.280 12.756 ( 7.828 0.000 -7.558) 10.881 12.947 ( 1.340 0.000 0.196) 1.355 13.023 ( 9.361 0.000 -2.483) 9.685 13.829 ( -1.309 -0.000 -0.386) 1.365 13.832 ( -2.351 -0.000 0.121) 2.354 15.865 ( -1.218 -0.000 4.964) 5.111 16.515 ( 12.731 0.000 18.040) 22.080 17.253 ( -1.734 -0.000 -0.971) 1.987 17.423 ( 2.265 0.000 -3.335) 4.032 17.886 ( 10.293 0.000 -2.332) 10.554 17.981 ( 15.497 0.000 -6.856) 16.946 19.253 ( -15.596 -0.000 -3.903) 16.077 19.390 ( -18.885 -0.000 -0.552) 18.893 19.695 ( 4.989 0.000 0.010) 4.989 19.967 ( 8.965 0.000 -1.870) 9.158 20.046 ( 27.414 0.000 -12.191) 30.002 20.158 ( 11.320 0.000 5.933) 12.780 20.579 ( 1.407 0.000 1.050) 1.756 20.628 ( 6.851 0.000 -1.210) 6.957 21.819 ( 0.824 0.000 1.056) 1.339 21.837 ( 2.610 0.000 -0.900) 2.760 22.319 ( 0.327 0.000 0.941) 0.996 22.366 ( 1.367 0.000 -1.401) 1.958 22.679 ( -26.207 -0.000 13.432) 29.449 22.921 ( -5.525 -0.000 1.970) 5.866 22.987 ( -2.767 -0.000 0.654) 2.843 23.039 ( -3.576 -0.000 -0.496) 3.611 ======================= Grid point 139 (49/102) ======================= q-point: ( 0.18 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.749 ( 15.223 -3.243 10.817) 18.954 1.046 ( 16.892 -5.317 -11.526) 21.130 1.140 ( 5.807 -21.792 17.075) 28.287 1.235 ( 17.507 -7.127 -14.751) 23.977 1.540 ( 33.119 -13.538 10.439) 37.271 1.848 ( 19.088 -2.859 -9.140) 21.355 2.078 ( 10.140 -2.315 -10.099) 14.497 2.349 ( 11.233 -3.809 7.639) 14.108 2.514 ( 6.763 -5.104 -1.665) 8.635 2.665 ( 3.105 -3.752 0.233) 4.876 2.820 ( -0.873 4.574 3.800) 6.010 2.983 ( -3.792 -1.678 3.559) 5.465 3.105 ( 1.404 0.814 -0.592) 1.728 3.196 ( -0.285 0.052 -0.179) 0.340 3.393 ( -1.448 3.420 -1.844) 4.146 3.467 ( 6.255 0.811 1.093) 6.401 3.649 ( -6.936 -3.231 -0.436) 7.664 3.710 ( 1.618 0.672 -4.237) 4.585 3.739 ( -1.516 1.757 1.006) 2.529 3.891 ( -2.091 -2.494 2.096) 3.871 3.963 ( -1.711 -5.970 0.829) 6.266 4.080 ( -3.578 -0.075 0.392) 3.600 4.135 ( 0.101 3.885 2.817) 4.799 4.199 ( -0.115 4.578 -0.979) 4.683 4.478 ( 5.081 -5.497 -1.668) 7.669 4.512 ( 3.951 2.905 -6.685) 8.291 4.845 ( -3.070 2.855 9.948) 10.796 4.955 ( -1.364 2.916 2.319) 3.968 5.085 ( -10.626 2.218 -4.256) 11.659 5.188 ( -1.913 6.628 -3.622) 7.791 5.350 ( -13.834 -1.693 4.568) 14.667 5.477 ( -8.211 -2.255 -1.451) 8.638 5.527 ( -1.460 4.599 0.450) 4.847 5.594 ( 3.561 8.771 -1.327) 9.559 5.708 ( 1.144 7.216 1.947) 7.561 5.828 ( 1.634 1.986 -1.089) 2.793 6.005 ( -1.014 -1.394 -1.246) 2.127 6.045 ( 4.222 -4.211 -0.100) 5.964 6.104 ( -3.209 0.948 -1.091) 3.519 6.218 ( 1.558 -4.760 -1.617) 5.263 6.308 ( 1.374 -2.621 -3.394) 4.503 6.430 ( -7.831 -9.059 1.652) 12.088 6.611 ( -0.385 2.751 -0.159) 2.782 6.704 ( -6.734 1.442 1.463) 7.041 6.838 ( 8.227 1.186 1.495) 8.445 6.915 ( 3.068 -1.419 1.518) 3.706 7.035 ( 6.575 -1.806 -2.235) 7.175 7.241 ( 10.734 -7.697 -8.128) 15.509 7.374 ( 4.640 -0.146 10.078) 11.096 7.785 ( 20.925 8.850 -12.803) 26.079 7.944 ( 0.990 -2.811 7.045) 7.649 8.188 ( 0.956 1.988 -2.651) 3.449 8.376 ( 5.367 4.102 -4.288) 8.001 8.553 ( 2.861 9.293 -4.032) 10.526 8.626 ( -5.509 2.418 5.701) 8.288 8.868 ( -5.609 2.522 -1.575) 6.349 9.029 ( 0.716 -5.374 0.198) 5.425 9.169 ( 5.428 0.286 -6.843) 8.739 9.406 ( -2.365 6.673 12.838) 14.661 9.530 ( 2.497 -0.313 6.912) 7.356 9.662 ( 9.715 -1.605 -7.857) 12.597 9.960 ( 2.236 6.665 7.755) 10.467 10.425 ( 0.047 5.943 -4.470) 7.436 10.514 ( -6.873 4.445 1.298) 8.287 10.666 ( -11.078 -3.209 -0.427) 11.541 10.746 ( -3.567 2.111 -0.774) 4.217 10.894 ( 0.852 1.484 1.066) 2.016 10.989 ( 1.013 -0.647 5.227) 5.364 11.205 ( 3.398 -8.351 0.086) 9.016 11.385 ( 6.297 -1.243 -1.622) 6.621 11.463 ( 7.260 -1.772 3.849) 8.406 11.892 ( 3.477 3.168 6.551) 8.065 12.227 ( -7.287 1.047 0.082) 7.363 12.252 ( -5.900 1.047 -3.087) 6.741 12.571 ( 20.110 6.096 2.487) 21.160 12.681 ( 9.148 9.378 -2.946) 13.428 12.945 ( 1.075 1.773 0.697) 2.188 13.029 ( 7.210 5.169 -1.072) 8.936 13.803 ( -2.240 1.496 -0.160) 2.698 13.832 ( -3.976 -0.160 -1.567) 4.277 15.884 ( 2.470 -0.030 1.491) 2.886 16.457 ( 1.760 12.686 9.124) 15.726 17.267 ( -1.443 -2.655 -0.650) 3.091 17.510 ( 4.406 -5.700 -0.471) 7.220 17.712 ( 7.784 7.237 -1.370) 10.717 18.381 ( 14.497 -10.495 -0.281) 17.899 19.058 ( -12.034 4.973 -1.939) 13.165 19.405 ( -13.068 -7.170 -0.484) 14.913 19.628 ( 4.915 10.869 0.270) 11.932 19.742 ( 10.936 22.773 -3.889) 25.561 19.968 ( 2.684 3.223 -3.187) 5.268 20.403 ( -3.606 10.455 0.122) 11.060 20.688 ( 18.138 -18.919 -0.010) 26.209 20.780 ( 10.207 -5.118 0.493) 11.429 21.801 ( 0.720 -0.346 -0.217) 0.828 21.858 ( 4.423 0.061 2.208) 4.944 22.297 ( -0.683 2.342 0.025) 2.440 22.374 ( 1.498 -0.763 -1.430) 2.207 22.713 ( -14.806 -10.327 4.133) 18.518 22.886 ( -5.660 -1.727 -0.675) 5.956 23.033 ( -8.758 -8.477 0.769) 12.212 23.090 ( -6.967 -7.929 1.093) 10.612 ======================= Grid point 140 (50/102) ======================= q-point: ( 0.27 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.032 ( 18.367 -11.181 0.972) 21.525 1.215 ( 15.361 -2.540 -8.019) 17.513 1.467 ( 15.158 -8.922 -10.960) 20.724 1.618 ( 7.466 -20.917 14.438) 26.490 1.986 ( 10.992 -13.165 4.005) 17.612 2.054 ( 10.216 -2.682 5.880) 12.089 2.229 ( 16.886 -9.906 -4.454) 20.078 2.482 ( -1.094 1.157 6.738) 6.923 2.581 ( 4.780 -3.373 0.152) 5.852 2.740 ( 10.905 -9.253 -11.173) 18.149 2.936 ( 5.871 -4.811 1.114) 7.672 2.962 ( 3.141 1.836 -4.300) 5.633 3.178 ( 5.414 -3.960 -0.234) 6.712 3.215 ( -4.050 -3.419 2.694) 5.946 3.361 ( -0.328 -1.356 -1.653) 2.163 3.472 ( 2.827 3.075 1.407) 4.407 3.563 ( -3.761 4.776 -0.476) 6.098 3.639 ( -0.855 2.499 1.425) 3.001 3.817 ( -5.684 -7.075 -2.246) 9.350 3.922 ( -0.215 0.395 -0.792) 0.911 3.953 ( -5.003 0.935 0.410) 5.106 4.041 ( -3.381 4.884 4.132) 7.236 4.095 ( -0.003 -0.808 0.616) 1.016 4.151 ( 2.237 -0.049 -0.489) 2.290 4.447 ( 1.382 4.576 -4.794) 6.770 4.575 ( -0.007 -0.960 -2.156) 2.360 4.733 ( -7.658 5.957 7.551) 12.294 4.886 ( -3.194 1.618 0.752) 3.659 4.999 ( -5.246 -1.184 -2.275) 5.840 5.126 ( 2.094 2.337 -1.474) 3.467 5.205 ( -8.810 7.893 -0.748) 11.853 5.380 ( -6.298 1.906 -1.787) 6.818 5.482 ( -1.324 0.559 7.834) 7.965 5.517 ( -2.366 2.681 1.107) 3.743 5.656 ( 3.594 1.976 -3.183) 5.192 5.774 ( -6.095 1.345 1.099) 6.338 5.948 ( -5.731 0.082 1.082) 5.833 6.122 ( 1.878 -3.239 -4.584) 5.919 6.168 ( 5.918 -3.613 1.576) 7.111 6.318 ( 3.184 -3.381 -0.007) 4.645 6.350 ( 0.381 -3.158 -1.495) 3.515 6.476 ( -8.902 -2.611 0.395) 9.285 6.579 ( 4.020 3.054 0.578) 5.082 6.634 ( -4.102 1.369 -0.546) 4.359 6.881 ( 7.369 0.527 -1.062) 7.463 6.967 ( 3.015 -0.772 1.921) 3.657 7.102 ( 2.838 -1.840 0.001) 3.382 7.401 ( 12.290 -1.331 -7.292) 14.353 7.417 ( 0.689 -0.647 6.390) 6.460 7.668 ( 15.972 15.513 -9.977) 24.399 8.027 ( 0.204 -0.942 5.899) 5.977 8.148 ( 1.535 2.012 0.359) 2.556 8.337 ( 9.510 5.099 -4.699) 11.770 8.425 ( 2.148 4.705 -1.060) 5.279 8.542 ( -5.701 3.266 3.140) 7.282 8.769 ( -6.331 2.955 -0.253) 6.992 9.078 ( -4.201 -1.742 0.833) 4.623 9.201 ( 4.569 -0.083 -7.857) 9.089 9.344 ( -6.458 2.204 15.670) 17.091 9.565 ( 0.820 -0.521 8.572) 8.626 9.730 ( 9.214 1.871 -7.748) 12.184 9.841 ( 2.567 7.343 -0.377) 7.788 10.322 ( 2.195 4.691 -4.161) 6.644 10.435 ( -0.858 0.402 0.830) 1.260 10.632 ( -10.629 -2.486 -4.624) 11.854 10.703 ( 0.183 0.324 2.780) 2.805 10.904 ( 1.475 -0.695 -0.199) 1.642 11.039 ( 2.064 -2.340 6.282) 7.014 11.323 ( 6.203 -0.687 1.215) 6.358 11.419 ( 8.575 2.399 -0.883) 8.948 11.565 ( 3.248 -3.237 0.910) 4.674 11.800 ( -0.157 8.267 -1.109) 8.343 12.168 ( -3.482 0.237 -0.518) 3.529 12.206 ( -5.265 0.066 -0.692) 5.311 12.555 ( 13.782 9.170 0.745) 16.571 12.612 ( 13.826 8.062 -0.400) 16.010 12.924 ( -0.530 0.243 1.188) 1.323 12.975 ( 1.065 3.130 -0.772) 3.395 13.726 ( -2.889 5.835 0.533) 6.533 13.760 ( -5.148 2.620 -1.631) 6.002 15.898 ( 0.539 -0.038 0.909) 1.057 16.253 ( -1.375 9.791 1.166) 9.955 17.316 ( -3.482 -4.597 -0.634) 5.802 17.635 ( 4.595 -4.429 0.359) 6.392 17.747 ( 7.322 -2.949 0.037) 7.894 18.516 ( 7.537 2.721 3.642) 8.802 18.868 ( -9.949 7.771 -2.252) 12.823 19.289 ( 5.087 14.714 -0.267) 15.571 19.452 ( 3.749 13.749 -1.462) 14.326 19.505 ( 1.996 6.524 0.845) 6.874 19.938 ( -14.743 -5.152 -2.630) 15.837 20.162 ( 0.180 13.331 -0.746) 13.353 20.931 ( 13.670 -2.155 -0.156) 13.839 21.120 ( 10.140 -16.407 2.875) 19.501 21.824 ( 0.863 -1.599 -2.438) 3.040 21.952 ( 4.838 -5.199 2.721) 7.605 22.241 ( -2.123 2.570 0.194) 3.339 22.403 ( 2.341 -1.164 -4.009) 4.786 22.749 ( -7.652 -2.583 6.545) 10.395 22.897 ( -3.432 -3.432 -4.480) 6.605 23.116 ( -11.298 -8.481 1.286) 14.186 23.177 ( -7.681 -6.858 0.079) 10.297 ======================= Grid point 141 (51/102) ======================= q-point: ( 0.36 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.340 ( 14.310 -7.776 -3.695) 16.700 1.404 ( 10.963 -9.983 1.591) 14.913 1.712 ( 8.677 -9.120 -2.383) 12.812 1.967 ( 9.195 -3.533 5.494) 11.279 2.126 ( 4.462 -9.076 2.610) 10.445 2.247 ( -1.421 -12.499 1.214) 12.638 2.497 ( 0.849 -6.609 2.410) 7.086 2.574 ( 8.814 -3.507 -3.357) 10.062 2.692 ( 9.864 -7.033 -1.472) 12.204 2.890 ( 8.778 3.080 -2.861) 9.733 2.994 ( -3.719 -2.125 3.695) 5.656 3.009 ( 6.048 -4.439 -5.473) 9.286 3.259 ( -0.854 -2.073 3.296) 3.986 3.288 ( 2.418 -4.002 -3.634) 5.922 3.396 ( -1.143 -2.514 -0.314) 2.779 3.426 ( 0.689 1.884 -2.409) 3.134 3.495 ( 2.028 -0.262 2.059) 2.902 3.632 ( 0.486 -0.115 -0.731) 0.885 3.816 ( -3.236 3.913 1.872) 5.411 3.853 ( -3.537 3.268 -0.362) 4.830 3.921 ( -4.211 -2.400 -0.406) 4.864 4.034 ( 3.495 -1.844 -1.282) 4.154 4.093 ( -1.157 0.230 2.471) 2.738 4.211 ( 3.519 -2.735 0.019) 4.457 4.359 ( -1.804 4.178 -0.709) 4.606 4.495 ( -6.821 3.619 5.122) 9.267 4.635 ( -2.947 1.840 -1.310) 3.712 4.839 ( -4.707 1.062 -1.194) 4.971 4.971 ( -9.564 4.080 3.610) 11.007 5.024 ( 0.656 2.392 -6.674) 7.121 5.109 ( 1.819 0.596 -1.180) 2.248 5.345 ( -5.796 -2.801 -2.642) 6.959 5.453 ( 1.313 1.983 1.624) 2.880 5.522 ( -3.674 -3.026 7.570) 8.942 5.643 ( -0.721 -0.885 -0.287) 1.177 5.748 ( -1.014 -1.323 -0.382) 1.710 5.934 ( -3.168 -0.242 -0.315) 3.193 6.187 ( -1.266 -3.749 -2.563) 4.715 6.276 ( 6.500 -3.419 1.412) 7.479 6.345 ( -2.679 -0.865 0.227) 2.825 6.428 ( -2.775 1.019 -0.688) 3.035 6.455 ( 7.462 -2.503 0.262) 7.875 6.521 ( 0.620 3.986 1.450) 4.287 6.626 ( 1.739 -0.701 -0.910) 2.084 6.917 ( 5.751 0.942 -1.362) 5.985 6.998 ( -0.664 -1.174 3.220) 3.491 7.126 ( 0.861 1.121 0.665) 1.562 7.397 ( 8.201 9.984 -11.544) 17.326 7.430 ( 5.720 3.479 6.101) 9.058 7.520 ( 6.517 5.210 -2.858) 8.819 7.965 ( -4.180 4.703 2.922) 6.938 8.154 ( 2.375 0.394 2.052) 3.163 8.294 ( 3.982 5.177 -7.080) 9.632 8.390 ( 8.086 5.040 0.392) 9.536 8.444 ( -4.886 3.746 0.601) 6.186 8.705 ( -3.207 -0.935 -0.402) 3.365 9.037 ( -5.723 2.866 1.492) 6.572 9.173 ( -0.916 2.547 -4.361) 5.133 9.290 ( -10.338 0.302 14.883) 18.123 9.586 ( -4.365 2.767 1.249) 5.317 9.612 ( 4.940 5.920 1.510) 7.856 9.857 ( 9.839 -0.756 -8.208) 12.836 10.274 ( 2.406 2.901 -0.294) 3.780 10.496 ( 1.819 -5.997 -0.109) 6.268 10.606 ( -3.815 -2.234 -3.601) 5.702 10.738 ( -1.279 -3.591 2.147) 4.375 10.929 ( 2.284 -0.766 -1.786) 2.999 11.121 ( 1.922 -3.306 6.075) 7.178 11.334 ( 6.533 4.601 0.750) 8.026 11.425 ( 7.816 4.007 -0.130) 8.784 11.607 ( -0.616 -0.127 -0.152) 0.647 11.634 ( 4.807 10.786 -2.675) 12.108 12.121 ( -5.020 1.622 -0.506) 5.300 12.179 ( -0.503 0.988 0.020) 1.109 12.487 ( 8.653 7.123 0.549) 11.221 12.567 ( 10.609 7.134 -0.281) 12.787 12.944 ( -0.794 -2.034 0.823) 2.334 12.964 ( -0.134 -2.810 -0.474) 2.852 13.564 ( -4.737 8.353 -0.208) 9.605 13.671 ( -4.111 3.473 -0.416) 5.398 15.898 ( -1.296 -0.220 0.535) 1.419 16.106 ( -2.515 5.333 -0.165) 5.899 17.371 ( -2.128 -4.055 -0.490) 4.605 17.742 ( 2.842 -3.992 0.689) 4.948 17.866 ( 4.243 -4.877 -0.452) 6.480 18.477 ( 2.100 5.295 3.740) 6.815 18.620 ( -3.366 12.740 -2.500) 13.412 19.109 ( 3.913 8.447 -0.624) 9.330 19.251 ( 4.927 11.133 -0.574) 12.188 19.418 ( 0.802 5.218 1.247) 5.425 19.827 ( -8.395 8.630 -0.272) 12.042 20.012 ( -9.015 -1.257 -1.561) 9.235 21.052 ( 13.578 -0.065 0.076) 13.578 21.440 ( 6.475 -11.992 2.192) 13.804 21.869 ( 0.005 -3.629 -2.155) 4.221 22.054 ( 2.200 -0.406 1.363) 2.620 22.198 ( -1.763 -0.470 2.298) 2.934 22.425 ( 3.069 -0.467 -8.169) 8.739 22.752 ( -5.205 -1.777 9.951) 11.370 22.926 ( -1.836 -2.879 -5.161) 6.188 23.177 ( -8.143 -6.198 1.752) 10.382 23.217 ( -6.545 -3.973 -1.183) 7.748 ======================= Grid point 143 (52/102) ======================= q-point: ( 0.45 0.09 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.563 ( 7.620 -6.470 -0.255) 10.000 1.610 ( 1.566 -8.146 4.856) 9.612 1.902 ( 5.073 -6.798 -1.434) 8.602 2.085 ( 10.552 -4.855 -1.143) 11.671 2.337 ( 7.027 -3.437 -2.713) 8.279 2.414 ( -2.459 -7.995 0.494) 8.380 2.529 ( 4.686 7.614 -3.326) 9.539 2.630 ( -6.305 -8.063 5.184) 11.474 2.836 ( 3.472 4.550 -5.391) 7.863 2.936 ( 8.804 -5.908 1.182) 10.668 2.995 ( -3.557 -3.324 4.557) 6.669 3.123 ( 5.797 -5.391 -4.445) 9.079 3.236 ( -4.324 2.779 4.458) 6.804 3.333 ( -2.329 -1.709 -1.228) 3.139 3.408 ( -1.011 -2.855 -2.090) 3.680 3.465 ( -2.604 -0.397 2.296) 3.495 3.547 ( 2.918 -3.569 -1.069) 4.733 3.662 ( 3.417 -0.987 -2.381) 4.281 3.733 ( 2.100 6.188 -0.835) 6.587 3.776 ( -0.447 0.538 0.052) 0.701 3.892 ( -6.035 4.722 1.659) 7.841 4.055 ( 0.029 0.502 0.843) 0.981 4.124 ( 4.176 -2.182 -0.663) 4.758 4.252 ( 2.931 2.138 -0.826) 3.721 4.289 ( -5.582 -1.723 0.144) 5.844 4.443 ( -3.445 -0.020 5.492) 6.483 4.617 ( -3.198 -2.851 -0.588) 4.324 4.759 ( -5.009 3.819 2.269) 6.695 4.879 ( -0.158 -1.461 -5.645) 5.833 5.018 ( 0.430 -0.278 1.253) 1.353 5.118 ( 0.555 -0.590 -3.462) 3.555 5.346 ( -5.633 -2.531 -1.493) 6.353 5.454 ( -3.421 -1.644 2.336) 4.457 5.598 ( 3.370 -4.407 1.919) 5.870 5.683 ( -2.473 -3.844 0.137) 4.573 5.774 ( 1.861 -1.126 0.623) 2.263 5.892 ( -1.329 2.118 1.137) 2.747 6.199 ( -2.819 0.276 -0.370) 2.857 6.253 ( -2.589 6.916 0.136) 7.386 6.386 ( 1.825 0.906 1.208) 2.369 6.434 ( 3.756 -5.756 -1.616) 7.060 6.511 ( 2.765 -0.977 0.676) 3.009 6.564 ( 6.489 -1.727 0.666) 6.748 6.655 ( 1.969 -1.622 -1.598) 3.010 6.913 ( 2.920 3.283 -0.943) 4.494 6.999 ( -3.276 1.500 6.042) 7.035 7.084 ( 1.013 3.059 -1.443) 3.530 7.236 ( 4.538 8.526 -8.433) 12.822 7.391 ( -0.595 4.449 4.630) 6.448 7.492 ( 2.285 2.598 -1.382) 3.725 7.881 ( -4.051 0.945 0.811) 4.238 8.163 ( 1.007 0.492 1.359) 1.762 8.185 ( -2.997 4.326 -6.193) 8.126 8.315 ( -7.181 4.760 2.402) 8.944 8.368 ( 12.315 6.809 -0.690) 14.089 8.745 ( 2.071 -2.853 -2.004) 4.056 8.905 ( -3.900 6.267 -0.184) 7.384 9.120 ( -3.031 0.591 -0.126) 3.091 9.243 ( -6.035 0.607 7.919) 9.975 9.488 ( -5.728 -0.349 0.349) 5.749 9.624 ( 5.173 2.127 5.426) 7.793 9.909 ( 8.972 1.317 -8.676) 12.550 10.244 ( 1.407 1.622 0.874) 2.319 10.611 ( -4.709 -6.305 -1.112) 7.948 10.659 ( 3.841 -4.135 0.346) 5.654 10.806 ( -1.658 -4.633 0.837) 4.991 10.955 ( 2.254 -0.560 -2.945) 3.751 11.199 ( 1.616 -2.174 4.506) 5.258 11.265 ( 0.194 5.153 -0.950) 5.243 11.396 ( 4.671 4.642 2.681) 7.111 11.476 ( 10.503 12.039 -3.789) 16.420 11.584 ( 1.157 2.397 -0.156) 2.666 12.048 ( -2.674 2.845 -1.053) 4.044 12.143 ( -0.998 2.337 1.197) 2.809 12.450 ( 5.547 3.177 0.368) 6.403 12.519 ( 4.235 3.991 -0.233) 5.824 12.993 ( -1.169 -4.385 -0.722) 4.595 13.053 ( 3.101 -4.923 1.076) 5.917 13.377 ( -4.785 8.171 -0.353) 9.475 13.577 ( -3.783 3.394 -0.239) 5.087 15.893 ( -2.196 -0.616 0.328) 2.304 16.016 ( -2.478 2.745 -0.182) 3.703 17.427 ( 0.060 -3.121 -0.246) 3.132 17.816 ( -1.526 -3.715 1.839) 4.417 17.969 ( 1.801 -4.159 -2.400) 5.128 18.358 ( -5.786 7.967 0.740) 9.874 18.443 ( 8.327 6.634 0.824) 10.678 19.018 ( 1.938 5.009 -3.364) 6.337 19.128 ( 4.849 6.895 3.176) 9.008 19.348 ( 1.027 3.188 -0.407) 3.374 19.602 ( -3.645 9.746 0.114) 10.406 19.989 ( -12.708 -4.738 -0.392) 13.568 21.131 ( 12.392 2.044 0.045) 12.560 21.657 ( 3.527 -7.827 1.283) 8.680 21.937 ( -0.919 -4.485 -1.300) 4.759 22.005 ( -1.889 3.928 -0.264) 4.366 22.226 ( -0.258 -0.839 4.582) 4.666 22.427 ( 2.582 0.632 -8.798) 9.190 22.790 ( -2.152 -3.281 7.805) 8.736 22.945 ( -1.209 -1.314 -2.629) 3.178 23.220 ( -2.789 -2.396 -0.339) 3.692 23.237 ( -5.678 -4.549 -0.203) 7.278 ======================= Grid point 144 (53/102) ======================= q-point: ( 0.55 0.09 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.638 ( -2.047 -2.300 6.094) 6.828 1.802 ( 1.403 -8.396 -2.457) 8.860 1.968 ( 4.579 3.436 -4.745) 7.436 2.248 ( 1.752 1.703 -0.991) 2.636 2.291 ( -1.587 0.945 3.813) 4.237 2.398 ( 1.334 6.629 2.347) 7.158 2.530 ( 7.687 0.683 -8.573) 11.535 2.698 ( -0.806 -3.251 2.339) 4.085 2.761 ( -0.660 1.660 -2.729) 3.262 3.045 ( -3.670 -3.854 8.253) 9.820 3.110 ( 1.155 -2.595 -0.363) 2.864 3.125 ( -2.948 1.170 0.126) 3.174 3.307 ( 4.458 -7.189 -2.122) 8.721 3.337 ( -1.517 -2.339 0.220) 2.796 3.422 ( -0.462 -0.187 -1.126) 1.232 3.465 ( -0.114 -0.801 1.568) 1.764 3.551 ( 2.592 9.620 -2.846) 10.362 3.604 ( -4.714 0.340 2.088) 5.167 3.663 ( -6.148 1.759 0.679) 6.431 3.757 ( -2.018 2.108 0.805) 3.027 3.869 ( 5.211 -5.210 -2.942) 7.935 4.014 ( 0.420 2.601 0.865) 2.774 4.111 ( -1.575 4.062 -2.047) 4.813 4.243 ( -3.244 -0.007 1.772) 3.697 4.367 ( 1.663 -6.986 -2.845) 7.724 4.439 ( 2.250 -0.427 0.121) 2.294 4.652 ( -1.013 1.412 1.314) 2.179 4.709 ( -4.952 -4.633 4.389) 8.078 4.924 ( 6.462 -0.306 -6.639) 9.270 5.030 ( -1.176 0.193 5.053) 5.192 5.133 ( 3.919 -0.941 -2.246) 4.614 5.344 ( -5.943 -1.416 -0.692) 6.148 5.469 ( -5.137 -4.212 0.819) 6.693 5.683 ( -0.127 -2.948 0.543) 3.000 5.709 ( -1.911 -1.202 -2.165) 3.128 5.816 ( 7.920 3.437 3.905) 9.476 5.926 ( 1.965 -7.288 -0.073) 7.549 6.117 ( -1.508 4.786 -0.269) 5.025 6.131 ( 0.130 6.041 0.777) 6.093 6.393 ( 4.279 0.701 -0.238) 4.343 6.526 ( -2.856 -0.153 -0.188) 2.866 6.531 ( -1.792 -2.221 -1.125) 3.068 6.565 ( -0.893 2.609 -0.102) 2.759 6.742 ( 3.690 -4.020 -2.514) 6.008 6.799 ( -2.875 8.640 2.649) 9.483 6.933 ( -1.093 4.181 0.838) 4.402 7.062 ( -1.265 -0.666 -0.347) 1.471 7.146 ( 1.138 2.817 -0.373) 3.061 7.322 ( -5.469 0.126 1.371) 5.640 7.438 ( -0.658 3.997 -1.871) 4.462 7.869 ( -3.531 -2.162 -0.086) 4.142 8.106 ( -3.299 0.722 -2.517) 4.212 8.163 ( 3.358 0.964 -2.599) 4.354 8.184 ( -6.655 3.340 -0.280) 7.451 8.365 ( 6.787 1.125 4.341) 8.135 8.686 ( -6.012 4.528 0.033) 7.526 8.935 ( 13.550 -4.059 -5.264) 15.093 9.106 ( -2.478 -1.063 2.635) 3.770 9.229 ( 0.578 -0.118 1.729) 1.827 9.491 ( -7.892 -3.691 6.914) 11.122 9.628 ( 5.867 2.808 2.843) 7.098 9.893 ( 4.793 3.954 -7.626) 9.837 10.252 ( 3.794 -0.023 -0.342) 3.810 10.675 ( -6.416 -5.750 1.218) 8.701 10.725 ( -0.474 -0.406 1.404) 1.536 10.868 ( -0.609 -2.186 -1.269) 2.600 10.956 ( 1.996 1.532 -3.263) 4.121 11.189 ( -2.416 1.034 1.568) 3.061 11.228 ( -2.014 1.114 2.375) 3.307 11.309 ( 5.253 6.659 -2.755) 8.918 11.396 ( 8.763 5.393 0.004) 10.289 11.558 ( 3.524 1.896 0.550) 4.039 11.993 ( -0.619 1.143 -0.951) 1.611 12.103 ( -2.182 0.901 1.544) 2.821 12.438 ( 2.995 2.053 -0.331) 3.646 12.490 ( 1.040 1.656 0.111) 1.959 13.059 ( -0.481 -2.703 -0.312) 2.763 13.173 ( 4.014 -4.852 1.325) 6.435 13.211 ( -3.982 6.049 -0.598) 7.267 13.513 ( -2.786 0.216 -0.555) 2.849 15.894 ( -2.489 -1.381 0.649) 2.920 15.967 ( -1.709 1.055 -0.528) 2.076 17.480 ( 2.475 -1.766 -0.100) 3.042 17.877 ( -4.825 -5.508 3.158) 7.974 18.012 ( 0.198 -0.473 -5.287) 5.312 18.204 ( 0.520 7.026 0.811) 7.092 18.437 ( 4.879 0.522 2.840) 5.670 18.915 ( -0.451 5.609 -4.537) 7.228 19.091 ( 2.869 1.994 3.637) 5.043 19.306 ( 1.905 3.586 -0.442) 4.084 19.480 ( -1.199 0.308 -0.104) 1.242 19.992 ( -11.016 -5.656 0.074) 12.384 21.161 ( 10.944 4.344 0.042) 11.775 21.753 ( -2.018 -0.234 0.606) 2.120 21.940 ( -0.136 -0.221 -0.647) 0.697 22.007 ( -1.237 -3.616 -0.499) 3.854 22.230 ( -0.270 0.840 3.930) 4.028 22.402 ( 1.215 1.906 -5.983) 6.395 22.859 ( 0.308 -3.466 2.806) 4.470 22.939 ( -1.293 0.695 0.888) 1.716 23.238 ( -0.987 -1.724 -0.464) 2.039 23.286 ( -1.292 -3.577 -0.745) 3.876 ======================= Grid point 145 (54/102) ======================= q-point: (-0.36 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.652 ( -6.046 0.671 8.710) 10.624 1.810 ( -0.220 14.630 -4.114) 15.199 1.871 ( 0.523 1.383 -3.889) 4.160 2.029 ( -3.698 12.074 -0.424) 12.634 2.287 ( -3.139 4.891 1.996) 6.145 2.329 ( -1.936 0.932 -1.986) 2.926 2.529 ( 7.158 3.114 -3.927) 8.738 2.742 ( -5.751 -1.626 1.285) 6.113 2.785 ( 6.370 -2.398 -2.690) 7.318 2.945 ( -7.128 10.002 3.173) 12.685 3.061 ( -3.458 1.552 5.617) 6.776 3.193 ( 0.978 0.347 -2.338) 2.558 3.272 ( -0.869 1.818 2.594) 3.284 3.398 ( 1.676 4.458 -1.657) 5.043 3.447 ( -2.312 -2.325 3.034) 4.467 3.495 ( 2.042 -0.830 0.284) 2.223 3.513 ( -1.961 -1.601 -3.537) 4.350 3.549 ( -0.884 -0.750 -1.639) 2.007 3.645 ( -0.564 -1.345 -0.675) 1.607 3.695 ( 0.376 -0.704 -1.409) 1.619 3.969 ( -1.377 -1.211 -0.392) 1.875 3.977 ( -4.165 0.966 4.894) 6.498 4.094 ( 0.230 -5.448 -3.023) 6.235 4.205 ( 1.902 1.851 1.678) 3.140 4.447 ( 1.621 1.554 -0.289) 2.265 4.482 ( 2.437 -2.490 -4.695) 5.847 4.616 ( 1.331 -0.033 -0.590) 1.457 4.797 ( -2.283 -4.852 6.091) 8.115 4.950 ( 6.361 0.298 -5.096) 8.156 5.016 ( 0.317 1.321 3.786) 4.022 5.187 ( 5.336 0.552 -0.263) 5.371 5.321 ( -5.241 -3.172 -0.498) 6.146 5.538 ( -3.560 -6.000 0.950) 7.040 5.693 ( 0.095 1.187 -4.972) 5.113 5.717 ( -0.857 1.187 2.737) 3.104 5.798 ( 8.255 2.971 1.039) 8.834 5.984 ( 3.616 8.775 -1.228) 9.570 6.065 ( -4.583 -5.623 -0.412) 7.266 6.126 ( -0.303 -3.006 4.743) 5.624 6.380 ( -6.950 5.289 2.539) 9.095 6.433 ( 1.799 1.332 -2.214) 3.148 6.468 ( -3.120 3.990 -0.751) 5.120 6.562 ( 0.940 4.095 -2.634) 4.959 6.648 ( -3.442 -0.139 -1.463) 3.743 6.789 ( -4.786 -0.614 1.670) 5.106 6.862 ( -4.611 -0.340 -0.060) 4.624 7.088 ( -0.169 -0.830 1.710) 1.908 7.143 ( 0.831 -1.873 0.987) 2.275 7.312 ( -5.243 -2.274 -0.127) 5.716 7.339 ( -4.926 3.162 -2.448) 6.345 7.894 ( -2.867 -3.181 0.536) 4.316 8.063 ( -2.279 1.048 -3.318) 4.160 8.130 ( -5.634 -1.321 3.415) 6.720 8.186 ( 5.871 -1.148 -6.901) 9.133 8.448 ( 2.599 -4.360 7.226) 8.830 8.619 ( -0.038 -0.394 -3.805) 3.825 9.086 ( 4.088 -3.171 2.980) 5.970 9.153 ( 8.399 -3.113 -4.975) 10.246 9.258 ( 4.008 -0.837 3.169) 5.178 9.508 ( -8.599 -2.585 9.962) 13.411 9.628 ( 4.901 1.959 0.537) 5.305 9.835 ( 2.689 2.775 -9.013) 9.806 10.275 ( 4.567 1.595 0.345) 4.849 10.666 ( -5.089 4.959 1.124) 7.194 10.712 ( -5.290 -2.621 0.643) 5.939 10.851 ( -1.088 1.214 -3.583) 3.937 10.945 ( 2.004 0.718 1.024) 2.363 11.136 ( -2.216 5.375 0.338) 5.824 11.194 ( -4.181 -2.923 1.717) 5.382 11.277 ( 1.966 2.095 -2.117) 3.569 11.384 ( 7.125 1.352 0.339) 7.260 11.582 ( 3.389 -1.133 0.106) 3.575 12.007 ( 0.733 -2.828 -0.562) 2.975 12.090 ( -2.513 -1.100 1.149) 2.974 12.419 ( 1.084 1.639 -0.251) 1.981 12.466 ( -0.145 1.587 0.038) 1.594 13.049 ( -0.990 3.277 1.009) 3.568 13.091 ( -1.550 3.823 -1.805) 4.503 13.316 ( 2.765 -7.265 2.198) 8.078 13.540 ( -0.771 -4.572 -1.476) 4.866 15.906 ( -3.446 -1.961 2.051) 4.464 15.949 ( -0.364 -0.246 -1.909) 1.959 17.527 ( 5.658 -0.305 -0.145) 5.668 17.956 ( -7.646 -7.129 4.202) 11.267 17.981 ( 0.478 2.478 -5.784) 6.311 18.089 ( 1.274 7.665 1.275) 7.874 18.500 ( 5.768 -2.740 1.467) 6.552 18.838 ( -4.443 -0.986 -1.477) 4.784 19.086 ( 1.850 1.403 -0.033) 2.322 19.264 ( -2.209 -0.061 0.423) 2.250 19.566 ( 5.755 -6.696 0.125) 8.831 20.029 ( -9.018 -6.655 -0.164) 11.209 21.139 ( 9.971 6.728 0.139) 12.029 21.647 ( -7.520 6.336 -0.012) 9.834 21.996 ( 1.759 -3.293 -0.548) 3.773 22.035 ( -0.600 -0.022 0.079) 0.605 22.219 ( -1.779 0.595 5.158) 5.489 22.362 ( 2.081 1.758 -7.059) 7.566 22.887 ( -2.386 1.543 5.300) 6.013 22.940 ( 2.140 -1.845 -2.254) 3.615 23.265 ( 0.179 -1.310 1.733) 2.179 23.342 ( 2.403 -2.704 -2.538) 4.419 ======================= Grid point 146 (55/102) ======================= q-point: (-0.27 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( -5.139 19.600 3.034) 20.488 1.496 ( -5.535 15.900 3.021) 17.105 1.729 ( -2.778 12.449 -2.310) 12.963 1.872 ( -4.502 2.167 -3.139) 5.901 2.162 ( -2.947 5.724 4.834) 8.050 2.350 ( 0.777 -2.916 -8.800) 9.302 2.444 ( 1.400 9.016 1.749) 9.290 2.599 ( -9.046 9.566 0.016) 13.166 2.784 ( -0.870 7.085 5.439) 8.974 2.814 ( 0.495 4.481 -3.082) 5.461 2.982 ( -4.268 4.645 4.344) 7.659 3.122 ( 1.403 6.170 -2.182) 6.693 3.263 ( -3.581 3.877 0.678) 5.322 3.342 ( 0.352 -1.372 -1.974) 2.430 3.388 ( -1.080 4.328 -2.452) 5.091 3.432 ( -1.346 3.034 -0.594) 3.372 3.532 ( 3.969 1.959 -2.837) 5.257 3.545 ( -2.712 -3.306 2.339) 4.874 3.736 ( -0.135 -6.496 2.542) 6.977 3.832 ( 5.492 -7.700 -6.472) 11.460 3.948 ( -3.012 -0.196 4.759) 5.636 3.966 ( -1.576 -1.097 0.566) 2.002 4.172 ( 3.705 -1.221 -0.284) 3.912 4.222 ( -1.169 -0.487 1.963) 2.336 4.403 ( 2.389 2.072 1.790) 3.634 4.534 ( -0.447 -3.441 -3.179) 4.706 4.672 ( 8.374 -1.627 -0.131) 8.532 4.835 ( -3.774 -1.136 6.443) 7.552 4.981 ( -0.415 -1.263 -1.727) 2.179 5.036 ( -0.347 -3.202 -6.339) 7.110 5.199 ( 6.335 0.658 2.545) 6.859 5.383 ( 3.394 -2.868 -2.449) 5.074 5.612 ( 0.097 -0.425 1.596) 1.655 5.628 ( 4.799 5.813 -0.927) 7.595 5.649 ( -6.606 0.570 1.739) 6.855 5.847 ( 10.726 1.659 -3.460) 11.392 5.919 ( 0.429 -1.313 1.312) 1.905 6.015 ( -13.872 3.004 -0.328) 14.198 6.126 ( -6.476 1.012 4.396) 7.893 6.258 ( -7.565 1.686 2.484) 8.139 6.380 ( -3.061 1.749 1.315) 3.763 6.473 ( 5.808 -0.746 -2.551) 6.387 6.495 ( 3.101 1.760 -3.733) 5.162 6.648 ( -2.479 -1.968 0.108) 3.166 6.827 ( -3.167 -3.396 -0.881) 4.726 6.867 ( -5.202 -6.423 0.172) 8.267 7.061 ( -3.253 2.289 4.670) 6.134 7.153 ( 1.524 4.023 -3.319) 5.434 7.288 ( -7.090 -4.810 0.352) 8.575 7.334 ( -3.466 -3.432 -1.782) 5.193 7.942 ( -3.092 -3.892 2.402) 5.520 8.045 ( -1.698 -1.502 -3.051) 3.801 8.135 ( -0.806 -1.513 1.407) 2.217 8.238 ( 2.965 -1.646 -6.288) 7.144 8.562 ( -1.146 -5.644 7.471) 9.434 8.665 ( 4.052 -3.327 -5.243) 7.414 9.144 ( 0.154 -1.401 5.556) 5.732 9.237 ( 6.246 -0.028 -4.309) 7.588 9.353 ( 7.613 -3.461 4.052) 9.293 9.494 ( -7.293 -0.250 8.632) 11.303 9.630 ( 1.469 0.792 0.463) 1.732 9.818 ( 2.270 -1.170 -10.675) 10.976 10.257 ( 4.155 3.686 1.599) 5.780 10.502 ( -7.316 6.931 0.012) 10.078 10.708 ( -0.004 0.579 0.020) 0.579 10.818 ( -0.796 1.391 -4.198) 4.494 10.960 ( 0.274 -0.424 3.052) 3.093 11.046 ( -3.605 1.073 1.460) 4.034 11.215 ( -4.161 -2.079 2.055) 5.086 11.253 ( 0.342 0.239 -2.741) 2.773 11.445 ( 6.404 -1.349 -0.223) 6.549 11.619 ( -0.533 -1.192 -0.214) 1.323 12.086 ( -1.226 -5.009 -0.057) 5.158 12.117 ( 0.081 -3.634 -0.146) 3.638 12.393 ( -0.396 1.753 1.165) 2.142 12.436 ( 0.074 1.499 -0.782) 1.692 12.978 ( -1.011 3.174 1.848) 3.810 13.026 ( 0.119 2.681 -2.490) 3.661 13.479 ( 1.507 -8.231 3.408) 9.036 13.634 ( 0.680 -6.091 -2.813) 6.743 15.915 ( -5.156 -1.827 4.120) 6.848 15.961 ( 1.011 -1.283 -3.961) 4.284 17.576 ( 9.497 1.291 0.301) 9.589 17.894 ( 2.397 7.338 -2.473) 8.106 17.943 ( -0.679 7.707 0.103) 7.738 18.032 ( -13.533 -7.972 2.455) 15.897 18.647 ( 9.375 -7.685 -1.075) 12.170 18.891 ( -7.010 -9.112 1.847) 11.644 19.076 ( 2.331 0.734 -1.138) 2.696 19.280 ( -4.734 -4.304 -0.500) 6.417 19.776 ( 8.963 -10.061 0.690) 13.492 20.092 ( -7.200 -7.132 -0.646) 10.155 21.069 ( 9.736 9.334 0.250) 13.490 21.439 ( -10.871 9.331 -0.136) 14.327 21.997 ( 1.270 4.315 -0.275) 4.506 22.026 ( -1.142 1.381 1.030) 2.067 22.215 ( -2.604 -1.468 5.686) 6.424 22.352 ( 3.888 0.108 -9.441) 10.210 22.846 ( -2.818 1.864 8.499) 9.146 22.982 ( 3.003 -1.205 -5.468) 6.354 23.288 ( 0.658 -0.074 4.216) 4.268 23.406 ( 4.651 -2.226 -4.325) 6.730 ======================= Grid point 147 (56/102) ======================= q-point: (-0.18 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.088 ( -1.622 15.261 -1.295) 15.402 1.119 ( -6.037 20.233 1.275) 21.153 1.461 ( 1.920 16.603 -0.057) 16.714 1.724 ( -8.918 7.789 -9.401) 15.119 2.041 ( -5.172 10.146 10.272) 15.336 2.191 ( -3.286 15.273 -2.368) 15.801 2.291 ( 0.532 9.530 9.202) 13.258 2.454 ( -10.039 16.599 7.031) 20.634 2.629 ( 3.264 -5.924 -3.950) 7.833 2.689 ( 2.086 5.053 -6.136) 8.218 2.871 ( -2.445 5.921 -1.537) 6.588 2.976 ( 1.678 10.767 -8.943) 14.097 3.192 ( -0.721 2.234 1.540) 2.807 3.215 ( -4.526 6.404 0.790) 7.882 3.433 ( -2.403 -2.019 2.925) 4.290 3.456 ( 6.053 1.519 -3.313) 7.065 3.523 ( 2.093 -3.578 1.067) 4.280 3.580 ( -3.768 -3.290 1.460) 5.211 3.849 ( -2.282 -5.995 3.614) 7.362 3.938 ( 3.504 -1.888 -1.589) 4.286 3.975 ( 0.867 -0.445 -2.312) 2.509 3.997 ( -0.946 -6.365 -3.297) 7.230 4.185 ( -2.270 2.747 4.015) 5.368 4.222 ( 5.591 -0.368 -3.220) 6.462 4.420 ( 6.946 1.732 0.685) 7.192 4.538 ( -4.392 2.084 0.077) 4.862 4.776 ( 1.577 -3.657 9.799) 10.578 4.886 ( 4.883 -4.721 0.167) 6.794 5.005 ( -7.673 -4.989 -0.210) 9.155 5.064 ( -4.128 -4.984 -7.218) 9.694 5.269 ( 9.479 -0.403 -0.351) 9.494 5.424 ( -0.359 -0.121 -2.301) 2.332 5.521 ( -2.870 2.888 2.004) 4.538 5.573 ( 7.463 4.126 -2.384) 8.854 5.696 ( 5.274 -0.463 0.786) 5.353 5.847 ( -14.725 -0.335 0.083) 14.729 5.930 ( 6.766 -0.373 -3.571) 7.660 5.984 ( 5.279 -4.992 5.949) 9.390 6.039 ( -10.014 3.282 1.883) 10.705 6.229 ( -5.000 -4.708 -0.762) 6.910 6.348 ( -3.873 0.432 1.994) 4.377 6.440 ( 1.640 3.558 -4.032) 5.622 6.584 ( 6.901 -4.172 -0.346) 8.071 6.690 ( -2.079 -3.431 -2.147) 4.550 6.838 ( 0.292 -0.296 2.727) 2.759 6.954 ( -6.139 -4.842 -1.365) 7.937 7.003 ( -4.104 1.812 5.000) 6.717 7.083 ( 1.587 2.493 -4.040) 5.005 7.323 ( -5.640 -3.728 1.789) 6.994 7.386 ( -0.367 -3.801 -5.154) 6.414 7.972 ( -4.681 -1.278 5.698) 7.484 8.078 ( 0.080 -3.708 -3.633) 5.192 8.179 ( 0.222 -2.642 -0.080) 2.652 8.252 ( 2.183 -0.295 -5.939) 6.335 8.665 ( -2.606 -5.676 6.179) 8.786 8.752 ( 3.677 -4.254 -4.000) 6.900 9.151 ( -0.066 2.447 4.852) 5.434 9.233 ( 2.571 3.815 -0.923) 4.692 9.438 ( -2.852 0.424 7.885) 8.396 9.493 ( 3.791 -3.166 1.847) 5.273 9.617 ( -4.065 0.060 2.559) 4.804 9.829 ( -0.219 -0.251 -7.631) 7.638 10.264 ( 6.193 -1.441 -0.509) 6.379 10.367 ( -5.995 1.158 -0.529) 6.128 10.687 ( 0.147 1.875 1.471) 2.388 10.765 ( 0.461 2.858 -4.357) 5.231 10.985 ( 4.169 -0.758 1.235) 4.414 11.061 ( -4.921 -4.139 2.321) 6.837 11.219 ( -4.836 -1.651 2.372) 5.634 11.256 ( 1.736 -0.252 -2.956) 3.437 11.496 ( 3.919 0.729 0.833) 4.072 11.615 ( -3.799 -0.747 -0.944) 3.985 12.149 ( -0.476 -3.915 0.480) 3.972 12.218 ( -1.158 -6.484 -1.900) 6.855 12.364 ( -0.323 1.085 2.362) 2.619 12.409 ( 0.595 1.545 -1.277) 2.091 12.938 ( -0.755 1.052 2.239) 2.587 12.989 ( 0.848 1.254 -2.268) 2.726 13.636 ( -0.172 -7.647 4.052) 8.656 13.746 ( 1.889 -6.041 -4.042) 7.510 15.916 ( -6.908 -2.136 5.610) 9.152 15.989 ( 2.687 -1.615 -5.213) 6.083 17.594 ( 8.219 5.968 3.038) 10.602 17.751 ( -1.480 8.284 -0.588) 8.435 17.846 ( 9.134 4.191 -2.121) 10.271 18.045 ( -19.867 -6.378 -0.982) 20.889 18.889 ( 9.702 -10.550 -0.717) 14.351 19.036 ( -9.020 -11.850 -0.622) 14.905 19.122 ( 5.621 -4.087 4.191) 8.116 19.337 ( -5.579 -6.819 -3.196) 9.373 20.037 ( 7.573 -11.175 1.516) 13.584 20.174 ( -3.382 -6.906 -1.546) 7.844 20.947 ( 9.395 12.716 0.632) 15.823 21.151 ( -13.442 12.625 -0.417) 18.446 21.907 ( 2.087 6.863 0.700) 7.208 21.948 ( -2.914 4.638 1.449) 5.666 22.255 ( -1.385 -2.868 2.955) 4.344 22.358 ( 3.274 0.416 -7.621) 8.305 22.827 ( -2.032 0.233 8.786) 9.021 23.001 ( 2.571 0.002 -6.602) 7.085 23.290 ( 0.782 1.951 6.164) 6.513 23.462 ( 4.369 -1.154 -6.741) 8.115 ======================= Grid point 148 (57/102) ======================= q-point: (-0.09 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.730 ( -3.389 17.952 5.058) 18.956 0.936 ( 6.440 3.324 -11.980) 14.001 1.168 ( 6.934 20.097 7.012) 22.386 1.458 ( -6.387 11.555 -16.760) 21.336 1.692 ( -5.138 30.315 11.332) 32.769 1.799 ( 0.766 18.743 4.038) 19.188 2.177 ( -5.355 4.079 5.382) 8.619 2.180 ( 2.822 9.690 5.150) 11.331 2.664 ( 3.590 5.238 -1.718) 6.578 2.680 ( -6.582 1.969 0.061) 6.871 2.762 ( 1.067 8.094 -6.415) 10.383 2.883 ( 7.931 -9.010 -9.500) 15.308 3.107 ( -4.513 1.453 4.284) 6.390 3.148 ( 3.177 4.339 1.405) 5.558 3.422 ( -6.250 -0.855 1.868) 6.580 3.442 ( 2.636 1.648 1.383) 3.403 3.607 ( -1.351 -3.424 1.030) 3.823 3.653 ( 0.926 -4.779 -1.106) 4.992 3.908 ( -2.999 -0.417 2.199) 3.742 3.975 ( 1.606 -1.657 -2.443) 3.361 4.009 ( 0.922 -2.434 1.113) 2.831 4.095 ( -4.587 5.295 3.509) 7.835 4.113 ( 1.167 -6.345 -3.804) 7.490 4.243 ( 4.627 1.916 -5.352) 7.330 4.421 ( -4.571 3.412 -1.868) 6.002 4.426 ( 7.022 4.289 -0.600) 8.250 4.843 ( -4.419 -2.148 12.644) 13.566 4.984 ( -2.247 -1.564 0.650) 2.814 5.061 ( -4.148 -7.581 0.746) 8.673 5.190 ( 8.528 -9.317 -9.036) 15.530 5.324 ( -5.837 -3.589 2.642) 7.344 5.420 ( 2.364 -3.189 -4.221) 5.794 5.515 ( -3.671 -2.854 4.163) 6.241 5.594 ( 6.453 -0.818 -1.886) 6.772 5.757 ( 12.619 0.879 -1.224) 12.708 5.775 ( -7.940 0.211 -2.714) 8.393 5.876 ( -12.022 2.789 3.202) 12.750 5.953 ( 6.436 2.791 -2.462) 7.435 6.217 ( 1.910 -10.574 4.957) 11.834 6.291 ( -4.190 -4.763 -0.493) 6.363 6.304 ( 3.504 2.851 0.701) 4.571 6.380 ( 0.143 2.081 -5.061) 5.474 6.680 ( -0.082 0.015 0.369) 0.379 6.709 ( 0.239 -0.943 -2.170) 2.378 6.859 ( 5.393 0.855 3.408) 6.436 6.901 ( -9.410 1.328 1.755) 9.664 6.992 ( 1.749 -0.238 1.860) 2.564 7.077 ( 1.893 -0.073 -3.173) 3.696 7.360 ( 1.998 -2.661 -2.252) 4.018 7.399 ( -1.395 1.213 -6.185) 6.455 7.950 ( -3.419 1.460 7.679) 8.532 8.136 ( 3.728 -0.862 -8.005) 8.873 8.219 ( -3.712 -6.074 3.364) 7.873 8.319 ( 5.454 -4.955 -4.560) 8.665 8.731 ( -6.879 -3.351 7.483) 10.703 8.861 ( 3.669 -5.587 -3.926) 7.752 9.066 ( 0.098 7.721 4.388) 8.881 9.154 ( 1.641 4.961 -1.898) 5.559 9.409 ( -2.093 2.392 6.983) 7.672 9.546 ( 2.688 1.529 -6.530) 7.225 9.626 ( -10.303 -6.810 15.288) 19.653 9.812 ( -1.106 -1.435 -0.406) 1.857 10.341 ( -2.262 -4.498 2.262) 5.520 10.443 ( 3.916 -10.417 -5.311) 12.331 10.669 ( 0.065 0.268 1.163) 1.195 10.727 ( 3.186 1.097 -4.781) 5.850 11.030 ( 3.004 0.305 3.217) 4.412 11.072 ( -7.372 -0.814 -0.965) 7.479 11.221 ( -3.231 -1.480 3.806) 5.207 11.284 ( 2.906 -1.365 -1.675) 3.622 11.489 ( 8.510 3.655 2.907) 9.707 11.578 ( -6.795 1.297 -4.363) 8.178 12.245 ( 5.171 -4.970 1.903) 7.420 12.287 ( -2.982 -3.798 -1.665) 5.108 12.355 ( -2.587 0.352 1.889) 3.223 12.406 ( 1.767 -1.695 -2.533) 3.523 12.935 ( -0.780 -0.635 2.190) 2.410 12.977 ( 0.498 0.453 -1.405) 1.558 13.758 ( -1.058 -5.425 3.235) 6.404 13.850 ( 1.824 -4.493 -4.608) 6.690 15.911 ( -9.972 -2.686 7.228) 12.606 16.055 ( 8.075 -3.465 -5.049) 10.134 17.503 ( 2.422 8.114 5.451) 10.071 17.595 ( -1.284 7.312 -1.366) 7.549 17.880 ( -6.987 0.904 0.784) 7.089 17.981 ( 4.313 -0.405 -7.926) 9.033 19.117 ( 3.304 -8.259 3.467) 9.547 19.168 ( -1.239 -9.648 -1.210) 9.802 19.332 ( 1.270 -13.015 3.729) 13.598 19.441 ( -1.687 -9.526 -5.121) 10.946 20.230 ( -0.985 -5.686 2.540) 6.305 20.300 ( 4.051 -6.225 -3.605) 8.256 20.732 ( -0.428 16.407 4.095) 16.915 20.825 ( -3.361 13.660 -3.928) 14.606 21.807 ( 2.153 5.584 3.253) 6.812 21.855 ( -1.420 3.712 -0.558) 4.014 22.292 ( -1.710 -1.860 1.329) 2.855 22.356 ( 2.614 0.680 -4.300) 5.078 22.841 ( -1.563 -1.170 6.843) 7.116 22.991 ( 0.867 0.999 -6.065) 6.208 23.249 ( 0.122 4.820 7.069) 8.557 23.452 ( -0.685 3.255 -10.995) 11.487 ======================= Grid point 151 (58/102) ======================= q-point: ( 0.18 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.918 ( 10.454 0.000 17.026) 19.979 0.971 ( 17.180 0.000 11.189) 20.503 1.114 ( 21.287 0.000 -9.320) 23.237 1.286 ( 22.170 0.000 -11.334) 24.899 1.738 ( 38.485 0.000 9.653) 39.677 1.978 ( 23.229 0.000 -13.554) 26.895 2.109 ( 13.545 0.000 -13.920) 19.422 2.417 ( 9.879 0.000 7.359) 12.318 2.535 ( 11.995 0.000 -2.785) 12.314 2.669 ( 5.486 0.000 2.554) 6.051 2.822 ( -14.564 -0.000 6.679) 16.023 2.952 ( -2.259 -0.000 7.895) 8.212 3.093 ( -6.947 -0.000 -0.226) 6.951 3.186 ( 3.900 0.000 -4.470) 5.932 3.436 ( -5.143 -0.000 -4.224) 6.655 3.483 ( -3.223 -0.000 -2.163) 3.881 3.555 ( 10.087 0.000 1.026) 10.139 3.757 ( 1.615 0.000 -5.829) 6.049 3.804 ( -4.290 -0.000 1.131) 4.437 3.840 ( 0.099 0.000 2.606) 2.608 3.876 ( -2.059 -0.000 6.370) 6.694 4.035 ( -8.574 -0.000 0.948) 8.626 4.197 ( 4.976 0.000 0.705) 5.025 4.256 ( 2.150 0.000 -1.278) 2.501 4.441 ( 4.005 0.000 0.524) 4.039 4.531 ( -0.377 -0.000 -7.153) 7.163 4.893 ( -9.445 -0.000 10.435) 14.075 4.972 ( 0.998 0.000 1.027) 1.432 5.043 ( 0.191 0.000 -10.061) 10.063 5.232 ( -12.020 -0.000 4.782) 12.936 5.278 ( -6.593 -0.000 -1.618) 6.789 5.325 ( -6.213 -0.000 1.817) 6.473 5.558 ( -2.764 -0.000 -1.879) 3.343 5.663 ( -6.467 -0.000 1.250) 6.587 5.842 ( -7.734 -0.000 3.879) 8.653 5.893 ( -2.816 -0.000 -3.790) 4.721 5.956 ( 4.875 0.000 0.977) 4.972 5.964 ( 3.997 0.000 -4.345) 5.904 6.121 ( 0.506 0.000 -6.610) 6.629 6.158 ( -0.612 -0.000 -0.145) 0.629 6.236 ( -7.372 -0.000 6.969) 10.145 6.315 ( -1.326 -0.000 0.151) 1.335 6.598 ( -4.934 -0.000 -0.052) 4.935 6.664 ( -5.833 -0.000 0.427) 5.848 6.910 ( 5.071 0.000 -3.607) 6.223 6.956 ( 9.412 0.000 4.674) 10.509 7.102 ( 13.107 0.000 -6.666) 14.705 7.180 ( 2.503 0.000 0.001) 2.503 7.455 ( 8.748 0.000 7.019) 11.215 7.919 ( 5.225 0.000 5.236) 7.397 7.982 ( 10.028 0.000 -8.080) 12.879 8.194 ( -1.364 -0.000 -3.464) 3.723 8.427 ( 3.946 0.000 -3.465) 5.252 8.638 ( -2.126 -0.000 -2.625) 3.378 8.641 ( -3.222 -0.000 0.619) 3.281 8.906 ( -7.748 -0.000 3.007) 8.311 8.914 ( 2.409 0.000 -2.139) 3.222 9.191 ( 1.852 0.000 -1.178) 2.195 9.450 ( -9.795 -0.000 21.952) 24.039 9.669 ( 12.921 0.000 -9.991) 16.333 9.724 ( 23.654 0.000 -21.165) 31.741 10.048 ( 0.287 0.000 10.994) 10.997 10.422 ( -6.379 -0.000 -5.891) 8.683 10.490 ( -17.608 -0.000 3.049) 17.870 10.606 ( 0.139 0.000 -0.622) 0.637 10.691 ( -3.127 -0.000 3.779) 4.905 11.003 ( 3.463 0.000 3.206) 4.719 11.038 ( 4.536 0.000 0.065) 4.536 11.077 ( 5.164 0.000 2.137) 5.589 11.395 ( 6.368 0.000 0.592) 6.396 11.550 ( 9.851 0.000 5.127) 11.105 11.907 ( -5.578 -0.000 2.270) 6.022 12.169 ( -8.376 -0.000 2.378) 8.707 12.212 ( -5.989 -0.000 -4.025) 7.216 12.747 ( 7.598 0.000 4.127) 8.646 12.780 ( 0.350 0.000 -3.198) 3.217 13.075 ( 16.884 0.000 5.154) 17.653 13.183 ( 13.092 0.000 -5.666) 14.265 13.788 ( -3.396 -0.000 0.521) 3.436 13.794 ( -2.876 -0.000 -1.063) 3.066 15.899 ( 0.686 0.000 -0.230) 0.723 16.519 ( -18.072 -0.000 11.340) 21.335 17.378 ( 13.954 0.000 5.315) 14.932 17.474 ( 6.953 0.000 -4.020) 8.031 18.067 ( 12.148 0.000 3.701) 12.699 18.140 ( 10.578 0.000 -6.980) 12.673 19.025 ( -12.729 -0.000 -4.872) 13.629 19.126 ( -16.847 -0.000 2.011) 16.966 19.750 ( 3.191 0.000 -0.732) 3.274 19.989 ( -2.603 -0.000 2.555) 3.647 20.330 ( 4.238 0.000 9.119) 10.056 20.368 ( 21.945 0.000 -20.972) 30.355 20.649 ( 7.569 0.000 4.451) 8.781 20.792 ( 16.166 0.000 -5.272) 17.004 21.841 ( 1.104 0.000 2.334) 2.582 21.891 ( 5.281 0.000 -1.692) 5.545 22.326 ( -1.501 -0.000 0.952) 1.777 22.383 ( 1.548 0.000 -0.785) 1.736 22.415 ( -16.529 -0.000 16.330) 23.235 22.801 ( -10.057 -0.000 -1.914) 10.237 22.933 ( -4.680 -0.000 0.337) 4.692 22.961 ( -5.342 -0.000 -1.394) 5.521 ======================= Grid point 152 (59/102) ======================= q-point: ( 0.27 0.18 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.043 ( 18.785 -3.959 5.565) 19.988 1.283 ( 19.664 -2.337 -7.237) 21.083 1.328 ( 9.443 -17.962 13.557) 24.405 1.475 ( 21.891 -3.860 -11.709) 25.124 2.003 ( 19.869 1.165 1.442) 19.956 2.135 ( 23.683 -4.879 1.890) 24.254 2.232 ( 14.995 -1.958 -8.045) 17.129 2.509 ( -0.338 0.495 7.735) 7.759 2.588 ( -0.953 2.026 3.224) 3.926 2.687 ( 14.939 -4.157 -9.420) 18.144 2.856 ( 2.312 -8.578 1.035) 8.944 2.941 ( -4.631 -1.678 3.090) 5.815 3.104 ( -3.501 -3.803 3.395) 6.184 3.213 ( 5.247 0.359 -4.942) 7.217 3.354 ( -0.672 1.648 -3.567) 3.986 3.506 ( -4.301 -2.431 0.444) 4.960 3.599 ( 1.750 2.671 3.378) 4.649 3.699 ( -2.747 5.006 1.016) 5.800 3.722 ( 0.236 0.498 -4.788) 4.819 3.879 ( -0.286 -2.399 1.334) 2.760 3.930 ( -3.327 -2.514 1.422) 4.406 3.970 ( -9.478 -1.488 3.950) 10.376 4.199 ( 5.101 4.233 -0.972) 6.699 4.226 ( 3.799 3.870 0.910) 5.499 4.494 ( -0.586 1.600 -5.447) 5.707 4.536 ( 4.011 -3.913 -3.331) 6.519 4.756 ( -15.249 3.809 7.849) 17.568 4.948 ( -1.886 6.484 0.182) 6.756 4.979 ( 1.957 2.254 -6.051) 6.747 5.170 ( -6.367 1.615 5.171) 8.359 5.208 ( -0.682 0.225 -2.331) 2.439 5.339 ( -8.669 -1.627 0.681) 8.847 5.498 ( -4.404 4.297 1.984) 6.465 5.597 ( -2.190 0.044 0.214) 2.200 5.696 ( -4.040 4.644 1.907) 6.444 5.777 ( -6.715 6.076 -1.755) 9.224 5.927 ( -7.107 2.568 3.461) 8.312 6.074 ( -0.315 -3.239 -3.086) 4.484 6.110 ( 2.080 -3.485 -3.174) 5.152 6.238 ( -0.953 -8.600 -2.206) 8.930 6.297 ( -0.145 -5.004 1.560) 5.243 6.326 ( -4.090 -2.618 2.255) 5.354 6.576 ( -4.425 -1.747 0.632) 4.799 6.628 ( -3.172 0.591 -0.446) 3.258 6.940 ( 6.847 0.419 -4.322) 8.108 7.026 ( 8.435 0.869 3.715) 9.258 7.123 ( 4.965 1.432 -0.511) 5.192 7.313 ( 4.191 -7.568 -3.826) 9.459 7.512 ( 8.315 1.688 3.079) 9.026 7.950 ( 4.170 5.974 -5.263) 8.988 8.004 ( 5.944 -1.097 2.730) 6.633 8.181 ( 0.438 -0.202 -2.328) 2.377 8.441 ( 4.591 1.497 -2.058) 5.249 8.526 ( -4.636 7.633 3.366) 9.544 8.594 ( -1.786 2.367 -0.481) 3.004 8.782 ( -5.855 3.892 -0.990) 7.100 9.000 ( -2.609 -3.416 0.378) 4.315 9.195 ( 0.290 -0.496 -3.155) 3.207 9.427 ( -1.799 2.501 14.861) 15.177 9.671 ( 13.388 7.789 -4.697) 16.185 9.801 ( 12.115 0.637 -9.190) 15.220 10.013 ( -0.169 6.984 4.271) 8.189 10.345 ( -6.040 0.714 -2.279) 6.495 10.447 ( -10.063 -5.696 -3.145) 11.983 10.515 ( 1.571 6.582 1.017) 6.843 10.720 ( -1.334 -0.873 2.910) 3.318 10.956 ( 5.469 4.115 0.358) 6.854 11.063 ( 5.591 0.075 4.351) 7.085 11.266 ( 4.893 -8.972 0.332) 10.225 11.480 ( 7.174 -2.517 -1.277) 7.709 11.606 ( 8.184 2.269 5.138) 9.926 11.843 ( -7.611 1.422 -1.972) 7.990 12.121 ( -7.380 -0.618 1.379) 7.533 12.173 ( -2.452 -0.275 -2.146) 3.270 12.746 ( 1.585 2.008 -1.227) 2.837 12.795 ( 4.591 0.182 1.469) 4.824 13.050 ( 12.264 13.168 2.067) 18.113 13.183 ( 13.752 10.597 -0.840) 17.382 13.738 ( -5.545 0.761 -1.108) 5.706 13.779 ( -2.964 1.843 0.033) 3.491 15.891 ( -2.670 -0.106 0.139) 2.675 16.343 ( -17.269 5.109 4.073) 18.463 17.359 ( 10.681 7.229 0.644) 12.913 17.607 ( 8.084 -4.314 0.245) 9.166 17.864 ( 12.701 9.135 -0.841) 15.667 18.516 ( 3.973 -9.630 2.708) 10.764 18.879 ( -10.517 3.526 -2.577) 11.387 19.173 ( -16.583 -14.648 0.321) 22.128 19.667 ( 0.842 10.700 0.460) 10.743 19.803 ( -0.506 14.377 1.214) 14.437 20.079 ( 8.662 21.643 -3.798) 23.620 20.402 ( 5.524 10.213 -5.010) 12.646 20.893 ( 8.198 -14.529 7.172) 18.159 20.979 ( 16.695 -6.462 -5.701) 18.788 21.821 ( 1.887 0.547 0.671) 2.076 21.938 ( 5.149 -0.775 1.584) 5.443 22.282 ( -1.483 2.968 -0.663) 3.383 22.380 ( -0.813 -1.505 -0.218) 1.724 22.541 ( -9.147 -13.245 4.975) 16.848 22.784 ( -7.689 -4.835 0.374) 9.090 22.921 ( -7.235 -3.421 0.368) 8.012 22.985 ( -6.480 -7.005 -1.224) 9.621 ======================= Grid point 154 (60/102) ======================= q-point: ( 0.36 0.18 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.321 ( 19.107 -9.372 -0.125) 21.282 1.410 ( 15.063 0.765 -5.718) 16.130 1.661 ( 14.713 -5.114 -7.409) 17.248 1.761 ( 3.767 -19.487 13.347) 23.918 2.127 ( 7.195 -3.719 -0.337) 8.107 2.171 ( 3.372 6.310 5.107) 8.790 2.440 ( -0.294 -1.424 0.226) 1.471 2.521 ( 17.424 -10.651 -3.695) 20.753 2.680 ( 6.674 -2.311 0.425) 7.076 2.875 ( 6.948 -5.986 -2.124) 9.414 2.981 ( 4.354 -3.433 -1.551) 5.757 3.012 ( 5.864 -1.605 -5.043) 7.899 3.149 ( -7.380 -6.512 4.932) 11.009 3.248 ( 3.753 -1.919 -1.947) 4.644 3.358 ( 1.029 -1.432 -2.343) 2.933 3.488 ( -5.276 4.645 2.674) 7.521 3.522 ( 1.315 1.626 1.794) 2.755 3.643 ( 0.828 0.690 1.158) 1.582 3.741 ( -1.657 -3.644 -5.296) 6.638 3.850 ( -7.484 3.186 1.736) 8.317 3.898 ( -5.687 -1.261 2.406) 6.303 4.032 ( 3.631 -2.493 0.952) 4.506 4.155 ( 6.207 3.875 -1.748) 7.523 4.210 ( 4.115 0.218 3.287) 5.271 4.433 ( 0.928 4.295 -3.266) 5.475 4.508 ( -8.267 3.683 2.342) 9.348 4.657 ( -5.639 2.233 -0.335) 6.074 4.819 ( -2.923 2.310 -2.869) 4.702 4.962 ( -1.275 0.779 -1.871) 2.395 5.090 ( -5.969 5.674 2.396) 8.577 5.148 ( 0.260 2.527 0.862) 2.683 5.286 ( -4.426 1.182 -3.259) 5.622 5.440 ( -3.911 -0.982 1.967) 4.487 5.567 ( 4.448 3.546 5.115) 7.650 5.636 ( -7.977 2.192 0.672) 8.300 5.686 ( -2.870 -3.423 -1.776) 4.807 5.852 ( -8.272 -1.654 1.664) 8.599 6.105 ( -0.946 -3.236 -3.996) 5.228 6.212 ( -1.730 -5.966 1.001) 6.292 6.329 ( -2.976 -0.465 0.968) 3.164 6.364 ( -1.218 -6.014 -0.479) 6.155 6.407 ( 4.008 -5.338 0.531) 6.696 6.581 ( -1.310 1.173 1.569) 2.357 6.605 ( -0.944 -1.851 -1.595) 2.619 6.971 ( 5.786 0.649 -4.334) 7.258 7.050 ( 5.761 3.154 4.677) 8.063 7.143 ( 2.249 0.171 -0.049) 2.256 7.417 ( 0.459 -2.451 -0.533) 2.550 7.544 ( 7.067 1.527 -1.315) 7.348 7.789 ( 5.463 13.493 -7.240) 16.258 8.017 ( -3.135 2.421 3.066) 5.009 8.202 ( 4.220 1.410 2.080) 4.911 8.387 ( -1.277 4.851 -3.993) 6.412 8.413 ( -2.461 2.829 2.502) 4.508 8.556 ( 3.585 1.881 -0.796) 4.126 8.686 ( -3.588 1.599 -0.060) 3.929 9.004 ( -4.467 -0.692 -0.139) 4.523 9.181 ( -4.501 0.240 -1.637) 4.796 9.356 ( 0.027 8.167 9.045) 12.187 9.624 ( 2.330 3.664 4.166) 6.017 9.803 ( 2.726 10.059 -2.742) 10.776 9.906 ( 8.875 0.022 -5.062) 10.217 10.320 ( -1.726 0.075 0.885) 1.941 10.436 ( -3.568 -0.583 0.307) 3.628 10.511 ( 3.173 -3.791 -5.567) 7.445 10.722 ( 0.797 0.443 2.917) 3.056 10.954 ( 4.692 1.046 -0.611) 4.846 11.116 ( 4.028 -0.755 4.958) 6.433 11.427 ( 7.276 -3.033 -0.282) 7.888 11.539 ( 7.389 1.983 -0.810) 7.694 11.610 ( 1.439 2.582 1.278) 3.220 11.768 ( -0.555 2.033 -1.039) 2.350 12.086 ( -5.566 -0.560 0.053) 5.594 12.170 ( -1.126 -0.756 -0.449) 1.429 12.726 ( 7.012 4.794 -0.380) 8.503 12.809 ( 11.468 7.268 0.846) 13.604 12.921 ( 0.125 2.286 0.140) 2.293 13.029 ( 7.228 13.481 -0.094) 15.297 13.659 ( -6.209 4.962 -0.219) 7.951 13.685 ( -4.100 3.377 -0.655) 5.352 15.871 ( -4.277 -0.652 0.096) 4.327 16.150 ( -11.608 4.308 0.868) 12.412 17.348 ( 6.606 1.407 -0.086) 6.754 17.715 ( 4.443 -2.438 0.367) 5.081 17.885 ( 11.920 0.886 -0.395) 11.959 18.564 ( -1.744 3.216 3.129) 4.813 18.734 ( -6.332 5.021 -2.112) 8.353 19.252 ( -8.936 -0.342 -1.032) 9.002 19.483 ( -3.311 4.565 3.487) 6.630 19.567 ( 5.790 14.609 0.879) 15.739 19.773 ( -4.010 11.288 -2.582) 12.254 20.197 ( 5.083 15.271 -3.704) 16.515 21.134 ( 12.446 -4.127 1.281) 13.174 21.261 ( 7.991 -13.153 1.187) 15.436 21.837 ( 2.346 -0.361 -2.059) 3.143 22.036 ( 4.617 -4.515 3.131) 7.177 22.206 ( -2.552 3.255 -0.547) 4.173 22.406 ( 0.371 -1.826 -4.672) 5.029 22.670 ( -5.701 -5.990 5.705) 10.046 22.830 ( -3.384 -4.657 -2.189) 6.159 22.962 ( -10.071 -8.253 2.000) 13.174 23.068 ( -6.683 -7.119 -1.157) 9.832 ======================= Grid point 155 (61/102) ======================= q-point: ( 0.45 0.18 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.504 ( 7.922 -3.570 -0.145) 8.691 1.588 ( 12.372 -3.940 -0.015) 12.984 1.806 ( 6.599 -6.302 -4.141) 10.021 2.101 ( 3.823 -6.430 8.010) 10.960 2.159 ( 0.052 -11.419 0.750) 11.444 2.285 ( 5.505 -6.028 -1.384) 8.280 2.495 ( 0.871 -4.550 -1.339) 4.822 2.654 ( 3.758 3.108 0.199) 4.881 2.860 ( 10.406 -9.204 -3.813) 14.406 2.955 ( -0.984 -0.387 2.087) 2.339 2.979 ( 4.241 5.005 -0.573) 6.585 3.094 ( 8.116 -2.848 -5.046) 9.972 3.203 ( -8.870 -3.551 3.435) 10.153 3.311 ( 2.592 -1.751 -0.743) 3.215 3.353 ( -3.394 1.362 -1.671) 4.021 3.430 ( -1.212 -1.685 0.034) 2.075 3.524 ( -0.020 -0.968 3.779) 3.902 3.650 ( -0.552 -0.211 1.908) 1.998 3.767 ( -5.449 0.272 0.607) 5.489 3.819 ( 5.619 -4.546 -6.876) 9.976 3.862 ( -3.856 1.332 1.830) 4.471 4.053 ( -1.074 1.114 -0.642) 1.675 4.129 ( 3.848 2.241 1.380) 4.662 4.317 ( 3.919 3.950 -0.040) 5.564 4.334 ( 4.132 0.009 1.143) 4.288 4.409 ( -7.066 1.738 5.013) 8.837 4.553 ( -5.842 1.533 -2.353) 6.482 4.794 ( 0.270 0.084 -3.524) 3.535 4.873 ( -4.843 3.786 1.998) 6.464 5.016 ( 0.148 0.187 -0.928) 0.958 5.110 ( -1.315 1.034 -0.190) 1.683 5.257 ( -3.734 -1.825 -2.977) 5.112 5.424 ( -2.822 0.101 0.072) 2.825 5.580 ( -0.753 -0.712 1.143) 1.543 5.610 ( -0.608 -2.306 5.565) 6.055 5.737 ( 1.126 -4.051 -2.623) 4.955 5.857 ( -6.210 -3.555 1.354) 7.282 6.143 ( -2.435 -3.095 -3.529) 5.288 6.257 ( -7.682 -0.869 4.446) 8.918 6.361 ( 3.266 -4.525 -2.404) 6.076 6.436 ( 4.277 -0.184 0.772) 4.350 6.497 ( -1.866 -2.950 1.102) 3.661 6.582 ( 4.841 -1.068 -0.182) 4.961 6.639 ( 0.908 -1.725 -0.851) 2.127 6.975 ( 3.049 1.746 -3.573) 5.011 7.036 ( 3.860 3.459 5.521) 7.573 7.128 ( -0.804 1.807 0.428) 2.024 7.420 ( 1.446 3.060 -2.380) 4.137 7.514 ( 1.860 8.122 -0.489) 8.347 7.571 ( 1.877 9.093 -2.624) 9.649 7.920 ( -2.277 5.166 0.433) 5.662 8.170 ( -2.189 3.001 5.306) 6.477 8.245 ( -4.281 6.807 -7.606) 11.069 8.354 ( -2.688 2.865 -0.446) 3.954 8.558 ( 4.749 2.673 0.322) 5.458 8.708 ( 4.248 -3.032 -1.016) 5.317 8.957 ( -2.438 2.684 -1.211) 3.823 9.127 ( -5.389 1.208 1.446) 5.709 9.227 ( -4.113 4.529 8.912) 10.810 9.511 ( -4.018 6.839 -3.206) 8.555 9.720 ( 5.949 2.681 5.800) 8.730 9.982 ( 11.022 0.154 -7.504) 13.335 10.288 ( -1.147 1.846 2.044) 2.983 10.475 ( -2.811 -4.937 -0.696) 5.724 10.610 ( 5.108 -4.736 -3.141) 7.641 10.740 ( 0.594 -1.306 2.030) 2.485 10.971 ( 3.673 0.392 -2.007) 4.204 11.165 ( -0.091 -1.704 3.666) 4.044 11.419 ( 4.442 7.793 -1.811) 9.151 11.525 ( 5.288 4.843 2.086) 7.468 11.607 ( 2.742 -1.112 1.441) 3.291 11.732 ( 8.374 6.550 -2.322) 10.882 12.053 ( -3.588 0.544 -0.548) 3.670 12.162 ( -2.273 0.698 0.528) 2.435 12.625 ( 9.462 10.797 -0.093) 14.356 12.724 ( 9.762 12.128 0.080) 15.569 12.913 ( -2.555 -1.381 -0.382) 2.929 12.977 ( 0.914 -5.390 0.565) 5.496 13.489 ( -4.975 8.135 0.228) 9.538 13.598 ( -5.159 2.880 -0.964) 5.987 15.855 ( -4.046 -1.090 -0.164) 4.194 16.025 ( -7.798 2.006 0.520) 8.068 17.392 ( 4.558 -1.496 -0.137) 4.800 17.760 ( -1.677 -1.440 0.624) 2.297 17.964 ( 9.758 -0.421 -0.810) 9.801 18.439 ( -5.629 7.200 1.481) 9.258 18.616 ( 2.005 5.568 -0.682) 5.958 19.129 ( -0.935 5.943 -2.648) 6.574 19.359 ( 5.761 12.077 5.599) 14.505 19.419 ( 1.410 5.861 -1.839) 6.302 19.647 ( -13.881 -2.988 0.781) 14.220 19.943 ( -0.409 13.120 -2.904) 13.443 21.268 ( 14.456 0.382 0.275) 14.463 21.520 ( 3.166 -10.532 2.261) 11.227 21.868 ( 1.427 -2.298 -2.862) 3.938 22.067 ( -1.088 4.240 -0.007) 4.377 22.194 ( -0.660 -3.328 4.272) 5.456 22.423 ( 1.510 -0.828 -8.469) 8.642 22.730 ( -3.265 -3.513 9.214) 10.387 22.883 ( -0.843 -3.749 -4.501) 5.918 23.060 ( -7.924 -9.053 1.833) 12.170 23.127 ( -5.127 -4.940 -1.251) 7.229 ======================= Grid point 156 (62/102) ======================= q-point: ( 0.55 0.18 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.624 ( -1.572 -2.158 5.025) 5.691 1.669 ( 6.936 -4.928 -4.484) 9.617 1.989 ( 7.082 -5.089 -2.437) 9.055 2.217 ( 7.602 -4.353 1.215) 8.844 2.289 ( -6.843 -2.053 -0.399) 7.155 2.458 ( -1.196 -9.216 3.662) 9.989 2.584 ( 3.313 6.320 1.670) 7.329 2.612 ( 6.319 -4.280 -4.093) 8.660 2.866 ( 3.330 7.302 -7.436) 10.941 2.963 ( -1.879 -2.610 8.529) 9.115 3.053 ( 1.347 -4.789 1.536) 5.207 3.135 ( -3.417 0.799 0.009) 3.509 3.234 ( 7.428 -4.130 -5.481) 10.113 3.293 ( -2.677 -0.355 0.697) 2.789 3.393 ( -0.841 -1.770 -2.394) 3.094 3.420 ( -3.190 -2.568 4.080) 5.781 3.558 ( -2.024 -1.479 0.196) 2.514 3.649 ( -3.569 0.346 0.097) 3.587 3.734 ( -0.156 3.836 -0.603) 3.887 3.803 ( 2.130 4.012 -0.962) 4.643 3.855 ( 1.661 3.691 -1.631) 4.364 4.046 ( -2.540 -3.571 1.029) 4.502 4.133 ( -4.218 -1.185 1.107) 4.519 4.173 ( -7.339 4.827 -0.087) 8.784 4.336 ( 6.455 0.502 -0.439) 6.489 4.456 ( 5.843 -0.921 0.395) 5.928 4.551 ( -4.510 -6.199 0.607) 7.689 4.713 ( -4.523 4.402 2.840) 6.921 4.927 ( 7.408 -4.005 -3.430) 9.093 5.028 ( -0.423 -0.894 4.681) 4.784 5.114 ( 1.704 -1.977 -3.308) 4.214 5.261 ( -5.031 -2.056 -2.245) 5.881 5.404 ( -2.368 -0.545 -1.556) 2.886 5.585 ( -6.570 -2.656 -1.509) 7.246 5.671 ( -1.044 -3.455 6.503) 7.437 5.843 ( 8.392 -4.164 -1.636) 9.511 5.888 ( -0.724 -2.699 1.134) 3.016 6.168 ( -0.945 -1.546 -3.765) 4.179 6.187 ( -4.082 3.694 3.325) 6.432 6.440 ( 1.128 -2.414 -1.232) 2.935 6.463 ( 2.165 0.096 1.095) 2.428 6.521 ( -0.410 0.644 1.674) 1.840 6.597 ( -2.588 0.858 0.281) 2.741 6.699 ( 4.496 -2.602 -3.466) 6.244 6.930 ( -0.173 4.878 0.513) 4.908 7.001 ( 0.087 3.344 2.841) 4.389 7.096 ( 1.893 2.485 2.069) 3.747 7.266 ( 4.529 11.260 -7.457) 14.244 7.355 ( -6.193 7.046 4.532) 10.418 7.486 ( -2.240 2.665 -0.980) 3.617 7.845 ( -0.207 1.572 -1.310) 2.057 8.093 ( -5.293 3.209 -4.688) 7.764 8.113 ( -7.292 1.063 5.547) 9.223 8.273 ( 1.112 4.085 -4.716) 6.338 8.501 ( 3.966 6.713 2.307) 8.131 8.729 ( -4.211 3.254 -0.564) 5.352 8.962 ( 12.413 -2.366 -4.869) 13.542 9.084 ( -2.774 0.080 3.334) 4.338 9.198 ( -3.617 -1.969 5.635) 6.979 9.407 ( -5.465 0.176 0.652) 5.506 9.737 ( 6.691 2.664 4.069) 8.271 9.997 ( 6.186 4.106 -6.229) 9.692 10.280 ( 3.457 -0.180 0.730) 3.538 10.532 ( -5.394 -4.867 0.187) 7.268 10.715 ( 2.950 -2.269 0.322) 3.736 10.789 ( 0.114 -4.119 -0.669) 4.175 10.982 ( 2.398 0.449 -2.578) 3.549 11.170 ( -5.795 -0.198 0.351) 5.809 11.308 ( 3.944 6.668 2.791) 8.234 11.457 ( 2.903 6.258 0.428) 6.912 11.634 ( 11.041 9.768 -1.977) 14.874 11.641 ( 6.261 3.186 0.339) 7.033 12.011 ( -1.597 1.543 -0.773) 2.351 12.112 ( -3.979 2.039 1.209) 4.632 12.536 ( 5.552 5.625 -0.282) 7.909 12.578 ( 3.293 7.902 0.280) 8.565 12.977 ( -0.592 -5.328 0.425) 5.378 13.096 ( 1.784 -6.147 0.009) 6.401 13.316 ( -2.911 7.670 0.549) 8.223 13.506 ( -5.076 2.475 -1.354) 5.807 15.851 ( -2.862 -1.344 0.175) 3.167 15.958 ( -4.966 0.508 0.116) 4.994 17.461 ( 4.362 -2.429 -0.095) 4.993 17.762 ( -6.245 -2.502 0.859) 6.782 18.028 ( 7.021 0.119 -2.180) 7.353 18.278 ( -5.660 5.383 1.318) 7.921 18.558 ( 6.670 5.038 1.748) 8.540 19.012 ( -0.980 6.373 -6.125) 8.893 19.231 ( 6.485 8.625 6.401) 12.546 19.369 ( 3.030 0.343 -1.914) 3.600 19.545 ( -5.019 7.861 0.894) 9.369 19.791 ( -12.393 -3.088 -0.943) 12.806 21.337 ( 14.297 3.790 0.217) 14.792 21.687 ( -0.683 -6.035 2.051) 6.410 21.924 ( 0.443 -3.564 -2.810) 4.560 21.966 ( -2.852 3.679 -0.933) 4.747 22.238 ( -1.068 -0.835 5.531) 5.695 22.419 ( 1.137 0.564 -7.440) 7.547 22.801 ( -0.418 -4.021 5.958) 7.200 22.923 ( -0.287 -1.704 -1.944) 2.601 23.157 ( -5.127 -6.048 1.253) 8.027 23.181 ( -1.827 -5.284 -1.820) 5.880 ======================= Grid point 157 (63/102) ======================= q-point: (-0.36 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.637 ( -0.919 -0.239 4.729) 4.824 1.801 ( 1.106 -5.505 -6.074) 8.272 2.026 ( 4.921 5.114 -1.738) 7.307 2.187 ( -5.832 7.119 -0.169) 9.204 2.334 ( 2.033 0.132 4.210) 4.678 2.435 ( 2.258 9.556 0.754) 9.848 2.573 ( -1.323 -4.321 1.143) 4.661 2.664 ( -0.658 1.235 -2.329) 2.717 2.814 ( 7.910 0.689 -5.001) 9.384 3.010 ( -8.711 1.580 2.711) 9.259 3.046 ( -0.634 -2.185 5.214) 5.689 3.172 ( 3.661 -2.051 -3.272) 5.321 3.299 ( -0.876 -1.654 1.927) 2.686 3.378 ( 0.314 -5.455 1.306) 5.618 3.405 ( 0.453 -1.965 -2.943) 3.568 3.471 ( -0.709 -1.934 1.423) 2.504 3.510 ( -2.404 3.432 -0.762) 4.259 3.567 ( -0.399 6.255 -1.908) 6.552 3.619 ( -1.889 0.198 1.171) 2.231 3.737 ( -0.976 3.995 -2.180) 4.654 3.905 ( 1.805 -5.060 -0.296) 5.381 4.001 ( -4.259 2.634 6.151) 7.931 4.046 ( -3.752 2.778 -2.157) 5.143 4.189 ( -3.267 -4.649 -3.758) 6.813 4.434 ( 7.234 -1.289 -1.064) 7.424 4.518 ( 7.943 -0.959 -2.678) 8.437 4.622 ( -2.190 1.547 0.464) 2.721 4.660 ( -4.872 -7.825 4.833) 10.408 5.008 ( 5.347 -0.058 -2.157) 5.766 5.052 ( 1.488 0.673 5.824) 6.049 5.183 ( 2.529 -4.488 -1.169) 5.283 5.219 ( -8.887 -0.340 0.068) 8.893 5.435 ( 2.120 -3.598 -4.091) 5.846 5.575 ( -8.801 -3.662 -3.879) 10.292 5.739 ( 0.768 -2.330 5.956) 6.441 5.919 ( 2.108 1.474 0.286) 2.588 5.981 ( 5.310 -4.321 -0.345) 6.855 6.110 ( 0.292 2.706 1.447) 3.082 6.174 ( 6.396 2.942 -0.366) 7.049 6.419 ( -3.922 2.954 0.326) 4.921 6.466 ( -3.882 2.342 -0.643) 4.579 6.510 ( 3.087 0.598 -1.577) 3.518 6.521 ( -4.028 1.150 -0.957) 4.297 6.738 ( -3.638 -1.603 -1.811) 4.368 6.775 ( -1.642 10.625 4.548) 11.673 6.910 ( -1.788 7.828 -0.889) 8.078 7.074 ( 3.009 0.228 0.588) 3.075 7.172 ( 1.940 2.762 1.228) 3.592 7.235 ( -5.515 0.420 1.003) 5.621 7.399 ( -2.785 4.743 -2.849) 6.195 7.846 ( 0.366 -1.217 -0.394) 1.330 8.018 ( -6.565 -0.510 -2.623) 7.088 8.080 ( -3.964 -0.862 4.199) 5.839 8.224 ( 4.456 1.846 -9.095) 10.294 8.440 ( -0.812 1.847 9.318) 9.534 8.636 ( 1.147 2.653 -6.121) 6.769 9.060 ( -1.034 -1.912 5.290) 5.719 9.153 ( 11.480 -3.859 -6.661) 13.823 9.244 ( 1.121 -3.434 3.046) 4.725 9.404 ( -8.034 -3.568 6.891) 11.170 9.731 ( 6.305 4.027 1.298) 7.593 9.919 ( 2.160 5.728 -5.811) 8.440 10.332 ( 6.761 -0.405 0.345) 6.782 10.571 ( -7.607 -4.613 0.475) 8.909 10.719 ( -1.411 2.163 2.636) 3.690 10.848 ( -0.099 -1.144 -4.428) 4.575 10.980 ( 2.386 0.790 -0.620) 2.589 11.118 ( -6.039 -0.322 0.432) 6.063 11.235 ( -0.370 5.107 4.624) 6.899 11.367 ( 3.983 5.682 -5.325) 8.746 11.530 ( 8.361 7.959 1.044) 11.591 11.631 ( 4.614 3.149 0.722) 5.633 11.989 ( 0.901 -0.049 -0.864) 1.250 12.060 ( -4.158 0.228 1.215) 4.338 12.481 ( 2.610 3.923 -0.229) 4.718 12.504 ( 0.602 2.852 0.134) 2.918 13.057 ( 0.377 -2.357 0.546) 2.449 13.154 ( -3.071 3.243 -1.108) 4.602 13.239 ( 3.332 -2.813 2.855) 5.212 13.455 ( -3.651 -1.883 -2.496) 4.807 15.860 ( -2.054 -1.384 1.295) 2.795 15.930 ( -2.388 -0.527 -0.997) 2.641 17.541 ( 5.688 -2.409 -0.076) 6.177 17.773 ( -8.683 -4.735 0.510) 9.903 18.052 ( 6.083 1.778 -2.854) 6.951 18.179 ( -3.974 2.870 1.582) 5.150 18.540 ( 5.926 2.499 4.133) 7.645 18.862 ( -3.103 6.386 -6.321) 9.506 19.165 ( 4.650 4.825 3.489) 7.555 19.321 ( -0.733 7.801 -0.488) 7.850 19.495 ( 4.379 -5.693 0.099) 7.183 19.806 ( -13.131 -8.019 -0.039) 15.386 21.349 ( 13.229 6.261 0.348) 14.640 21.683 ( -7.350 3.511 0.157) 8.147 21.943 ( 0.274 -2.995 0.411) 3.035 21.991 ( 0.130 -3.460 -2.248) 4.128 22.239 ( -1.205 0.942 5.165) 5.387 22.391 ( 0.867 1.533 -6.010) 6.263 22.878 ( 0.529 -2.691 2.393) 3.639 22.929 ( -0.459 -0.004 0.525) 0.698 23.217 ( -2.083 -3.813 1.816) 4.709 23.272 ( 0.409 -5.369 -2.658) 6.005 ======================= Grid point 158 (64/102) ======================= q-point: (-0.27 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.620 ( -2.987 3.503 8.226) 9.426 1.781 ( -0.992 12.702 -2.467) 12.977 1.879 ( 0.300 7.594 0.443) 7.613 1.982 ( -0.518 12.023 -5.346) 13.168 2.259 ( -2.065 6.639 1.807) 7.184 2.309 ( 0.517 1.711 -1.664) 2.442 2.608 ( 4.598 5.572 -3.265) 7.928 2.659 ( -3.961 -1.199 -0.800) 4.215 2.836 ( -2.118 3.727 1.054) 4.414 2.868 ( 0.927 2.157 -2.614) 3.514 3.070 ( 0.397 3.346 7.364) 8.099 3.173 ( -3.338 1.473 1.341) 3.887 3.295 ( 2.356 2.471 1.568) 3.758 3.381 ( -3.786 2.893 1.111) 4.893 3.432 ( 0.583 -0.410 0.300) 0.774 3.466 ( -2.185 -1.350 -2.307) 3.452 3.504 ( 0.944 1.787 -2.017) 2.855 3.529 ( -0.600 0.496 -1.495) 1.686 3.646 ( -1.021 -5.522 2.401) 6.108 3.727 ( 4.471 -4.665 -6.243) 8.985 3.943 ( -1.459 1.035 3.289) 3.744 3.974 ( 1.405 0.064 -1.546) 2.090 4.086 ( 0.050 -7.107 2.540) 7.547 4.206 ( -2.553 -1.639 -0.926) 3.172 4.453 ( -0.218 3.079 0.451) 3.120 4.485 ( 0.572 0.781 -2.927) 3.083 4.711 ( 9.272 -2.306 -1.798) 9.722 4.755 ( -4.894 -5.931 4.375) 8.847 5.001 ( -5.691 3.870 3.191) 7.586 5.022 ( 5.139 1.133 -4.256) 6.768 5.227 ( 3.838 -2.638 2.437) 5.256 5.308 ( 0.672 -7.465 0.193) 7.497 5.503 ( -4.307 -4.285 0.713) 6.117 5.582 ( -3.126 -3.497 -7.034) 8.454 5.772 ( 2.240 1.411 2.620) 3.725 5.864 ( -0.484 3.366 -0.783) 3.490 6.009 ( -1.081 5.368 2.125) 5.874 6.065 ( 3.936 4.755 -2.818) 6.785 6.156 ( 2.169 2.732 6.583) 7.451 6.285 ( -4.030 7.000 -0.263) 8.081 6.400 ( -6.480 2.855 3.007) 7.693 6.463 ( 3.240 -4.050 -5.179) 7.329 6.594 ( 4.274 2.397 -1.690) 5.184 6.622 ( 0.268 4.626 0.517) 4.662 6.722 ( -4.191 -2.676 0.032) 4.972 6.765 ( -5.984 0.552 -0.768) 6.058 7.111 ( 0.991 2.136 4.515) 5.092 7.158 ( -0.096 -1.851 2.670) 3.251 7.238 ( -2.859 -3.569 -1.693) 4.876 7.276 ( -1.951 5.611 -4.143) 7.243 7.882 ( 0.104 -2.322 1.790) 2.934 7.999 ( -1.935 -1.429 -4.791) 5.361 8.090 ( -2.966 -2.113 4.252) 5.598 8.232 ( 4.742 -0.623 -9.347) 10.499 8.467 ( -4.247 -4.010 10.957) 12.417 8.643 ( 5.731 -1.611 -8.394) 10.291 9.104 ( -2.305 -2.994 6.697) 7.689 9.243 ( 3.754 -2.175 -6.386) 7.720 9.361 ( 5.968 -3.744 4.763) 8.504 9.425 ( -6.663 -3.196 7.389) 10.450 9.695 ( 3.672 4.203 -0.373) 5.594 9.831 ( 1.405 3.306 -7.726) 8.520 10.369 ( 6.496 2.609 2.336) 7.380 10.542 ( -8.911 2.718 -1.550) 9.444 10.680 ( -1.322 -0.461 3.982) 4.221 10.818 ( -0.366 1.355 -5.781) 5.949 10.988 ( 2.916 1.397 1.851) 3.725 11.081 ( -4.354 1.523 -0.601) 4.652 11.168 ( -1.383 1.076 4.214) 4.564 11.286 ( 1.687 3.846 -5.209) 6.692 11.503 ( 6.215 1.738 2.281) 6.845 11.608 ( -0.380 1.281 -0.926) 1.625 12.022 ( 0.989 -2.290 0.308) 2.514 12.056 ( -1.535 -2.391 -0.214) 2.849 12.435 ( 0.101 2.735 1.278) 3.020 12.465 ( 0.499 1.825 -1.036) 2.157 13.037 ( -1.187 3.629 1.508) 4.106 13.075 ( 0.538 3.135 -2.380) 3.973 13.358 ( 0.723 -6.926 4.995) 8.569 13.512 ( -0.724 -6.313 -4.272) 7.656 15.870 ( -2.484 -0.958 3.055) 4.052 15.936 ( 0.287 -1.383 -2.765) 3.105 17.634 ( 8.365 -2.099 0.227) 8.627 17.797 ( -10.612 -5.595 -0.644) 12.013 18.039 ( 4.755 4.595 -0.749) 6.654 18.083 ( -1.931 6.006 0.501) 6.329 18.596 ( 3.792 -4.156 4.070) 6.944 18.754 ( -3.655 0.439 -3.915) 5.374 19.136 ( 4.476 2.759 0.059) 5.259 19.212 ( -4.806 1.431 0.116) 5.016 19.683 ( 9.478 -8.482 0.887) 12.750 19.867 ( -11.258 -8.976 -0.649) 14.413 21.315 ( 12.118 8.090 0.690) 14.587 21.510 ( -10.210 7.637 -1.038) 12.792 22.012 ( -0.389 -3.003 1.131) 3.232 22.030 ( 0.785 -0.736 -1.007) 1.474 22.211 ( -2.426 1.706 5.916) 6.618 22.367 ( 3.092 0.649 -8.470) 9.040 22.874 ( -2.738 1.845 6.130) 6.963 22.962 ( 2.199 -2.129 -3.078) 4.341 23.269 ( -1.051 -2.613 3.554) 4.535 23.361 ( 1.827 -4.261 -3.874) 6.042 ======================= Grid point 159 (65/102) ======================= q-point: (-0.18 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.410 ( -2.162 20.189 5.115) 20.938 1.454 ( -1.746 17.427 3.831) 17.929 1.724 ( 2.183 11.210 -0.728) 11.443 1.795 ( -0.967 7.249 -6.707) 9.923 2.142 ( -3.252 4.805 6.122) 8.435 2.367 ( 6.530 -0.650 -9.684) 11.698 2.482 ( 4.026 9.510 0.807) 10.359 2.507 ( -2.924 6.418 -1.364) 7.184 2.766 ( -4.532 8.231 5.064) 10.674 2.823 ( 1.377 7.789 -1.552) 8.061 2.962 ( -0.648 5.969 5.814) 8.357 3.112 ( -0.926 5.132 -1.331) 5.382 3.240 ( -0.546 4.418 0.648) 4.498 3.319 ( 1.437 3.002 -3.855) 5.093 3.399 ( 1.358 0.733 -0.434) 1.603 3.423 ( 1.327 0.421 -3.262) 3.547 3.510 ( -3.158 -2.005 2.785) 4.664 3.575 ( 3.083 -0.758 -3.193) 4.502 3.742 ( -1.395 -4.960 4.158) 6.621 3.848 ( -2.040 -6.920 -3.390) 7.971 3.937 ( 2.200 -0.051 0.688) 2.306 3.985 ( 3.226 -0.243 -2.639) 4.176 4.182 ( -3.600 -1.346 3.995) 5.543 4.236 ( 2.153 -2.518 -0.242) 3.322 4.425 ( 0.032 -2.620 2.516) 3.632 4.504 ( -1.153 -1.684 -3.826) 4.337 4.743 ( -8.052 -1.962 7.595) 11.241 4.858 ( 9.995 -3.363 -2.056) 10.744 4.908 ( -6.172 1.032 2.248) 6.649 5.025 ( 4.281 1.534 -7.558) 8.820 5.320 ( 5.234 -1.790 2.088) 5.913 5.404 ( -1.463 -1.670 -4.711) 5.208 5.522 ( -8.069 -3.208 3.978) 9.551 5.609 ( 3.275 0.395 -2.438) 4.102 5.746 ( 0.653 2.781 1.856) 3.406 5.807 ( 0.430 1.252 -2.369) 2.714 5.914 ( -5.932 0.431 3.206) 6.757 5.983 ( 3.534 3.840 -2.083) 5.619 6.132 ( 4.938 5.207 4.643) 8.547 6.167 ( -3.333 2.747 0.049) 4.320 6.347 ( -1.450 -0.265 3.160) 3.487 6.502 ( 1.216 4.413 -4.640) 6.518 6.572 ( -1.597 -4.559 -2.420) 5.403 6.603 ( 5.672 -0.562 -2.834) 6.366 6.768 ( -4.653 -5.939 4.024) 8.551 6.834 ( 1.089 -5.443 -1.375) 5.719 7.051 ( -0.472 4.220 4.294) 6.039 7.159 ( 1.682 4.625 -4.128) 6.423 7.220 ( -3.469 -3.928 4.105) 6.657 7.308 ( 1.596 -4.676 -3.387) 5.991 7.929 ( -0.326 -2.212 3.346) 4.025 8.014 ( 0.051 -2.319 -4.160) 4.763 8.136 ( -0.478 -3.128 2.080) 3.786 8.252 ( 2.941 -0.441 -7.677) 8.233 8.550 ( -4.002 -5.972 7.780) 10.592 8.707 ( 4.382 -2.585 -6.176) 8.001 9.145 ( -3.857 -1.956 6.790) 8.051 9.278 ( 1.439 -0.477 -4.284) 4.544 9.415 ( -6.071 -2.076 8.612) 10.739 9.489 ( 4.937 -2.400 3.969) 6.774 9.636 ( 0.175 3.631 -0.978) 3.764 9.799 ( 0.755 -0.466 -8.777) 8.822 10.342 ( 0.920 3.947 2.747) 4.896 10.394 ( -1.433 6.290 -1.542) 6.633 10.707 ( -0.297 -0.988 2.558) 2.758 10.788 ( -0.503 1.111 -4.358) 4.526 10.980 ( 0.767 1.041 2.757) 3.045 11.037 ( 1.805 0.221 -2.313) 2.942 11.168 ( -2.887 -1.022 3.862) 4.929 11.256 ( 1.793 0.219 -3.553) 3.986 11.529 ( -1.203 -0.429 2.368) 2.690 11.585 ( 1.055 0.118 -2.298) 2.531 12.077 ( -0.178 -3.954 1.425) 4.207 12.119 ( 1.021 -4.195 -2.248) 4.868 12.389 ( -1.750 2.038 2.739) 3.836 12.440 ( 0.983 1.451 -1.667) 2.419 12.971 ( -0.865 2.853 1.907) 3.538 13.023 ( 0.936 2.543 -2.551) 3.722 13.503 ( -0.845 -7.794 5.433) 9.538 13.626 ( 0.853 -7.097 -4.918) 8.676 15.872 ( -2.594 -0.532 4.167) 4.937 15.968 ( 2.511 -1.903 -3.917) 5.027 17.719 ( 4.474 0.686 2.973) 5.415 17.804 ( -7.109 -3.351 -4.160) 8.892 17.928 ( -2.706 7.650 2.469) 8.482 17.980 ( 5.832 5.359 -1.591) 8.078 18.747 ( -6.842 -10.911 2.537) 13.126 18.802 ( 6.200 -6.556 -2.038) 9.251 19.142 ( 4.393 0.106 1.904) 4.789 19.195 ( -4.497 -3.608 -2.503) 6.285 19.905 ( 0.408 -9.395 2.926) 9.848 19.973 ( -0.187 -9.928 -2.827) 10.324 21.234 ( 2.054 9.283 1.423) 9.613 21.272 ( -1.982 11.490 -1.589) 11.767 22.009 ( -1.672 3.540 1.222) 4.102 22.014 ( 0.815 2.620 0.508) 2.791 22.203 ( -1.915 -1.814 4.727) 5.413 22.373 ( 4.481 0.048 -10.111) 11.059 22.836 ( -3.699 1.211 9.122) 9.918 22.997 ( 2.162 -0.906 -5.479) 5.959 23.305 ( -1.289 -1.070 5.285) 5.544 23.428 ( 1.019 -2.936 -5.154) 6.018 ======================= Grid point 160 (66/102) ======================= q-point: (-0.09 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.087 ( 1.844 18.481 -0.058) 18.573 1.120 ( 5.740 15.668 -0.509) 16.694 1.539 ( 4.111 13.381 0.909) 14.028 1.623 ( 5.053 11.129 -7.577) 14.381 2.035 ( -1.511 8.295 9.333) 12.577 2.196 ( 5.496 17.665 -2.364) 18.651 2.320 ( -3.770 13.662 8.455) 16.503 2.414 ( 2.305 13.570 6.934) 15.412 2.656 ( 0.714 -5.129 -5.895) 7.846 2.691 ( 3.026 2.689 -4.370) 5.957 2.870 ( 4.090 7.025 -0.825) 8.171 2.973 ( 3.556 10.298 -9.448) 14.420 3.154 ( -0.674 3.680 3.282) 4.977 3.273 ( 6.891 4.300 -2.119) 8.394 3.387 ( -4.662 0.282 1.893) 5.039 3.503 ( 1.449 -3.052 -2.698) 4.323 3.523 ( -4.645 -3.081 1.580) 5.793 3.571 ( 3.373 0.443 2.028) 3.961 3.832 ( -1.727 -5.508 3.208) 6.604 3.932 ( -3.224 -5.842 0.517) 6.693 3.959 ( 0.700 -0.412 -3.098) 3.203 4.033 ( 5.122 -2.705 -4.120) 7.109 4.133 ( -5.990 2.790 3.054) 7.279 4.277 ( 2.145 -0.266 -2.425) 3.249 4.447 ( -6.068 4.031 -1.858) 7.518 4.519 ( 4.686 -2.307 2.191) 5.664 4.762 ( -9.538 -5.836 9.945) 14.965 4.889 ( -3.010 -1.534 1.775) 3.816 4.997 ( 5.596 -1.241 -2.085) 6.100 5.050 ( 5.337 -8.111 -5.257) 11.041 5.295 ( -7.926 3.209 -1.892) 8.758 5.402 ( 1.254 -1.635 -0.725) 2.184 5.493 ( -3.645 2.378 2.492) 5.015 5.588 ( -1.783 -0.166 -2.497) 3.073 5.730 ( 3.521 0.081 -2.376) 4.249 5.820 ( -14.161 1.140 5.477) 15.226 5.894 ( 16.981 1.130 -2.611) 17.217 6.011 ( -4.276 -5.170 0.924) 6.773 6.100 ( 5.006 2.848 3.164) 6.571 6.186 ( 6.550 -4.950 -1.408) 8.330 6.368 ( 3.171 0.545 0.964) 3.359 6.430 ( -0.511 2.817 -2.705) 3.939 6.608 ( -6.108 -3.877 -2.401) 7.623 6.678 ( 4.327 -2.787 -1.120) 5.267 6.861 ( -5.368 -0.409 1.536) 5.599 6.907 ( 8.101 -4.218 1.948) 9.339 6.999 ( 0.861 0.989 2.191) 2.553 7.110 ( 4.110 2.038 -3.569) 5.812 7.297 ( 1.573 -4.654 2.215) 5.389 7.388 ( 2.855 -2.618 -4.101) 5.641 7.964 ( 0.435 -0.603 5.124) 5.178 8.081 ( 1.443 -5.670 -2.333) 6.299 8.160 ( -0.610 0.272 -1.480) 1.624 8.289 ( 5.251 -2.419 -6.275) 8.532 8.629 ( -5.723 -4.366 6.278) 9.551 8.775 ( 1.276 -4.149 -3.091) 5.329 9.138 ( -4.131 0.759 5.292) 6.757 9.243 ( -0.304 3.803 -2.412) 4.513 9.427 ( -3.272 -0.689 7.041) 7.795 9.547 ( -5.936 -0.535 11.204) 12.691 9.593 ( 6.746 0.842 -5.082) 8.488 9.793 ( -0.448 -0.255 -6.507) 6.527 10.280 ( -4.319 -0.606 -1.226) 4.530 10.361 ( 6.402 -0.011 -0.213) 6.405 10.699 ( 0.793 2.294 1.659) 2.941 10.758 ( 0.810 0.568 -4.803) 4.904 10.974 ( -4.631 -1.225 1.825) 5.126 11.073 ( 1.866 0.292 1.874) 2.661 11.193 ( 2.079 -2.321 1.767) 3.582 11.267 ( 0.499 -0.950 -1.751) 2.054 11.526 ( -1.595 -2.175 -0.642) 2.773 11.604 ( 4.964 0.957 -0.526) 5.083 12.182 ( 3.072 -5.431 1.076) 6.332 12.186 ( -0.597 -4.555 -2.601) 5.279 12.353 ( -2.237 0.962 2.387) 3.410 12.419 ( 1.026 1.231 -1.209) 2.008 12.935 ( -0.853 1.021 2.251) 2.614 12.990 ( 0.424 1.265 -2.135) 2.517 13.641 ( -1.513 -7.293 3.975) 8.443 13.746 ( 0.410 -6.479 -4.220) 7.744 15.870 ( -1.808 -0.064 4.530) 4.878 16.033 ( 5.507 -3.443 -4.009) 7.632 17.637 ( -7.318 5.766 2.023) 9.534 17.749 ( 2.877 7.040 -2.835) 8.117 17.778 ( -10.609 4.218 2.352) 11.657 18.061 ( 18.019 -3.762 -1.604) 18.478 18.887 ( -10.244 -12.892 -0.582) 16.477 19.013 ( 6.116 -8.592 0.940) 10.588 19.210 ( -0.024 -6.487 1.596) 6.680 19.275 ( 3.790 -6.341 -2.409) 7.771 20.042 ( -7.973 -10.867 1.286) 13.539 20.177 ( 4.910 -7.730 -1.748) 9.323 20.962 ( -10.084 12.358 -0.213) 15.951 21.127 ( 12.755 13.934 0.909) 18.912 21.909 ( -2.082 5.157 0.688) 5.604 21.954 ( 2.777 5.531 1.052) 6.278 22.241 ( -2.020 -2.532 2.448) 4.060 22.380 ( 3.982 0.569 -7.725) 8.709 22.821 ( -4.043 -0.445 9.282) 10.134 22.999 ( 0.906 0.629 -6.394) 6.489 23.304 ( -2.732 1.180 6.675) 7.309 23.441 ( -2.889 0.010 -6.951) 7.527 ======================= Grid point 165 (67/102) ======================= q-point: ( 0.27 0.27 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.169 ( 14.330 0.000 9.817) 17.370 1.258 ( 15.830 0.000 6.163) 16.988 1.408 ( 22.109 0.000 -5.749) 22.844 1.592 ( 24.259 0.000 -8.729) 25.782 2.213 ( 11.083 0.000 -2.323) 11.324 2.254 ( 23.591 0.000 4.467) 24.010 2.288 ( 18.613 0.000 -12.438) 22.386 2.527 ( -4.002 -0.000 7.236) 8.269 2.647 ( -5.161 -0.000 7.172) 8.836 2.696 ( -6.055 -0.000 7.417) 9.574 2.770 ( 20.416 0.000 -10.266) 22.852 2.875 ( -4.802 -0.000 -0.590) 4.839 3.068 ( 0.877 0.000 0.375) 0.954 3.244 ( 5.052 0.000 -4.706) 6.904 3.353 ( -3.127 -0.000 -4.553) 5.523 3.460 ( 1.911 0.000 1.498) 2.428 3.651 ( -0.368 -0.000 6.236) 6.247 3.690 ( -9.371 -0.000 0.792) 9.404 3.761 ( 0.645 0.000 -6.804) 6.834 3.859 ( -3.182 -0.000 5.065) 5.982 3.877 ( 4.580 0.000 4.867) 6.683 3.897 ( -8.052 -0.000 -1.504) 8.192 4.276 ( 5.495 0.000 -2.189) 5.915 4.288 ( -1.322 -0.000 3.733) 3.960 4.504 ( 4.448 0.000 -1.958) 4.860 4.525 ( 8.199 0.000 -10.973) 13.698 4.678 ( -18.999 -0.000 7.667) 20.488 4.990 ( -0.910 -0.000 0.799) 1.211 5.058 ( -1.375 -0.000 -7.591) 7.714 5.106 ( -6.133 -0.000 4.985) 7.904 5.244 ( 5.120 0.000 -0.306) 5.129 5.249 ( -4.999 -0.000 3.980) 6.390 5.498 ( -5.103 -0.000 -2.015) 5.486 5.536 ( -11.429 -0.000 0.120) 11.430 5.727 ( -9.275 -0.000 5.064) 10.568 5.780 ( -8.117 -0.000 -1.917) 8.340 5.942 ( -10.895 -0.000 7.284) 13.105 5.991 ( 2.016 0.000 -4.977) 5.370 6.089 ( -4.707 -0.000 0.945) 4.801 6.096 ( -0.305 -0.000 -8.364) 8.370 6.226 ( 1.532 0.000 1.579) 2.200 6.329 ( 2.429 0.000 2.516) 3.498 6.517 ( -5.007 -0.000 0.663) 5.051 6.614 ( -1.003 -0.000 -0.632) 1.185 6.985 ( 6.844 0.000 -5.150) 8.565 7.106 ( 7.938 0.000 4.366) 9.060 7.180 ( -2.016 -0.000 3.072) 3.674 7.260 ( 11.134 0.000 -6.182) 12.735 7.593 ( 7.345 0.000 0.588) 7.368 7.953 ( -2.511 -0.000 3.753) 4.516 8.116 ( 10.583 0.000 -3.837) 11.257 8.142 ( -3.518 -0.000 -2.798) 4.495 8.480 ( 4.179 0.000 -1.915) 4.597 8.569 ( -6.626 -0.000 3.466) 7.477 8.584 ( -3.463 -0.000 -0.886) 3.575 8.773 ( -10.586 -0.000 1.751) 10.730 8.967 ( 4.719 0.000 -2.807) 5.491 9.184 ( -3.127 -0.000 2.092) 3.762 9.460 ( 0.132 0.000 9.948) 9.948 9.846 ( 15.891 0.000 -9.426) 18.477 9.914 ( 9.996 0.000 -10.264) 14.327 10.038 ( -10.737 -0.000 7.282) 12.974 10.302 ( -5.494 -0.000 5.362) 7.677 10.334 ( 0.529 0.000 -8.381) 8.398 10.635 ( 3.741 0.000 -1.296) 3.959 10.672 ( -2.189 -0.000 4.468) 4.976 11.076 ( 4.295 0.000 1.812) 4.662 11.113 ( 5.246 0.000 1.225) 5.387 11.195 ( 9.839 0.000 2.285) 10.101 11.496 ( 6.752 0.000 0.363) 6.762 11.702 ( 6.689 0.000 4.812) 8.240 11.779 ( -9.007 -0.000 -4.619) 10.122 12.068 ( -5.565 -0.000 1.333) 5.723 12.148 ( -1.817 -0.000 -1.639) 2.447 12.757 ( -2.184 -0.000 -1.010) 2.407 12.780 ( -1.079 -0.000 0.741) 1.309 13.341 ( 10.994 0.000 -4.597) 11.916 13.350 ( 13.080 0.000 6.157) 14.456 13.740 ( -3.621 -0.000 -1.050) 3.770 13.748 ( -1.858 -0.000 0.389) 1.898 15.857 ( -5.984 -0.000 0.657) 6.020 16.231 ( -21.779 -0.000 2.546) 21.928 17.584 ( 9.443 0.000 -3.173) 9.962 17.596 ( 11.432 0.000 4.553) 12.305 18.243 ( 8.288 0.000 6.491) 10.528 18.249 ( 8.072 0.000 -5.434) 9.730 18.831 ( -10.916 -0.000 -4.411) 11.773 18.911 ( -13.499 -0.000 2.672) 13.761 19.784 ( 1.275 0.000 0.656) 1.433 19.930 ( -5.786 -0.000 0.973) 5.867 20.360 ( -3.068 -0.000 7.133) 7.765 20.543 ( 13.937 0.000 -18.136) 22.873 20.811 ( 8.227 0.000 9.456) 12.533 21.013 ( 16.431 0.000 -8.579) 18.536 21.871 ( 0.817 0.000 4.735) 4.805 21.972 ( 6.625 0.000 -2.810) 7.197 22.220 ( -11.428 -0.000 11.343) 16.102 22.385 ( 1.278 0.000 3.780) 3.990 22.406 ( 1.611 0.000 0.232) 1.628 22.642 ( -7.775 -0.000 -7.462) 10.776 22.854 ( -5.913 -0.000 0.111) 5.914 22.877 ( -5.556 -0.000 -0.045) 5.557 ======================= Grid point 166 (68/102) ======================= q-point: ( 0.36 0.27 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.326 ( 16.371 -4.690 1.725) 17.116 1.503 ( 6.990 -12.188 9.267) 16.831 1.551 ( 19.320 1.092 -4.143) 19.789 1.761 ( 21.809 -0.600 -9.105) 23.641 2.182 ( 6.246 4.225 0.896) 7.594 2.335 ( -3.443 8.804 6.303) 11.362 2.422 ( 0.930 -0.964 -1.570) 2.063 2.482 ( 16.213 -6.131 -4.558) 17.923 2.669 ( 4.374 -3.905 2.056) 6.213 2.825 ( -8.264 -11.200 5.977) 15.148 2.861 ( 3.864 -2.583 -1.753) 4.967 2.966 ( 12.944 -5.418 -6.183) 15.334 3.079 ( 2.170 0.453 -1.769) 2.836 3.263 ( 3.197 0.285 -2.115) 3.844 3.331 ( -1.338 -1.092 -2.723) 3.225 3.506 ( 2.688 -0.635 3.771) 4.675 3.576 ( -8.054 4.335 4.286) 10.101 3.628 ( -5.964 0.307 2.216) 6.370 3.730 ( 2.071 1.100 -6.839) 7.230 3.847 ( -4.877 1.267 1.749) 5.334 3.849 ( -1.251 -0.437 0.158) 1.335 4.000 ( 8.476 -5.182 3.763) 10.624 4.229 ( -1.528 3.001 1.878) 3.856 4.296 ( 5.518 2.326 -0.874) 6.052 4.507 ( -6.843 3.060 0.477) 7.511 4.529 ( 1.095 3.503 0.617) 3.722 4.601 ( 1.062 -2.267 -5.815) 6.330 4.895 ( -4.296 7.465 -1.962) 8.834 4.971 ( -2.701 1.183 -0.675) 3.025 5.147 ( 1.049 -2.397 4.114) 4.875 5.166 ( -5.430 5.462 1.116) 7.782 5.303 ( 1.955 1.624 -2.027) 3.251 5.403 ( -7.646 1.163 -0.925) 7.789 5.503 ( -10.939 -4.431 -0.082) 11.803 5.627 ( -5.446 1.781 3.628) 6.782 5.709 ( -0.421 3.428 -1.268) 3.679 5.800 ( -12.191 3.094 5.448) 13.707 6.047 ( -1.316 -1.445 -2.235) 2.969 6.085 ( -3.717 -5.003 -1.123) 6.333 6.167 ( -4.086 -8.920 -2.991) 10.257 6.286 ( 0.358 -3.807 0.242) 3.831 6.373 ( 1.383 -2.847 2.657) 4.133 6.522 ( -0.226 -2.546 -0.480) 2.601 6.611 ( 0.517 0.092 0.063) 0.529 7.015 ( 5.798 0.729 -4.452) 7.346 7.151 ( 3.834 1.790 5.047) 6.586 7.170 ( 3.601 0.464 0.210) 3.637 7.366 ( 4.788 -3.808 -3.150) 6.881 7.623 ( 6.321 1.922 -1.453) 6.764 7.925 ( -4.476 1.954 -0.442) 4.904 8.056 ( -0.356 4.151 -0.830) 4.248 8.220 ( 5.735 -2.864 -0.912) 6.475 8.463 ( -5.333 5.518 6.023) 9.755 8.487 ( 1.602 3.588 -3.163) 5.044 8.561 ( -1.919 -0.185 -0.779) 2.079 8.676 ( -7.455 1.703 0.195) 7.650 8.987 ( 1.431 0.502 -1.899) 2.430 9.151 ( -5.528 0.660 2.167) 5.974 9.473 ( 2.003 1.987 4.200) 5.059 9.799 ( -0.233 10.497 2.442) 10.780 9.944 ( 13.531 -0.961 -8.558) 16.039 9.952 ( -6.028 4.867 1.371) 7.868 10.294 ( -1.675 0.031 5.288) 5.547 10.368 ( 2.825 -2.495 -7.412) 8.315 10.577 ( 5.328 4.285 -1.031) 6.915 10.723 ( -0.136 -1.799 2.680) 3.231 11.041 ( 5.287 4.187 0.787) 6.790 11.167 ( 5.016 0.702 3.124) 5.951 11.364 ( 8.293 -7.519 0.814) 11.224 11.573 ( 5.387 -1.887 -1.753) 5.971 11.704 ( -1.390 2.419 -0.908) 2.935 11.737 ( -0.339 -1.280 1.313) 1.865 12.043 ( -2.889 -0.305 0.466) 2.942 12.144 ( -1.224 -0.894 -0.630) 1.641 12.738 ( -1.712 -0.764 -0.208) 1.886 12.806 ( -1.422 -3.355 0.095) 3.645 13.226 ( 9.958 14.878 0.386) 17.907 13.387 ( 12.170 11.742 0.855) 16.933 13.647 ( -5.924 2.200 -0.924) 6.386 13.736 ( -2.693 3.032 -0.132) 4.057 15.816 ( -6.902 -0.800 0.825) 6.997 16.078 ( -17.898 0.426 0.458) 17.909 17.524 ( 10.673 8.990 -0.090) 13.955 17.721 ( 6.191 -1.529 0.574) 6.403 18.065 ( 14.197 8.134 -0.213) 16.364 18.549 ( -0.449 -6.016 2.537) 6.544 18.731 ( -7.805 1.372 -2.473) 8.302 18.943 ( -14.331 -13.717 0.480) 19.843 19.654 ( -2.925 13.043 1.805) 13.489 19.777 ( -2.482 9.972 -0.936) 10.319 20.152 ( 1.903 19.373 4.790) 20.047 20.491 ( 9.310 11.529 -11.268) 18.616 21.020 ( 4.320 -12.234 8.762) 15.656 21.179 ( 13.749 -6.572 -8.111) 17.263 21.865 ( 2.821 0.693 3.665) 4.676 22.017 ( 4.148 -1.074 1.902) 4.688 22.240 ( -3.363 -1.098 -0.961) 3.666 22.347 ( -2.889 0.070 0.213) 2.898 22.499 ( -0.120 -8.182 2.953) 8.699 22.681 ( -5.347 -7.846 -0.948) 9.542 22.820 ( -6.239 -1.571 -0.419) 6.447 22.890 ( -5.827 -5.864 -0.940) 8.320 ======================= Grid point 167 (69/102) ======================= q-point: ( 0.45 0.27 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.528 ( 6.776 -3.109 3.495) 8.234 1.634 ( 16.363 -0.483 -2.321) 16.534 1.758 ( 1.594 -8.015 -1.563) 8.320 1.885 ( 8.379 -4.904 -0.349) 9.715 2.184 ( 1.540 1.134 4.009) 4.442 2.251 ( 6.582 -1.569 -0.918) 6.828 2.455 ( 3.429 -1.388 -2.438) 4.431 2.668 ( 2.305 -5.131 1.401) 5.796 2.780 ( 6.582 -4.611 -3.474) 8.756 2.930 ( 3.502 -3.223 0.617) 4.799 2.988 ( -12.516 -10.605 2.976) 16.672 3.079 ( 6.522 1.387 -1.823) 6.913 3.104 ( 7.485 -2.184 -4.383) 8.945 3.289 ( 2.447 -1.762 -0.815) 3.123 3.371 ( 1.695 -2.756 -1.032) 3.396 3.410 ( -9.196 5.053 4.788) 11.534 3.527 ( -1.635 1.085 3.315) 3.853 3.622 ( -2.332 -2.087 0.781) 3.225 3.704 ( -4.620 -0.313 -3.568) 5.846 3.789 ( -2.980 0.653 0.471) 3.087 3.889 ( 8.949 0.294 -1.163) 9.029 4.076 ( 0.391 1.557 1.990) 2.557 4.242 ( 6.888 1.451 -3.836) 8.016 4.291 ( -1.959 0.036 8.214) 8.444 4.423 ( 3.184 -0.660 0.960) 3.390 4.469 ( 3.046 7.001 -3.650) 8.463 4.559 ( -5.250 3.790 -2.139) 6.820 4.787 ( 0.257 1.485 -4.181) 4.444 4.917 ( -3.897 3.565 1.819) 5.586 5.044 ( -1.049 3.290 -0.547) 3.497 5.145 ( -3.347 4.344 4.259) 6.943 5.216 ( -2.663 0.205 -1.423) 3.026 5.406 ( -1.959 -1.315 -3.499) 4.220 5.484 ( -10.796 -3.470 0.992) 11.383 5.613 ( -3.708 -0.977 3.932) 5.492 5.684 ( 2.819 -0.554 -2.295) 3.677 5.739 ( -4.520 -3.578 3.760) 6.883 6.060 ( -2.718 -2.376 -5.882) 6.901 6.159 ( -4.582 -6.119 6.281) 9.894 6.287 ( -0.698 -5.825 -3.152) 6.660 6.360 ( -2.399 -5.976 1.734) 6.669 6.445 ( -0.448 -3.867 -0.103) 3.894 6.572 ( 1.725 -1.152 0.906) 2.264 6.631 ( 4.032 -1.236 -1.453) 4.461 7.023 ( 3.961 1.537 -3.381) 5.429 7.151 ( 1.425 1.166 1.784) 2.564 7.164 ( 4.126 4.191 2.511) 6.395 7.424 ( 0.617 -1.129 -0.876) 1.557 7.606 ( 1.900 3.854 0.224) 4.303 7.788 ( -1.309 9.831 -4.738) 10.991 7.990 ( -0.923 3.354 1.120) 3.655 8.270 ( 2.675 4.552 2.904) 6.026 8.330 ( -3.494 6.377 -3.325) 7.995 8.373 ( -2.696 3.639 -1.697) 4.836 8.561 ( -1.175 -0.912 1.318) 1.988 8.652 ( -3.368 -3.324 1.381) 4.930 8.984 ( 2.653 0.577 -2.171) 3.476 9.092 ( -6.844 0.897 2.554) 7.360 9.389 ( 1.353 9.557 1.828) 9.823 9.620 ( -4.580 8.192 -0.322) 9.391 9.833 ( 1.430 5.017 6.708) 8.498 10.042 ( 12.156 -0.770 -8.537) 14.874 10.287 ( -3.094 0.048 4.561) 5.512 10.403 ( 0.472 -1.748 -2.642) 3.202 10.598 ( 8.332 -1.041 -3.947) 9.278 10.746 ( 0.472 -0.311 2.373) 2.439 11.019 ( 3.852 2.408 0.011) 4.543 11.171 ( 0.437 1.514 2.194) 2.701 11.522 ( 5.173 -1.229 -2.181) 5.747 11.600 ( 2.773 -1.051 1.260) 3.222 11.650 ( 3.729 4.207 0.220) 5.626 11.802 ( 3.992 -2.810 0.294) 4.890 12.031 ( -1.302 -0.003 -0.381) 1.356 12.145 ( -2.555 -0.416 0.411) 2.621 12.768 ( 0.213 -3.083 0.481) 3.127 12.876 ( -1.021 -5.436 -0.334) 5.541 13.003 ( 9.211 17.147 0.477) 19.470 13.155 ( 8.001 20.353 -0.471) 21.874 13.566 ( -5.836 3.516 0.467) 6.829 13.623 ( -3.625 5.134 -1.178) 6.395 15.794 ( -5.266 -1.769 0.321) 5.565 15.965 ( -12.246 -0.339 0.138) 12.252 17.470 ( 9.113 4.743 -0.086) 10.273 17.746 ( -0.540 0.847 0.202) 1.025 18.087 ( 14.480 3.415 0.095) 14.877 18.520 ( -4.656 4.885 0.729) 6.788 18.672 ( -1.252 1.041 -0.391) 1.675 19.076 ( -12.755 -9.132 -1.300) 15.741 19.432 ( -4.336 5.589 2.707) 7.574 19.563 ( -3.184 10.473 -3.427) 11.470 19.825 ( 5.924 20.301 7.307) 22.375 20.255 ( 5.157 17.761 -7.363) 19.906 21.275 ( 3.986 -10.210 5.869) 12.432 21.383 ( 9.625 -7.722 -5.189) 13.387 21.879 ( 3.904 1.360 0.389) 4.153 22.108 ( 2.299 -4.168 5.435) 7.225 22.160 ( -2.646 4.638 -2.351) 5.834 22.373 ( -1.191 -3.550 -6.346) 7.369 22.641 ( -1.706 -6.322 5.465) 8.528 22.786 ( -1.451 -6.158 -0.613) 6.356 22.838 ( -7.568 -7.352 1.567) 10.667 22.971 ( -5.426 -7.352 -2.145) 9.386 ======================= Grid point 168 (70/102) ======================= q-point: ( 0.55 0.27 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.564 ( -1.779 -1.593 7.387) 7.764 1.716 ( 7.393 2.179 -7.772) 10.946 1.907 ( 8.028 -8.473 -3.125) 12.084 2.096 ( -3.149 -12.467 0.551) 12.870 2.220 ( 4.573 -1.670 4.597) 6.696 2.342 ( 1.533 -2.803 0.041) 3.195 2.562 ( 10.735 -6.040 -5.179) 13.362 2.696 ( 0.893 1.938 1.079) 2.391 2.885 ( -3.090 -3.221 1.474) 4.700 2.955 ( -10.524 -2.122 6.301) 12.448 3.045 ( 8.312 2.903 -5.354) 10.305 3.095 ( -1.003 -2.362 2.856) 3.840 3.204 ( 5.605 -4.919 -5.115) 9.043 3.285 ( -3.996 2.739 -0.993) 4.945 3.358 ( 1.969 -3.167 2.296) 4.379 3.393 ( -0.220 0.930 0.060) 0.958 3.528 ( -1.105 -0.986 -0.148) 1.488 3.616 ( -4.619 -0.137 -0.135) 4.623 3.711 ( -0.093 -3.433 0.338) 3.451 3.798 ( -3.295 -2.572 1.806) 4.554 3.937 ( 6.046 -1.227 -3.355) 7.023 4.045 ( 3.077 4.011 0.936) 5.141 4.147 ( -3.312 8.941 1.698) 9.685 4.251 ( -7.337 5.512 -0.249) 9.181 4.373 ( 2.195 0.721 -0.246) 2.323 4.452 ( -2.338 -0.007 -0.516) 2.395 4.521 ( 9.580 0.632 -1.743) 9.758 4.739 ( -8.487 2.764 3.173) 9.473 4.909 ( 8.090 -2.485 -1.170) 8.544 5.019 ( 0.425 -0.194 0.418) 0.627 5.096 ( 1.581 -0.993 -0.150) 1.873 5.207 ( -3.391 -0.452 0.938) 3.547 5.388 ( -0.011 0.300 -5.038) 5.047 5.475 ( -10.523 -3.707 -0.303) 11.161 5.617 ( -3.272 -1.895 7.426) 8.333 5.761 ( -3.273 -7.209 -1.770) 8.113 5.833 ( 7.197 -4.200 0.173) 8.335 6.084 ( -2.735 -3.974 -5.175) 7.075 6.210 ( -1.653 -0.258 6.004) 6.233 6.353 ( -2.761 -3.761 -0.748) 4.726 6.468 ( -0.516 -5.960 0.030) 5.983 6.502 ( 1.164 -2.782 -0.604) 3.076 6.585 ( -0.504 0.870 2.813) 2.987 6.689 ( 4.125 -1.671 -3.645) 5.753 7.004 ( 3.091 2.855 -2.490) 4.889 7.077 ( -1.821 4.904 -0.563) 5.261 7.166 ( 5.624 1.973 5.477) 8.094 7.421 ( -0.425 1.644 -1.444) 2.229 7.492 ( -4.876 8.580 3.475) 10.462 7.566 ( 0.355 12.068 -4.043) 12.732 7.916 ( 1.972 4.910 -1.074) 5.399 8.130 ( -6.773 7.235 -4.070) 10.713 8.165 ( -0.464 6.822 3.689) 7.770 8.329 ( -0.278 2.894 -4.142) 5.061 8.587 ( 0.879 -0.146 1.562) 1.798 8.697 ( -5.171 -3.094 1.439) 6.195 9.004 ( 3.839 -0.381 -0.255) 3.866 9.054 ( -1.962 -1.083 0.957) 2.436 9.234 ( 1.150 7.219 3.444) 8.081 9.437 ( -4.456 6.872 -2.836) 8.667 9.827 ( 4.594 1.361 6.856) 8.365 10.084 ( 5.199 2.222 -6.621) 8.706 10.291 ( 1.700 -1.047 2.681) 3.343 10.433 ( -2.243 -2.738 -1.529) 3.855 10.690 ( 6.254 -3.021 -2.383) 7.342 10.759 ( 0.380 -0.655 1.303) 1.507 11.007 ( 2.012 1.287 -0.752) 2.504 11.135 ( -4.431 1.014 0.367) 4.560 11.472 ( 3.311 6.636 0.865) 7.467 11.577 ( 1.552 5.037 -0.745) 5.323 11.705 ( 7.560 -1.198 2.634) 8.095 11.840 ( 6.281 3.477 -1.866) 7.417 12.018 ( -0.297 0.715 -0.695) 1.041 12.112 ( -4.963 1.319 1.004) 5.232 12.750 ( 6.788 12.744 0.434) 14.445 12.838 ( 4.989 16.642 -0.259) 17.376 12.879 ( -1.523 -3.329 0.909) 3.772 12.984 ( -0.079 -6.634 -1.081) 6.722 13.429 ( -3.292 6.885 1.498) 7.777 13.521 ( -3.812 3.515 -2.102) 5.595 15.802 ( -2.436 -2.093 0.286) 3.224 15.907 ( -7.417 -1.062 0.037) 7.493 17.484 ( 7.351 0.762 -0.043) 7.390 17.703 ( -5.783 0.726 0.098) 5.829 18.120 ( 10.097 3.264 0.335) 10.617 18.359 ( -5.158 7.826 -0.927) 9.419 18.666 ( 4.221 1.815 2.785) 5.373 19.062 ( -5.549 1.188 -5.962) 8.231 19.374 ( -1.140 3.132 0.641) 3.394 19.433 ( -6.708 -4.013 -0.480) 7.831 19.565 ( 4.408 15.092 8.742) 17.989 19.930 ( 0.264 18.408 -5.523) 19.220 21.453 ( 8.590 -3.428 1.852) 9.433 21.560 ( 2.257 -7.337 0.089) 7.677 21.889 ( 2.653 -0.243 -1.866) 3.253 22.027 ( -3.023 5.802 -2.312) 6.939 22.204 ( -1.703 -3.289 7.140) 8.043 22.403 ( 1.066 -1.439 -8.607) 8.792 22.735 ( -1.094 -4.482 7.519) 8.821 22.866 ( 0.883 -4.187 -3.998) 5.856 22.970 ( -5.174 -10.083 2.772) 11.667 23.054 ( -3.650 -6.540 -2.076) 7.772 ======================= Grid point 169 (71/102) ======================= q-point: ( 0.64 0.27 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.618 ( -0.960 -3.492 3.319) 4.912 1.732 ( 5.503 -1.281 -8.134) 9.904 2.067 ( 2.548 -3.859 2.399) 5.209 2.182 ( -5.923 -1.739 -1.818) 6.436 2.347 ( 9.246 -3.793 0.803) 10.026 2.403 ( -6.492 -6.387 5.094) 10.435 2.631 ( 0.611 7.038 2.555) 7.512 2.710 ( 5.859 -0.665 -5.119) 7.808 2.886 ( 3.683 -0.146 -3.695) 5.219 2.930 ( -10.558 -1.506 2.110) 10.872 2.987 ( -2.578 -0.639 10.145) 10.487 3.181 ( 7.527 -1.233 -8.669) 11.547 3.251 ( -4.371 -2.235 3.531) 6.047 3.321 ( 5.710 -3.834 -5.280) 8.671 3.372 ( 0.329 -0.506 0.835) 1.030 3.430 ( 1.239 -1.830 -0.046) 2.210 3.516 ( -1.370 0.282 -0.424) 1.461 3.583 ( -3.683 0.469 -0.789) 3.796 3.760 ( 3.639 4.846 -0.964) 6.137 3.784 ( -3.397 2.052 0.747) 4.038 3.899 ( 1.779 6.874 1.324) 7.223 4.004 ( -4.691 -3.056 -1.069) 5.700 4.011 ( -7.547 1.826 6.430) 10.082 4.135 ( 3.355 2.063 -6.324) 7.450 4.437 ( 5.493 -4.696 -0.674) 7.258 4.487 ( -3.470 -5.134 1.335) 6.339 4.582 ( 8.399 0.134 -1.532) 8.539 4.636 ( -6.582 2.375 2.091) 7.303 4.979 ( -0.943 -2.966 3.550) 4.721 5.068 ( 2.423 -2.174 4.958) 5.931 5.134 ( -4.280 -0.365 -2.837) 5.147 5.198 ( 4.948 0.350 -1.962) 5.334 5.411 ( 5.082 -1.713 -6.031) 8.071 5.450 ( -8.611 -2.844 -3.044) 9.566 5.680 ( -1.857 -4.840 8.665) 10.097 5.857 ( -4.007 -6.379 1.209) 7.630 5.963 ( 7.436 -3.465 -2.214) 8.497 6.118 ( -3.071 -2.240 -2.775) 4.706 6.214 ( 4.350 -0.011 3.118) 5.352 6.377 ( -5.074 -2.295 -2.503) 6.105 6.520 ( 0.335 1.255 0.179) 1.311 6.537 ( 1.523 3.486 4.086) 5.583 6.552 ( -0.051 -0.597 -0.652) 0.886 6.709 ( -0.807 0.941 -4.784) 4.942 6.932 ( -1.159 6.855 3.442) 7.758 7.001 ( 1.205 2.442 -3.042) 4.083 7.176 ( 5.816 4.339 5.371) 9.028 7.255 ( -8.295 8.923 4.957) 13.152 7.324 ( 5.519 10.247 -4.794) 12.587 7.425 ( -4.538 2.009 -2.845) 5.720 7.864 ( 3.098 2.328 -0.947) 3.989 7.976 ( -6.573 2.704 -2.873) 7.666 8.085 ( -0.512 2.988 4.890) 5.753 8.263 ( 1.399 2.476 -8.360) 8.830 8.535 ( -0.942 6.066 5.745) 8.408 8.676 ( -0.491 1.713 -3.899) 4.286 9.020 ( -5.801 -1.972 8.115) 10.169 9.138 ( 6.396 -3.707 -6.309) 9.719 9.207 ( 4.548 -1.836 3.638) 6.107 9.328 ( -5.342 0.752 0.326) 5.405 9.843 ( 4.907 2.659 3.800) 6.752 10.018 ( 0.199 5.121 -5.018) 7.172 10.351 ( 2.950 -2.079 2.935) 4.652 10.463 ( -1.497 -3.054 -3.126) 4.620 10.735 ( -1.379 -0.002 2.846) 3.163 10.806 ( 2.718 -2.685 -3.441) 5.142 11.003 ( 1.610 0.401 -0.145) 1.666 11.079 ( -5.247 0.688 -0.797) 5.352 11.365 ( 1.344 7.754 4.438) 9.035 11.483 ( 1.450 5.958 -3.303) 6.965 11.735 ( 4.017 3.658 1.838) 5.735 11.760 ( 5.814 9.464 -1.454) 11.202 12.004 ( 1.577 0.855 -0.914) 2.013 12.041 ( -5.584 1.478 1.082) 5.877 12.598 ( 2.097 7.486 0.151) 7.776 12.611 ( 1.235 9.451 -0.157) 9.532 12.987 ( 1.115 -5.862 2.352) 6.414 13.092 ( -1.449 -5.609 -2.173) 6.187 13.308 ( 0.652 5.367 2.633) 6.013 13.429 ( -3.284 2.668 -3.075) 5.230 15.829 ( -0.005 -1.633 0.847) 1.839 15.888 ( -3.689 -1.434 -0.530) 3.993 17.545 ( 6.703 -1.651 0.020) 6.903 17.658 ( -7.563 -1.596 -0.023) 7.730 18.128 ( 5.312 2.046 0.261) 5.698 18.203 ( -3.352 5.001 -1.175) 6.134 18.656 ( 3.543 3.953 6.280) 8.223 18.940 ( -3.017 5.874 -10.031) 12.009 19.362 ( 5.367 11.264 8.380) 15.030 19.425 ( 5.000 -4.984 -1.058) 7.138 19.460 ( -5.232 1.226 0.433) 5.391 19.635 ( -7.320 6.596 -3.087) 10.326 21.533 ( 11.119 2.930 0.739) 11.523 21.646 ( -6.218 -2.344 2.089) 6.966 21.920 ( -1.236 0.428 -1.444) 1.948 21.932 ( 1.650 -1.464 -4.093) 4.649 22.241 ( -2.018 -0.975 6.709) 7.073 22.400 ( 0.293 0.456 -6.120) 6.144 22.825 ( 0.657 -4.247 4.093) 5.935 22.917 ( 0.353 -1.403 -1.770) 2.286 23.101 ( -3.191 -7.280 2.296) 8.274 23.156 ( -0.103 -6.983 -2.483) 7.412 ======================= Grid point 170 (72/102) ======================= q-point: (-0.27 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.660 ( 1.635 0.324 3.596) 3.963 1.800 ( 3.752 -3.514 -9.332) 10.654 2.049 ( -5.525 6.370 3.696) 9.207 2.135 ( 2.919 4.233 -3.305) 6.112 2.367 ( -1.805 7.234 8.113) 11.018 2.444 ( -1.541 7.192 -1.177) 7.448 2.516 ( -6.582 -4.785 6.135) 10.191 2.695 ( 6.418 1.150 -6.659) 9.320 2.881 ( -8.183 0.255 -0.296) 8.192 2.920 ( 9.022 2.112 -3.620) 9.948 3.072 ( -0.590 -4.747 5.504) 7.292 3.174 ( -1.027 2.237 -1.107) 2.699 3.327 ( 1.596 -4.317 0.097) 4.604 3.376 ( 1.679 -1.993 -1.597) 3.057 3.407 ( 2.011 -0.924 -0.334) 2.238 3.448 ( -0.599 -0.837 -1.769) 2.046 3.516 ( -4.390 2.694 1.878) 5.483 3.531 ( 0.750 0.565 0.246) 0.971 3.628 ( 1.286 4.496 2.334) 5.227 3.704 ( -0.767 1.631 -4.930) 5.249 3.953 ( 3.546 -2.441 0.338) 4.318 3.961 ( -1.128 1.050 1.300) 2.016 4.006 ( -2.402 -4.337 4.271) 6.544 4.148 ( 1.721 -0.017 -6.871) 7.084 4.520 ( -4.749 3.481 0.391) 5.901 4.527 ( 3.033 0.992 0.160) 3.195 4.583 ( -5.577 -6.878 4.628) 9.992 4.702 ( 9.571 -6.476 -5.598) 12.841 5.013 ( -9.373 0.626 6.071) 11.185 5.060 ( 1.968 0.111 3.760) 4.245 5.176 ( -0.339 -4.503 0.460) 4.539 5.227 ( 7.890 -1.490 -4.882) 9.397 5.399 ( -8.927 -1.808 0.669) 9.133 5.517 ( 7.688 -3.577 -9.376) 12.641 5.760 ( -2.020 -2.395 7.942) 8.538 5.912 ( -0.488 -1.321 -3.235) 3.528 6.040 ( 1.169 -0.797 3.339) 3.626 6.103 ( -3.288 0.573 1.732) 3.760 6.267 ( -0.323 1.394 0.901) 1.691 6.359 ( 3.350 -0.732 -5.134) 6.173 6.444 ( -2.419 7.543 -0.157) 7.923 6.451 ( 2.437 4.929 -0.852) 5.564 6.595 ( 5.553 -2.243 2.097) 6.346 6.633 ( -8.616 0.747 -0.741) 8.680 6.798 ( 1.939 8.476 3.724) 9.459 6.880 ( -1.119 10.822 -2.228) 11.105 7.141 ( 4.580 0.955 1.938) 5.064 7.147 ( -3.913 0.058 -0.361) 3.930 7.238 ( 2.656 4.319 3.211) 6.002 7.340 ( -2.615 3.796 -4.715) 6.593 7.864 ( 0.542 -0.406 1.597) 1.735 7.944 ( 0.087 -2.327 -4.154) 4.763 8.060 ( -1.650 0.455 4.014) 4.363 8.240 ( 3.843 0.183 -10.472) 11.156 8.443 ( -3.435 2.895 10.062) 11.019 8.655 ( 5.069 0.410 -8.483) 9.891 9.039 ( -5.563 -2.981 8.299) 10.426 9.196 ( -0.062 -2.786 -4.465) 5.263 9.295 ( -6.510 -3.442 6.306) 9.695 9.363 ( 6.476 -4.625 0.645) 7.984 9.808 ( 2.476 4.936 1.153) 5.642 9.907 ( 0.341 5.595 -6.286) 8.422 10.391 ( -5.245 -1.876 5.299) 7.688 10.516 ( 6.164 -1.603 -5.485) 8.405 10.710 ( -1.638 2.012 4.687) 5.357 10.825 ( -0.256 0.560 -5.202) 5.238 11.017 ( -0.475 -0.795 1.925) 2.136 11.051 ( 0.322 -0.036 -1.095) 1.141 11.246 ( -1.011 6.270 5.141) 8.171 11.375 ( 0.721 5.724 -6.045) 8.356 11.622 ( 1.227 7.984 2.551) 8.471 11.659 ( -0.921 4.693 -0.922) 4.871 12.001 ( -2.482 -0.299 0.907) 2.660 12.022 ( 2.700 -1.030 -0.883) 3.021 12.496 ( -1.009 4.284 0.804) 4.474 12.513 ( 0.760 3.593 -0.662) 3.732 13.073 ( 0.515 -0.659 1.758) 1.947 13.117 ( -0.205 0.733 -2.178) 2.307 13.284 ( -0.513 -1.650 5.231) 5.509 13.404 ( 0.173 -3.191 -4.972) 5.910 15.854 ( 0.332 -0.552 2.109) 2.205 15.901 ( -0.301 -1.970 -1.798) 2.684 17.638 ( 2.888 -3.093 0.497) 4.261 17.651 ( -3.194 -3.513 -0.568) 4.782 18.110 ( -4.544 1.074 0.793) 4.736 18.143 ( 6.038 2.832 -2.181) 7.017 18.605 ( -2.866 3.298 8.158) 9.254 18.805 ( 1.929 5.433 -9.272) 10.918 19.226 ( -1.444 6.344 4.473) 7.895 19.296 ( 0.991 9.324 -1.940) 9.575 19.608 ( 3.906 -7.058 1.007) 8.130 19.632 ( -3.656 -9.067 -0.964) 9.824 21.504 ( -2.151 6.069 3.042) 7.121 21.575 ( 2.043 5.132 -2.732) 6.162 21.939 ( -1.217 -3.607 1.280) 4.016 21.999 ( 2.513 -3.323 -3.714) 5.581 22.239 ( -2.116 1.260 6.263) 6.730 22.378 ( 1.008 0.520 -5.887) 5.995 22.890 ( -0.289 -0.354 2.337) 2.381 22.930 ( 0.427 -1.745 -0.299) 1.821 23.198 ( -1.576 -4.956 2.823) 5.917 23.273 ( 1.311 -5.838 -3.189) 6.781 ======================= Grid point 171 (73/102) ======================= q-point: (-0.18 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.629 ( -1.118 5.792 7.881) 9.844 1.769 ( -0.378 14.374 0.405) 14.385 1.875 ( 1.601 4.164 -3.544) 5.698 1.982 ( 2.598 13.561 -3.378) 14.214 2.239 ( -1.228 6.692 1.708) 7.015 2.321 ( 1.477 -0.471 -1.373) 2.071 2.581 ( -3.138 -1.843 -0.675) 3.701 2.695 ( 6.296 6.851 -4.117) 10.175 2.778 ( -3.182 2.380 2.206) 4.545 2.934 ( 6.613 3.060 -4.362) 8.492 3.091 ( -2.968 4.403 6.874) 8.686 3.147 ( -0.494 -0.336 2.813) 2.876 3.316 ( -2.361 6.239 2.669) 7.185 3.346 ( 0.970 1.704 -0.611) 2.054 3.438 ( 1.101 0.083 -0.824) 1.378 3.466 ( 2.386 -1.525 0.343) 2.853 3.518 ( -0.398 -0.877 -2.513) 2.691 3.528 ( 3.518 0.647 -2.611) 4.429 3.643 ( 0.733 -5.038 2.063) 5.493 3.718 ( -3.343 -3.983 -4.093) 6.617 3.950 ( 1.603 -0.309 -0.442) 1.691 3.998 ( 1.182 -0.726 -0.577) 1.502 4.133 ( 3.788 -4.959 4.724) 7.827 4.143 ( -4.054 -3.272 -2.057) 5.601 4.423 ( -2.317 2.712 0.232) 3.574 4.508 ( 1.483 2.078 -2.376) 3.488 4.634 ( -7.656 -3.391 3.103) 8.929 4.874 ( 8.516 -4.393 -4.256) 10.485 4.915 ( -6.513 2.776 4.772) 8.538 5.084 ( 5.595 1.609 -3.171) 6.630 5.251 ( -4.696 -6.385 3.395) 8.623 5.335 ( -2.469 -2.384 -6.092) 6.992 5.403 ( 1.900 -5.329 5.807) 8.107 5.627 ( 8.240 -4.068 -6.662) 11.351 5.744 ( -5.384 2.487 3.432) 6.852 5.885 ( -1.458 4.340 -0.056) 4.579 5.966 ( -0.230 6.100 0.923) 6.174 6.063 ( -3.545 2.418 1.423) 4.520 6.206 ( -0.002 2.428 1.821) 3.035 6.304 ( 2.264 5.950 3.719) 7.372 6.350 ( 4.105 3.457 -2.585) 5.957 6.483 ( 0.492 -2.505 -2.977) 3.922 6.590 ( -8.091 -3.733 2.528) 9.262 6.611 ( 0.706 7.045 -2.195) 7.412 6.724 ( 9.959 2.894 -0.939) 10.413 6.774 ( 3.574 -2.414 -0.728) 4.374 7.134 ( -2.557 0.041 3.978) 4.729 7.162 ( 1.041 2.034 3.990) 4.598 7.240 ( 3.530 -3.489 -1.508) 5.187 7.243 ( 0.573 4.239 -4.838) 6.458 7.897 ( 0.668 -2.372 1.953) 3.144 7.990 ( 3.718 -0.501 -5.930) 7.017 8.070 ( -2.236 -3.354 4.683) 6.179 8.248 ( 2.564 -0.257 -8.614) 8.991 8.444 ( -4.123 -3.469 9.101) 10.576 8.694 ( 5.839 -1.603 -8.867) 10.737 9.071 ( -6.929 -3.428 7.814) 10.992 9.232 ( -1.202 -2.878 -4.725) 5.662 9.319 ( -7.973 -3.989 7.590) 11.708 9.479 ( 3.266 -3.092 3.977) 6.003 9.721 ( -0.543 5.176 -0.239) 5.210 9.815 ( 2.002 3.433 -8.603) 9.477 10.354 ( -8.932 1.133 2.990) 9.487 10.545 ( 8.941 4.693 -1.448) 10.201 10.692 ( 0.570 0.003 4.161) 4.200 10.800 ( 1.478 0.610 -5.446) 5.676 11.018 ( -2.789 -0.447 0.151) 2.829 11.052 ( 3.723 2.235 0.931) 4.441 11.176 ( 0.003 1.836 3.785) 4.207 11.287 ( 1.518 2.955 -5.364) 6.309 11.506 ( -7.718 2.974 2.250) 8.572 11.605 ( 0.910 0.737 -0.824) 1.432 12.013 ( -1.179 -2.568 0.572) 2.883 12.073 ( 2.717 -2.304 -0.922) 3.680 12.424 ( -2.090 2.900 1.462) 3.862 12.471 ( 0.585 1.802 -0.898) 2.096 13.031 ( -0.257 3.613 1.325) 3.857 13.082 ( 1.523 3.400 -2.272) 4.364 13.370 ( -2.439 -7.003 5.166) 9.038 13.499 ( 1.862 -6.533 -4.349) 8.066 15.866 ( 0.190 -0.094 2.923) 2.931 15.941 ( 1.940 -2.198 -2.675) 3.969 17.643 ( -8.860 -2.748 -0.294) 9.281 17.772 ( 8.769 -3.866 0.673) 9.608 18.038 ( -2.509 4.293 -0.373) 4.987 18.113 ( 4.427 5.247 -1.509) 7.029 18.561 ( -9.183 -2.770 4.934) 10.786 18.781 ( 7.795 -1.286 -4.279) 8.985 19.129 ( -5.701 1.836 0.466) 6.008 19.209 ( 4.591 2.735 0.252) 5.350 19.693 ( -9.626 -8.461 0.402) 12.823 19.861 ( 11.678 -8.979 -0.343) 14.735 21.315 ( -12.448 7.702 0.701) 14.655 21.512 ( 11.043 7.998 -1.160) 13.684 21.998 ( -1.665 -3.272 1.012) 3.808 22.043 ( 0.856 0.211 -0.740) 1.151 22.202 ( -1.963 1.584 5.506) 6.056 22.380 ( 3.435 -0.390 -8.394) 9.079 22.859 ( -2.688 2.207 5.907) 6.855 22.976 ( 1.333 -1.953 -2.764) 3.638 23.265 ( -1.553 -3.009 3.640) 4.972 23.361 ( 0.464 -3.928 -3.751) 5.451 ======================= Grid point 172 (74/102) ======================= q-point: (-0.09 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.416 ( 0.055 17.207 4.460) 17.776 1.477 ( 2.623 16.757 3.120) 17.245 1.761 ( 4.326 11.079 -0.249) 11.896 1.833 ( 7.024 5.998 -3.249) 9.791 2.132 ( 0.478 5.226 2.440) 5.787 2.432 ( 7.052 -3.677 -10.280) 12.997 2.483 ( -0.202 6.687 -0.154) 6.692 2.592 ( 9.664 7.990 0.263) 12.541 2.727 ( -2.011 9.252 3.700) 10.165 2.814 ( -2.714 9.324 3.024) 10.171 3.003 ( 1.991 3.179 3.804) 5.343 3.102 ( 0.660 5.058 -3.446) 6.156 3.239 ( -0.168 3.242 2.250) 3.950 3.352 ( 2.389 -0.012 -1.110) 2.634 3.424 ( 3.616 6.057 -5.524) 8.960 3.439 ( 2.448 0.805 -0.184) 2.583 3.483 ( -1.367 0.594 0.796) 1.689 3.598 ( 1.884 -2.983 -2.695) 4.439 3.727 ( -3.049 -4.932 3.416) 6.730 3.785 ( -2.822 -6.870 -1.234) 7.529 3.977 ( 2.848 -0.045 -1.056) 3.038 4.027 ( 1.927 -1.543 -0.937) 2.641 4.132 ( -4.197 1.024 2.169) 4.834 4.246 ( -1.209 -4.200 0.862) 4.455 4.435 ( -1.192 -3.510 3.391) 5.024 4.460 ( -2.945 1.346 -2.398) 4.029 4.636 ( -4.915 -2.541 1.935) 5.861 4.873 ( -1.808 -0.656 4.584) 4.971 4.967 ( 3.066 -3.400 -2.525) 5.228 5.070 ( 5.899 3.454 -6.753) 9.609 5.255 ( -13.767 0.882 -2.141) 13.960 5.337 ( -0.115 -3.849 1.552) 4.152 5.530 ( 1.885 0.192 3.270) 3.779 5.630 ( -1.102 4.454 1.024) 4.701 5.741 ( 5.692 -2.810 -4.564) 7.818 5.756 ( -11.581 2.470 4.033) 12.509 5.915 ( -2.236 0.458 0.767) 2.408 6.041 ( 12.611 1.042 -1.020) 12.695 6.202 ( 6.918 1.247 -2.399) 7.427 6.245 ( 6.139 5.275 6.230) 10.214 6.363 ( 1.400 -2.028 -0.779) 2.584 6.460 ( -3.490 0.809 0.278) 3.593 6.507 ( -4.065 0.330 -3.852) 5.610 6.649 ( 0.861 -2.637 -0.895) 2.915 6.819 ( 4.452 -3.216 0.466) 5.511 6.869 ( 8.026 -5.064 -0.545) 9.505 7.068 ( -0.456 4.687 3.687) 5.981 7.174 ( 2.773 2.246 -4.937) 6.092 7.232 ( 3.383 -4.481 3.554) 6.645 7.347 ( 4.908 -4.165 -1.541) 6.619 7.961 ( 2.133 -1.821 3.724) 4.662 8.000 ( 0.099 -2.708 -3.274) 4.250 8.147 ( 1.874 -2.806 0.457) 3.405 8.259 ( 2.162 -1.992 -6.924) 7.522 8.514 ( -5.314 -5.289 6.460) 9.896 8.736 ( 2.870 -1.098 -5.853) 6.611 9.085 ( -7.807 -2.671 6.724) 10.644 9.247 ( -2.698 -0.917 -3.938) 4.861 9.359 ( -5.510 -4.374 5.876) 9.166 9.532 ( -3.124 -0.552 10.619) 11.083 9.639 ( 0.225 2.167 -3.551) 4.166 9.781 ( 3.409 0.852 -9.717) 10.333 10.266 ( -4.979 2.027 1.052) 5.478 10.491 ( 7.316 6.909 0.509) 10.076 10.723 ( 0.923 -1.610 -0.206) 1.867 10.770 ( 0.222 3.375 -1.185) 3.583 10.979 ( -1.953 2.408 0.764) 3.193 11.092 ( 6.492 -1.540 -0.722) 6.711 11.181 ( 2.585 -1.072 2.570) 3.800 11.259 ( -0.432 0.764 -1.737) 1.946 11.446 ( -5.297 -3.087 -0.308) 6.138 11.621 ( 0.646 -1.229 -0.330) 1.427 12.085 ( 0.910 -5.609 -0.032) 5.682 12.132 ( 1.052 -2.725 -1.028) 3.097 12.369 ( -1.550 1.877 1.997) 3.149 12.447 ( 0.871 1.315 -0.861) 1.797 12.974 ( 0.299 3.038 1.848) 3.568 13.026 ( 0.635 2.951 -2.266) 3.775 13.495 ( -2.843 -7.955 3.033) 8.976 13.623 ( 0.737 -6.603 -2.727) 7.182 15.876 ( 0.738 0.043 3.071) 3.159 15.999 ( 3.283 -3.057 -2.896) 5.340 17.595 ( -10.562 0.349 -0.754) 10.595 17.827 ( -0.168 4.349 1.516) 4.608 17.936 ( 2.856 7.790 0.509) 8.313 18.101 ( 11.573 -2.875 -1.719) 12.048 18.603 ( -10.542 -9.116 1.395) 14.006 18.929 ( 8.482 -7.356 -0.037) 11.227 19.089 ( -5.196 -2.504 -2.377) 6.238 19.249 ( 5.640 -2.366 1.511) 6.300 19.785 ( -9.224 -9.959 0.189) 13.576 20.088 ( 7.693 -7.392 -0.465) 10.680 21.077 ( -9.753 9.002 -0.141) 13.273 21.433 ( 11.045 10.098 0.163) 14.966 21.986 ( -1.965 4.809 0.835) 5.262 22.025 ( 0.200 -0.051 0.648) 0.680 22.201 ( -0.937 -0.923 4.102) 4.308 22.397 ( 4.577 -0.163 -10.141) 11.128 22.816 ( -4.138 1.347 9.262) 10.234 22.996 ( 0.681 -0.286 -4.835) 4.891 23.294 ( -2.899 -0.939 4.555) 5.480 23.395 ( -2.583 -1.320 -4.379) 5.253 ======================= Grid point 178 (75/102) ======================= q-point: ( 0.36 0.36 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.395 ( 11.551 0.000 3.733) 12.139 1.475 ( 10.342 0.000 2.188) 10.571 1.708 ( 20.519 0.000 -2.532) 20.674 1.906 ( 21.004 0.000 -5.262) 21.654 2.281 ( 0.656 0.000 -0.953) 1.157 2.414 ( -9.970 -0.000 8.315) 12.982 2.420 ( 4.153 0.000 -1.771) 4.515 2.506 ( 2.312 0.000 -2.001) 3.058 2.602 ( 0.678 0.000 -0.608) 0.911 2.656 ( -1.759 -0.000 4.004) 4.374 2.856 ( 2.286 0.000 -3.627) 4.287 3.017 ( 13.700 0.000 -4.718) 14.490 3.124 ( 7.192 0.000 -1.947) 7.451 3.283 ( 2.791 0.000 -1.848) 3.347 3.294 ( -3.642 -0.000 -0.857) 3.742 3.496 ( -11.970 -0.000 5.872) 13.333 3.565 ( 2.822 0.000 -0.893) 2.960 3.614 ( -7.091 -0.000 7.316) 10.188 3.726 ( -0.760 -0.000 -8.352) 8.387 3.820 ( -4.802 -0.000 5.164) 7.052 3.885 ( 12.451 0.000 -7.901) 14.746 4.035 ( 9.939 0.000 7.715) 12.582 4.253 ( -2.580 -0.000 4.307) 5.020 4.340 ( 5.179 0.000 -4.341) 6.758 4.461 ( -13.217 -0.000 9.076) 16.033 4.533 ( 0.994 0.000 -5.353) 5.445 4.680 ( 16.147 0.000 -9.049) 18.510 4.939 ( -10.310 -0.000 -4.027) 11.069 4.944 ( -4.343 -0.000 2.418) 4.970 5.060 ( -5.763 -0.000 4.420) 7.263 5.254 ( 3.121 0.000 4.956) 5.857 5.328 ( -15.131 -0.000 -0.322) 15.135 5.359 ( -11.879 -0.000 -2.966) 12.244 5.367 ( 10.670 0.000 -5.117) 11.834 5.622 ( -9.702 -0.000 7.284) 12.132 5.669 ( -5.673 -0.000 -1.551) 5.881 5.793 ( -9.659 -0.000 7.389) 12.161 5.991 ( 0.536 0.000 -5.379) 5.405 6.027 ( -5.731 -0.000 4.852) 7.509 6.059 ( 1.461 0.000 -8.630) 8.752 6.263 ( 3.721 0.000 -3.659) 5.218 6.325 ( -6.811 -0.000 6.750) 9.589 6.524 ( 7.026 0.000 -3.142) 7.697 6.610 ( -0.697 -0.000 2.049) 2.164 7.058 ( 5.538 0.000 -3.765) 6.697 7.169 ( -0.589 -0.000 1.563) 1.670 7.226 ( 5.763 0.000 3.982) 7.005 7.367 ( 6.162 0.000 -4.037) 7.367 7.684 ( 5.972 0.000 -2.784) 6.589 7.890 ( -6.977 -0.000 1.909) 7.234 8.076 ( -4.173 -0.000 0.446) 4.197 8.240 ( 6.545 0.000 -1.056) 6.630 8.489 ( -5.929 -0.000 3.062) 6.673 8.508 ( 1.500 0.000 -6.350) 6.525 8.563 ( 0.035 0.000 4.120) 4.120 8.633 ( -7.696 -0.000 0.282) 7.701 9.015 ( 4.284 0.000 -4.892) 6.502 9.120 ( -7.331 -0.000 5.209) 8.993 9.513 ( 3.678 0.000 1.061) 3.828 9.824 ( -15.899 -0.000 3.840) 16.356 9.954 ( -0.503 -0.000 3.496) 3.532 10.049 ( 14.191 0.000 -7.748) 16.168 10.334 ( 2.404 0.000 5.538) 6.038 10.363 ( 7.004 0.000 -10.050) 12.250 10.659 ( -2.047 -0.000 4.111) 4.593 10.696 ( 5.045 0.000 -2.002) 5.428 11.135 ( 2.448 0.000 2.014) 3.170 11.196 ( 4.400 0.000 1.882) 4.786 11.377 ( 12.610 0.000 1.534) 12.703 11.580 ( 3.328 0.000 -2.412) 4.110 11.649 ( -4.107 -0.000 -2.283) 4.699 11.756 ( -1.732 -0.000 2.122) 2.739 12.039 ( 1.190 0.000 0.831) 1.451 12.125 ( -0.947 -0.000 -0.838) 1.264 12.712 ( -3.390 -0.000 0.444) 3.419 12.756 ( -1.810 -0.000 -0.494) 1.876 13.465 ( 7.680 0.000 -2.749) 8.158 13.487 ( 2.989 0.000 3.932) 4.940 13.688 ( -2.692 -0.000 -0.115) 2.694 13.746 ( 1.500 0.000 -0.905) 1.752 15.755 ( -7.396 -0.000 1.653) 7.578 15.946 ( -16.170 -0.000 -0.693) 16.184 17.709 ( 8.168 0.000 -1.358) 8.281 17.750 ( 7.560 0.000 1.558) 7.719 18.336 ( 6.295 0.000 -3.574) 7.238 18.373 ( 6.224 0.000 5.466) 8.284 18.662 ( -9.551 -0.000 -3.372) 10.129 18.748 ( -9.848 -0.000 1.903) 10.030 19.791 ( -0.841 -0.000 1.151) 1.425 19.846 ( -5.208 -0.000 0.047) 5.208 20.339 ( -3.400 -0.000 7.894) 8.595 20.634 ( 8.764 0.000 -17.410) 19.492 20.945 ( 3.741 0.000 10.653) 11.291 21.187 ( 12.288 0.000 -9.993) 15.838 21.905 ( -0.204 -0.000 8.758) 8.761 22.053 ( 5.936 0.000 -3.945) 7.128 22.129 ( -6.905 -0.000 9.586) 11.814 22.419 ( -0.927 -0.000 -0.851) 1.258 22.431 ( 2.870 0.000 2.712) 3.948 22.533 ( -0.945 -0.000 -8.508) 8.561 22.767 ( -5.640 -0.000 0.026) 5.640 22.794 ( -5.748 -0.000 0.489) 5.769 ======================= Grid point 179 (76/102) ======================= q-point: ( 0.45 0.36 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.509 ( 4.946 -3.435 4.537) 7.539 1.608 ( 6.237 -7.354 -2.177) 9.885 1.798 ( 12.944 5.183 2.797) 14.221 2.001 ( 13.645 3.826 -6.793) 15.715 2.229 ( 1.029 2.953 2.210) 3.830 2.294 ( 0.763 2.473 0.369) 2.614 2.461 ( 3.693 -1.276 -2.287) 4.527 2.564 ( -6.637 -6.564 3.262) 9.888 2.689 ( -7.284 -6.755 3.935) 10.685 2.742 ( 3.795 -7.755 -5.808) 10.406 2.910 ( 8.047 -3.064 -3.115) 9.157 3.098 ( 3.433 -1.969 -1.492) 4.229 3.153 ( 5.772 1.857 -0.396) 6.076 3.278 ( -1.142 -0.830 0.728) 1.588 3.312 ( -0.951 -2.193 -1.511) 2.828 3.406 ( -10.298 0.589 4.491) 11.251 3.544 ( -3.240 2.210 2.304) 4.549 3.596 ( 0.525 -0.385 0.342) 0.736 3.689 ( -0.055 1.998 -5.029) 5.411 3.781 ( -5.529 1.199 3.397) 6.599 3.999 ( 18.310 0.496 -5.178) 19.035 4.102 ( -0.372 -0.210 5.485) 5.502 4.239 ( -0.862 1.049 3.604) 3.851 4.369 ( 2.205 2.144 2.326) 3.857 4.428 ( 7.476 -2.328 2.616) 8.256 4.500 ( -4.014 1.804 -6.820) 8.117 4.698 ( 7.456 7.980 -3.734) 11.542 4.814 ( -3.806 1.883 -4.150) 5.937 4.927 ( -3.689 -0.298 3.242) 4.920 5.066 ( -4.991 -0.762 1.104) 5.168 5.192 ( -13.042 2.702 0.409) 13.326 5.231 ( 1.973 0.618 -2.290) 3.085 5.273 ( -8.014 1.430 3.722) 8.951 5.447 ( 3.343 0.023 -5.261) 6.233 5.541 ( -6.416 -1.390 4.230) 7.809 5.649 ( -8.537 0.185 3.309) 9.158 5.748 ( 3.258 -0.072 1.950) 3.798 5.998 ( -3.439 -0.971 -6.337) 7.275 6.035 ( -2.761 -4.721 4.841) 7.304 6.130 ( 0.884 -7.846 -4.607) 9.142 6.281 ( -3.759 -1.764 4.279) 5.962 6.351 ( -0.606 -4.691 -1.547) 4.977 6.589 ( 7.011 -0.956 -2.550) 7.522 6.620 ( -0.431 -1.499 2.168) 2.671 7.074 ( 4.266 1.409 -2.488) 5.136 7.166 ( -0.462 0.433 -0.794) 1.015 7.260 ( 4.721 1.527 4.215) 6.511 7.407 ( 1.750 -1.100 -2.039) 2.904 7.693 ( 4.191 3.029 -1.545) 5.397 7.836 ( -6.301 0.949 -0.517) 6.393 8.038 ( -0.945 1.701 2.249) 2.974 8.288 ( 2.492 -1.793 -2.430) 3.916 8.400 ( -5.115 4.732 1.109) 7.056 8.476 ( -0.306 5.813 -3.148) 6.617 8.543 ( -0.221 0.003 1.049) 1.072 8.602 ( -3.036 -0.065 2.494) 3.929 9.019 ( 4.269 1.260 -3.824) 5.868 9.067 ( -6.753 0.862 3.440) 7.628 9.522 ( 4.055 3.204 -1.393) 5.352 9.683 ( -11.816 4.340 3.148) 12.975 9.926 ( -1.401 3.345 8.411) 9.159 10.121 ( 12.960 0.818 -9.714) 16.217 10.307 ( -0.616 3.047 4.402) 5.389 10.401 ( 3.852 0.143 -5.854) 7.009 10.645 ( 3.402 0.549 0.718) 3.520 10.737 ( 1.234 -0.875 -0.037) 1.513 11.109 ( 3.044 3.856 1.670) 5.188 11.215 ( 0.207 1.950 1.077) 2.238 11.503 ( 8.655 -3.705 -0.422) 9.424 11.598 ( 1.207 -1.767 -1.313) 2.511 11.680 ( -0.447 -1.996 0.203) 2.055 11.755 ( -0.189 -2.892 0.483) 2.938 12.046 ( 2.365 0.918 0.138) 2.541 12.121 ( -1.925 -0.309 -0.005) 1.950 12.708 ( -1.907 -2.247 0.997) 3.111 12.777 ( -1.854 -3.706 -0.918) 4.244 13.351 ( 6.623 12.732 1.172) 14.400 13.531 ( 6.587 11.603 0.569) 13.354 13.559 ( -4.771 2.359 -1.122) 5.439 13.698 ( -2.311 5.448 -0.818) 5.974 15.725 ( -5.118 -1.594 1.564) 5.584 15.854 ( -11.249 -1.400 -1.081) 11.387 17.665 ( 8.263 8.103 -0.197) 11.574 17.781 ( 1.438 2.334 0.194) 2.748 18.271 ( 13.307 4.794 0.075) 14.144 18.531 ( -3.438 -0.498 1.340) 3.724 18.631 ( -4.518 -4.139 -0.747) 6.173 18.761 ( -9.718 -10.563 -0.496) 14.362 19.615 ( -2.825 13.888 2.563) 14.402 19.730 ( -2.357 9.700 -3.204) 10.484 20.198 ( 0.155 14.255 10.067) 17.452 20.552 ( 6.040 11.518 -13.809) 18.969 21.095 ( 0.814 -10.666 8.922) 13.930 21.309 ( 9.198 -6.388 -10.409) 15.290 21.931 ( 2.010 -0.499 8.539) 8.787 22.065 ( 0.035 -0.956 4.719) 4.815 22.201 ( 0.311 -4.594 -3.614) 5.854 22.302 ( -2.144 4.370 -4.199) 6.428 22.526 ( 1.230 -6.194 3.382) 7.163 22.628 ( -1.420 -7.670 -0.749) 7.836 22.740 ( -3.911 -1.557 -0.540) 4.244 22.805 ( -4.873 -5.513 -1.139) 7.446 ======================= Grid point 180 (77/102) ======================= q-point: ( 0.55 0.36 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.553 ( -6.600 -0.258 11.926) 13.633 1.755 ( 1.627 -1.437 -2.002) 2.953 1.828 ( 8.050 -5.680 -4.211) 10.715 1.978 ( 8.655 1.999 -10.448) 13.714 2.239 ( 2.993 -0.647 5.244) 6.073 2.331 ( 3.460 -1.385 -2.359) 4.411 2.542 ( 7.724 -4.205 -1.545) 8.930 2.628 ( -6.393 -5.231 1.026) 8.324 2.771 ( -7.372 -6.733 4.490) 10.947 2.855 ( 1.169 -4.764 -4.580) 6.711 3.047 ( 8.438 -3.830 -2.296) 9.547 3.103 ( -10.017 0.491 6.007) 11.691 3.152 ( 0.087 -0.360 2.191) 2.223 3.300 ( -1.516 0.464 -2.259) 2.759 3.325 ( 4.077 -3.184 -0.562) 5.204 3.396 ( 0.012 -1.521 0.260) 1.543 3.514 ( 1.289 0.235 -0.890) 1.584 3.590 ( -2.671 0.473 -2.470) 3.669 3.663 ( -0.280 -0.992 2.388) 2.601 3.743 ( -1.764 -0.421 -0.832) 1.995 4.007 ( 3.220 4.439 2.257) 5.930 4.140 ( 7.876 2.829 -2.347) 8.692 4.198 ( -8.911 -0.526 8.489) 12.319 4.313 ( 2.679 5.776 -3.214) 7.133 4.430 ( 1.129 0.919 -5.351) 5.545 4.497 ( -3.815 7.129 -1.178) 8.171 4.620 ( 13.725 1.940 -1.078) 13.903 4.730 ( -8.427 3.844 2.414) 9.572 4.959 ( 10.639 -0.889 -3.298) 11.174 5.023 ( -5.120 1.314 -1.339) 5.453 5.087 ( -2.139 -0.388 4.000) 4.553 5.199 ( -3.063 1.892 7.955) 8.732 5.275 ( -10.606 -6.594 -3.432) 12.951 5.408 ( 1.170 2.129 -6.835) 7.254 5.581 ( -2.176 -2.398 5.024) 5.978 5.618 ( -5.349 -3.700 3.155) 7.229 5.825 ( 8.082 -3.049 -1.824) 8.829 5.986 ( -3.238 -2.721 -6.043) 7.376 6.150 ( -1.086 -6.721 5.850) 8.976 6.262 ( -1.511 -5.342 -1.210) 5.681 6.326 ( -2.978 -6.980 3.993) 8.576 6.427 ( 0.925 -3.927 -3.445) 5.305 6.624 ( 3.031 0.343 0.183) 3.055 6.668 ( 1.297 -2.205 -1.320) 2.878 7.065 ( 3.010 2.145 -1.359) 3.938 7.126 ( -2.394 2.717 -2.409) 4.349 7.265 ( 4.853 2.589 5.134) 7.524 7.413 ( -1.836 -0.101 -1.664) 2.480 7.619 ( -0.594 7.160 3.467) 7.978 7.740 ( -1.377 6.542 -4.449) 8.030 8.010 ( 2.487 3.303 2.387) 4.774 8.216 ( -6.287 7.382 -5.650) 11.222 8.332 ( 2.137 9.209 0.560) 9.471 8.349 ( 0.360 0.210 -0.750) 0.858 8.563 ( 0.562 -2.034 2.166) 3.024 8.597 ( -4.470 -2.592 2.357) 5.679 9.007 ( -3.927 1.701 2.767) 5.096 9.046 ( 4.696 -1.335 -4.479) 6.625 9.420 ( 1.392 9.624 1.969) 9.921 9.528 ( -4.677 6.644 -2.502) 8.501 9.889 ( 0.214 1.697 10.625) 10.762 10.143 ( 4.937 2.814 -8.902) 10.561 10.291 ( 1.396 -0.828 3.344) 3.717 10.398 ( 0.545 0.103 -3.748) 3.789 10.688 ( 2.493 -1.654 1.140) 3.202 10.750 ( 0.877 -0.487 -1.284) 1.629 11.064 ( 1.880 3.378 1.551) 4.166 11.149 ( -2.774 3.445 -0.657) 4.472 11.566 ( 2.815 1.332 -0.328) 3.132 11.635 ( -0.897 0.857 -1.014) 1.602 11.723 ( 5.929 -3.163 2.462) 7.157 11.840 ( 0.046 -4.086 -1.081) 4.227 12.048 ( 3.367 1.101 -0.436) 3.569 12.095 ( -4.345 0.711 0.759) 4.468 12.772 ( 0.253 -4.937 1.813) 5.266 12.849 ( -1.522 -5.768 -1.667) 6.194 13.119 ( 4.608 17.945 2.452) 18.689 13.225 ( 1.932 20.856 -2.617) 21.108 13.509 ( -1.867 4.271 1.612) 4.932 13.573 ( -1.926 4.954 -1.947) 5.661 15.744 ( -1.707 -2.785 1.698) 3.682 15.823 ( -5.601 -2.196 -1.429) 6.183 17.600 ( 8.124 5.341 -0.047) 9.723 17.703 ( -5.105 3.883 -0.067) 6.414 18.279 ( 9.089 5.590 2.195) 10.894 18.444 ( -4.067 5.099 -3.019) 7.187 18.694 ( 2.785 -2.951 3.508) 5.364 18.895 ( -9.080 -10.394 -3.423) 14.220 19.396 ( -1.822 7.301 2.950) 8.083 19.503 ( -1.902 10.815 -4.840) 12.000 19.936 ( 2.723 17.907 12.087) 21.776 20.273 ( 2.301 19.240 -10.613) 22.093 21.320 ( -1.020 -11.647 6.674) 13.462 21.478 ( 6.741 -7.388 -8.454) 13.096 21.941 ( 1.427 2.571 5.162) 5.941 22.111 ( -1.202 2.190 -2.838) 3.781 22.142 ( -2.037 0.332 6.368) 6.694 22.342 ( 2.572 -4.757 -9.829) 11.218 22.650 ( -1.252 -5.894 6.444) 8.822 22.756 ( -4.254 -8.301 2.795) 9.737 22.788 ( 2.195 -6.007 -1.854) 6.659 22.893 ( -3.339 -7.465 -2.850) 8.660 ======================= Grid point 181 (78/102) ======================= q-point: (-0.36 -0.64 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.548 ( -3.612 -2.860 7.579) 8.870 1.765 ( 3.643 0.874 -7.539) 8.419 1.940 ( -3.998 -7.019 1.960) 8.312 2.092 ( 5.808 -6.073 -6.674) 10.731 2.302 ( 0.638 -2.810 2.545) 3.844 2.358 ( 4.068 -1.568 -2.043) 4.815 2.626 ( -10.679 -5.543 2.922) 12.382 2.713 ( 7.200 -1.919 -3.198) 8.108 2.824 ( -1.791 -1.446 2.446) 3.359 2.918 ( 4.474 -0.901 0.226) 4.569 2.986 ( -11.584 1.381 7.818) 14.044 3.126 ( -4.484 -4.352 4.188) 7.523 3.225 ( 1.328 -5.695 -1.931) 6.158 3.277 ( 3.179 2.686 -5.947) 7.259 3.397 ( 5.178 -0.060 -1.130) 5.301 3.422 ( 1.004 -0.935 -1.446) 1.993 3.537 ( 3.017 -0.705 -2.034) 3.707 3.562 ( 2.188 0.591 -3.996) 4.594 3.713 ( -5.178 -5.006 4.552) 8.520 3.774 ( 1.438 -2.808 0.438) 3.185 3.968 ( -0.107 2.330 2.428) 3.367 4.056 ( -4.856 8.046 3.063) 9.884 4.147 ( -2.794 4.877 -4.751) 7.360 4.179 ( 7.443 8.008 -0.639) 10.952 4.378 ( -2.737 -0.093 1.083) 2.945 4.444 ( 4.146 -0.956 -3.969) 5.819 4.608 ( -10.387 1.586 3.234) 10.994 4.667 ( 9.571 2.290 -0.995) 9.891 4.945 ( -4.797 -0.320 3.063) 5.701 5.041 ( 1.564 -1.696 -3.714) 4.372 5.121 ( -4.946 1.979 7.569) 9.256 5.242 ( 12.334 -2.971 -1.811) 12.816 5.301 ( -9.110 -5.635 -1.651) 10.838 5.406 ( 5.719 -1.504 -8.082) 10.015 5.606 ( -2.699 -3.004 8.002) 8.963 5.704 ( -3.595 -6.825 3.358) 8.413 5.944 ( 6.715 -3.937 -3.043) 8.358 6.015 ( -3.581 -4.211 -5.704) 7.943 6.233 ( -0.168 -1.748 5.861) 6.119 6.314 ( -0.242 -2.505 0.551) 2.576 6.461 ( -0.672 -6.979 0.231) 7.015 6.502 ( 0.963 -3.977 -1.836) 4.485 6.612 ( 0.798 2.630 2.967) 4.044 6.705 ( 1.058 -1.302 -5.060) 5.331 7.028 ( -3.828 4.483 -0.753) 5.943 7.041 ( 2.726 2.677 -1.516) 4.110 7.271 ( 3.391 1.952 6.098) 7.245 7.384 ( -3.438 0.489 -3.746) 5.108 7.437 ( -3.349 12.362 6.470) 14.349 7.572 ( 3.193 11.129 -4.747) 12.513 7.959 ( 3.486 4.745 0.774) 5.939 8.016 ( -5.701 7.485 -3.943) 10.202 8.203 ( 3.076 7.473 3.133) 8.667 8.307 ( 1.059 3.270 -6.682) 7.514 8.598 ( -2.329 0.051 3.639) 4.321 8.648 ( -0.058 -3.797 0.963) 3.918 8.960 ( -6.111 0.104 6.109) 8.641 9.119 ( 6.502 -2.697 -6.650) 9.684 9.280 ( 1.375 6.164 4.115) 7.538 9.366 ( -1.706 6.888 -3.097) 7.742 9.905 ( 1.108 0.297 7.886) 7.968 10.077 ( -1.208 3.558 -6.144) 7.202 10.329 ( -1.205 -0.995 2.874) 3.271 10.419 ( 3.799 -2.543 -4.972) 6.755 10.707 ( -4.868 -1.419 3.533) 6.180 10.786 ( 3.427 -1.501 -3.454) 5.092 11.029 ( -0.075 1.812 1.973) 2.680 11.074 ( -1.145 2.185 -1.666) 2.976 11.513 ( 0.740 6.225 2.629) 6.797 11.578 ( -0.045 4.104 -2.891) 5.020 11.802 ( 2.275 0.388 2.931) 3.730 11.860 ( -2.425 0.490 -2.047) 3.211 12.033 ( -3.988 1.637 1.119) 4.453 12.056 ( 3.937 2.006 -0.830) 4.496 12.812 ( -0.493 15.018 1.770) 15.130 12.849 ( 0.263 12.107 -1.289) 12.178 12.898 ( 0.820 -1.740 2.577) 3.215 12.966 ( -0.865 -4.919 -2.942) 5.796 13.413 ( 0.097 5.462 2.556) 6.031 13.480 ( 0.066 4.530 -3.011) 5.439 15.796 ( 0.430 -2.975 1.723) 3.465 15.835 ( -0.271 -1.742 -1.535) 2.338 17.594 ( 1.950 1.660 0.378) 2.589 17.604 ( -1.972 1.494 -0.459) 2.516 18.203 ( -3.839 5.397 4.214) 7.850 18.318 ( 4.810 6.943 -5.758) 10.222 18.738 ( -0.955 1.517 8.685) 8.868 18.955 ( -0.248 -0.964 -10.699) 10.745 19.346 ( -3.715 -2.263 2.690) 5.114 19.388 ( 2.534 -0.454 -1.454) 2.957 19.669 ( 2.111 16.301 10.739) 19.634 19.896 ( -0.523 20.154 -8.620) 21.927 21.502 ( -3.118 -8.452 4.422) 10.036 21.606 ( 3.641 -3.006 -3.494) 5.874 21.903 ( -2.083 1.047 1.037) 2.552 21.999 ( 3.508 5.934 -5.546) 8.847 22.198 ( -3.742 -3.490 8.860) 10.232 22.388 ( 1.595 -0.812 -7.783) 7.986 22.752 ( -0.649 -5.213 5.234) 7.416 22.869 ( 1.485 -4.655 -2.127) 5.329 22.940 ( -0.334 -8.752 1.861) 8.954 23.011 ( -0.520 -8.358 -2.005) 8.610 ======================= Grid point 182 (79/102) ======================= q-point: (-0.27 -0.64 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.634 ( 1.654 -5.246 0.968) 5.585 1.775 ( 5.531 -0.824 -9.462) 10.991 2.017 ( -8.854 -4.401 3.180) 10.386 2.169 ( 1.829 -1.015 2.053) 2.931 2.334 ( -3.954 -4.080 0.930) 5.758 2.458 ( 2.347 -1.475 2.924) 4.029 2.598 ( -5.341 5.834 1.896) 8.134 2.722 ( -4.202 -3.465 -2.317) 5.919 2.773 ( -3.105 1.275 1.391) 3.633 2.966 ( -2.864 -3.110 6.254) 7.549 3.032 ( 11.551 -1.213 -4.020) 12.291 3.182 ( -6.906 -4.662 5.789) 10.146 3.239 ( 3.483 0.307 -7.506) 8.280 3.320 ( -1.786 -5.322 -1.690) 5.862 3.393 ( -2.309 1.919 -2.022) 3.620 3.444 ( 6.054 -0.807 -1.713) 6.343 3.566 ( 7.829 3.255 -1.686) 8.645 3.573 ( 1.093 -0.874 -1.167) 1.822 3.722 ( -3.840 1.545 0.781) 4.212 3.796 ( -0.505 10.242 0.343) 10.260 3.903 ( 0.550 -5.834 5.425) 7.985 3.910 ( -7.437 1.529 1.347) 7.711 4.042 ( 7.716 4.727 0.759) 9.081 4.208 ( 9.248 1.379 -8.853) 12.876 4.393 ( -7.065 -4.562 3.434) 9.084 4.507 ( -2.496 -2.761 1.238) 3.923 4.545 ( -2.106 -2.276 -0.432) 3.131 4.689 ( 6.015 1.219 -1.461) 6.309 4.943 ( -7.463 -2.180 5.233) 9.373 5.050 ( -4.684 -1.811 2.663) 5.685 5.120 ( 2.968 -1.934 2.184) 4.161 5.267 ( -0.011 0.047 -7.439) 7.439 5.338 ( 2.085 -0.010 -0.781) 2.226 5.508 ( 9.159 -2.909 -6.593) 11.654 5.698 ( -0.870 -5.253 8.939) 10.404 5.801 ( -3.736 -6.561 1.757) 7.752 6.027 ( -3.609 -3.317 -0.389) 4.917 6.051 ( 1.563 -2.286 -3.002) 4.084 6.248 ( -3.217 0.337 1.880) 3.741 6.366 ( 6.462 -1.722 -2.055) 6.996 6.524 ( -0.566 1.061 0.027) 1.203 6.534 ( 0.871 -0.360 0.468) 1.053 6.608 ( 1.827 -0.744 4.170) 4.613 6.663 ( -0.434 6.065 -6.814) 9.132 6.915 ( -2.712 4.625 3.264) 6.277 7.025 ( 3.577 2.389 -3.619) 5.621 7.147 ( -9.134 9.575 6.635) 14.803 7.283 ( 3.523 4.948 4.157) 7.361 7.345 ( -1.785 2.338 -5.435) 6.180 7.395 ( 5.325 9.563 -1.651) 11.069 7.876 ( -2.347 2.843 -1.743) 4.078 7.935 ( 3.446 0.869 0.206) 3.560 8.122 ( 2.943 5.007 3.158) 6.611 8.259 ( 3.488 1.743 -9.341) 10.122 8.535 ( -1.944 5.567 5.128) 7.814 8.688 ( 3.965 0.482 -3.713) 5.453 8.944 ( -9.003 -2.737 8.192) 12.476 9.155 ( 0.260 -0.291 -2.337) 2.369 9.232 ( -4.647 0.629 1.999) 5.098 9.340 ( 7.075 -2.952 -1.005) 7.732 9.891 ( -1.939 3.150 4.678) 5.964 9.985 ( -0.716 4.205 -6.580) 7.842 10.324 ( -5.469 -1.030 3.083) 6.362 10.512 ( 7.285 -3.781 -4.890) 9.554 10.711 ( -3.068 -1.524 4.178) 5.403 10.808 ( -1.059 -0.679 -3.092) 3.338 10.994 ( -3.391 0.499 0.515) 3.466 11.074 ( 5.271 -0.027 -0.471) 5.292 11.384 ( -1.520 7.965 4.310) 9.183 11.474 ( -0.431 6.666 -3.771) 7.671 11.720 ( -7.314 5.865 1.651) 9.520 11.775 ( -3.125 6.371 -1.220) 7.200 11.996 ( 0.135 0.959 -0.230) 0.995 12.051 ( 4.099 1.501 0.311) 4.376 12.590 ( -2.465 7.780 0.397) 8.171 12.617 ( -0.967 9.184 -0.329) 9.241 13.016 ( 0.021 -5.783 2.524) 6.310 13.061 ( -0.115 -5.556 -2.153) 5.959 13.324 ( -0.756 5.069 2.432) 5.672 13.414 ( 3.750 2.844 -2.991) 5.576 15.856 ( 0.634 -2.759 -0.818) 2.947 15.864 ( 3.247 -0.261 0.986) 3.403 17.547 ( -6.900 -1.653 -0.092) 7.095 17.654 ( 7.651 -1.501 0.171) 7.799 18.093 ( -6.639 2.221 1.415) 7.143 18.252 ( 7.056 4.644 -3.217) 9.038 18.662 ( -7.909 4.579 7.211) 11.641 18.902 ( 4.654 4.873 -8.412) 10.778 19.340 ( -7.081 4.724 5.324) 10.040 19.452 ( -2.413 -1.407 -0.600) 2.857 19.526 ( 4.152 9.863 1.855) 10.861 19.586 ( 8.184 1.395 -3.728) 9.100 21.518 ( -11.690 2.245 1.458) 11.993 21.657 ( 4.436 -1.416 1.663) 4.944 21.913 ( 1.966 -0.631 -2.649) 3.359 21.954 ( 3.255 -0.533 -4.038) 5.214 22.239 ( -2.490 -1.398 7.724) 8.235 22.377 ( -0.006 0.477 -5.270) 5.291 22.848 ( 0.133 -4.502 3.039) 5.433 22.915 ( 0.462 -0.638 -2.032) 2.180 23.089 ( 0.401 -7.000 2.379) 7.404 23.160 ( 1.979 -7.500 -2.163) 8.052 ======================= Grid point 183 (80/102) ======================= q-point: (-0.18 -0.64 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.707 ( 2.212 0.568 3.169) 3.906 1.836 ( 6.833 -2.905 -11.961) 14.078 1.957 ( -6.740 4.454 1.969) 8.315 2.180 ( 1.740 2.997 1.485) 3.770 2.346 ( -5.941 7.068 11.659) 14.872 2.396 ( -2.999 3.633 -1.734) 5.020 2.460 ( -2.420 -0.939 0.039) 2.596 2.766 ( 1.844 -1.449 -2.342) 3.315 2.772 ( -2.989 -1.647 -2.411) 4.178 3.031 ( 3.796 -1.597 0.770) 4.190 3.088 ( 2.621 -0.333 0.561) 2.701 3.160 ( 1.083 2.979 0.790) 3.267 3.323 ( -0.387 -3.619 -1.014) 3.778 3.377 ( -4.049 -7.447 -2.036) 8.717 3.401 ( 0.119 -4.518 -0.984) 4.626 3.478 ( -0.202 10.113 3.583) 10.731 3.509 ( 0.861 -1.064 -1.377) 1.941 3.553 ( 7.175 4.767 -0.236) 8.617 3.647 ( 0.797 0.614 -0.024) 1.006 3.691 ( 1.942 2.107 -1.828) 3.399 3.905 ( -6.022 -4.661 1.523) 7.766 4.013 ( 5.264 4.117 -0.830) 6.734 4.079 ( 5.068 -7.474 5.388) 10.515 4.156 ( 2.198 6.198 -6.645) 9.349 4.435 ( -6.144 -2.937 -0.800) 6.856 4.475 ( -2.105 -0.326 0.257) 2.146 4.619 ( 3.181 0.733 1.159) 3.464 4.767 ( 1.614 -8.396 -2.441) 8.891 4.905 ( -7.699 0.360 3.354) 8.405 5.098 ( -4.541 -5.068 7.011) 9.770 5.158 ( 1.543 1.244 -1.424) 2.440 5.274 ( 1.130 -2.334 -6.303) 6.816 5.378 ( 7.226 -2.259 0.433) 7.583 5.602 ( 6.656 -2.840 -4.835) 8.703 5.747 ( -3.887 -0.065 5.603) 6.819 5.890 ( -1.278 -3.578 0.766) 3.876 6.019 ( -8.386 -2.000 -0.218) 8.624 6.067 ( 1.820 3.504 0.572) 3.990 6.188 ( -4.531 1.525 0.449) 4.802 6.457 ( 5.264 -1.849 -0.631) 5.614 6.463 ( 3.628 7.354 -1.006) 8.262 6.489 ( -2.716 3.633 0.442) 4.558 6.528 ( 2.690 4.047 -3.248) 5.845 6.672 ( 2.374 -2.786 3.770) 5.255 6.839 ( 0.151 4.957 1.112) 5.083 6.872 ( 2.132 9.283 -0.160) 9.526 7.094 ( -2.026 -1.902 -1.712) 3.264 7.217 ( 1.278 3.333 3.495) 4.995 7.262 ( 2.191 2.861 -3.645) 5.126 7.326 ( 3.065 4.345 0.762) 5.371 7.865 ( 1.177 -1.740 -1.546) 2.608 7.988 ( 3.930 -3.122 1.058) 5.129 8.071 ( 2.858 4.140 0.701) 5.079 8.241 ( 0.655 0.405 -6.524) 6.569 8.443 ( -1.242 3.464 5.245) 6.407 8.702 ( 6.087 0.102 -8.278) 10.276 8.951 ( -11.164 -4.241 8.135) 14.451 9.163 ( -2.090 -2.102 -2.473) 3.861 9.221 ( -4.996 -2.281 4.995) 7.424 9.450 ( 3.446 -3.483 2.328) 5.424 9.794 ( -5.017 4.907 2.536) 7.462 9.890 ( 1.134 4.503 -8.237) 9.456 10.300 ( -6.302 -0.452 1.964) 6.617 10.624 ( 7.925 -2.636 -2.786) 8.805 10.725 ( 1.229 0.591 5.100) 5.279 10.801 ( -0.168 -0.473 -3.899) 3.931 10.975 ( -3.003 -0.963 -0.375) 3.176 11.120 ( 5.945 0.289 0.479) 5.971 11.245 ( -2.100 6.526 4.725) 8.326 11.342 ( -1.979 4.525 -4.584) 6.739 11.547 ( -8.982 6.662 -0.325) 11.188 11.632 ( -3.868 4.529 0.748) 6.003 11.986 ( 0.585 0.121 -0.578) 0.831 12.069 ( 2.766 -0.344 0.606) 2.852 12.472 ( -2.274 4.284 0.299) 4.859 12.509 ( -1.024 2.760 -0.152) 2.948 13.069 ( -0.797 -0.440 -0.113) 0.918 13.142 ( 3.270 -0.036 -0.328) 3.287 13.258 ( -4.082 -1.503 2.057) 4.812 13.434 ( 4.602 -1.900 -1.704) 5.262 15.881 ( 2.054 0.158 0.886) 2.242 15.912 ( 2.369 -1.971 -0.749) 3.171 17.542 ( -5.817 -2.530 -0.141) 6.345 17.764 ( 8.303 -3.855 0.941) 9.202 18.037 ( -4.401 -0.096 -1.396) 4.618 18.224 ( 4.980 3.920 -1.803) 6.589 18.524 ( -9.865 3.754 5.543) 11.922 18.842 ( 5.308 3.456 -5.046) 8.098 19.172 ( -5.368 6.584 2.740) 8.926 19.326 ( 1.036 8.005 -0.674) 8.100 19.504 ( -4.608 -5.762 -0.393) 7.388 19.802 ( 13.427 -8.069 0.184) 15.666 21.342 ( -13.473 5.873 0.711) 14.714 21.688 ( 6.929 3.238 -0.051) 7.649 21.929 ( -0.227 -2.016 0.172) 2.036 22.022 ( 2.438 -3.261 -3.304) 5.244 22.232 ( -2.417 1.733 6.293) 6.961 22.371 ( 1.170 -0.864 -5.207) 5.406 22.892 ( -0.292 1.501 1.163) 1.921 22.933 ( -0.305 -3.053 0.643) 3.135 23.198 ( 0.267 -4.346 1.928) 4.762 23.282 ( 1.506 -4.995 -2.347) 5.721 ======================= Grid point 185 (81/102) ======================= q-point: (-0.09 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.638 ( -2.183 8.053 7.938) 11.516 1.772 ( 0.458 12.805 1.122) 12.863 1.907 ( 4.995 -0.636 -9.124) 10.421 2.030 ( 5.346 13.670 1.379) 14.743 2.256 ( 2.941 4.387 1.162) 5.408 2.337 ( 1.214 -3.267 -0.315) 3.499 2.532 ( -2.642 -3.433 -2.536) 5.020 2.738 ( -0.188 1.618 -1.948) 2.539 2.784 ( 2.655 0.981 0.220) 2.839 3.002 ( 4.498 9.779 -1.987) 10.946 3.065 ( -2.811 2.852 5.428) 6.745 3.171 ( 1.821 -0.969 2.526) 3.262 3.269 ( -3.981 7.634 1.107) 8.680 3.373 ( 1.824 -1.471 -1.825) 2.970 3.459 ( 0.467 -0.643 1.102) 1.358 3.485 ( -1.454 -4.734 0.807) 5.018 3.514 ( 0.349 -0.796 -1.504) 1.737 3.603 ( 8.984 0.473 -2.379) 9.306 3.637 ( -1.490 2.854 -4.613) 5.625 3.694 ( 4.008 -2.976 1.230) 5.142 3.935 ( -6.020 -3.190 2.297) 7.190 4.004 ( 0.186 -1.892 3.112) 3.647 4.077 ( -2.604 -0.314 -3.255) 4.180 4.222 ( 5.416 -1.568 1.555) 5.849 4.411 ( 0.406 0.096 -0.403) 0.580 4.465 ( -3.762 1.433 -2.054) 4.519 4.615 ( 2.011 0.867 0.224) 2.202 4.840 ( -5.802 -1.481 4.928) 7.755 4.919 ( 0.729 -3.583 -5.047) 6.232 5.125 ( -3.730 0.281 -0.536) 3.779 5.143 ( -5.776 -1.611 0.335) 6.006 5.314 ( 5.077 -1.138 -1.160) 5.331 5.523 ( 7.268 -5.266 3.685) 9.702 5.649 ( -3.944 0.930 -2.395) 4.707 5.716 ( -1.991 -0.503 1.966) 2.843 5.803 ( -3.572 7.217 0.379) 8.062 5.972 ( -2.429 4.939 -0.098) 5.505 6.077 ( 5.062 -3.462 -0.667) 6.169 6.176 ( -3.427 -4.609 1.149) 5.857 6.361 ( 1.207 2.659 2.808) 4.051 6.432 ( 3.592 4.072 0.956) 5.513 6.468 ( 4.406 4.567 -4.347) 7.692 6.525 ( -0.029 1.410 0.852) 1.648 6.655 ( 3.815 3.786 -1.906) 5.703 6.808 ( 1.089 -2.674 1.292) 3.163 6.863 ( 7.479 -1.167 -0.969) 7.632 7.108 ( -1.594 -0.944 0.755) 2.000 7.173 ( -1.269 0.920 -0.176) 1.577 7.282 ( 5.553 3.395 0.161) 6.511 7.316 ( 7.029 -3.534 -0.344) 7.875 7.932 ( 4.658 -3.783 -1.350) 6.151 8.003 ( -2.355 3.458 0.752) 4.251 8.094 ( 4.947 -4.538 -0.053) 6.713 8.234 ( -0.391 -0.766 -4.225) 4.311 8.421 ( -3.969 -1.438 4.977) 6.526 8.734 ( 4.771 -0.626 -8.721) 9.960 8.962 ( -11.310 -4.624 6.758) 13.963 9.184 ( -2.726 -2.303 -2.143) 4.163 9.249 ( -4.941 -3.818 4.598) 7.754 9.514 ( -0.660 -1.762 6.575) 6.839 9.672 ( -5.896 4.284 1.924) 7.538 9.827 ( 4.691 2.366 -10.460) 11.706 10.256 ( -4.893 0.750 1.476) 5.165 10.657 ( 5.161 4.738 1.080) 7.088 10.733 ( 2.868 1.149 1.029) 3.256 10.813 ( 2.431 0.190 -2.229) 3.303 10.980 ( -1.839 -1.009 -0.836) 2.258 11.128 ( 6.228 0.928 -0.181) 6.299 11.196 ( 0.482 0.145 2.471) 2.522 11.284 ( 0.358 1.386 -2.964) 3.292 11.376 ( -8.822 2.893 1.081) 9.347 11.582 ( -3.279 -1.196 0.101) 3.492 12.011 ( 0.527 -2.864 -0.718) 2.999 12.101 ( 1.067 -1.416 0.503) 1.843 12.401 ( -1.071 2.344 0.680) 2.665 12.473 ( 0.125 1.228 -0.305) 1.272 13.044 ( 1.199 2.985 1.015) 3.373 13.095 ( 1.322 4.539 -1.692) 5.021 13.334 ( -3.880 -7.510 1.336) 8.557 13.522 ( 1.984 -4.877 -0.708) 5.313 15.893 ( 1.572 0.303 1.865) 2.457 15.964 ( 2.138 -2.408 -1.792) 3.685 17.531 ( -5.812 -0.602 -0.355) 5.854 17.875 ( 2.667 -0.267 2.783) 3.864 18.033 ( 3.910 -1.209 -1.942) 4.530 18.150 ( 1.437 4.404 -3.535) 5.827 18.446 ( -7.868 -1.258 4.786) 9.295 18.874 ( 6.073 -3.914 -3.524) 8.038 19.061 ( -3.557 2.771 1.723) 4.827 19.265 ( 2.530 0.610 0.311) 2.621 19.574 ( -6.074 -6.766 -0.327) 9.098 20.025 ( 9.178 -6.565 0.056) 11.284 21.140 ( -9.921 6.316 0.080) 11.761 21.653 ( 7.944 6.545 -0.356) 10.299 21.976 ( -1.660 -3.496 0.485) 3.900 22.043 ( -0.591 2.110 -0.104) 2.194 22.203 ( -0.701 0.406 4.229) 4.306 22.395 ( 3.060 -1.195 -7.426) 8.120 22.848 ( -1.945 2.748 5.092) 6.104 22.975 ( -0.260 -1.635 -1.538) 2.260 23.257 ( -1.105 -2.102 1.897) 3.039 23.343 ( -0.998 -2.031 -2.378) 3.283 ======================= Grid point 192 (82/102) ======================= q-point: ( 0.45 0.45 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.534 ( 6.589 0.000 -0.798) 6.637 1.570 ( 2.873 0.000 -1.535) 3.257 1.977 ( 13.704 0.000 3.977) 14.269 2.105 ( 2.714 0.000 3.302) 4.274 2.270 ( -4.320 -0.000 2.346) 4.916 2.349 ( 1.561 0.000 1.795) 2.379 2.351 ( -11.098 -0.000 -0.383) 11.105 2.482 ( 9.740 0.000 -8.801) 13.128 2.612 ( -5.413 -0.000 3.639) 6.522 2.671 ( 1.935 0.000 -7.142) 7.399 2.953 ( 12.839 0.000 -3.216) 13.235 3.072 ( -6.956 -0.000 1.435) 7.102 3.206 ( 1.135 0.000 2.869) 3.085 3.250 ( -0.757 -0.000 1.780) 1.934 3.288 ( -1.730 -0.000 -1.580) 2.343 3.348 ( -5.021 -0.000 0.020) 5.021 3.545 ( -4.059 -0.000 3.434) 5.317 3.600 ( 3.265 0.000 -4.406) 5.484 3.734 ( 6.193 0.000 -4.841) 7.861 3.750 ( -7.462 -0.000 4.567) 8.748 4.086 ( -6.338 -0.000 9.297) 11.252 4.137 ( 20.713 0.000 -7.068) 21.886 4.274 ( -2.790 -0.000 8.709) 9.146 4.393 ( 3.681 0.000 -1.884) 4.135 4.495 ( 12.699 0.000 1.707) 12.813 4.504 ( 0.731 0.000 -8.635) 8.666 4.719 ( -14.956 -0.000 0.897) 14.983 4.870 ( -8.745 -0.000 3.346) 9.363 4.874 ( 13.138 0.000 -5.303) 14.167 4.971 ( -8.586 -0.000 1.758) 8.764 5.149 ( -7.216 -0.000 -0.504) 7.234 5.161 ( -7.542 -0.000 -5.530) 9.352 5.341 ( 0.876 0.000 7.981) 8.029 5.481 ( 6.262 0.000 -5.704) 8.471 5.519 ( -4.968 -0.000 6.445) 8.137 5.604 ( -0.068 -0.000 -3.686) 3.687 5.739 ( -3.418 -0.000 7.473) 8.217 5.958 ( -0.866 -0.000 -7.701) 7.749 5.971 ( -4.526 -0.000 5.534) 7.149 6.069 ( 3.399 0.000 -6.287) 7.147 6.243 ( -6.664 -0.000 6.792) 9.515 6.309 ( 5.371 0.000 -5.265) 7.521 6.593 ( -3.941 -0.000 4.605) 6.061 6.628 ( 7.272 0.000 -3.917) 8.260 7.115 ( 3.918 0.000 -1.902) 4.356 7.161 ( -1.256 -0.000 -1.329) 1.829 7.309 ( 2.803 0.000 4.178) 5.031 7.404 ( 0.522 0.000 -1.854) 1.926 7.754 ( 5.586 0.000 -3.279) 6.477 7.787 ( -7.027 -0.000 1.602) 7.207 8.049 ( -0.159 -0.000 5.186) 5.188 8.275 ( -0.617 -0.000 -3.435) 3.490 8.410 ( -5.298 -0.000 0.200) 5.302 8.497 ( 0.672 0.000 -5.528) 5.569 8.584 ( 0.431 0.000 2.608) 2.644 8.590 ( 1.313 0.000 1.322) 1.863 9.026 ( -7.731 -0.000 5.409) 9.436 9.065 ( 5.799 0.000 -5.518) 8.005 9.582 ( 6.262 0.000 -2.184) 6.632 9.638 ( -10.693 -0.000 3.422) 11.227 9.963 ( -2.400 -0.000 10.182) 10.461 10.187 ( 8.507 0.000 -8.310) 11.892 10.353 ( -3.257 -0.000 2.752) 4.264 10.421 ( 5.603 0.000 -7.439) 9.314 10.656 ( -0.930 -0.000 4.827) 4.915 10.748 ( 2.853 0.000 -3.115) 4.224 11.169 ( 1.009 0.000 2.956) 3.123 11.237 ( 0.112 0.000 0.190) 0.221 11.546 ( 8.177 0.000 0.155) 8.179 11.568 ( 1.228 0.000 -2.003) 2.350 11.657 ( 0.618 0.000 0.760) 0.979 11.698 ( -5.190 -0.000 -0.236) 5.195 12.075 ( 1.908 0.000 0.645) 2.014 12.109 ( -0.721 -0.000 -0.646) 0.968 12.675 ( -1.563 -0.000 1.725) 2.328 12.729 ( -1.006 -0.000 -1.523) 1.826 13.507 ( -1.215 -0.000 2.775) 3.029 13.541 ( 4.045 0.000 -2.398) 4.702 13.668 ( -0.534 -0.000 2.209) 2.272 13.759 ( 0.505 0.000 -2.735) 2.781 15.682 ( -2.722 -0.000 2.153) 3.471 15.769 ( -6.588 -0.000 -1.720) 6.808 17.799 ( 3.891 0.000 0.088) 3.892 17.827 ( 2.181 0.000 -0.122) 2.185 18.407 ( 4.856 0.000 -1.130) 4.986 18.486 ( 6.596 0.000 3.272) 7.363 18.519 ( -8.254 -0.000 -1.595) 8.407 18.635 ( -6.013 -0.000 -0.206) 6.016 19.778 ( -1.002 -0.000 0.687) 1.214 19.791 ( -1.957 -0.000 -0.171) 1.964 20.334 ( -2.574 -0.000 9.702) 10.038 20.657 ( 4.517 0.000 -17.103) 17.689 21.015 ( -0.280 -0.000 10.652) 10.656 21.288 ( 7.944 0.000 -12.394) 14.721 21.936 ( -1.979 -0.000 12.831) 12.983 22.094 ( -3.262 -0.000 8.396) 9.008 22.109 ( 4.072 0.000 -4.434) 6.020 22.359 ( -3.382 -0.000 -7.189) 7.944 22.482 ( 1.737 0.000 2.557) 3.091 22.542 ( 3.644 0.000 -3.756) 5.234 22.702 ( -2.392 -0.000 0.054) 2.392 22.718 ( -4.236 -0.000 0.391) 4.254 ======================= Grid point 193 (83/102) ======================= q-point: (-0.45 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.520 ( -4.197 0.979 6.091) 7.461 1.694 ( 7.772 -7.117 -8.658) 13.639 1.881 ( -6.446 8.396 9.192) 14.019 2.114 ( 3.018 4.392 -8.282) 9.848 2.255 ( 2.045 -0.496 2.846) 3.540 2.316 ( 0.865 -1.567 -2.299) 2.914 2.408 ( -7.347 -4.867 5.268) 10.268 2.580 ( 6.347 -4.351 -5.879) 9.684 2.637 ( 2.846 -4.216 1.122) 5.209 2.738 ( 0.645 -7.074 -5.488) 8.976 3.006 ( -13.259 -1.008 3.120) 13.659 3.053 ( 6.742 -1.942 -0.425) 7.029 3.176 ( -4.119 2.497 5.981) 7.679 3.279 ( -0.686 -1.022 -1.016) 1.597 3.295 ( 3.464 -3.131 0.350) 4.682 3.347 ( -0.592 -2.443 -2.195) 3.337 3.536 ( 1.969 -0.105 0.391) 2.010 3.601 ( 2.920 2.142 -4.048) 5.432 3.675 ( -5.223 2.509 3.559) 6.800 3.765 ( 6.076 1.372 -3.304) 7.051 4.058 ( -6.438 -0.270 7.962) 10.243 4.207 ( -2.490 4.922 4.480) 7.106 4.251 ( 11.228 2.118 -4.212) 12.178 4.357 ( -7.053 3.311 -2.059) 8.059 4.466 ( 4.121 -0.147 -0.407) 4.144 4.551 ( 0.404 0.622 -5.377) 5.428 4.721 ( -1.778 1.595 0.739) 2.500 4.780 ( 4.134 4.292 -2.737) 6.558 4.878 ( -9.200 -4.625 7.768) 12.898 5.025 ( 5.975 -2.615 -4.217) 7.767 5.101 ( -0.473 1.137 0.189) 1.246 5.137 ( -1.303 -1.549 -4.330) 4.779 5.269 ( -4.597 5.887 9.434) 12.033 5.450 ( 2.760 2.055 -5.603) 6.575 5.560 ( 3.576 0.091 3.537) 5.031 5.572 ( -2.293 0.641 1.170) 2.652 5.803 ( 2.037 -4.450 1.213) 5.042 5.928 ( -1.299 -0.351 -5.935) 6.086 6.022 ( -1.903 -6.561 4.568) 8.218 6.133 ( 1.680 -5.936 -4.693) 7.751 6.238 ( -3.304 -2.448 6.584) 7.762 6.376 ( 5.170 -3.159 -5.575) 8.233 6.589 ( -4.517 -2.365 3.947) 6.448 6.671 ( 3.725 -0.369 -3.174) 4.908 7.119 ( 1.610 1.785 -0.714) 2.507 7.136 ( -1.542 1.048 -2.406) 3.044 7.327 ( 1.057 0.500 4.498) 4.647 7.394 ( -2.294 0.160 -1.522) 2.758 7.720 ( -2.032 3.132 1.903) 4.191 7.784 ( 2.901 1.117 -3.422) 4.623 8.071 ( 3.010 0.383 5.860) 6.599 8.243 ( -3.359 2.066 -9.142) 9.956 8.358 ( -2.381 0.999 5.192) 5.798 8.464 ( -0.308 3.177 -3.972) 5.096 8.569 ( 2.196 1.809 2.569) 3.834 8.585 ( -0.261 2.280 0.716) 2.404 8.992 ( -4.464 -0.660 2.795) 5.308 9.080 ( 5.576 1.714 -4.498) 7.367 9.541 ( -5.596 4.350 3.005) 7.698 9.608 ( 6.759 2.884 -3.296) 8.053 9.937 ( -4.006 2.381 12.103) 12.969 10.209 ( 3.994 2.129 -11.747) 12.589 10.298 ( -2.653 0.969 4.792) 5.563 10.422 ( 2.668 2.072 -5.595) 6.536 10.664 ( -3.132 -0.643 4.850) 5.809 10.755 ( 1.822 -0.175 -3.355) 3.822 11.146 ( 0.279 3.601 3.279) 4.878 11.200 ( -0.870 3.295 -1.360) 3.669 11.586 ( 3.925 -1.074 -0.365) 4.086 11.598 ( -3.986 -1.556 -1.125) 4.424 11.690 ( 2.667 -3.879 2.541) 5.349 11.737 ( -2.338 -5.384 -1.609) 6.087 12.084 ( -0.348 0.372 0.248) 0.567 12.090 ( 0.418 1.208 -0.159) 1.288 12.704 ( 0.514 -3.139 2.082) 3.802 12.752 ( -0.349 -3.386 -1.957) 3.926 13.419 ( -0.810 10.340 3.355) 10.901 13.500 ( 0.776 8.467 -3.450) 9.175 13.603 ( 0.608 5.841 2.395) 6.342 13.661 ( -0.683 7.448 -2.497) 7.885 15.697 ( 0.190 -1.759 2.673) 3.206 15.757 ( -0.263 -2.092 -2.346) 3.154 17.757 ( 1.508 5.728 0.172) 5.926 17.763 ( -1.472 6.051 -0.262) 6.233 18.416 ( -4.962 4.292 2.194) 6.918 18.472 ( 5.965 -0.395 -2.746) 6.578 18.602 ( -0.237 -6.627 3.343) 7.426 18.671 ( -0.954 -8.078 -2.653) 8.556 19.607 ( 0.231 13.471 3.241) 13.857 19.691 ( -0.433 10.807 -4.053) 11.550 20.239 ( -1.364 11.017 12.019) 16.361 20.550 ( 2.085 11.523 -14.801) 18.873 21.122 ( -2.306 -9.558 8.670) 13.108 21.365 ( 5.242 -6.146 -12.497) 14.881 21.974 ( -3.256 -1.358 12.811) 13.288 22.058 ( -3.597 0.029 5.895) 6.906 22.227 ( 4.972 -4.154 -4.979) 8.171 22.257 ( 0.814 2.728 -8.383) 8.853 22.540 ( -2.435 -5.341 4.907) 7.651 22.616 ( -0.760 -5.289 -0.314) 5.353 22.719 ( 1.598 -3.142 -0.230) 3.532 22.753 ( -0.415 -5.286 -2.003) 5.668 ======================= Grid point 194 (84/102) ======================= q-point: (-0.36 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.491 ( -7.658 -1.243 10.532) 13.081 1.714 ( -8.711 -0.535 4.549) 9.842 1.895 ( 7.259 -2.568 -12.070) 14.317 2.038 ( 2.104 -1.692 -8.265) 8.695 2.278 ( -0.768 -0.074 1.379) 1.580 2.342 ( 0.267 -1.284 -3.329) 3.578 2.449 ( -7.067 -5.016 3.749) 9.442 2.706 ( -4.754 -8.413 4.856) 10.814 2.741 ( 8.813 -1.525 -5.739) 10.627 2.885 ( 2.455 -7.499 -1.106) 7.968 2.935 ( -9.491 0.239 5.716) 11.082 3.070 ( -3.455 0.803 4.661) 5.857 3.151 ( -1.758 -2.086 1.498) 3.113 3.279 ( -3.468 -1.341 -1.145) 3.890 3.387 ( 0.662 -3.146 -0.958) 3.355 3.437 ( 11.555 -3.377 -3.907) 12.657 3.548 ( -0.451 3.067 -2.587) 4.037 3.571 ( -0.483 -1.976 2.373) 3.126 3.635 ( 1.944 -0.017 -1.041) 2.205 3.772 ( 4.260 1.112 -1.361) 4.608 4.018 ( -6.237 1.970 3.424) 7.383 4.127 ( -3.093 2.382 4.205) 5.738 4.160 ( -1.446 3.876 -0.244) 4.144 4.372 ( 2.758 -0.298 -2.474) 3.717 4.425 ( 4.305 10.701 -4.978) 12.563 4.487 ( 1.622 1.288 -0.172) 2.078 4.591 ( -8.257 5.278 -0.101) 9.801 4.756 ( -1.925 -1.513 0.520) 2.504 4.891 ( -4.154 2.468 1.732) 5.133 5.033 ( -2.049 1.360 -0.876) 2.611 5.124 ( -0.966 0.107 3.372) 3.509 5.207 ( 2.903 -1.501 -0.620) 3.326 5.253 ( 13.726 -5.701 2.589) 15.087 5.425 ( 4.065 1.491 -8.373) 9.426 5.569 ( -1.564 -0.789 2.742) 3.254 5.606 ( 0.532 -3.028 7.073) 7.712 5.865 ( -4.745 -4.104 -2.298) 6.681 5.963 ( 6.493 -2.128 -6.118) 9.172 6.164 ( 0.089 -7.173 5.520) 9.051 6.251 ( 0.582 -5.965 -0.102) 5.994 6.319 ( 0.281 -6.844 2.187) 7.191 6.450 ( 3.488 -2.637 -3.414) 5.548 6.632 ( -1.856 -4.067 -0.051) 4.470 6.663 ( -1.265 1.404 -1.275) 2.280 7.061 ( -4.196 2.815 -1.549) 5.285 7.107 ( 2.151 2.614 -0.274) 3.397 7.328 ( -0.366 1.087 5.537) 5.655 7.357 ( -3.477 0.755 -3.080) 4.706 7.632 ( 0.588 7.426 3.233) 8.121 7.728 ( 2.157 6.280 -4.475) 8.007 8.069 ( 1.868 4.131 3.892) 5.975 8.114 ( -2.211 6.921 -4.130) 8.357 8.347 ( 0.785 1.901 -1.158) 2.360 8.378 ( 3.384 6.603 -2.258) 7.756 8.551 ( -2.842 -1.083 2.505) 3.940 8.590 ( 1.198 -2.686 3.276) 4.402 8.967 ( -2.083 2.166 1.463) 3.342 9.099 ( 3.665 -1.841 -4.051) 5.765 9.415 ( -1.104 7.267 2.215) 7.677 9.539 ( 6.614 9.858 -3.009) 12.246 9.908 ( -4.652 -0.500 11.094) 12.041 10.116 ( -2.562 4.207 -8.073) 9.457 10.321 ( 0.108 -0.617 1.750) 1.859 10.398 ( 2.269 -0.573 -5.125) 5.635 10.639 ( -7.926 -0.918 3.472) 8.701 10.778 ( 1.330 -1.055 -1.994) 2.619 11.073 ( -2.740 3.728 1.536) 4.875 11.134 ( 2.423 3.596 -0.230) 4.342 11.585 ( -4.077 -0.403 -1.718) 4.443 11.608 ( 2.050 2.095 0.993) 3.095 11.785 ( -3.151 -4.256 -1.102) 5.409 11.793 ( -1.883 -2.819 1.425) 3.678 12.038 ( -2.318 1.615 0.230) 2.834 12.105 ( 3.256 0.244 0.111) 3.267 12.791 ( 0.481 -5.312 1.824) 5.637 12.832 ( 1.022 -5.491 -1.807) 5.870 13.117 ( -6.545 18.914 2.618) 20.185 13.220 ( -0.818 19.923 -2.401) 20.084 13.520 ( 1.939 4.445 1.667) 5.128 13.564 ( 2.220 4.962 -2.108) 5.831 15.747 ( 1.278 -2.713 1.597) 3.397 15.821 ( 6.194 -2.358 -1.448) 6.784 17.602 ( -8.214 5.310 -0.128) 9.782 17.702 ( 5.323 3.939 0.001) 6.622 18.263 ( -10.826 5.647 2.623) 12.489 18.471 ( 7.947 5.645 -4.281) 10.646 18.690 ( -6.546 -4.261 4.228) 8.881 18.883 ( 10.303 -9.484 -2.983) 14.318 19.408 ( 1.453 9.022 3.550) 9.804 19.476 ( 1.089 9.510 -4.217) 10.460 19.995 ( -2.361 16.821 11.871) 20.723 20.234 ( -0.574 19.477 -11.875) 22.819 21.309 ( -4.223 -10.893 6.001) 13.134 21.508 ( 2.514 -7.961 -9.261) 12.468 21.922 ( -6.742 3.425 5.804) 9.533 22.102 ( -4.583 -5.142 8.285) 10.774 22.137 ( 4.237 6.365 -5.263) 9.282 22.363 ( 4.832 -2.608 -8.707) 10.294 22.647 ( -1.939 -6.535 4.560) 8.202 22.744 ( 0.204 -9.802 5.269) 11.130 22.829 ( 3.860 -5.590 -3.727) 7.749 22.862 ( 1.504 -7.258 -1.503) 7.563 ======================= Grid point 195 (85/102) ======================= q-point: (-0.27 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.529 ( -3.163 -6.113 4.523) 8.236 1.726 ( -8.696 -5.918 2.798) 10.884 1.886 ( 0.604 -0.822 -9.548) 9.602 2.173 ( 6.714 -3.814 -2.047) 7.988 2.252 ( -7.682 -1.864 1.094) 7.980 2.369 ( -4.182 -4.297 0.059) 5.996 2.530 ( 0.717 -7.077 -3.866) 8.096 2.700 ( -5.637 4.377 1.689) 7.334 2.821 ( -10.121 -1.616 9.955) 14.288 2.882 ( 4.358 -1.729 -1.643) 4.967 3.022 ( -6.017 -6.660 5.875) 10.728 3.093 ( 9.477 -0.506 -3.232) 10.026 3.193 ( -1.493 -4.090 -1.769) 4.700 3.282 ( -1.265 -1.555 -0.112) 2.008 3.402 ( -3.570 1.488 -1.026) 4.002 3.475 ( 4.839 0.394 -5.907) 7.646 3.550 ( -0.126 -0.539 0.560) 0.787 3.657 ( 2.196 -6.245 2.705) 7.151 3.675 ( 9.154 0.787 -4.539) 10.247 3.793 ( -2.847 -2.794 2.444) 4.678 3.919 ( -4.287 4.689 -0.574) 6.379 4.007 ( -2.440 8.475 3.544) 9.505 4.183 ( 3.471 -3.537 -3.346) 5.980 4.237 ( 3.775 8.029 1.531) 9.003 4.404 ( 6.086 3.671 -1.842) 7.342 4.462 ( -6.676 -0.030 3.174) 7.392 4.480 ( -1.824 0.253 -2.649) 3.226 4.791 ( 6.203 1.375 -0.399) 6.366 4.816 ( -11.321 -2.006 4.006) 12.175 4.991 ( -4.945 -0.324 0.789) 5.018 5.133 ( 2.992 -0.408 2.361) 3.834 5.228 ( 1.642 -0.091 -4.175) 4.488 5.393 ( 5.290 1.217 -3.705) 6.572 5.508 ( 11.842 -4.781 -3.862) 13.342 5.613 ( -0.191 -4.752 6.060) 7.703 5.684 ( -2.055 -4.505 4.780) 6.883 5.900 ( -6.184 -4.793 -1.729) 8.012 6.036 ( 5.283 -2.244 -3.168) 6.556 6.249 ( 0.980 -0.880 3.539) 3.776 6.360 ( 4.305 -3.771 -1.474) 5.910 6.460 ( 0.881 -7.114 0.233) 7.172 6.502 ( -1.359 -1.759 -0.459) 2.270 6.610 ( -2.699 0.805 2.550) 3.800 6.698 ( 1.267 -2.369 -5.464) 6.089 6.964 ( -4.427 3.806 0.452) 5.855 7.068 ( 1.557 2.859 -0.055) 3.256 7.277 ( -5.345 4.372 6.136) 9.237 7.308 ( -3.776 2.746 -3.813) 6.028 7.473 ( 3.441 9.854 3.776) 11.099 7.605 ( 2.925 8.435 -4.299) 9.909 7.947 ( -0.600 6.917 -3.411) 7.736 8.017 ( 3.016 4.977 3.759) 6.928 8.268 ( 4.851 7.216 -0.746) 8.727 8.314 ( 3.131 2.745 -6.031) 7.328 8.573 ( -1.958 -0.824 2.953) 3.638 8.674 ( 0.135 -3.770 3.524) 5.162 8.905 ( -3.263 2.342 2.459) 4.710 9.150 ( -0.104 -1.239 -2.596) 2.879 9.288 ( 1.440 7.097 2.091) 7.538 9.405 ( 6.144 6.386 -2.414) 9.185 9.904 ( -6.289 0.094 8.138) 10.285 10.014 ( -2.955 2.795 -8.198) 9.152 10.301 ( -2.353 1.078 1.863) 3.189 10.469 ( 4.376 -4.498 -4.198) 7.550 10.629 ( -6.171 -3.842 2.147) 7.580 10.784 ( -1.952 -0.245 -0.621) 2.063 10.994 ( -3.659 2.263 0.161) 4.305 11.123 ( 4.974 0.974 0.919) 5.151 11.499 ( -3.384 6.277 -0.366) 7.140 11.569 ( 0.162 3.482 -0.636) 3.543 11.750 ( -9.651 3.096 2.521) 10.444 11.788 ( -5.802 1.081 -1.307) 6.045 12.020 ( 2.223 0.444 -0.737) 2.384 12.116 ( 2.988 1.458 0.769) 3.413 12.749 ( -7.200 14.183 0.479) 15.913 12.837 ( -3.794 14.837 -0.154) 15.316 12.905 ( -0.248 -4.818 -0.201) 4.828 12.956 ( 1.038 -5.035 0.119) 5.142 13.446 ( 2.667 6.881 1.321) 7.497 13.504 ( 4.539 3.590 -1.876) 6.083 15.815 ( 2.964 -2.781 -0.525) 4.099 15.899 ( 7.074 -0.374 0.535) 7.104 17.485 ( -7.506 0.754 -0.068) 7.544 17.703 ( 6.277 0.757 0.076) 6.323 18.095 ( -10.183 4.040 1.518) 11.060 18.401 ( 7.089 6.745 -3.342) 10.340 18.664 ( -8.888 1.542 3.496) 9.674 19.017 ( 8.727 3.321 -3.330) 9.913 19.330 ( -0.135 1.776 2.964) 3.458 19.440 ( 3.701 -2.022 -0.521) 4.249 19.701 ( -1.563 12.402 4.347) 13.234 19.862 ( 0.851 18.812 -5.591) 19.644 21.423 ( -9.511 -4.459 2.563) 10.813 21.608 ( -1.762 -4.478 -1.135) 4.945 21.867 ( -1.104 -2.053 -2.043) 3.100 22.054 ( 4.425 5.693 -2.863) 7.758 22.179 ( -3.026 -4.442 7.753) 9.434 22.379 ( 1.027 0.647 -5.590) 5.721 22.755 ( -1.332 -5.972 4.051) 7.338 22.893 ( 2.875 -2.454 -3.607) 5.225 22.971 ( 3.649 -8.924 2.603) 9.986 23.030 ( 3.622 -8.576 -1.127) 9.377 ======================= Grid point 196 (86/102) ======================= q-point: (-0.18 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.657 ( 1.000 -7.399 -2.190) 7.781 1.784 ( -2.603 -5.518 -3.466) 7.017 1.919 ( -2.220 -3.032 -2.989) 4.802 2.156 ( -7.870 -0.286 7.106) 10.607 2.315 ( 1.681 -3.714 -2.005) 4.543 2.412 ( -7.177 -2.235 4.318) 8.669 2.531 ( -5.704 5.971 2.449) 8.613 2.670 ( 1.028 -3.799 -1.436) 4.189 2.780 ( 1.036 0.753 -1.890) 2.283 2.955 ( -1.916 -4.833 3.369) 6.195 3.085 ( -3.998 -3.500 4.806) 7.165 3.157 ( -1.224 -5.105 -4.204) 6.726 3.263 ( 9.404 1.063 -6.208) 11.319 3.322 ( 1.843 -3.042 -1.231) 3.764 3.340 ( -4.321 0.024 1.038) 4.444 3.502 ( 1.510 0.885 -0.790) 1.920 3.550 ( -1.902 -2.255 1.073) 3.139 3.675 ( 0.906 4.191 -0.066) 4.288 3.734 ( 7.427 3.797 -4.261) 9.367 3.757 ( -4.647 3.757 3.005) 6.688 3.830 ( 0.046 1.247 -0.174) 1.260 3.976 ( 3.762 -5.602 4.384) 8.047 4.160 ( 5.865 5.807 -0.732) 8.285 4.276 ( 3.211 -1.492 -6.199) 7.139 4.308 ( -6.508 2.867 2.304) 7.476 4.473 ( 3.330 -1.290 -0.879) 3.678 4.541 ( -1.062 -7.612 2.141) 7.978 4.751 ( -0.146 2.907 3.650) 4.668 4.825 ( -5.358 -2.248 -1.339) 5.963 5.000 ( -3.615 -3.355 4.012) 6.358 5.180 ( 2.352 0.138 -0.757) 2.475 5.233 ( 2.807 -2.282 -4.815) 6.023 5.415 ( 5.909 -0.244 -1.294) 6.054 5.604 ( 5.871 -1.427 -2.401) 6.502 5.706 ( -2.634 -2.409 3.969) 5.338 5.777 ( -0.847 -6.895 2.311) 7.321 5.919 ( -6.373 -2.146 0.024) 6.725 6.107 ( 4.318 -1.446 -0.079) 4.554 6.237 ( 2.146 3.983 -0.559) 4.559 6.424 ( -0.129 -1.984 -0.134) 1.993 6.489 ( -2.968 0.027 -0.195) 2.975 6.555 ( 0.956 -1.432 -0.908) 1.946 6.616 ( -3.143 -2.725 3.056) 5.162 6.671 ( 4.465 5.541 -5.942) 9.271 6.890 ( -2.482 2.059 3.296) 4.611 7.043 ( -4.627 2.860 3.620) 6.534 7.077 ( 1.425 8.697 -0.011) 8.813 7.236 ( -4.248 1.047 -4.281) 6.121 7.404 ( 5.404 5.101 0.962) 7.493 7.449 ( 1.787 8.989 0.449) 9.176 7.871 ( 3.780 1.722 -3.351) 5.337 7.992 ( 2.554 0.938 3.676) 4.574 8.205 ( 7.344 4.950 0.015) 8.856 8.269 ( 1.865 3.453 -6.591) 7.671 8.515 ( -3.871 4.887 0.947) 6.306 8.724 ( -2.080 -2.404 3.063) 4.414 8.858 ( -0.722 1.686 -0.173) 1.842 9.126 ( -2.364 0.296 -0.159) 2.388 9.207 ( -1.043 2.756 4.427) 5.318 9.430 ( 5.576 -2.123 -0.511) 5.989 9.828 ( -8.693 3.304 5.515) 10.812 9.931 ( -2.357 2.621 -8.625) 9.317 10.271 ( -2.783 0.578 1.170) 3.074 10.586 ( 4.969 -5.366 -3.430) 8.078 10.700 ( -0.818 -5.845 2.356) 6.355 10.772 ( -1.117 -0.269 -0.273) 1.181 10.945 ( -3.322 0.297 -0.118) 3.338 11.160 ( 5.112 -0.324 0.720) 5.172 11.354 ( -3.794 5.955 0.418) 7.073 11.449 ( -2.015 10.121 0.792) 10.350 11.573 ( -11.485 5.235 0.798) 12.647 11.687 ( -6.730 4.361 -1.740) 8.206 12.019 ( 2.471 1.822 -1.384) 3.368 12.106 ( 2.456 1.786 1.735) 3.498 12.540 ( -3.934 5.306 -0.552) 6.628 12.576 ( -4.369 8.429 0.436) 9.505 13.000 ( -1.122 -5.241 -1.092) 5.470 13.073 ( 0.207 -6.242 1.534) 6.431 13.332 ( 1.789 7.443 -0.194) 7.658 13.486 ( 5.885 2.604 -0.368) 6.446 15.879 ( 3.472 -1.867 -2.012) 4.426 15.935 ( 4.307 1.157 1.996) 4.886 17.461 ( -4.375 -2.430 -0.069) 5.005 17.769 ( 7.390 -2.390 0.535) 7.785 17.995 ( -6.591 0.278 -0.210) 6.601 18.337 ( 6.035 5.219 -2.697) 8.422 18.537 ( -10.411 4.770 3.657) 12.022 18.954 ( 3.548 6.174 -1.778) 7.339 19.264 ( -5.944 6.963 3.195) 9.697 19.375 ( -4.320 1.214 -2.204) 5.000 19.576 ( 3.094 13.023 -0.741) 13.406 19.771 ( 14.566 -7.070 0.058) 16.191 21.325 ( -14.390 3.480 0.865) 14.830 21.685 ( -1.161 -4.892 2.050) 5.430 21.942 ( 3.265 -3.779 -4.025) 6.414 21.990 ( 3.365 3.243 -2.479) 5.290 22.236 ( -2.505 -1.604 8.186) 8.710 22.356 ( 0.227 0.426 -5.259) 5.282 22.854 ( -1.234 -4.952 3.769) 6.344 22.917 ( 1.417 0.340 -2.941) 3.282 23.131 ( 3.829 -5.129 1.352) 6.542 23.193 ( 3.418 -6.589 -1.242) 7.526 ======================= Grid point 197 (87/102) ======================= q-point: (-0.09 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.733 ( -1.342 1.348 4.503) 4.888 1.859 ( -0.861 -4.209 -4.686) 6.358 1.901 ( 2.336 1.669 -7.986) 8.487 2.170 ( -5.607 -4.126 6.473) 9.506 2.335 ( -0.249 7.307 6.912) 10.061 2.361 ( -0.745 1.099 -0.964) 1.641 2.438 ( -0.310 -1.557 -2.759) 3.183 2.687 ( -2.767 -1.821 -2.191) 3.971 2.805 ( 0.836 -0.345 -0.162) 0.919 3.048 ( -0.426 -4.829 1.248) 5.006 3.114 ( -0.460 -0.772 3.344) 3.462 3.221 ( 2.922 5.273 -0.941) 6.102 3.293 ( -1.774 -10.248 -4.104) 11.181 3.341 ( 1.767 -1.535 -1.737) 2.914 3.412 ( 0.920 -2.090 -0.767) 2.409 3.440 ( -2.297 5.603 4.246) 7.396 3.516 ( -1.639 5.526 -0.085) 5.764 3.608 ( 1.112 -2.251 0.577) 2.576 3.691 ( 0.752 0.370 3.002) 3.117 3.780 ( 3.794 -0.834 -3.277) 5.082 3.834 ( 4.138 1.339 -1.481) 4.594 4.038 ( -2.726 3.993 -0.212) 4.839 4.120 ( 0.878 5.205 -1.882) 5.604 4.187 ( 1.700 -4.443 3.346) 5.815 4.379 ( -0.054 -4.334 -2.269) 4.893 4.491 ( 2.326 2.480 -3.571) 4.931 4.646 ( -0.422 -0.632 2.119) 2.251 4.752 ( -3.545 -3.978 6.830) 8.662 4.839 ( 1.613 -3.642 -6.063) 7.255 5.041 ( -4.001 -2.491 4.581) 6.573 5.142 ( -2.454 1.442 -3.269) 4.334 5.331 ( 6.080 -2.684 -0.730) 6.686 5.492 ( 7.448 -3.584 0.685) 8.294 5.649 ( 0.819 0.898 -0.829) 1.471 5.697 ( -4.254 -0.453 2.296) 4.855 5.865 ( -6.370 2.784 -0.080) 6.952 5.911 ( -0.907 -8.499 1.142) 8.624 6.097 ( 1.980 4.521 0.107) 4.936 6.169 ( 0.241 4.183 -0.934) 4.293 6.381 ( -5.113 2.537 0.477) 5.727 6.519 ( 2.246 0.039 0.412) 2.283 6.525 ( 1.206 0.099 -0.140) 1.219 6.602 ( 5.238 4.528 -4.125) 8.060 6.682 ( -2.180 -4.607 2.993) 5.910 6.834 ( -0.071 5.400 -0.170) 5.403 6.904 ( 0.334 2.557 1.914) 3.212 7.083 ( 1.798 -0.556 -1.857) 2.644 7.175 ( -4.164 1.607 -0.930) 4.560 7.342 ( 5.115 2.038 -0.122) 5.508 7.384 ( 3.556 3.405 1.134) 5.052 7.913 ( 7.177 -2.269 -3.607) 8.347 8.017 ( -1.670 -0.405 4.245) 4.580 8.149 ( 4.483 6.228 -3.634) 8.491 8.218 ( 1.531 0.636 -0.007) 1.658 8.410 ( -6.463 2.012 0.345) 6.778 8.756 ( 0.789 -1.391 -1.266) 2.039 8.828 ( -2.297 0.071 -1.017) 2.513 9.131 ( -1.079 -1.776 0.617) 2.168 9.188 ( -2.584 -0.805 4.737) 5.456 9.498 ( 2.074 -1.617 3.443) 4.332 9.705 ( -8.715 4.152 5.349) 11.036 9.862 ( 0.820 1.516 -10.132) 10.278 10.242 ( -2.225 0.681 0.228) 2.339 10.700 ( 2.860 -3.127 -0.041) 4.238 10.780 ( 2.102 -0.325 -2.111) 2.997 10.800 ( 3.105 -2.965 2.666) 5.053 10.935 ( -1.635 -1.543 -1.705) 2.822 11.200 ( 3.326 -0.403 0.509) 3.389 11.225 ( -2.598 6.942 3.605) 8.242 11.281 ( -3.869 2.007 -2.012) 4.801 11.415 ( -7.259 5.502 -0.996) 9.163 11.567 ( -3.961 2.895 0.046) 4.907 11.997 ( 0.974 1.058 -1.232) 1.894 12.102 ( 0.994 0.472 1.650) 1.984 12.439 ( -1.942 3.090 -0.390) 3.670 12.488 ( -1.563 1.079 0.243) 1.915 13.061 ( -0.232 -2.095 -0.393) 2.144 13.179 ( -0.970 -5.412 0.983) 5.586 13.216 ( 0.691 5.980 -0.878) 6.083 13.497 ( 3.830 0.088 0.290) 3.842 15.917 ( 2.548 0.219 -0.705) 2.653 15.946 ( 1.507 -0.422 0.675) 1.704 17.480 ( -2.434 -1.820 -0.087) 3.040 17.886 ( 6.004 -2.783 3.518) 7.495 17.983 ( -0.283 -3.360 -4.158) 5.353 18.245 ( -2.452 7.185 -2.632) 8.035 18.421 ( -4.793 1.232 4.548) 6.721 18.884 ( 2.073 2.456 -2.195) 3.892 19.115 ( -3.387 5.023 1.605) 6.268 19.306 ( -2.241 3.077 -0.448) 3.833 19.484 ( 1.045 0.400 -0.316) 1.162 19.992 ( 11.182 -5.541 0.069) 12.480 21.155 ( -10.925 3.965 0.338) 11.627 21.748 ( 0.873 -1.345 0.851) 1.815 21.941 ( 1.955 1.524 -0.894) 2.635 22.038 ( 1.316 -2.658 -2.347) 3.782 22.224 ( -1.975 1.710 5.388) 5.987 22.367 ( 1.174 -1.989 -4.634) 5.177 22.896 ( 0.495 2.314 -0.073) 2.367 22.925 ( -1.450 -3.301 2.334) 4.295 23.220 ( 1.868 -2.416 0.214) 3.061 23.297 ( 1.440 -3.030 -1.105) 3.532 ======================= Grid point 204 (88/102) ======================= q-point: (-0.45 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.578 ( 0.650 0.000 -4.805) 4.849 1.594 ( 1.917 0.000 -2.224) 2.936 1.956 ( -18.795 -0.000 2.837) 19.008 1.995 ( -16.639 -0.000 11.216) 20.066 2.292 ( 5.754 0.000 4.386) 7.235 2.296 ( 0.304 0.000 -1.736) 1.763 2.447 ( 9.690 0.000 -4.604) 10.728 2.554 ( 3.852 0.000 -11.466) 12.096 2.556 ( -4.362 -0.000 4.984) 6.624 2.708 ( 8.759 0.000 -5.567) 10.378 2.913 ( -8.929 -0.000 -1.171) 9.005 3.052 ( -3.378 -0.000 2.951) 4.485 3.194 ( -4.441 -0.000 7.163) 8.428 3.223 ( -6.493 -0.000 -1.710) 6.714 3.312 ( -0.574 -0.000 -2.079) 2.157 3.320 ( 9.122 0.000 2.561) 9.475 3.554 ( 4.528 0.000 -0.551) 4.561 3.663 ( 7.364 0.000 -4.641) 8.704 3.668 ( -3.469 -0.000 0.404) 3.493 3.829 ( 7.235 0.000 -2.151) 7.548 3.986 ( -13.619 -0.000 6.907) 15.271 4.294 ( 0.706 0.000 8.994) 9.022 4.306 ( 6.560 0.000 -9.795) 11.789 4.355 ( -16.069 -0.000 0.275) 16.072 4.399 ( -5.151 -0.000 1.511) 5.368 4.524 ( 3.505 0.000 -3.828) 5.190 4.733 ( -11.279 -0.000 3.585) 11.835 4.838 ( -1.262 -0.000 -6.565) 6.686 4.860 ( 16.048 0.000 3.175) 16.359 4.998 ( 4.683 0.000 0.305) 4.693 5.127 ( 5.642 0.000 -1.003) 5.730 5.150 ( 6.112 0.000 -0.939) 6.183 5.319 ( -5.205 -0.000 6.835) 8.591 5.469 ( -2.499 -0.000 -4.083) 4.787 5.568 ( 6.204 0.000 1.935) 6.499 5.669 ( 8.905 0.000 -6.885) 11.256 5.737 ( -1.644 -0.000 10.111) 10.244 5.913 ( 0.115 0.000 -5.908) 5.909 5.941 ( -2.869 -0.000 4.780) 5.575 6.088 ( 1.915 0.000 -4.439) 4.835 6.209 ( -0.568 -0.000 3.132) 3.183 6.380 ( 7.205 0.000 -5.439) 9.027 6.532 ( -6.711 -0.000 4.743) 8.218 6.676 ( 0.697 0.000 -2.665) 2.754 7.112 ( -4.308 -0.000 -2.079) 4.784 7.159 ( 2.664 0.000 -0.600) 2.731 7.327 ( -3.202 -0.000 4.567) 5.578 7.374 ( -3.089 -0.000 -1.811) 3.581 7.720 ( -1.752 -0.000 -0.631) 1.863 7.833 ( 6.539 0.000 -1.701) 6.757 8.117 ( 4.777 0.000 7.372) 8.784 8.217 ( -2.511 -0.000 -8.547) 8.908 8.358 ( -3.286 -0.000 5.016) 5.996 8.463 ( -3.372 -0.000 -1.454) 3.672 8.613 ( 3.703 0.000 -1.353) 3.942 8.627 ( 1.756 0.000 -0.078) 1.758 8.958 ( -3.477 -0.000 3.460) 4.905 9.135 ( 5.759 0.000 -3.814) 6.907 9.550 ( -1.913 -0.000 0.860) 2.097 9.688 ( 9.028 0.000 -1.098) 9.095 9.953 ( -5.481 -0.000 10.891) 12.192 10.216 ( -0.119 -0.000 -11.793) 11.794 10.278 ( -6.534 -0.000 4.680) 8.037 10.465 ( 3.912 0.000 -5.595) 6.827 10.652 ( -3.237 -0.000 5.435) 6.326 10.746 ( -0.893 -0.000 -3.334) 3.451 11.198 ( 0.919 0.000 3.777) 3.887 11.214 ( -2.349 -0.000 -0.895) 2.514 11.551 ( -6.475 -0.000 -0.261) 6.480 11.570 ( -4.119 -0.000 -1.990) 4.575 11.667 ( 0.557 0.000 -0.437) 0.708 11.676 ( 4.549 0.000 1.643) 4.837 12.090 ( -0.016 -0.000 0.950) 0.950 12.096 ( -0.710 -0.000 -1.102) 1.311 12.688 ( 2.048 0.000 1.940) 2.821 12.719 ( 0.792 0.000 -1.915) 2.072 13.488 ( -2.901 -0.000 2.045) 3.550 13.570 ( 1.517 0.000 -2.472) 2.900 13.683 ( 0.429 0.000 3.559) 3.585 13.732 ( -1.905 -0.000 -3.211) 3.734 15.712 ( 5.663 0.000 3.017) 6.417 15.738 ( 3.338 0.000 -2.554) 4.203 17.808 ( -4.604 -0.000 -0.625) 4.646 17.818 ( -1.581 -0.000 0.639) 1.705 18.394 ( -7.892 -0.000 -0.112) 7.893 18.474 ( 3.586 0.000 1.737) 3.985 18.568 ( -1.583 -0.000 -3.129) 3.507 18.613 ( 8.813 0.000 1.758) 8.986 19.781 ( 1.412 0.000 0.733) 1.591 19.788 ( 1.482 0.000 -0.259) 1.504 20.338 ( -3.126 -0.000 10.370) 10.830 20.629 ( 1.655 0.000 -15.954) 16.039 21.028 ( -4.099 -0.000 10.146) 10.943 21.319 ( 4.477 0.000 -15.688) 16.314 21.950 ( -3.641 -0.000 12.161) 12.695 22.105 ( -1.255 -0.000 12.318) 12.382 22.129 ( 0.521 0.000 -4.383) 4.414 22.286 ( -1.036 -0.000 -8.249) 8.314 22.483 ( -2.756 -0.000 1.949) 3.375 22.557 ( -0.171 -0.000 -3.785) 3.789 22.703 ( 2.712 0.000 0.048) 2.712 22.716 ( 3.820 0.000 0.479) 3.850 ======================= Grid point 205 (89/102) ======================= q-point: (-0.36 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.463 ( -6.844 3.375 3.482) 8.387 1.680 ( -13.333 2.321 3.650) 14.017 1.808 ( 2.394 -7.502 -8.254) 11.408 1.925 ( -20.771 -2.487 2.539) 21.073 2.304 ( -0.821 -1.441 -3.666) 4.024 2.360 ( 0.524 -2.393 5.668) 6.175 2.385 ( 5.979 7.277 -6.390) 11.381 2.541 ( -5.231 -4.717 3.356) 7.803 2.727 ( -1.335 -7.020 1.793) 7.367 2.778 ( 8.987 -3.822 -6.534) 11.750 2.874 ( -3.048 -0.914 -0.982) 3.330 3.039 ( -5.296 -2.690 1.863) 6.225 3.125 ( -5.915 1.575 3.241) 6.926 3.210 ( -5.252 -1.913 1.011) 5.680 3.328 ( -1.582 -2.666 -0.960) 3.245 3.431 ( 8.424 -3.523 3.722) 9.860 3.575 ( 2.515 1.946 0.260) 3.191 3.638 ( -0.005 3.585 -1.335) 3.826 3.668 ( 7.594 1.194 -4.014) 8.672 3.851 ( 5.094 2.608 -2.157) 6.115 3.923 ( -13.100 -3.189 1.756) 13.597 4.185 ( -2.167 4.438 1.915) 5.297 4.223 ( -2.979 5.508 2.788) 6.855 4.387 ( 3.951 -1.774 -2.022) 4.780 4.423 ( -9.219 -4.579 -0.022) 10.294 4.535 ( -2.463 -1.059 -0.181) 2.687 4.627 ( -5.484 4.562 -3.387) 7.897 4.752 ( 3.515 7.319 0.368) 8.127 4.947 ( 2.916 0.359 1.317) 3.219 5.091 ( -0.613 3.207 4.202) 5.321 5.123 ( 5.686 -1.877 -1.383) 6.146 5.235 ( 13.204 0.100 -3.447) 13.647 5.295 ( 7.482 -1.028 5.442) 9.309 5.445 ( -1.406 0.598 -5.441) 5.651 5.577 ( 3.959 1.597 -0.857) 4.355 5.665 ( 6.037 4.164 6.779) 9.987 5.773 ( -4.505 -1.442 -0.231) 4.735 5.953 ( 5.557 -3.330 -4.355) 7.806 6.031 ( 2.200 -8.535 3.306) 9.413 6.131 ( 0.031 -5.196 -2.215) 5.649 6.253 ( 2.661 -3.271 1.624) 4.518 6.438 ( 4.553 -1.389 -4.085) 6.273 6.527 ( -4.443 -3.908 2.270) 6.337 6.664 ( -3.030 0.282 -1.115) 3.241 7.059 ( -5.415 1.347 -1.676) 5.827 7.158 ( 1.368 1.597 0.333) 2.129 7.316 ( -5.036 -0.879 4.477) 6.796 7.340 ( -3.397 0.287 -2.299) 4.112 7.705 ( 1.501 1.463 -2.859) 3.545 7.847 ( 4.623 3.914 -0.375) 6.069 8.126 ( -0.586 2.683 -2.098) 3.456 8.203 ( 4.186 0.649 0.869) 4.324 8.344 ( -3.318 0.438 4.765) 5.823 8.428 ( -2.131 -0.463 -0.560) 2.251 8.597 ( 1.881 3.930 0.704) 4.413 8.614 ( 2.322 2.774 -0.436) 3.644 8.966 ( 0.137 -1.528 0.317) 1.566 9.129 ( 2.099 3.090 -1.323) 3.963 9.525 ( 3.950 3.567 -1.276) 5.472 9.736 ( 10.963 3.588 -1.290) 11.607 9.889 ( -9.328 2.886 10.354) 14.232 10.138 ( -5.831 2.905 -8.737) 10.898 10.283 ( -2.394 -2.952 2.381) 4.485 10.433 ( 1.558 3.555 -5.373) 6.629 10.603 ( -6.435 2.320 3.660) 7.758 10.753 ( -0.527 -1.670 -1.103) 2.069 11.124 ( -4.014 4.478 0.900) 6.080 11.213 ( 1.902 2.415 1.259) 3.322 11.496 ( -7.960 -2.705 -0.205) 8.409 11.603 ( -3.861 -4.870 -1.359) 6.362 11.689 ( -1.940 -1.819 -0.913) 2.812 11.739 ( 3.058 -2.205 1.871) 4.209 12.057 ( -0.896 1.832 -0.577) 2.119 12.113 ( 0.699 -1.030 0.482) 1.335 12.728 ( 1.416 -2.295 0.371) 2.722 12.761 ( 2.430 -3.600 -0.515) 4.374 13.351 ( -7.723 12.005 1.200) 14.325 13.525 ( -3.940 15.202 0.167) 15.705 13.574 ( 2.383 0.496 -1.120) 2.679 13.686 ( 3.039 4.707 -0.212) 5.607 15.750 ( 6.098 0.076 0.560) 6.124 15.830 ( 10.158 -3.228 -0.138) 10.659 17.664 ( -8.623 8.008 -0.118) 11.768 17.783 ( -0.973 2.313 0.087) 2.511 18.257 ( -12.997 4.664 0.817) 13.832 18.574 ( 5.829 -1.577 -0.519) 6.061 18.615 ( 0.534 -1.458 -0.372) 1.597 18.746 ( 10.995 -11.450 0.371) 15.878 19.649 ( 3.258 12.748 3.604) 13.642 19.688 ( 2.164 11.865 -3.647) 12.600 20.248 ( -4.547 10.248 10.726) 15.516 20.495 ( -0.757 12.411 -13.864) 18.623 21.100 ( -5.634 -9.009 7.914) 13.249 21.362 ( 2.075 -6.062 -14.204) 15.582 21.933 ( -8.767 1.968 11.095) 14.277 22.019 ( -4.480 0.186 4.692) 6.490 22.245 ( 3.031 3.159 -6.496) 7.833 22.317 ( 7.980 -7.728 -3.887) 11.769 22.508 ( -3.842 -7.200 5.326) 9.745 22.593 ( -1.749 -5.432 0.349) 5.718 22.769 ( 5.153 -3.733 -2.177) 6.725 22.786 ( 4.794 -3.798 0.313) 6.124 ======================= Grid point 206 (90/102) ======================= q-point: (-0.27 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.405 ( -9.696 -3.118 7.110) 12.421 1.551 ( -14.425 -2.255 1.977) 14.734 1.828 ( -14.843 -2.928 -2.199) 15.287 2.027 ( 4.513 -11.830 -7.259) 14.595 2.283 ( -1.007 3.527 -2.511) 4.445 2.304 ( -1.165 2.481 -4.635) 5.385 2.411 ( -1.610 -5.136 -0.221) 5.387 2.630 ( -7.328 -8.732 3.629) 11.963 2.735 ( -1.898 1.880 1.079) 2.881 2.884 ( -3.546 -2.929 1.550) 4.853 2.896 ( -5.180 -4.356 6.573) 9.435 3.098 ( -3.377 -1.822 -2.451) 4.553 3.132 ( 6.943 -6.351 -3.012) 9.879 3.217 ( -1.221 -1.768 1.223) 2.472 3.358 ( -4.714 -2.589 0.435) 5.396 3.506 ( -2.493 2.274 2.090) 3.969 3.558 ( -1.004 1.751 3.575) 4.106 3.601 ( 10.775 -3.016 -3.380) 11.688 3.711 ( -0.572 -1.369 -2.684) 3.066 3.804 ( 3.941 3.471 -2.361) 5.758 3.919 ( -0.736 -1.311 -1.163) 1.900 4.112 ( -4.132 4.716 2.659) 6.811 4.154 ( 0.339 0.656 1.347) 1.536 4.376 ( -5.260 1.873 1.282) 5.729 4.405 ( -1.823 1.655 -3.335) 4.146 4.477 ( -9.506 2.014 2.432) 10.016 4.559 ( 10.629 4.537 -3.537) 12.086 4.687 ( 1.067 0.792 1.014) 1.671 4.921 ( 0.975 2.573 2.089) 3.455 4.997 ( -0.679 4.735 2.387) 5.346 5.165 ( 4.940 0.527 0.394) 4.984 5.291 ( 7.927 3.455 -4.673) 9.830 5.409 ( -1.654 -0.678 -3.029) 3.517 5.488 ( 13.803 -6.827 0.958) 15.428 5.590 ( 3.410 0.259 -0.215) 3.427 5.657 ( 0.967 1.454 6.988) 7.203 5.782 ( -2.594 -3.837 -0.288) 4.640 6.027 ( 3.956 -2.136 -3.521) 5.711 6.211 ( 2.627 -6.284 2.982) 7.436 6.269 ( 2.946 -8.302 -1.584) 8.951 6.357 ( 4.024 -5.313 0.058) 6.665 6.465 ( -1.430 -1.394 -0.657) 2.102 6.598 ( -3.764 -2.180 0.445) 4.373 6.623 ( -0.419 -1.571 -2.128) 2.678 6.982 ( -5.392 2.226 -0.405) 5.848 7.130 ( 0.048 2.278 1.379) 2.663 7.270 ( -5.211 1.393 -2.713) 6.038 7.326 ( -3.479 -0.035 4.165) 5.427 7.662 ( 2.398 5.670 -0.822) 6.212 7.733 ( -0.557 8.633 -3.165) 9.212 8.060 ( 1.938 4.463 -3.793) 6.170 8.163 ( 2.481 7.260 7.243) 10.551 8.332 ( -2.070 -0.970 -3.237) 3.963 8.428 ( 5.030 5.096 -2.634) 7.629 8.539 ( -0.890 -0.610 3.228) 3.403 8.622 ( 1.467 -1.581 2.813) 3.544 8.955 ( -0.262 3.538 0.076) 3.549 9.112 ( -0.070 -1.576 0.389) 1.625 9.469 ( 7.984 7.608 -1.898) 11.191 9.632 ( 5.638 12.999 -1.940) 14.302 9.845 ( -8.539 -2.050 8.785) 12.422 10.018 ( -5.145 3.171 -9.145) 10.961 10.308 ( -3.546 -0.061 3.921) 5.287 10.413 ( 2.306 -2.753 -4.190) 5.519 10.533 ( -6.366 -0.552 0.652) 6.423 10.765 ( -1.705 -0.387 0.575) 1.840 11.016 ( -4.971 3.592 0.200) 6.136 11.180 ( 2.014 2.183 1.756) 3.450 11.507 ( -5.355 -2.322 -1.178) 5.955 11.619 ( -1.225 2.192 0.456) 2.552 11.673 ( -8.497 -1.823 -2.035) 8.926 11.777 ( -2.020 0.050 2.198) 2.986 12.040 ( 2.428 0.249 -0.944) 2.617 12.137 ( 0.997 -0.685 0.928) 1.525 12.791 ( -0.562 -4.009 -0.923) 4.152 12.858 ( 1.186 -4.515 0.874) 4.750 12.992 ( -10.032 18.039 1.026) 20.667 13.153 ( -7.291 19.442 -0.336) 20.767 13.581 ( 5.581 2.266 0.124) 6.025 13.608 ( 4.095 6.608 -0.854) 7.821 15.810 ( 6.531 -1.309 -0.603) 6.688 15.956 ( 11.053 -0.947 0.723) 11.117 17.469 ( -9.244 4.658 -0.006) 10.351 17.752 ( 1.307 0.879 -0.115) 1.579 18.075 ( -14.502 3.738 0.744) 14.994 18.565 ( 6.294 5.888 -2.366) 8.937 18.634 ( -1.570 -0.123 2.299) 2.787 19.065 ( 13.445 -8.593 -0.576) 15.966 19.469 ( 4.320 10.382 4.332) 12.050 19.495 ( 3.352 7.489 -2.955) 8.721 19.944 ( -9.288 17.786 3.282) 20.331 20.178 ( -1.092 17.377 -6.074) 18.440 21.241 ( -8.224 -8.999 4.466) 12.983 21.473 ( -2.389 -7.527 -7.707) 11.034 21.835 ( -6.476 1.341 3.211) 7.352 22.054 ( -5.722 -4.681 7.210) 10.327 22.196 ( 5.337 4.134 -4.342) 8.027 22.386 ( 1.715 0.084 -4.463) 4.782 22.649 ( 0.405 -5.973 2.053) 6.329 22.805 ( 5.227 -14.164 5.094) 15.934 22.863 ( 4.494 -3.070 -4.763) 7.232 22.925 ( 5.607 -6.861 0.660) 8.885 ======================= Grid point 207 (91/102) ======================= q-point: (-0.18 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.474 ( -5.745 -9.788 -0.291) 11.353 1.561 ( -14.006 -9.466 3.094) 17.186 1.828 ( -6.491 -6.952 -3.524) 10.143 2.128 ( -7.139 4.644 1.321) 8.619 2.247 ( 2.051 -5.019 -0.845) 5.488 2.285 ( -6.136 -5.400 -1.411) 8.294 2.546 ( 2.676 -9.343 -4.472) 10.699 2.621 ( -4.490 5.855 2.496) 7.789 2.754 ( -4.673 -5.783 2.924) 7.989 2.885 ( -4.621 -0.041 2.893) 5.452 2.963 ( -3.003 -6.042 2.055) 7.053 3.108 ( -0.253 -1.643 -5.459) 5.707 3.234 ( -6.433 -5.017 3.565) 8.903 3.303 ( 10.228 -2.698 -3.409) 11.113 3.332 ( -2.619 1.383 0.647) 3.031 3.474 ( -2.325 -2.182 -0.941) 3.325 3.556 ( 2.314 1.005 1.951) 3.189 3.660 ( -10.283 -1.156 -0.245) 10.350 3.756 ( 5.650 -1.088 0.656) 5.791 3.804 ( 7.977 -0.538 -3.190) 8.608 3.904 ( 1.830 4.273 -2.218) 5.151 4.024 ( 2.287 3.590 1.280) 4.445 4.149 ( -3.534 -2.292 -0.111) 4.213 4.299 ( -5.345 1.875 0.920) 5.738 4.353 ( -2.301 3.215 -0.312) 3.966 4.426 ( -3.167 -2.378 4.840) 6.254 4.539 ( 8.764 3.326 -0.939) 9.421 4.721 ( 2.407 -1.083 -0.195) 2.647 4.904 ( 5.008 6.212 0.441) 7.991 4.943 ( 0.581 -2.061 1.570) 2.655 5.207 ( 5.392 -0.432 -0.472) 5.430 5.234 ( 0.115 2.846 -5.589) 6.273 5.430 ( 3.266 -1.128 -0.430) 3.482 5.611 ( 1.072 -0.790 -0.142) 1.339 5.668 ( -1.587 -2.124 1.292) 2.950 5.671 ( 4.455 -4.602 2.423) 6.848 5.853 ( 1.267 -3.223 1.411) 3.740 6.098 ( 4.438 -3.002 -1.003) 5.451 6.303 ( 3.629 -1.579 1.666) 4.294 6.382 ( 1.122 -1.879 -3.978) 4.540 6.447 ( -5.388 -1.192 0.369) 5.531 6.494 ( 1.803 -4.796 1.359) 5.301 6.558 ( -4.962 -0.320 0.629) 5.012 6.685 ( -1.078 -2.449 -3.272) 4.227 6.913 ( -2.814 1.813 1.836) 3.818 7.086 ( 0.340 2.600 0.180) 2.628 7.203 ( -5.317 1.225 -0.608) 5.490 7.245 ( -4.472 7.738 2.667) 9.326 7.517 ( -0.356 6.981 2.034) 7.280 7.606 ( 0.337 6.475 -5.085) 8.240 7.976 ( 5.629 6.210 -3.027) 8.912 8.076 ( 1.703 5.111 6.077) 8.121 8.299 ( -0.537 1.656 -6.656) 6.880 8.366 ( 7.211 5.326 -0.555) 8.981 8.547 ( -5.672 1.680 1.146) 6.026 8.656 ( -1.919 -1.339 2.805) 3.653 8.916 ( 3.705 0.836 1.631) 4.134 9.130 ( -0.503 0.490 0.212) 0.733 9.351 ( 3.747 10.763 4.245) 12.162 9.487 ( 6.507 4.746 -4.319) 9.138 9.800 ( -11.477 0.821 7.946) 13.984 9.928 ( -2.287 1.619 -11.442) 11.780 10.271 ( -3.922 1.101 3.461) 5.345 10.514 ( 4.379 -5.219 -3.485) 7.653 10.560 ( -3.954 -6.591 0.506) 7.703 10.760 ( -0.220 -0.664 0.571) 0.903 10.935 ( -4.105 1.585 0.446) 4.423 11.183 ( 1.537 -0.303 2.192) 2.694 11.428 ( -4.770 5.860 -2.239) 7.881 11.554 ( -5.624 2.197 -0.396) 6.051 11.607 ( -6.904 4.778 3.702) 9.176 11.691 ( -6.196 4.495 -1.508) 7.802 12.062 ( 3.689 0.573 -1.198) 3.921 12.151 ( 1.439 0.653 1.327) 2.063 12.627 ( -8.731 10.464 -0.168) 13.629 12.728 ( -9.992 12.103 -0.157) 15.695 12.911 ( 1.001 -2.391 -0.272) 2.607 12.976 ( 0.857 -4.816 0.646) 4.934 13.498 ( 4.040 8.317 -0.209) 9.248 13.583 ( 6.104 2.927 -0.216) 6.773 15.878 ( 5.548 -1.343 -1.713) 5.960 16.010 ( 6.161 2.347 1.657) 6.798 17.392 ( -4.457 -1.529 -0.092) 4.713 17.777 ( 3.498 -1.814 -0.302) 3.952 17.940 ( -10.505 0.480 0.521) 10.529 18.490 ( 6.096 6.554 -1.559) 9.086 18.571 ( -4.615 5.538 2.075) 7.501 19.102 ( 2.791 7.669 -0.614) 8.184 19.356 ( -0.100 6.677 3.685) 7.627 19.429 ( -4.299 7.768 -1.211) 8.961 19.752 ( 10.492 -3.659 -4.872) 12.133 19.866 ( 0.699 15.625 1.585) 15.721 21.251 ( -14.101 -0.450 1.166) 14.156 21.558 ( -4.646 -6.922 0.663) 8.363 21.856 ( 0.941 -5.195 -3.427) 6.294 22.073 ( -1.766 1.305 2.048) 3.003 22.192 ( 1.605 -1.441 2.737) 3.485 22.368 ( 0.271 1.387 -3.959) 4.203 22.758 ( -0.696 -5.520 4.959) 7.453 22.919 ( 3.413 -1.156 -5.288) 6.399 23.072 ( 8.072 -7.447 2.036) 11.169 23.093 ( 5.191 -7.643 -0.221) 9.242 ======================= Grid point 208 (92/102) ======================= q-point: (-0.09 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.630 ( -2.611 -10.653 -4.736) 11.947 1.677 ( -9.441 -11.798 2.544) 15.323 1.919 ( 2.668 -0.874 -5.648) 6.307 2.009 ( -14.175 -4.276 6.212) 16.057 2.295 ( -4.893 -4.638 -0.580) 6.766 2.383 ( 1.101 -3.109 2.692) 4.257 2.463 ( -3.839 5.988 -0.151) 7.115 2.716 ( 5.581 -1.264 -2.586) 6.280 2.774 ( -1.649 -1.382 3.393) 4.018 2.905 ( -7.330 -8.155 1.590) 11.080 3.048 ( -1.912 -4.602 0.678) 5.029 3.138 ( 1.499 -3.097 -5.832) 6.771 3.270 ( -4.301 -2.848 4.310) 6.722 3.328 ( 1.774 -0.926 -1.828) 2.710 3.394 ( 5.934 -1.714 -2.653) 6.722 3.499 ( -1.835 1.488 2.894) 3.736 3.554 ( 2.057 -1.942 -3.108) 4.203 3.597 ( -7.775 0.288 0.583) 7.802 3.738 ( -0.809 2.252 2.165) 3.227 3.762 ( 1.065 8.272 -2.523) 8.713 3.939 ( 8.245 -2.219 -0.631) 8.561 4.014 ( -0.646 -0.956 2.924) 3.144 4.178 ( -1.035 -0.045 -3.395) 3.550 4.217 ( -4.287 4.426 0.149) 6.163 4.305 ( 1.310 -2.028 0.547) 2.475 4.494 ( -0.999 -3.103 3.301) 4.639 4.590 ( 4.121 -2.967 0.775) 5.137 4.745 ( 4.074 1.071 2.472) 4.884 4.839 ( 3.884 2.379 -3.422) 5.697 5.008 ( 3.971 -1.465 0.760) 4.301 5.142 ( -4.090 2.313 -3.515) 5.868 5.309 ( 5.909 -3.667 0.593) 6.979 5.490 ( 4.097 -2.663 0.029) 4.886 5.643 ( 0.144 -2.102 -0.460) 2.156 5.686 ( 0.841 0.609 -1.831) 2.105 5.756 ( -3.773 -5.390 3.210) 7.320 5.878 ( -0.331 1.123 2.005) 2.321 6.174 ( 4.111 -0.427 0.419) 4.155 6.275 ( 1.380 6.807 -0.619) 6.973 6.391 ( -1.838 0.471 0.337) 1.927 6.445 ( -3.100 -3.745 -1.342) 5.043 6.520 ( -5.741 -0.446 -0.387) 5.771 6.555 ( -5.694 -3.226 1.486) 6.711 6.695 ( 0.945 -0.674 -4.761) 4.900 6.872 ( -1.589 2.202 3.464) 4.401 6.996 ( -3.869 8.081 4.777) 10.153 7.113 ( 3.211 0.829 -2.835) 4.363 7.160 ( -3.927 0.678 -2.514) 4.712 7.442 ( -2.215 4.131 1.501) 4.922 7.465 ( 1.138 6.188 -1.311) 6.427 7.950 ( 8.153 1.143 -4.469) 9.367 8.033 ( -0.506 2.230 5.480) 5.938 8.242 ( -1.129 4.166 -4.929) 6.552 8.326 ( 2.979 4.223 1.098) 5.284 8.394 ( -6.495 5.260 -1.550) 8.500 8.679 ( -2.636 -1.783 2.014) 3.767 8.948 ( 10.172 3.254 -2.296) 10.924 9.114 ( 0.803 0.365 0.432) 0.982 9.216 ( -1.160 5.082 7.339) 9.002 9.508 ( 5.429 -0.570 -0.405) 5.474 9.701 ( -11.512 2.114 8.063) 14.213 9.863 ( -0.049 1.576 -12.079) 12.182 10.240 ( -2.236 0.313 1.250) 2.581 10.628 ( 1.560 -5.638 -1.955) 6.168 10.676 ( -1.393 -7.473 -0.983) 7.665 10.810 ( 4.355 -2.462 1.014) 5.104 10.904 ( -1.396 -0.356 0.164) 1.450 11.208 ( -0.441 -0.642 3.324) 3.414 11.291 ( -3.271 4.087 -2.647) 5.866 11.361 ( -11.621 9.499 4.549) 15.684 11.466 ( -2.323 6.469 -2.584) 7.343 11.597 ( -3.105 2.664 -0.897) 4.188 12.048 ( 2.271 3.069 -1.101) 3.973 12.136 ( 0.644 2.014 1.615) 2.661 12.478 ( -3.710 3.224 -1.707) 5.203 12.501 ( -5.555 4.273 1.307) 7.129 12.987 ( -0.363 -4.608 -0.207) 4.626 13.066 ( -1.427 -5.069 0.223) 5.271 13.375 ( 3.836 8.420 -0.272) 9.256 13.567 ( 4.743 3.329 0.304) 5.802 15.926 ( 3.547 -0.727 -2.206) 4.240 15.987 ( 0.910 2.997 2.134) 3.790 17.426 ( 0.043 -3.118 -0.217) 3.125 17.869 ( 5.563 -4.788 0.038) 7.340 17.909 ( -4.169 -2.626 -0.184) 4.931 18.373 ( -6.113 10.692 -0.216) 12.318 18.440 ( 1.778 2.856 1.124) 3.547 18.968 ( -1.105 6.260 0.223) 6.361 19.184 ( -5.404 6.367 -0.704) 8.381 19.336 ( -0.729 2.984 0.188) 3.078 19.614 ( 2.670 10.939 -0.499) 11.271 19.985 ( 13.412 -5.780 -0.216) 14.606 21.122 ( -12.412 1.893 0.551) 12.568 21.653 ( -4.119 -6.612 1.469) 7.927 21.966 ( 2.179 -5.534 -3.532) 6.917 22.023 ( 1.743 3.708 -0.903) 4.195 22.234 ( -2.463 -0.937 7.805) 8.238 22.341 ( 1.279 0.163 -6.334) 6.464 22.850 ( -1.836 -4.357 5.512) 7.262 22.933 ( 2.624 0.897 -4.003) 4.869 23.199 ( 4.111 -2.845 0.577) 5.033 23.252 ( 5.248 -4.338 -0.774) 6.853 ======================= Grid point 216 (93/102) ======================= q-point: (-0.36 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.509 ( -15.710 -0.000 3.581) 16.113 1.541 ( -2.436 -0.000 -8.323) 8.673 1.705 ( -12.381 -0.000 -6.388) 13.932 1.717 ( -24.999 -0.000 9.984) 26.919 2.286 ( -12.182 -0.000 6.672) 13.889 2.288 ( -0.455 -0.000 -2.076) 2.126 2.484 ( -2.456 -0.000 0.495) 2.505 2.575 ( 4.025 0.000 -3.318) 5.216 2.611 ( 8.162 0.000 4.361) 9.253 2.771 ( 0.702 0.000 -6.975) 7.010 2.871 ( 3.377 0.000 -8.798) 9.424 2.925 ( -13.517 -0.000 2.538) 13.753 3.134 ( -7.321 -0.000 9.441) 11.947 3.140 ( -0.324 -0.000 -2.810) 2.829 3.282 ( -2.930 -0.000 -0.296) 2.945 3.472 ( 7.112 0.000 5.582) 9.040 3.607 ( -7.146 -0.000 1.559) 7.314 3.646 ( 2.138 0.000 -2.469) 3.266 3.739 ( 2.807 0.000 -1.622) 3.242 3.821 ( 1.934 0.000 -2.796) 3.400 3.909 ( 5.434 0.000 -2.678) 6.058 4.236 ( -11.141 -0.000 -8.140) 13.798 4.240 ( -1.812 -0.000 3.320) 3.782 4.335 ( -0.030 -0.000 0.991) 0.992 4.361 ( 1.791 0.000 8.595) 8.780 4.465 ( -11.317 -0.000 3.455) 11.833 4.660 ( 5.964 0.000 -6.537) 8.849 4.904 ( 7.844 0.000 -2.236) 8.156 4.964 ( 0.093 0.000 1.754) 1.756 5.070 ( 3.985 0.000 2.361) 4.631 5.217 ( -2.546 -0.000 6.674) 7.143 5.287 ( 10.209 0.000 -1.619) 10.336 5.365 ( 12.655 0.000 -2.682) 12.936 5.426 ( 2.097 0.000 -4.144) 4.644 5.665 ( 6.650 0.000 -0.983) 6.723 5.742 ( 4.199 0.000 -2.636) 4.958 5.793 ( 2.705 0.000 11.940) 12.243 5.920 ( -2.386 -0.000 3.306) 4.077 5.968 ( 10.310 0.000 -5.692) 11.777 6.082 ( -0.503 -0.000 -2.653) 2.701 6.246 ( 4.291 0.000 -0.947) 4.394 6.426 ( -5.302 -0.000 0.490) 5.324 6.486 ( 5.411 0.000 -1.995) 5.767 6.633 ( -4.684 -0.000 0.254) 4.691 7.023 ( -6.371 -0.000 -1.261) 6.495 7.183 ( 0.048 0.000 0.656) 0.658 7.260 ( -8.202 -0.000 4.763) 9.485 7.310 ( -3.521 -0.000 -3.819) 5.194 7.730 ( 4.804 0.000 -6.838) 8.357 7.915 ( 3.494 0.000 1.809) 3.934 8.153 ( -1.422 -0.000 -5.812) 5.983 8.199 ( 0.894 0.000 1.611) 1.842 8.340 ( -3.432 -0.000 7.334) 8.097 8.420 ( -1.154 -0.000 4.574) 4.717 8.631 ( -0.083 -0.000 -1.362) 1.364 8.683 ( 6.522 0.000 -1.195) 6.630 8.952 ( 0.794 0.000 0.246) 0.831 9.176 ( 0.150 0.000 0.268) 0.307 9.596 ( 8.897 0.000 -5.268) 10.340 9.780 ( -5.177 -0.000 8.644) 10.076 9.946 ( 7.573 0.000 0.615) 7.598 10.080 ( -10.516 -0.000 -6.219) 12.217 10.231 ( -3.021 -0.000 1.016) 3.187 10.471 ( -0.102 -0.000 -6.375) 6.376 10.609 ( -4.994 -0.000 4.985) 7.056 10.722 ( 0.131 0.000 -1.672) 1.677 11.167 ( -3.423 -0.000 -0.606) 3.477 11.212 ( -1.895 -0.000 2.000) 2.756 11.446 ( -9.022 -0.000 -4.461) 10.064 11.457 ( -5.692 -0.000 5.948) 8.232 11.647 ( -2.473 -0.000 -1.026) 2.677 11.774 ( 5.778 0.000 0.594) 5.808 12.079 ( 0.018 0.000 -2.362) 2.362 12.092 ( -0.454 -0.000 1.996) 2.047 12.733 ( 1.681 0.000 -1.297) 2.123 12.739 ( 3.419 0.000 1.018) 3.568 13.418 ( -8.161 -0.000 1.298) 8.264 13.558 ( -2.577 -0.000 -1.498) 2.981 13.702 ( 0.045 0.000 -1.428) 1.429 13.708 ( 1.749 0.000 1.741) 2.468 15.825 ( 9.285 0.000 -4.147) 10.169 15.878 ( 14.274 0.000 5.018) 15.130 17.693 ( -10.181 -0.000 0.008) 10.181 17.765 ( -5.407 -0.000 0.247) 5.412 18.280 ( -7.988 -0.000 1.339) 8.100 18.475 ( -2.802 -0.000 -1.492) 3.174 18.612 ( 7.727 0.000 -0.504) 7.743 18.764 ( 10.917 0.000 0.490) 10.928 19.818 ( 2.326 0.000 -1.102) 2.574 19.829 ( 4.204 0.000 1.753) 4.555 20.319 ( -5.457 -0.000 9.245) 10.735 20.580 ( 0.574 0.000 -13.329) 13.342 20.978 ( -8.350 -0.000 8.859) 12.174 21.288 ( 1.495 0.000 -19.454) 19.511 21.933 ( -4.468 -0.000 8.133) 9.280 22.073 ( -4.655 -0.000 -4.919) 6.773 22.162 ( -0.252 -0.000 19.705) 19.707 22.280 ( 3.740 0.000 -5.463) 6.621 22.438 ( -3.719 -0.000 1.221) 3.914 22.532 ( 0.490 0.000 -5.387) 5.410 22.774 ( 6.156 0.000 -0.526) 6.179 22.794 ( 5.682 0.000 0.590) 5.712 ======================= Grid point 217 (94/102) ======================= q-point: (-0.27 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.325 ( -14.705 2.465 4.736) 15.644 1.442 ( -16.889 2.527 -0.938) 17.103 1.598 ( -24.295 -4.272 5.434) 25.259 1.778 ( -2.777 -14.489 -11.511) 18.713 2.198 ( -13.786 -0.958 1.927) 13.953 2.299 ( -6.963 -3.951 0.977) 8.065 2.463 ( -5.935 1.187 0.376) 6.064 2.519 ( 8.659 4.420 -5.440) 11.140 2.728 ( -3.690 -3.029 5.124) 7.003 2.765 ( -11.036 -1.989 2.284) 11.444 2.793 ( -4.359 -2.387 -1.207) 5.114 2.985 ( -0.320 -6.613 -5.980) 8.921 3.086 ( -0.881 -0.043 3.911) 4.010 3.196 ( 4.278 -2.811 -1.750) 5.410 3.278 ( -4.323 -2.245 0.787) 4.935 3.530 ( -0.450 1.224 5.415) 5.570 3.551 ( -3.639 -3.195 1.005) 4.946 3.654 ( 5.709 1.866 -0.872) 6.070 3.706 ( -1.425 3.342 -1.636) 3.984 3.876 ( 8.515 -0.204 -3.258) 9.120 3.931 ( 5.324 1.075 -1.617) 5.667 4.118 ( -9.278 2.065 -3.724) 10.209 4.211 ( 2.624 2.894 -0.596) 3.952 4.332 ( -3.806 1.990 0.572) 4.332 4.341 ( -10.894 -2.011 8.761) 14.124 4.478 ( 2.398 -2.545 -1.121) 3.672 4.691 ( 10.509 1.396 -5.111) 11.769 4.825 ( 4.207 9.344 1.798) 10.404 4.968 ( 1.822 2.648 0.598) 3.270 5.080 ( -1.433 2.669 4.853) 5.721 5.211 ( 5.975 -0.543 -1.098) 6.099 5.343 ( -4.884 -1.740 -2.004) 5.559 5.427 ( 12.129 3.412 -3.412) 13.053 5.505 ( 11.754 -3.420 1.169) 12.297 5.659 ( 7.761 3.357 -1.453) 8.580 5.727 ( -0.115 3.545 -0.566) 3.592 5.790 ( 5.543 3.637 7.968) 10.365 5.986 ( 1.163 -4.529 -0.496) 4.702 6.116 ( -0.393 -5.792 -1.535) 6.005 6.131 ( 7.793 -8.236 -1.160) 11.398 6.319 ( 5.832 -3.728 -1.660) 7.117 6.400 ( -6.500 -2.236 0.762) 6.916 6.547 ( 4.423 -1.839 -2.043) 5.207 6.606 ( -2.406 -0.267 0.580) 2.489 6.965 ( -6.163 0.857 -0.621) 6.253 7.148 ( -4.182 1.396 1.756) 4.746 7.236 ( -7.135 -0.881 1.794) 7.410 7.282 ( -2.699 -1.276 -1.864) 3.519 7.733 ( 4.960 2.226 -9.558) 10.996 7.874 ( -3.170 6.715 4.073) 8.469 8.110 ( 2.346 1.173 -4.372) 5.098 8.244 ( -2.665 -4.199 -3.232) 5.932 8.316 ( -2.463 4.553 9.287) 10.632 8.421 ( -0.439 -2.064 5.123) 5.540 8.641 ( 2.561 -0.377 -0.127) 2.592 8.652 ( 5.382 7.677 -0.983) 9.427 8.985 ( 1.889 -1.301 -1.485) 2.733 9.126 ( -2.715 3.291 2.944) 5.184 9.631 ( 10.724 3.214 -5.970) 12.688 9.736 ( -14.084 -0.373 8.354) 16.380 9.898 ( 5.158 7.495 -4.463) 10.134 10.023 ( -0.147 3.184 -5.408) 6.277 10.247 ( -3.520 -3.180 4.598) 6.607 10.408 ( -1.393 2.581 -5.040) 5.832 10.540 ( -2.751 3.694 1.043) 4.722 10.744 ( -0.257 -1.230 0.643) 1.411 11.049 ( -6.123 4.991 0.283) 7.904 11.231 ( -0.712 1.696 -0.330) 1.869 11.376 ( -7.876 -4.943 0.633) 9.320 11.522 ( -5.200 -5.467 0.554) 7.565 11.647 ( -2.723 -0.787 2.236) 3.611 11.786 ( 0.968 1.424 -1.270) 2.139 12.066 ( 3.143 0.713 -0.937) 3.356 12.120 ( 0.331 -1.707 0.813) 1.919 12.745 ( 0.725 -1.007 -0.711) 1.429 12.801 ( 2.268 -3.191 0.456) 3.941 13.214 ( -11.249 13.801 1.037) 17.835 13.401 ( -10.961 14.479 0.167) 18.161 13.650 ( 6.294 1.571 -1.101) 6.580 13.732 ( 3.154 2.891 0.124) 4.280 15.867 ( 9.415 1.232 -2.753) 9.886 16.034 ( 15.728 -1.555 3.602) 16.210 17.515 ( -11.028 8.198 0.371) 13.747 17.737 ( -4.709 -1.021 -0.342) 4.831 18.056 ( -14.179 8.129 0.263) 16.346 18.621 ( 0.457 -4.735 0.161) 4.760 18.673 ( 8.146 0.420 -0.815) 8.197 18.944 ( 14.756 -12.663 0.414) 19.449 19.709 ( 1.944 11.513 -1.446) 11.765 19.730 ( 5.154 12.578 1.957) 13.733 20.176 ( -10.500 13.664 5.036) 17.953 20.426 ( -1.372 12.839 -8.684) 15.560 21.020 ( -9.214 -8.859 6.154) 14.187 21.301 ( -1.859 -5.957 -15.481) 16.692 21.835 ( -9.253 4.879 8.494) 13.475 21.970 ( -4.622 -0.822 3.772) 6.023 22.274 ( 3.647 1.497 -4.134) 5.713 22.391 ( 1.358 0.086 -1.742) 2.210 22.530 ( 6.615 -16.907 4.389) 18.678 22.585 ( 0.594 -7.615 1.855) 7.860 22.844 ( 6.134 -2.331 -2.340) 6.966 22.871 ( 5.702 -3.919 0.963) 6.985 ======================= Grid point 218 (95/102) ======================= q-point: (-0.18 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.259 ( -13.372 -6.092 4.317) 15.315 1.327 ( -14.821 -3.940 -2.062) 15.474 1.560 ( -19.530 -9.607 3.070) 21.981 2.015 ( -4.173 -15.348 -5.592) 16.860 2.139 ( -10.913 -2.974 -0.345) 11.316 2.282 ( -7.263 6.179 -1.116) 9.601 2.384 ( -5.145 -5.913 1.484) 7.977 2.550 ( -1.396 -5.132 -5.493) 7.646 2.719 ( -1.343 1.966 -0.130) 2.385 2.759 ( -12.868 -8.008 4.097) 15.701 2.857 ( -3.357 -4.814 2.976) 6.580 3.034 ( -4.157 -1.989 -2.691) 5.337 3.132 ( -1.396 -4.029 3.369) 5.434 3.283 ( 2.621 -3.234 -3.750) 5.603 3.304 ( -1.081 -3.195 1.908) 3.876 3.498 ( 2.200 3.458 2.128) 4.618 3.585 ( 1.232 1.728 3.067) 3.730 3.605 ( -4.869 0.971 -3.595) 6.130 3.731 ( 7.776 -4.707 -2.086) 9.326 3.882 ( 3.798 3.490 0.401) 5.174 3.971 ( 4.453 1.056 -4.594) 6.484 4.037 ( -4.058 -1.096 4.414) 6.095 4.163 ( 1.868 4.382 -5.227) 7.072 4.239 ( -8.738 0.253 -0.001) 8.742 4.332 ( -6.892 0.054 7.405) 10.116 4.489 ( 4.580 3.438 -0.448) 5.744 4.699 ( 6.570 7.779 0.571) 10.198 4.772 ( 11.399 -0.731 -2.159) 11.624 4.938 ( 1.556 1.056 0.274) 1.900 5.044 ( 5.160 3.618 3.365) 7.144 5.247 ( 0.631 0.746 -3.266) 3.409 5.279 ( 1.087 3.374 -2.951) 4.612 5.454 ( 6.215 0.657 -0.159) 6.252 5.593 ( -0.973 0.961 4.276) 4.489 5.657 ( -0.989 1.470 -1.175) 2.126 5.704 ( 10.665 0.940 -1.164) 10.770 5.827 ( 5.840 -2.568 3.222) 7.147 6.056 ( 1.716 -3.653 -1.774) 4.409 6.235 ( 1.006 -5.770 -0.910) 5.928 6.315 ( -0.577 -7.905 2.282) 8.248 6.387 ( -2.624 -1.046 -1.620) 3.257 6.436 ( 2.325 -3.919 -1.297) 4.737 6.555 ( 0.476 1.448 1.316) 2.014 6.635 ( 0.750 -1.476 -1.665) 2.348 6.912 ( -3.694 0.539 0.505) 3.767 7.102 ( -4.475 0.631 0.780) 4.586 7.173 ( -6.500 0.891 -1.772) 6.796 7.293 ( -2.646 -0.187 3.154) 4.121 7.667 ( -7.271 11.104 3.848) 13.820 7.681 ( 1.479 3.959 -9.934) 10.795 8.107 ( 5.241 3.242 -2.816) 6.776 8.202 ( -2.176 6.230 7.836) 10.245 8.264 ( -4.264 -0.832 -3.801) 5.772 8.478 ( -2.501 -2.815 1.285) 3.978 8.543 ( 4.196 7.357 -0.892) 8.516 8.670 ( 4.323 0.402 0.530) 4.374 8.959 ( 0.196 2.081 3.091) 3.731 9.122 ( 1.043 -1.693 1.008) 2.229 9.585 ( 5.800 8.044 -4.317) 10.816 9.620 ( -6.753 5.113 4.825) 9.748 9.797 ( -0.896 7.641 2.560) 8.108 9.912 ( -1.596 2.107 -12.213) 12.496 10.254 ( -5.811 0.135 5.950) 8.318 10.431 ( 0.661 -4.619 1.282) 4.839 10.493 ( 3.124 -0.062 -4.375) 5.376 10.750 ( -0.543 -0.204 0.596) 0.832 10.939 ( -4.969 2.459 0.487) 5.565 11.187 ( -2.161 0.742 1.198) 2.580 11.421 ( -5.652 -2.835 -0.540) 6.346 11.528 ( -10.015 0.219 0.049) 10.017 11.610 ( 0.379 2.151 1.655) 2.741 11.743 ( -4.185 3.165 -0.037) 5.248 12.095 ( 5.212 -0.070 -0.438) 5.231 12.156 ( 1.758 -1.217 0.357) 2.168 12.735 ( -8.550 4.162 -1.147) 9.578 12.798 ( -9.403 8.404 1.734) 12.730 12.919 ( 0.187 1.725 0.226) 1.750 13.029 ( -7.570 13.418 -0.105) 15.407 13.667 ( 4.533 5.153 -0.895) 6.921 13.674 ( 5.989 3.494 0.176) 6.936 15.911 ( 7.077 0.298 -2.583) 7.540 16.121 ( 8.779 3.646 2.983) 9.963 17.347 ( -6.363 1.343 -0.041) 6.503 17.740 ( -2.402 -2.598 -1.095) 3.704 17.865 ( -13.194 1.438 0.743) 13.293 18.610 ( 0.302 4.563 2.105) 5.034 18.690 ( 7.770 4.498 -1.226) 9.061 19.241 ( 9.314 0.421 -0.217) 9.326 19.519 ( 0.344 9.564 0.511) 9.584 19.571 ( 4.070 9.425 2.074) 10.474 19.788 ( -7.009 9.107 -4.050) 12.184 20.149 ( -0.949 15.428 -0.899) 15.483 21.101 ( -12.282 -5.733 2.243) 13.738 21.374 ( -7.125 -8.034 -4.715) 11.728 21.775 ( -3.008 -2.545 1.714) 4.297 21.998 ( -5.338 -4.396 4.908) 8.480 22.249 ( 4.023 2.969 -3.235) 5.956 22.379 ( -0.713 0.500 -1.542) 1.771 22.679 ( 2.411 -4.852 2.768) 6.084 22.899 ( 5.768 -4.616 -5.454) 9.183 22.967 ( 11.195 -11.209 2.568) 16.049 23.018 ( 6.301 -6.714 1.725) 9.367 ======================= Grid point 219 (96/102) ======================= q-point: (-0.09 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.347 ( -11.263 -12.405 -3.715) 17.162 1.377 ( -10.324 -12.810 2.283) 16.610 1.669 ( -12.585 -14.555 0.967) 19.265 2.055 ( -5.622 7.629 0.586) 9.495 2.136 ( -9.335 -6.531 1.779) 11.531 2.270 ( -0.856 -9.715 0.565) 9.769 2.508 ( -9.122 -7.306 0.064) 11.687 2.604 ( 2.722 -1.568 -5.552) 6.379 2.680 ( -5.190 -4.456 0.229) 6.845 2.817 ( -6.426 -3.570 3.001) 7.940 2.934 ( -1.984 -6.570 0.104) 6.864 3.032 ( -6.128 -4.558 -1.562) 7.795 3.215 ( 1.722 -4.210 1.993) 4.966 3.322 ( 0.827 -1.410 -0.753) 1.800 3.369 ( 0.133 -2.228 -1.158) 2.514 3.451 ( -0.839 0.805 -0.200) 1.180 3.528 ( -5.071 0.177 -1.419) 5.268 3.602 ( 2.223 1.466 0.320) 2.682 3.820 ( 2.549 4.852 0.929) 5.559 3.880 ( 2.668 -2.433 -0.168) 3.615 3.928 ( 2.473 3.156 -1.085) 4.154 4.062 ( 2.055 3.090 -1.908) 4.173 4.108 ( -1.732 -2.612 -0.906) 3.263 4.217 ( -0.333 -1.962 -1.816) 2.694 4.284 ( -6.095 0.270 6.785) 9.125 4.479 ( 3.862 0.535 4.020) 5.600 4.634 ( 4.156 3.961 0.336) 5.751 4.861 ( 14.844 1.538 -2.815) 15.186 4.905 ( -0.958 3.845 2.148) 4.508 5.062 ( 9.460 1.704 -2.704) 9.985 5.155 ( -4.006 3.410 -4.242) 6.758 5.308 ( 6.383 -1.458 0.254) 6.552 5.476 ( 1.367 -0.089 -0.163) 1.379 5.598 ( -3.760 -4.361 2.653) 6.340 5.640 ( -0.212 -0.347 0.100) 0.419 5.733 ( 3.667 0.951 0.771) 3.866 5.912 ( 3.334 0.077 0.793) 3.428 6.147 ( 1.656 -4.732 -0.611) 5.051 6.318 ( -0.987 -4.032 -1.474) 4.405 6.334 ( -8.175 0.304 1.610) 8.337 6.417 ( -1.590 -2.314 -0.627) 2.877 6.480 ( -0.412 1.136 -0.755) 1.425 6.518 ( -0.670 3.368 1.426) 3.719 6.637 ( -2.659 -2.139 -1.581) 3.761 6.889 ( -2.034 0.451 1.120) 2.365 7.074 ( -1.356 -0.292 -1.513) 2.053 7.127 ( -5.213 -0.040 2.466) 5.767 7.195 ( -4.182 8.952 0.954) 9.927 7.476 ( -4.839 3.760 0.229) 6.133 7.571 ( -2.799 6.228 -5.645) 8.860 8.054 ( 5.072 4.891 -1.165) 7.141 8.106 ( -1.250 5.168 4.940) 7.258 8.224 ( -6.021 -0.633 -3.377) 6.932 8.390 ( -9.250 6.091 -1.416) 11.166 8.505 ( 9.071 3.522 -1.943) 9.923 8.684 ( 2.948 1.465 0.553) 3.338 9.000 ( 4.934 -2.387 5.135) 7.511 9.145 ( 2.702 0.462 -1.343) 3.053 9.405 ( -0.373 13.128 7.597) 15.172 9.545 ( 2.260 0.297 -3.230) 3.954 9.671 ( -8.492 2.937 6.851) 11.300 9.873 ( 2.563 1.466 -14.080) 14.387 10.219 ( -4.358 -0.136 3.757) 5.756 10.504 ( -3.536 -5.661 -0.362) 6.684 10.580 ( 5.738 -4.359 -1.532) 7.367 10.779 ( 1.659 -2.858 -1.297) 3.550 10.897 ( -0.453 -0.014 0.904) 1.011 11.182 ( -2.759 -1.311 3.003) 4.283 11.350 ( -4.697 5.154 -1.460) 7.124 11.394 ( -12.305 4.425 2.793) 13.372 11.585 ( -5.442 8.201 -0.851) 9.879 11.610 ( 0.702 0.428 -0.125) 0.831 12.119 ( 4.531 1.979 -0.380) 4.959 12.177 ( 1.761 1.113 0.182) 2.092 12.506 ( -6.960 5.502 -0.526) 8.888 12.558 ( -12.234 8.278 0.202) 14.773 12.926 ( 0.645 -1.802 1.038) 2.177 12.984 ( 0.461 -3.304 -0.828) 3.437 13.559 ( 3.926 8.541 0.070) 9.400 13.667 ( 4.989 3.465 -0.184) 6.077 15.943 ( 3.839 0.120 -2.509) 4.587 16.067 ( -0.311 5.217 2.581) 5.829 17.369 ( 1.981 -4.036 -0.387) 4.513 17.787 ( -2.481 -4.855 -2.987) 6.217 17.828 ( -3.499 -3.893 2.783) 5.928 18.485 ( -7.000 8.356 3.750) 11.527 18.612 ( 8.489 9.662 -2.449) 13.092 19.090 ( -3.469 9.888 0.306) 10.484 19.272 ( -7.786 9.546 -1.607) 12.423 19.428 ( 1.310 6.689 0.802) 6.863 19.858 ( 3.703 12.488 -2.422) 13.249 19.971 ( 13.372 -6.712 1.075) 15.001 21.042 ( -13.469 -0.223 0.602) 13.484 21.473 ( -7.464 -9.098 0.581) 11.782 21.861 ( 1.425 -6.528 -2.539) 7.148 22.038 ( -3.995 -2.350 3.347) 5.717 22.230 ( 1.947 1.181 1.083) 2.521 22.356 ( 0.499 1.174 -4.152) 4.344 22.778 ( -0.048 -3.987 6.579) 7.692 22.950 ( 3.988 -0.418 -5.931) 7.160 23.165 ( 4.461 -5.008 1.978) 6.992 23.224 ( 11.037 -5.470 -1.075) 12.365 ======================= Grid point 228 (97/102) ======================= q-point: (-0.27 -0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.222 ( -23.875 -0.000 8.401) 25.310 1.344 ( -26.167 -0.000 5.262) 26.691 1.459 ( -6.723 -0.000 -6.394) 9.278 1.494 ( -11.980 -0.000 -11.371) 16.518 2.078 ( -16.067 -0.000 4.451) 16.672 2.161 ( -22.175 -0.000 1.416) 22.220 2.356 ( -16.555 -0.000 -4.307) 17.106 2.576 ( -11.318 -0.000 6.112) 12.863 2.667 ( -1.649 -0.000 -5.959) 6.183 2.701 ( -2.153 -0.000 9.254) 9.501 2.815 ( 2.191 0.000 -4.068) 4.620 2.908 ( 9.080 0.000 -9.342) 13.027 3.072 ( -5.643 -0.000 8.201) 9.955 3.211 ( 4.293 0.000 -9.007) 9.977 3.242 ( 3.168 0.000 5.047) 5.959 3.460 ( -5.729 -0.000 0.402) 5.743 3.586 ( 4.910 0.000 5.441) 7.329 3.706 ( -5.808 -0.000 0.982) 5.891 3.725 ( 6.410 0.000 -0.593) 6.437 3.934 ( 8.548 0.000 -0.817) 8.587 3.978 ( 4.559 0.000 -4.356) 6.306 4.065 ( -5.350 -0.000 -8.950) 10.427 4.247 ( -12.110 -0.000 8.986) 15.080 4.265 ( 3.331 0.000 -2.841) 4.378 4.396 ( -0.967 -0.000 6.199) 6.274 4.411 ( 2.423 0.000 -2.690) 3.620 4.767 ( 9.389 0.000 -1.276) 9.476 4.986 ( 1.009 0.000 4.817) 4.921 5.012 ( 9.078 0.000 -4.321) 10.054 5.120 ( 2.986 0.000 -1.021) 3.156 5.192 ( -3.146 -0.000 4.557) 5.537 5.313 ( 1.072 0.000 -1.134) 1.560 5.531 ( 7.727 0.000 -1.851) 7.946 5.554 ( 11.741 0.000 -1.758) 11.872 5.786 ( 10.931 0.000 -2.156) 11.141 5.829 ( 9.804 0.000 -3.649) 10.461 5.888 ( 0.738 0.000 9.752) 9.780 5.904 ( 0.663 0.000 2.548) 2.633 6.023 ( -3.647 -0.000 2.188) 4.254 6.126 ( 8.664 0.000 -7.139) 11.226 6.311 ( 5.037 0.000 -2.381) 5.571 6.329 ( -6.814 -0.000 1.693) 7.021 6.575 ( 6.648 0.000 -3.105) 7.337 6.588 ( -0.172 -0.000 1.686) 1.695 6.925 ( -5.924 -0.000 -0.464) 5.942 7.137 ( -10.443 -0.000 3.981) 11.176 7.145 ( -5.923 -0.000 0.864) 5.985 7.250 ( -2.111 -0.000 -4.540) 5.007 7.776 ( 6.188 0.000 -14.110) 15.407 7.913 ( -8.028 -0.000 8.100) 11.405 8.131 ( 0.471 0.000 -0.979) 1.086 8.157 ( -1.735 -0.000 -7.683) 7.876 8.306 ( -5.739 -0.000 8.867) 10.562 8.463 ( 0.529 0.000 9.027) 9.043 8.641 ( 3.231 0.000 -2.792) 4.270 8.800 ( 9.275 0.000 1.129) 9.344 8.955 ( -0.593 -0.000 -2.102) 2.184 9.139 ( -6.590 -0.000 4.446) 7.949 9.639 ( -15.058 -0.000 9.445) 17.775 9.714 ( 6.864 0.000 -8.455) 10.890 9.898 ( -6.368 -0.000 -9.990) 11.847 10.161 ( 17.786 0.000 -2.539) 17.967 10.208 ( -0.879 -0.000 5.380) 5.451 10.420 ( -1.577 -0.000 -6.479) 6.668 10.568 ( -2.082 -0.000 2.937) 3.600 10.734 ( 1.450 0.000 -0.817) 1.665 11.111 ( -3.703 -0.000 -0.566) 3.746 11.146 ( -6.257 -0.000 -0.741) 6.300 11.295 ( -7.506 -0.000 -6.414) 9.874 11.438 ( -3.469 -0.000 7.345) 8.123 11.632 ( 1.634 0.000 6.674) 6.871 11.796 ( -3.017 -0.000 -3.346) 4.505 12.099 ( 0.379 0.000 2.342) 2.373 12.112 ( 6.393 0.000 -2.386) 6.824 12.745 ( -0.148 -0.000 -0.084) 0.171 12.789 ( 2.963 0.000 -0.071) 2.964 13.263 ( -13.000 -0.000 2.360) 13.212 13.466 ( -8.937 -0.000 -2.884) 9.391 13.725 ( 3.032 0.000 0.132) 3.035 13.751 ( 3.443 0.000 -0.218) 3.450 15.945 ( 8.916 0.000 -6.456) 11.008 16.170 ( 21.067 0.000 8.130) 22.581 17.528 ( -11.603 -0.000 1.690) 11.726 17.670 ( -6.949 -0.000 -1.294) 7.068 18.166 ( -8.402 -0.000 2.075) 8.655 18.412 ( -3.711 -0.000 -5.865) 6.940 18.748 ( 9.896 0.000 1.336) 9.986 18.939 ( 12.614 0.000 0.048) 12.614 19.827 ( -0.539 -0.000 -2.858) 2.908 19.905 ( 3.658 0.000 3.765) 5.250 20.251 ( -8.176 -0.000 6.193) 10.257 20.542 ( 1.135 0.000 -9.427) 9.495 20.859 ( -11.904 -0.000 6.698) 13.659 21.188 ( -2.891 -0.000 -24.293) 24.464 21.892 ( -4.571 -0.000 4.792) 6.623 21.977 ( -5.219 -0.000 -3.735) 6.418 22.271 ( 1.495 0.000 26.322) 26.364 22.323 ( 3.547 0.000 -2.452) 4.312 22.398 ( -1.584 -0.000 1.306) 2.053 22.546 ( 5.991 0.000 -7.583) 9.664 22.867 ( 6.490 0.000 -0.881) 6.550 22.877 ( 5.082 0.000 0.317) 5.092 ======================= Grid point 229 (98/102) ======================= q-point: (-0.18 -0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.076 ( -21.857 -1.929 9.448) 23.890 1.182 ( -19.173 -1.635 -0.801) 19.259 1.292 ( -16.004 -1.123 -2.192) 16.192 1.644 ( -8.023 -17.025 -9.355) 21.018 1.987 ( -17.831 -3.826 0.533) 18.244 2.059 ( -23.716 -8.979 5.731) 25.999 2.219 ( -23.012 -3.067 -4.935) 23.734 2.538 ( -10.086 -3.228 2.926) 10.986 2.655 ( 0.599 -0.604 -4.139) 4.226 2.713 ( 2.432 7.153 -4.011) 8.553 2.742 ( -4.819 -4.443 7.702) 10.114 3.007 ( 4.175 -1.473 -3.448) 5.612 3.063 ( -4.550 -0.937 6.105) 7.671 3.221 ( -1.304 -3.021 -2.179) 3.947 3.304 ( 9.657 0.162 -2.049) 9.873 3.506 ( 0.040 -5.699 0.086) 5.700 3.607 ( 2.151 2.722 3.702) 5.073 3.636 ( -1.666 2.537 -0.234) 3.044 3.755 ( 5.327 1.113 -2.227) 5.880 3.959 ( 0.865 1.036 -0.288) 1.380 3.994 ( 1.565 2.141 -6.581) 7.095 4.012 ( 1.916 -0.544 1.890) 2.746 4.184 ( -8.163 0.287 3.147) 8.753 4.261 ( 4.973 3.137 -7.145) 9.253 4.338 ( -2.946 2.828 8.025) 9.005 4.497 ( -0.326 -3.853 0.200) 3.872 4.843 ( 11.731 -0.077 -0.820) 11.759 4.902 ( 5.309 7.824 0.547) 9.471 5.011 ( 3.912 5.548 -1.535) 6.960 5.125 ( 3.595 0.064 1.824) 4.031 5.215 ( -0.955 -0.637 0.183) 1.162 5.355 ( 7.028 -0.010 -0.063) 7.028 5.551 ( 5.403 5.401 -1.553) 7.796 5.613 ( 2.133 -2.282 1.006) 3.281 5.737 ( 1.931 8.814 -2.201) 9.288 5.797 ( 8.609 2.451 -2.485) 9.290 5.903 ( 5.585 2.824 7.637) 9.874 6.008 ( 3.204 -2.929 -2.833) 5.183 6.107 ( 0.378 -8.754 -1.612) 8.909 6.194 ( -0.398 -4.598 1.206) 4.770 6.307 ( -5.766 -2.096 0.713) 6.176 6.400 ( 6.349 -4.737 -2.739) 8.381 6.595 ( 4.799 0.653 0.381) 4.858 6.633 ( 3.575 -0.598 -1.473) 3.912 6.885 ( -4.149 -0.230 0.266) 4.164 7.057 ( -7.526 -0.174 1.037) 7.599 7.122 ( -8.828 -0.669 -0.003) 8.854 7.242 ( -2.664 -2.512 -1.321) 3.892 7.739 ( 1.580 4.061 -14.467) 15.109 7.778 ( -12.813 7.140 8.047) 16.731 8.144 ( -0.635 -0.556 0.833) 1.186 8.171 ( 0.192 -3.061 -8.427) 8.968 8.294 ( -4.641 0.893 7.161) 8.580 8.436 ( -2.276 2.315 7.519) 8.190 8.688 ( 5.403 -0.713 -3.541) 6.500 8.748 ( 6.105 8.251 1.049) 10.318 8.991 ( -1.435 0.417 2.492) 2.906 9.084 ( -4.029 -1.920 2.651) 5.191 9.557 ( -13.067 -0.563 6.695) 14.693 9.683 ( -4.652 2.041 -3.639) 6.249 9.872 ( 6.191 -0.301 -15.905) 17.070 10.098 ( 3.750 14.241 0.862) 14.752 10.254 ( 1.888 1.395 1.815) 2.968 10.415 ( 6.501 -0.646 1.110) 6.627 10.537 ( 2.884 2.477 -1.974) 4.284 10.748 ( -0.030 -0.116 0.649) 0.660 10.959 ( -5.665 4.759 0.236) 7.402 11.183 ( -3.787 1.097 -4.017) 5.628 11.277 ( -5.797 -7.391 0.404) 9.402 11.442 ( -6.505 -2.035 0.845) 6.868 11.677 ( 2.510 2.280 8.121) 8.801 11.736 ( -4.712 0.573 -1.823) 5.085 12.120 ( 2.160 -0.902 1.426) 2.741 12.167 ( 7.622 -0.425 -1.841) 7.852 12.724 ( -4.395 1.472 0.391) 4.651 12.818 ( -0.764 -0.133 -0.274) 0.822 13.051 ( -10.167 11.931 1.790) 15.778 13.204 ( -15.023 14.901 -1.742) 21.231 13.738 ( 6.095 0.788 -1.189) 6.260 13.779 ( 3.088 1.820 0.043) 3.585 15.973 ( 6.530 1.378 -5.994) 8.970 16.304 ( 16.269 5.802 7.728) 18.923 17.360 ( -9.562 6.708 0.554) 11.694 17.652 ( -5.805 -3.290 -2.001) 6.966 17.847 ( -13.804 10.046 0.100) 17.073 18.617 ( -1.149 -7.413 -2.490) 7.904 18.809 ( 10.032 1.889 0.865) 10.245 19.180 ( 16.870 -14.806 -0.091) 22.446 19.709 ( -0.973 9.641 -2.728) 10.066 19.811 ( 3.914 11.542 2.671) 12.477 19.971 ( -18.592 21.152 0.408) 28.165 20.392 ( 0.421 12.313 -3.014) 12.684 20.887 ( -11.159 -8.499 3.358) 14.423 21.163 ( -8.099 -6.433 -15.757) 18.849 21.753 ( -6.222 4.491 7.877) 10.997 21.916 ( -4.391 -1.183 2.441) 5.161 22.308 ( 2.828 1.393 -3.065) 4.397 22.372 ( -2.316 0.203 0.966) 2.518 22.629 ( 5.938 -4.777 -0.856) 7.668 22.728 ( 15.059 -21.567 5.307) 26.834 22.927 ( 6.199 -2.228 -0.997) 6.662 22.957 ( 5.349 -4.652 0.741) 7.128 ======================= Grid point 230 (99/102) ======================= q-point: (-0.09 -0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.048 ( -15.347 -9.631 0.772) 18.135 1.121 ( -11.980 -5.401 -2.363) 13.352 1.307 ( -15.463 -13.594 2.720) 20.768 1.849 ( -12.217 -13.407 -4.330) 18.649 2.038 ( -6.779 -13.017 0.039) 14.677 2.088 ( -15.637 -4.208 4.827) 16.897 2.173 ( -19.348 -14.045 0.162) 23.909 2.519 ( -11.826 -3.583 6.263) 13.854 2.642 ( 4.576 -0.345 -7.520) 8.809 2.682 ( -1.279 -1.306 -5.814) 6.094 2.831 ( -2.861 -5.848 4.302) 7.803 2.953 ( -5.435 1.894 -2.476) 6.265 3.110 ( -3.178 -5.430 3.958) 7.433 3.273 ( -1.549 -3.562 0.459) 3.911 3.365 ( 6.480 -0.049 -3.046) 7.161 3.499 ( -4.692 2.005 0.209) 5.106 3.551 ( 2.186 5.127 0.150) 5.576 3.640 ( 2.330 1.006 0.867) 2.682 3.834 ( 7.823 -5.233 -2.999) 9.879 3.935 ( 4.257 4.539 -0.634) 6.255 3.960 ( -0.103 0.267 -0.757) 0.810 4.047 ( -2.121 -0.564 3.109) 3.805 4.141 ( -1.525 -0.695 0.134) 1.681 4.206 ( 4.685 3.654 -7.322) 9.430 4.284 ( -3.454 2.054 7.056) 8.120 4.527 ( 0.231 -0.030 1.520) 1.538 4.786 ( 4.905 8.462 3.220) 10.297 4.922 ( 3.257 0.882 -0.581) 3.424 4.999 ( 10.858 0.783 -2.355) 11.138 5.158 ( 4.347 -1.269 -5.645) 7.237 5.192 ( 5.223 5.223 1.989) 7.650 5.372 ( 6.614 3.413 -0.612) 7.468 5.487 ( -3.546 1.208 3.721) 5.280 5.569 ( -3.427 5.746 2.253) 7.059 5.632 ( -0.664 -0.238 -3.339) 3.412 5.845 ( 8.606 3.967 -0.707) 9.502 5.920 ( 4.001 -0.807 1.948) 4.522 6.061 ( -0.119 -3.847 -2.193) 4.430 6.216 ( -6.310 -3.972 -2.512) 7.867 6.265 ( -4.181 -2.801 4.879) 7.009 6.324 ( -1.418 -5.032 -0.787) 5.287 6.516 ( 6.561 -1.332 -1.768) 6.924 6.605 ( -2.783 1.554 -1.159) 3.392 6.607 ( 3.599 3.412 1.182) 5.099 6.874 ( -2.409 -0.246 0.053) 2.422 7.033 ( -3.359 -1.206 -2.646) 4.443 7.071 ( -6.652 -1.665 2.359) 7.251 7.261 ( -4.185 0.334 1.769) 4.556 7.528 ( -12.232 8.251 2.671) 14.995 7.633 ( -2.734 5.257 -11.210) 12.680 8.113 ( -7.786 0.440 6.093) 9.896 8.189 ( 0.994 1.951 -7.189) 7.515 8.217 ( 0.322 5.057 1.629) 5.322 8.374 ( -8.930 1.993 1.533) 9.277 8.652 ( 9.458 5.582 -3.059) 11.400 8.744 ( 4.420 1.149 0.886) 4.653 8.989 ( 0.594 -2.601 7.298) 7.770 9.140 ( 1.053 -2.778 -1.134) 3.180 9.502 ( -7.629 -1.216 2.754) 8.202 9.596 ( -4.324 4.525 1.544) 6.447 9.788 ( -3.572 15.776 3.276) 16.504 9.885 ( 3.851 0.311 -12.834) 13.403 10.227 ( 1.246 2.787 1.659) 3.475 10.441 ( 0.147 0.833 0.886) 1.225 10.577 ( 7.566 -1.649 -0.245) 7.747 10.744 ( -0.590 -0.958 -0.881) 1.430 10.898 ( -0.134 0.220 0.330) 0.419 11.143 ( -2.873 -0.880 -0.039) 3.005 11.333 ( -6.333 -2.301 0.466) 6.755 11.388 ( -8.755 2.579 1.236) 9.211 11.617 ( -4.370 1.328 -3.682) 5.866 11.675 ( -1.993 5.964 7.301) 9.636 12.162 ( 3.375 -0.825 -0.176) 3.479 12.222 ( 7.593 0.601 -1.333) 7.732 12.565 ( -11.903 8.000 0.308) 14.344 12.613 ( -15.913 10.248 -0.539) 18.935 12.928 ( 0.118 0.591 1.178) 1.323 12.970 ( -0.726 2.213 -0.663) 2.422 13.720 ( 2.816 6.052 0.640) 6.706 13.759 ( 5.508 2.720 -1.368) 6.293 15.975 ( 3.500 1.128 -4.691) 5.960 16.196 ( -2.538 10.517 5.616) 12.190 17.310 ( 2.334 -4.194 -0.329) 4.811 17.677 ( -3.577 -3.541 -2.871) 5.794 17.725 ( -6.561 -3.711 2.154) 7.840 18.581 ( -7.269 6.156 0.846) 9.563 18.823 ( 10.321 5.657 -0.525) 11.781 19.298 ( -3.541 15.843 -0.699) 16.249 19.414 ( -9.928 14.146 0.317) 17.285 19.569 ( -0.682 7.737 -2.531) 8.169 19.877 ( 15.092 -11.590 0.742) 19.043 20.151 ( 1.976 14.507 0.090) 14.642 20.916 ( -12.635 -3.299 0.646) 13.074 21.221 ( -11.323 -10.638 -3.178) 15.858 21.757 ( -0.647 -4.938 1.994) 5.364 21.940 ( -4.577 -4.180 2.805) 6.804 22.286 ( 2.425 2.389 -2.044) 3.971 22.359 ( -0.953 0.030 -1.288) 1.602 22.741 ( 3.477 -2.996 4.597) 6.496 22.953 ( 4.765 -1.534 -5.881) 7.723 23.101 ( 5.702 -6.652 2.009) 8.989 23.194 ( 15.875 -9.553 -0.556) 18.536 ======================= Grid point 241 (100/102) ======================= q-point: (-0.18 -0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.905 ( -24.359 -0.000 10.642) 26.583 0.967 ( -27.987 -0.000 10.138) 29.767 1.263 ( -11.332 -0.000 -13.328) 17.494 1.355 ( -1.382 -0.000 -11.472) 11.555 1.661 ( -43.374 -0.000 10.965) 44.738 1.877 ( -14.810 -0.000 -0.542) 14.820 1.999 ( -22.070 -0.000 -8.536) 23.663 2.461 ( -5.659 -0.000 1.151) 5.775 2.584 ( -5.952 -0.000 -5.340) 7.996 2.624 ( -11.880 -0.000 4.663) 12.763 2.869 ( -0.902 -0.000 6.958) 7.016 3.006 ( 3.710 0.000 2.083) 4.255 3.102 ( 8.873 0.000 0.387) 8.882 3.176 ( 0.547 0.000 -3.703) 3.743 3.401 ( 11.892 0.000 -2.099) 12.076 3.423 ( -0.530 -0.000 0.392) 0.660 3.636 ( -0.811 -0.000 -4.975) 5.040 3.670 ( 3.691 0.000 3.345) 4.982 3.807 ( 4.262 0.000 0.183) 4.266 3.934 ( -4.655 -0.000 -5.523) 7.223 4.010 ( -0.020 -0.000 3.780) 3.780 4.043 ( 2.281 0.000 -5.499) 5.953 4.150 ( -4.485 -0.000 5.318) 6.957 4.279 ( 2.044 0.000 -4.867) 5.279 4.410 ( -4.364 -0.000 5.122) 6.729 4.427 ( 3.268 0.000 -0.134) 3.271 4.935 ( 14.767 0.000 -1.687) 14.863 4.971 ( -5.497 -0.000 3.543) 6.540 5.101 ( 2.122 0.000 -6.043) 6.405 5.205 ( 5.972 0.000 3.810) 7.084 5.216 ( 10.230 0.000 1.114) 10.291 5.386 ( 8.727 0.000 -0.636) 8.750 5.597 ( 2.613 0.000 -2.368) 3.527 5.682 ( 6.256 0.000 -0.904) 6.321 5.870 ( -0.675 -0.000 0.171) 0.697 5.900 ( -1.644 -0.000 1.492) 2.220 5.957 ( 5.090 0.000 -6.368) 8.152 5.971 ( 0.352 0.000 -1.567) 1.606 6.007 ( 10.697 0.000 2.787) 11.054 6.166 ( -0.161 -0.000 -0.241) 0.289 6.258 ( -4.066 -0.000 3.801) 5.566 6.366 ( 3.614 0.000 -3.777) 5.228 6.644 ( 4.313 0.000 -2.820) 5.153 6.665 ( 9.014 0.000 0.616) 9.035 6.848 ( -5.624 -0.000 2.229) 6.049 7.010 ( -6.511 -0.000 0.450) 6.526 7.031 ( -8.501 -0.000 -1.351) 8.607 7.181 ( -6.018 -0.000 -2.628) 6.567 7.741 ( -19.715 -0.000 10.893) 22.524 7.757 ( -0.257 -0.000 -17.514) 17.515 8.121 ( 1.558 0.000 -9.617) 9.743 8.128 ( -4.101 -0.000 2.878) 5.010 8.280 ( 0.170 0.000 5.917) 5.920 8.481 ( -3.219 -0.000 8.680) 9.258 8.710 ( 7.829 0.000 -3.400) 8.535 8.905 ( -4.746 -0.000 -2.019) 5.158 8.950 ( 8.716 0.000 0.113) 8.717 9.023 ( -11.823 -0.000 10.341) 15.707 9.472 ( -11.716 -0.000 8.308) 14.362 9.630 ( -7.991 -0.000 -6.389) 10.231 9.884 ( 5.810 0.000 -13.852) 15.021 10.284 ( 8.751 0.000 5.248) 10.204 10.297 ( 2.237 0.000 -11.551) 11.765 10.496 ( 14.706 0.000 2.190) 14.869 10.590 ( 4.307 0.000 -0.010) 4.307 10.746 ( 0.681 0.000 -0.831) 1.075 11.052 ( -5.582 -0.000 -0.582) 5.612 11.055 ( -3.470 -0.000 -0.704) 3.541 11.181 ( -3.760 -0.000 -6.985) 7.933 11.379 ( -5.864 -0.000 1.371) 6.022 11.673 ( -9.703 -0.000 -6.025) 11.421 11.788 ( 11.603 0.000 16.859) 20.466 12.129 ( 2.617 0.000 1.684) 3.112 12.223 ( 8.762 0.000 -2.302) 9.059 12.713 ( -5.289 -0.000 2.542) 5.868 12.820 ( 1.174 0.000 -2.015) 2.332 13.089 ( -10.894 -0.000 3.284) 11.378 13.256 ( -16.643 -0.000 -8.850) 18.850 13.779 ( 3.655 0.000 0.350) 3.672 13.802 ( 3.433 0.000 -0.835) 3.533 16.011 ( 4.311 0.000 -8.590) 9.611 16.565 ( 26.771 0.000 10.026) 28.587 17.393 ( -7.286 -0.000 3.241) 7.974 17.548 ( -7.969 -0.000 -5.683) 9.788 18.046 ( -9.037 -0.000 2.036) 9.264 18.282 ( -10.198 -0.000 -15.420) 18.488 18.910 ( 10.509 0.000 3.650) 11.125 19.138 ( 14.013 0.000 0.551) 14.024 19.772 ( -4.740 -0.000 -3.207) 5.723 19.930 ( -5.516 -0.000 7.527) 9.331 20.145 ( -6.897 -0.000 0.358) 6.906 20.529 ( 1.440 0.000 -7.060) 7.205 20.704 ( -11.010 -0.000 3.999) 11.714 20.967 ( -12.503 -0.000 -28.874) 31.465 21.846 ( -3.412 -0.000 2.376) 4.158 21.896 ( -3.972 -0.000 -2.020) 4.456 22.336 ( -2.541 -0.000 6.320) 6.812 22.348 ( 1.045 0.000 -1.495) 1.824 22.527 ( 12.601 0.000 25.354) 28.313 22.653 ( 12.220 0.000 -6.945) 14.056 22.944 ( 3.758 0.000 0.229) 3.765 22.952 ( 5.291 0.000 -1.174) 5.420 ======================= Grid point 242 (101/102) ======================= q-point: (-0.09 -0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.787 ( -22.184 -5.078 10.102) 24.899 0.885 ( -21.313 -9.834 8.817) 25.073 1.107 ( -5.371 2.252 -14.298) 15.439 1.497 ( -7.539 -14.518 -5.988) 17.420 1.561 ( -30.887 -19.130 10.647) 37.859 1.786 ( -26.008 -8.650 -10.533) 29.362 1.929 ( -4.220 -4.975 1.498) 6.693 2.413 ( -8.310 0.561 -0.431) 8.340 2.569 ( -4.281 -4.895 -4.368) 7.834 2.636 ( -9.339 -8.905 2.174) 13.086 2.802 ( 0.879 6.767 8.773) 11.114 3.031 ( 0.592 3.378 -4.117) 5.358 3.045 ( 0.529 3.462 3.385) 4.871 3.225 ( 1.312 -0.515 -0.465) 1.484 3.413 ( 3.548 1.370 -3.339) 5.061 3.505 ( 3.771 -0.671 0.739) 3.901 3.653 ( 3.142 0.116 -1.858) 3.652 3.658 ( 1.992 2.909 -0.933) 3.647 3.807 ( 4.662 -1.888 -3.827) 6.320 3.932 ( -1.689 -2.165 1.315) 3.045 4.016 ( 1.289 0.167 -2.857) 3.139 4.051 ( 1.820 -1.211 -0.892) 2.361 4.118 ( -2.046 2.075 4.084) 5.017 4.302 ( -0.828 0.119 2.392) 2.534 4.305 ( -0.438 5.323 -2.852) 6.055 4.483 ( -1.348 -2.607 0.417) 2.965 4.912 ( -4.001 2.081 4.861) 6.631 5.037 ( 11.708 5.492 0.344) 12.936 5.106 ( 0.155 -2.710 -5.970) 6.558 5.128 ( 12.497 5.721 -1.857) 13.869 5.340 ( 10.985 1.220 3.140) 11.490 5.473 ( 8.160 0.928 -0.293) 8.218 5.565 ( -2.169 7.219 -1.055) 7.611 5.613 ( -1.083 3.096 -1.756) 3.721 5.716 ( -4.381 11.647 0.767) 12.467 5.852 ( 0.150 -2.408 -1.874) 3.055 5.979 ( -0.952 -0.346 -0.146) 1.023 6.048 ( -1.860 -0.657 -0.713) 2.097 6.121 ( 7.933 -2.780 -3.346) 9.048 6.189 ( 1.333 -4.047 1.733) 4.600 6.248 ( -2.623 -1.210 1.243) 3.145 6.478 ( 4.923 -7.442 -2.442) 9.251 6.638 ( 0.038 2.952 -1.719) 3.417 6.701 ( 4.784 3.542 1.246) 6.082 6.838 ( -2.740 -2.094 2.089) 4.032 6.980 ( -2.240 -1.279 -3.015) 3.968 6.991 ( -7.163 -1.382 0.858) 7.346 7.173 ( -5.842 -4.851 -1.955) 7.841 7.554 ( -19.492 5.560 8.085) 21.822 7.661 ( -4.926 3.751 -16.460) 17.586 8.068 ( -8.445 0.983 5.306) 10.022 8.152 ( -0.629 -2.752 -8.550) 9.004 8.305 ( 3.815 2.019 1.332) 4.517 8.411 ( -4.871 5.558 6.971) 10.159 8.766 ( 6.619 0.362 -4.689) 8.120 8.817 ( 2.590 3.368 2.155) 4.764 8.960 ( -6.279 -0.537 9.097) 11.066 9.059 ( 1.084 -4.692 -1.263) 4.978 9.427 ( -8.027 -1.392 6.346) 10.327 9.571 ( -4.734 -0.666 -5.952) 7.635 9.880 ( 0.642 1.012 -6.914) 7.017 10.114 ( -1.619 17.945 -4.209) 18.503 10.340 ( 11.394 4.097 -1.091) 12.157 10.540 ( 5.909 6.664 0.767) 8.939 10.623 ( 7.517 0.363 1.585) 7.690 10.737 ( -1.909 1.481 0.570) 2.482 10.909 ( 0.152 1.214 -0.113) 1.229 11.117 ( -1.457 0.299 -4.442) 4.684 11.201 ( -5.018 -7.290 1.019) 8.908 11.350 ( -5.826 -0.500 0.710) 5.890 11.569 ( -10.183 0.977 -5.820) 11.769 11.840 ( 5.867 8.626 15.108) 18.359 12.165 ( 3.897 -1.087 -0.279) 4.055 12.281 ( 7.330 -0.185 -1.937) 7.584 12.609 ( -11.795 6.712 2.100) 13.732 12.687 ( -18.596 12.167 -5.227) 22.829 12.960 ( -2.489 3.783 0.184) 4.533 13.007 ( -7.084 4.005 -0.134) 8.139 13.808 ( 2.878 1.794 -0.174) 3.396 13.826 ( 4.331 0.044 -1.642) 4.632 16.007 ( 3.149 1.131 -7.940) 8.616 16.497 ( -0.990 25.240 9.107) 26.851 17.263 ( -1.633 -0.483 -0.598) 1.805 17.566 ( -2.877 -6.553 -4.085) 8.241 17.677 ( -7.785 6.331 0.855) 10.070 18.506 ( -13.638 -9.068 -9.487) 18.926 18.972 ( 10.613 2.669 3.847) 11.600 19.423 ( 14.497 -10.907 -1.772) 18.229 19.641 ( -10.719 12.027 -2.310) 16.275 19.678 ( -13.769 19.309 1.489) 23.762 19.873 ( 3.969 5.325 3.473) 7.495 20.413 ( 2.774 11.999 -0.257) 12.318 20.734 ( -9.936 -8.209 -0.570) 12.901 20.922 ( -15.528 -9.849 -13.332) 22.713 21.722 ( -2.442 3.115 7.332) 8.332 21.864 ( -3.446 -1.240 1.070) 3.816 22.329 ( 1.767 1.045 -2.749) 3.431 22.344 ( -2.075 -0.100 1.328) 2.465 22.741 ( 8.088 -2.375 1.691) 8.598 22.936 ( 7.817 -4.861 -3.936) 10.011 23.032 ( 5.031 -5.367 0.624) 7.383 23.090 ( 18.119 -16.497 2.087) 24.593 ======================= Grid point 253 (102/102) ======================= q-point: (-0.09 -0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.589 ( -24.000 -0.000 12.070) 26.864 0.635 ( -23.043 -0.000 16.753) 28.489 1.050 ( -15.436 -0.000 -3.244) 15.773 1.122 ( -29.136 -0.000 14.176) 32.402 1.343 ( 4.031 0.000 -14.415) 14.968 1.485 ( -20.226 -0.000 -20.790) 29.005 1.873 ( 1.219 0.000 3.237) 3.459 2.399 ( -2.702 -0.000 -3.540) 4.453 2.441 ( -12.447 -0.000 4.406) 13.204 2.483 ( -3.781 -0.000 -4.611) 5.963 2.860 ( -3.997 -0.000 10.992) 11.696 3.020 ( -2.031 -0.000 2.149) 2.957 3.206 ( 3.438 0.000 0.247) 3.447 3.250 ( 6.655 0.000 1.752) 6.882 3.445 ( 4.525 0.000 -3.066) 5.466 3.542 ( 8.222 0.000 -4.648) 9.445 3.651 ( 6.477 0.000 -9.834) 11.775 3.721 ( 1.477 0.000 1.440) 2.063 3.841 ( 0.694 0.000 -1.658) 1.798 3.843 ( -4.462 -0.000 -3.003) 5.379 3.984 ( -4.499 -0.000 5.029) 6.748 4.033 ( -0.174 -0.000 -4.451) 4.454 4.152 ( 1.276 0.000 4.142) 4.334 4.309 ( 3.583 0.000 -4.724) 5.929 4.343 ( -6.332 -0.000 5.166) 8.172 4.454 ( 0.341 0.000 -5.379) 5.390 4.900 ( -5.963 -0.000 6.308) 8.680 5.050 ( -2.949 -0.000 -2.931) 4.158 5.195 ( 19.046 0.000 -2.526) 19.213 5.346 ( 9.437 0.000 -0.180) 9.439 5.377 ( 8.891 0.000 -2.162) 9.151 5.532 ( 9.064 0.000 -3.008) 9.551 5.595 ( 0.975 0.000 -1.738) 1.993 5.728 ( -0.048 -0.000 0.155) 0.163 5.798 ( -9.341 -0.000 1.943) 9.540 5.870 ( 0.490 0.000 -2.210) 2.264 5.894 ( -5.264 -0.000 -2.111) 5.671 5.991 ( -3.082 -0.000 -9.151) 9.656 6.155 ( 2.822 0.000 2.750) 3.940 6.161 ( -0.848 -0.000 -1.585) 1.797 6.250 ( 3.876 0.000 1.132) 4.038 6.359 ( -2.746 -0.000 -2.220) 3.532 6.675 ( 0.164 0.000 -0.426) 0.457 6.779 ( -3.474 -0.000 5.768) 6.733 6.824 ( 10.608 0.000 -0.104) 10.609 6.910 ( -4.760 -0.000 -3.310) 5.797 6.979 ( 2.239 0.000 -3.585) 4.226 7.043 ( -10.453 -0.000 -2.509) 10.749 7.465 ( -21.837 -0.000 10.598) 24.273 7.598 ( -11.344 -0.000 -17.983) 21.263 8.024 ( -11.201 -0.000 8.603) 14.124 8.118 ( 3.923 0.000 -10.059) 10.797 8.363 ( 7.746 0.000 1.334) 7.860 8.455 ( -4.156 -0.000 6.431) 7.657 8.816 ( 0.575 0.000 -4.807) 4.841 8.852 ( 6.986 0.000 1.865) 7.231 8.852 ( -12.530 -0.000 7.335) 14.519 9.077 ( 3.459 0.000 1.771) 3.886 9.372 ( -6.618 -0.000 7.718) 10.167 9.518 ( -1.969 -0.000 -8.547) 8.771 9.896 ( 0.948 0.000 -0.268) 0.985 10.255 ( -0.542 -0.000 -12.130) 12.142 10.515 ( 21.268 0.000 -2.603) 21.426 10.679 ( 7.269 0.000 -1.096) 7.351 10.693 ( 6.328 0.000 1.540) 6.513 10.766 ( 4.502 0.000 0.458) 4.525 10.979 ( -3.986 -0.000 -0.376) 4.004 10.999 ( -3.953 -0.000 -0.526) 3.988 11.138 ( 2.916 0.000 -6.307) 6.949 11.307 ( -3.602 -0.000 0.534) 3.641 11.485 ( -11.425 -0.000 -4.847) 12.411 12.064 ( 11.540 0.000 0.660) 11.558 12.209 ( 9.736 0.000 7.797) 12.473 12.315 ( 3.917 0.000 -2.226) 4.505 12.622 ( -8.157 -0.000 5.119) 9.630 12.642 ( -34.145 -0.000 -19.161) 39.154 12.976 ( -6.545 -0.000 -3.463) 7.404 12.987 ( -4.431 -0.000 1.408) 4.650 13.827 ( 2.577 0.000 -0.087) 2.579 13.838 ( 1.668 0.000 -0.678) 1.800 16.031 ( 5.703 0.000 -8.427) 10.175 17.005 ( 21.913 0.000 -8.874) 23.641 17.302 ( -23.493 -0.000 -18.225) 29.733 17.344 ( -1.916 -0.000 3.489) 3.980 17.884 ( -30.895 -0.000 -11.050) 32.812 17.918 ( -8.608 -0.000 0.537) 8.624 19.117 ( 15.910 0.000 9.231) 18.394 19.356 ( 14.589 0.000 1.874) 14.709 19.694 ( -3.445 -0.000 -0.228) 3.452 19.780 ( -17.229 -0.000 5.672) 18.139 20.069 ( -3.494 -0.000 -1.544) 3.820 20.428 ( -17.559 -0.000 -20.894) 27.292 20.597 ( -4.675 -0.000 1.563) 4.929 20.632 ( -10.148 -0.000 -7.079) 12.373 21.817 ( -1.488 -0.000 0.903) 1.740 21.843 ( -2.266 -0.000 -0.887) 2.434 22.322 ( -1.560 -0.000 2.708) 3.125 22.351 ( 0.577 0.000 -1.667) 1.764 22.822 ( 12.163 0.000 -3.005) 12.529 22.891 ( 19.300 0.000 12.788) 23.152 22.993 ( 3.319 0.000 1.981) 3.865 23.010 ( 3.285 0.000 -1.249) 3.515 =================== 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 3/37026 10.0 235.950 143.067 92.105 -0.000 -27.897 0.000 3/37026 20.0 73.432 49.050 24.764 -0.000 -9.287 0.000 3/37026 30.0 36.005 24.506 12.225 -0.000 -4.660 0.000 3/37026 40.0 22.323 15.319 7.766 -0.000 -2.987 0.000 3/37026 50.0 15.768 10.835 5.607 -0.000 -2.182 0.000 3/37026 60.0 12.074 8.279 4.367 -0.000 -1.718 0.000 3/37026 70.0 9.750 6.663 3.574 -0.000 -1.417 0.000 3/37026 80.0 8.169 5.563 3.026 -0.000 -1.207 0.000 3/37026 90.0 7.030 4.771 2.627 -0.000 -1.052 0.000 3/37026 100.0 6.173 4.177 2.324 -0.000 -0.933 0.000 3/37026 110.0 5.506 3.717 2.085 -0.000 -0.838 0.000 3/37026 120.0 4.973 3.350 1.893 -0.000 -0.762 0.000 3/37026 130.0 4.537 3.052 1.735 -0.000 -0.698 0.000 3/37026 140.0 4.175 2.805 1.602 -0.000 -0.645 0.000 3/37026 150.0 3.869 2.597 1.489 -0.000 -0.599 0.000 3/37026 160.0 3.606 2.419 1.392 -0.000 -0.560 0.000 3/37026 170.0 3.379 2.266 1.308 -0.000 -0.526 0.000 3/37026 180.0 3.181 2.133 1.234 -0.000 -0.495 0.000 3/37026 190.0 3.005 2.015 1.168 -0.000 -0.469 0.000 3/37026 200.0 2.849 1.911 1.110 -0.000 -0.445 0.000 3/37026 210.0 2.710 1.818 1.057 -0.000 -0.423 0.000 3/37026 220.0 2.584 1.735 1.010 -0.000 -0.404 0.000 3/37026 230.0 2.470 1.659 0.967 -0.000 -0.386 0.000 3/37026 240.0 2.367 1.590 0.928 -0.000 -0.370 0.000 3/37026 250.0 2.272 1.527 0.892 -0.000 -0.355 0.000 3/37026 260.0 2.184 1.469 0.859 -0.000 -0.341 0.000 3/37026 270.0 2.104 1.416 0.828 -0.000 -0.329 0.000 3/37026 280.0 2.029 1.367 0.800 -0.000 -0.317 0.000 3/37026 290.0 1.960 1.321 0.773 -0.000 -0.306 0.000 3/37026 300.0 1.896 1.278 0.749 -0.000 -0.296 0.000 3/37026 310.0 1.835 1.238 0.726 -0.000 -0.287 0.000 3/37026 320.0 1.779 1.201 0.704 -0.000 -0.278 0.000 3/37026 330.0 1.726 1.166 0.684 -0.000 -0.270 0.000 3/37026 340.0 1.676 1.133 0.665 -0.000 -0.262 0.000 3/37026 350.0 1.629 1.101 0.647 -0.000 -0.255 0.000 3/37026 360.0 1.585 1.072 0.630 -0.000 -0.248 0.000 3/37026 370.0 1.543 1.044 0.614 -0.000 -0.241 0.000 3/37026 380.0 1.504 1.018 0.598 -0.000 -0.235 0.000 3/37026 390.0 1.466 0.993 0.584 -0.000 -0.229 0.000 3/37026 400.0 1.430 0.969 0.570 -0.000 -0.224 0.000 3/37026 410.0 1.396 0.946 0.557 -0.000 -0.218 0.000 3/37026 420.0 1.363 0.925 0.544 -0.000 -0.213 0.000 3/37026 430.0 1.332 0.904 0.532 -0.000 -0.208 0.000 3/37026 440.0 1.303 0.884 0.521 -0.000 -0.204 0.000 3/37026 450.0 1.275 0.865 0.510 -0.000 -0.199 0.000 3/37026 460.0 1.247 0.847 0.499 -0.000 -0.195 0.000 3/37026 470.0 1.221 0.830 0.489 -0.000 -0.191 0.000 3/37026 480.0 1.197 0.813 0.479 -0.000 -0.187 0.000 3/37026 490.0 1.173 0.797 0.470 -0.000 -0.183 0.000 3/37026 500.0 1.150 0.782 0.461 -0.000 -0.180 0.000 3/37026 510.0 1.128 0.767 0.452 -0.000 -0.176 0.000 3/37026 520.0 1.106 0.753 0.444 -0.000 -0.173 0.000 3/37026 530.0 1.086 0.739 0.436 -0.000 -0.170 0.000 3/37026 540.0 1.066 0.726 0.428 -0.000 -0.167 0.000 3/37026 550.0 1.047 0.713 0.421 -0.000 -0.164 0.000 3/37026 560.0 1.029 0.701 0.413 -0.000 -0.161 0.000 3/37026 570.0 1.011 0.689 0.407 -0.000 -0.158 0.000 3/37026 580.0 0.994 0.677 0.400 -0.000 -0.156 0.000 3/37026 590.0 0.978 0.666 0.393 -0.000 -0.153 0.000 3/37026 600.0 0.962 0.655 0.387 -0.000 -0.150 0.000 3/37026 610.0 0.946 0.645 0.381 -0.000 -0.148 0.000 3/37026 620.0 0.931 0.635 0.375 -0.000 -0.146 0.000 3/37026 630.0 0.917 0.625 0.369 -0.000 -0.143 0.000 3/37026 640.0 0.903 0.615 0.364 -0.000 -0.141 0.000 3/37026 650.0 0.889 0.606 0.358 -0.000 -0.139 0.000 3/37026 660.0 0.876 0.597 0.353 -0.000 -0.137 0.000 3/37026 670.0 0.863 0.589 0.348 -0.000 -0.135 0.000 3/37026 680.0 0.850 0.580 0.343 -0.000 -0.133 0.000 3/37026 690.0 0.838 0.572 0.338 -0.000 -0.131 0.000 3/37026 700.0 0.826 0.564 0.333 -0.000 -0.129 0.000 3/37026 710.0 0.815 0.556 0.329 -0.000 -0.127 0.000 3/37026 720.0 0.804 0.549 0.324 -0.000 -0.126 0.000 3/37026 730.0 0.793 0.541 0.320 -0.000 -0.124 0.000 3/37026 740.0 0.782 0.534 0.316 -0.000 -0.122 0.000 3/37026 750.0 0.772 0.527 0.312 -0.000 -0.121 0.000 3/37026 760.0 0.762 0.520 0.308 -0.000 -0.119 0.000 3/37026 770.0 0.752 0.514 0.304 -0.000 -0.118 0.000 3/37026 780.0 0.743 0.507 0.300 -0.000 -0.116 0.000 3/37026 790.0 0.733 0.501 0.296 -0.000 -0.115 0.000 3/37026 800.0 0.724 0.495 0.293 -0.000 -0.113 0.000 3/37026 810.0 0.716 0.489 0.289 -0.000 -0.112 0.000 3/37026 820.0 0.707 0.483 0.286 -0.000 -0.111 0.000 3/37026 830.0 0.698 0.477 0.282 -0.000 -0.109 0.000 3/37026 840.0 0.690 0.472 0.279 -0.000 -0.108 0.000 3/37026 850.0 0.682 0.466 0.276 -0.000 -0.107 0.000 3/37026 860.0 0.674 0.461 0.273 -0.000 -0.106 0.000 3/37026 870.0 0.667 0.456 0.270 -0.000 -0.104 0.000 3/37026 880.0 0.659 0.451 0.267 -0.000 -0.103 0.000 3/37026 890.0 0.652 0.446 0.264 -0.000 -0.102 0.000 3/37026 900.0 0.645 0.441 0.261 -0.000 -0.101 0.000 3/37026 910.0 0.638 0.436 0.258 -0.000 -0.100 0.000 3/37026 920.0 0.631 0.431 0.255 -0.000 -0.099 0.000 3/37026 930.0 0.624 0.427 0.253 -0.000 -0.098 0.000 3/37026 940.0 0.618 0.422 0.250 -0.000 -0.097 0.000 3/37026 950.0 0.611 0.418 0.247 -0.000 -0.096 0.000 3/37026 960.0 0.605 0.414 0.245 -0.000 -0.095 0.000 3/37026 970.0 0.599 0.410 0.242 -0.000 -0.094 0.000 3/37026 980.0 0.593 0.405 0.240 -0.000 -0.093 0.000 3/37026 990.0 0.587 0.401 0.238 -0.000 -0.092 0.000 3/37026 1000.0 0.581 0.397 0.235 -0.000 -0.091 0.000 3/37026 Thermal conductivity related properties were written into "kappa-m11113.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 21:58:04]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|