----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 10:35:04]------------------------- 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 6.063618720001768 -2.510442505000000 0.000000000000000 b 6.063618720001768 2.510442505000000 0.000000000000000 c -4.477639085396406 0.000000000000000 15.133371501011576 Atomic positions (fractional): *1 Lu 0.86863824976519 0.37059125602206 0.03623370908250 174.967 2 Lu 0.62940874397794 0.13136175023482 0.46376629091750 174.967 3 Lu 0.13136175023481 0.62940874397794 0.96376629091750 174.967 4 Lu 0.37059125602206 0.86863824976519 0.53623370908250 174.967 *5 Te 0.83755237321907 0.40693363048702 0.37214422275556 127.600 6 Te 0.59306636951298 0.16244762678093 0.12785577724444 127.600 7 Te 0.16244762678093 0.59306636951298 0.62785577724444 127.600 8 Te 0.40693363048702 0.83755237321907 0.87214422275556 127.600 *9 Te 0.40598152418059 0.84664584556384 0.20042118232232 127.600 10 Te 0.15335415443616 0.59401847581941 0.29957881767768 127.600 11 Te 0.59401847581941 0.15335415443616 0.79957881767768 127.600 12 Te 0.84664584556384 0.40598152418059 0.70042118232232 127.600 *13 O 0.19234221446075 0.31229120930709 0.37100603558389 15.999 14 O 0.68770879069291 0.80765778553925 0.12899396441611 15.999 15 O 0.80765778553925 0.68770879069291 0.62899396441611 15.999 16 O 0.31229120930709 0.19234221446075 0.87100603558389 15.999 *17 O 0.65907047553448 0.75763577753010 0.44854965106514 15.999 18 O 0.24236422246990 0.34092952446552 0.05145034893486 15.999 19 O 0.34092952446552 0.24236422246990 0.55145034893486 15.999 20 O 0.75763577753010 0.65907047553448 0.94854965106514 15.999 *21 O 0.96495259706869 0.16819125812798 0.45575765533408 15.999 22 O 0.83180874187202 0.03504740293131 0.04424234466592 15.999 23 O 0.03504740293131 0.83180874187202 0.54424234466592 15.999 24 O 0.16819125812798 0.96495259706869 0.95575765533408 15.999 *25 O 0.40375959257044 0.54987097335518 0.40626795273025 15.999 26 O 0.45012902664482 0.59624040742956 0.09373204726975 15.999 27 O 0.59624040742956 0.45012902664482 0.59373204726975 15.999 28 O 0.54987097335518 0.40375959257044 0.90626795273025 15.999 *29 O 0.78104916812377 0.91360237546290 0.33228190564332 15.999 30 O 0.08639762453710 0.21895083187623 0.16771809435668 15.999 31 O 0.21895083187623 0.08639762453710 0.66771809435668 15.999 32 O 0.91360237546290 0.78104916812377 0.83228190564332 15.999 *33 O 0.13447470295929 0.86552529704071 0.25000000000000 15.999 34 O 0.86552529704071 0.13447470295930 0.75000000000000 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 12.127237440003537 0.000000000000000 0.000000000000000 b 0.000000000000000 5.020885010000000 0.000000000000000 c -4.477639085396406 0.000000000000000 15.133371501011576 Atomic positions (fractional): *1 Lu 0.61961475289362 0.75097650312844 0.03623370908250 174.967 > 1 2 Lu 0.88038524710638 0.25097650312844 0.46376629091750 174.967 > 2 3 Lu 0.38038524710638 0.24902349687156 0.96376629091750 174.967 > 3 4 Lu 0.11961475289362 0.74902349687156 0.53623370908250 174.967 > 4 5 Lu 0.11961475289362 0.25097650312844 0.03623370908250 174.967 > 1 6 Lu 0.38038524710638 0.75097650312844 0.46376629091750 174.967 > 2 7 Lu 0.88038524710638 0.74902349687156 0.96376629091750 174.967 > 3 8 Lu 0.61961475289362 0.24902349687156 0.53623370908250 174.967 > 4 *9 Te 0.12224300185304 0.28469062863397 0.37214422275556 127.600 > 5 10 Te 0.87775699814695 0.28469062863397 0.12785577724444 127.600 > 6 11 Te 0.87775699814695 0.71530937136603 0.62785577724444 127.600 > 7 12 Te 0.12224300185304 0.71530937136603 0.87214422275556 127.600 > 8 *13 Te 0.62631368487221 0.22033216069162 0.20042118232232 127.600 > 9 14 Te 0.87368631512779 0.72033216069162 0.29957881767768 127.600 > 10 15 Te 0.37368631512779 0.77966783930838 0.79957881767768 127.600 > 11 16 Te 0.12631368487221 0.27966783930838 0.70042118232232 127.600 > 12 17 Te 0.62224300185305 0.78469062863397 0.37214422275556 127.600 > 5 18 Te 0.37775699814696 0.78469062863397 0.12785577724444 127.600 > 6 19 Te 0.37775699814696 0.21530937136603 0.62785577724444 127.600 > 7 20 Te 0.62224300185305 0.21530937136603 0.87214422275556 127.600 > 8 21 Te 0.12631368487221 0.72033216069162 0.20042118232232 127.600 > 9 22 Te 0.37368631512779 0.22033216069162 0.29957881767768 127.600 > 10 23 Te 0.87368631512779 0.27966783930838 0.79957881767768 127.600 > 11 24 Te 0.62631368487221 0.77966783930838 0.70042118232232 127.600 > 12 *25 O 0.75231671188392 0.55997449742317 0.37100603558389 15.999 > 13 26 O 0.74768328811608 0.05997449742317 0.12899396441611 15.999 > 14 27 O 0.24768328811608 0.44002550257683 0.62899396441611 15.999 > 15 28 O 0.25231671188392 0.94002550257683 0.87100603558389 15.999 > 16 *29 O 0.20835312653229 0.54928265099781 0.44854965106514 15.999 > 17 30 O 0.79164687346771 0.54928265099781 0.05145034893486 15.999 > 18 31 O 0.79164687346771 0.45071734900219 0.55145034893486 15.999 > 19 32 O 0.20835312653229 0.45071734900219 0.94854965106514 15.999 > 20 *33 O 0.06657192759833 0.10161933052965 0.45575765533408 15.999 > 21 34 O 0.93342807240167 0.10161933052965 0.04424234466592 15.999 > 22 35 O 0.93342807240167 0.89838066947035 0.54424234466592 15.999 > 23 36 O 0.06657192759833 0.89838066947035 0.95575765533408 15.999 > 24 *37 O 0.97681528296281 0.57305569039237 0.40626795273025 15.999 > 25 38 O 0.02318471703719 0.57305569039237 0.09373204726975 15.999 > 26 39 O 0.02318471703719 0.42694430960763 0.59373204726975 15.999 > 27 40 O 0.97681528296281 0.42694430960763 0.90626795273025 15.999 > 28 *41 O 0.84732577179334 0.06627660366957 0.33228190564332 15.999 > 29 42 O 0.65267422820666 0.56627660366957 0.16771809435668 15.999 > 30 43 O 0.15267422820666 0.93372339633043 0.66771809435668 15.999 > 31 44 O 0.34732577179334 0.43372339633043 0.83228190564332 15.999 > 32 *45 O 0.00000000000000 0.86552529704071 0.25000000000000 15.999 > 33 46 O 0.00000000000000 0.13447470295930 0.75000000000000 15.999 > 34 47 O 0.25231671188392 0.05997449742317 0.37100603558389 15.999 > 13 48 O 0.24768328811608 0.55997449742317 0.12899396441611 15.999 > 14 49 O 0.74768328811608 0.94002550257683 0.62899396441611 15.999 > 15 50 O 0.75231671188392 0.44002550257683 0.87100603558389 15.999 > 16 51 O 0.70835312653229 0.04928265099781 0.44854965106514 15.999 > 17 52 O 0.29164687346771 0.04928265099781 0.05145034893486 15.999 > 18 53 O 0.29164687346771 0.95071734900219 0.55145034893486 15.999 > 19 54 O 0.70835312653229 0.95071734900219 0.94854965106514 15.999 > 20 55 O 0.56657192759833 0.60161933052965 0.45575765533408 15.999 > 21 56 O 0.43342807240167 0.60161933052965 0.04424234466592 15.999 > 22 57 O 0.43342807240167 0.39838066947035 0.54424234466592 15.999 > 23 58 O 0.56657192759833 0.39838066947035 0.95575765533408 15.999 > 24 59 O 0.47681528296281 0.07305569039237 0.40626795273025 15.999 > 25 60 O 0.52318471703719 0.07305569039237 0.09373204726975 15.999 > 26 61 O 0.52318471703719 0.92694430960763 0.59373204726975 15.999 > 27 62 O 0.47681528296281 0.92694430960763 0.90626795273025 15.999 > 28 63 O 0.34732577179334 0.56627660366957 0.33228190564332 15.999 > 29 64 O 0.15267422820666 0.06627660366957 0.16771809435668 15.999 > 30 65 O 0.65267422820666 0.43372339633043 0.66771809435668 15.999 > 31 66 O 0.84732577179334 0.93372339633043 0.83228190564332 15.999 > 32 67 O 0.50000000000000 0.36552529704071 0.25000000000000 15.999 > 33 68 O 0.50000000000000 0.63447470295929 0.75000000000000 15.999 > 34 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.127237440003537 0.000000000000000 0.000000000000000 b 0.000000000000000 10.041770020000000 0.000000000000000 c -4.477639085396406 0.000000000000000 15.133371501011576 Atomic positions (fractional): *1 Lu 0.61961475289362 0.37548825156422 0.03623370908250 174.967 > 1 2 Lu 0.61961475289362 0.87548825156422 0.03623370908250 174.967 > 1 3 Lu 0.88038524710638 0.12548825156422 0.46376629091750 174.967 > 2 4 Lu 0.88038524710638 0.62548825156422 0.46376629091750 174.967 > 2 5 Lu 0.38038524710638 0.12451174843578 0.96376629091750 174.967 > 3 6 Lu 0.38038524710638 0.62451174843578 0.96376629091750 174.967 > 3 7 Lu 0.11961475289362 0.37451174843578 0.53623370908250 174.967 > 4 8 Lu 0.11961475289362 0.87451174843578 0.53623370908250 174.967 > 4 9 Lu 0.11961475289362 0.12548825156422 0.03623370908250 174.967 > 1 10 Lu 0.11961475289362 0.62548825156422 0.03623370908250 174.967 > 1 11 Lu 0.38038524710638 0.37548825156422 0.46376629091750 174.967 > 2 12 Lu 0.38038524710638 0.87548825156422 0.46376629091750 174.967 > 2 13 Lu 0.88038524710638 0.37451174843578 0.96376629091750 174.967 > 3 14 Lu 0.88038524710638 0.87451174843578 0.96376629091750 174.967 > 3 15 Lu 0.61961475289362 0.12451174843578 0.53623370908250 174.967 > 4 16 Lu 0.61961475289362 0.62451174843578 0.53623370908250 174.967 > 4 *17 Te 0.12224300185304 0.14234531431699 0.37214422275556 127.600 > 5 18 Te 0.12224300185304 0.64234531431699 0.37214422275556 127.600 > 5 19 Te 0.87775699814695 0.14234531431699 0.12785577724444 127.600 > 6 20 Te 0.87775699814695 0.64234531431699 0.12785577724444 127.600 > 6 21 Te 0.87775699814695 0.35765468568301 0.62785577724444 127.600 > 7 22 Te 0.87775699814695 0.85765468568301 0.62785577724444 127.600 > 7 23 Te 0.12224300185304 0.35765468568301 0.87214422275556 127.600 > 8 24 Te 0.12224300185304 0.85765468568301 0.87214422275556 127.600 > 8 *25 Te 0.62631368487221 0.11016608034581 0.20042118232232 127.600 > 9 26 Te 0.62631368487221 0.61016608034581 0.20042118232232 127.600 > 9 27 Te 0.87368631512779 0.36016608034581 0.29957881767768 127.600 > 10 28 Te 0.87368631512779 0.86016608034581 0.29957881767768 127.600 > 10 29 Te 0.37368631512779 0.38983391965419 0.79957881767768 127.600 > 11 30 Te 0.37368631512779 0.88983391965419 0.79957881767768 127.600 > 11 31 Te 0.12631368487221 0.13983391965419 0.70042118232232 127.600 > 12 32 Te 0.12631368487221 0.63983391965419 0.70042118232232 127.600 > 12 33 Te 0.62224300185305 0.39234531431699 0.37214422275556 127.600 > 5 34 Te 0.62224300185305 0.89234531431699 0.37214422275556 127.600 > 5 35 Te 0.37775699814696 0.39234531431699 0.12785577724444 127.600 > 6 36 Te 0.37775699814696 0.89234531431699 0.12785577724444 127.600 > 6 37 Te 0.37775699814696 0.10765468568301 0.62785577724444 127.600 > 7 38 Te 0.37775699814696 0.60765468568301 0.62785577724444 127.600 > 7 39 Te 0.62224300185305 0.10765468568301 0.87214422275556 127.600 > 8 40 Te 0.62224300185305 0.60765468568301 0.87214422275556 127.600 > 8 41 Te 0.12631368487221 0.36016608034581 0.20042118232232 127.600 > 9 42 Te 0.12631368487221 0.86016608034581 0.20042118232232 127.600 > 9 43 Te 0.37368631512779 0.11016608034581 0.29957881767768 127.600 > 10 44 Te 0.37368631512779 0.61016608034581 0.29957881767768 127.600 > 10 45 Te 0.87368631512779 0.13983391965419 0.79957881767768 127.600 > 11 46 Te 0.87368631512779 0.63983391965419 0.79957881767768 127.600 > 11 47 Te 0.62631368487221 0.38983391965419 0.70042118232232 127.600 > 12 48 Te 0.62631368487221 0.88983391965419 0.70042118232232 127.600 > 12 *49 O 0.75231671188392 0.27998724871159 0.37100603558389 15.999 > 13 50 O 0.75231671188392 0.77998724871159 0.37100603558389 15.999 > 13 51 O 0.74768328811608 0.02998724871159 0.12899396441611 15.999 > 14 52 O 0.74768328811608 0.52998724871159 0.12899396441611 15.999 > 14 53 O 0.24768328811608 0.22001275128841 0.62899396441611 15.999 > 15 54 O 0.24768328811608 0.72001275128841 0.62899396441611 15.999 > 15 55 O 0.25231671188392 0.47001275128841 0.87100603558389 15.999 > 16 56 O 0.25231671188392 0.97001275128841 0.87100603558389 15.999 > 16 *57 O 0.20835312653229 0.27464132549891 0.44854965106514 15.999 > 17 58 O 0.20835312653229 0.77464132549891 0.44854965106514 15.999 > 17 59 O 0.79164687346771 0.27464132549891 0.05145034893486 15.999 > 18 60 O 0.79164687346771 0.77464132549891 0.05145034893486 15.999 > 18 61 O 0.79164687346771 0.22535867450109 0.55145034893486 15.999 > 19 62 O 0.79164687346771 0.72535867450109 0.55145034893486 15.999 > 19 63 O 0.20835312653229 0.22535867450109 0.94854965106514 15.999 > 20 64 O 0.20835312653229 0.72535867450109 0.94854965106514 15.999 > 20 *65 O 0.06657192759833 0.05080966526482 0.45575765533408 15.999 > 21 66 O 0.06657192759833 0.55080966526482 0.45575765533408 15.999 > 21 67 O 0.93342807240167 0.05080966526482 0.04424234466592 15.999 > 22 68 O 0.93342807240167 0.55080966526482 0.04424234466592 15.999 > 22 69 O 0.93342807240167 0.44919033473518 0.54424234466592 15.999 > 23 70 O 0.93342807240167 0.94919033473518 0.54424234466592 15.999 > 23 71 O 0.06657192759833 0.44919033473518 0.95575765533408 15.999 > 24 72 O 0.06657192759833 0.94919033473518 0.95575765533408 15.999 > 24 *73 O 0.97681528296281 0.28652784519618 0.40626795273025 15.999 > 25 74 O 0.97681528296281 0.78652784519618 0.40626795273025 15.999 > 25 75 O 0.02318471703719 0.28652784519618 0.09373204726975 15.999 > 26 76 O 0.02318471703719 0.78652784519618 0.09373204726975 15.999 > 26 77 O 0.02318471703719 0.21347215480382 0.59373204726975 15.999 > 27 78 O 0.02318471703719 0.71347215480382 0.59373204726975 15.999 > 27 79 O 0.97681528296281 0.21347215480382 0.90626795273025 15.999 > 28 80 O 0.97681528296281 0.71347215480382 0.90626795273025 15.999 > 28 *81 O 0.84732577179334 0.03313830183478 0.33228190564332 15.999 > 29 82 O 0.84732577179334 0.53313830183478 0.33228190564332 15.999 > 29 83 O 0.65267422820666 0.28313830183478 0.16771809435668 15.999 > 30 84 O 0.65267422820666 0.78313830183478 0.16771809435668 15.999 > 30 85 O 0.15267422820666 0.46686169816522 0.66771809435668 15.999 > 31 86 O 0.15267422820666 0.96686169816522 0.66771809435668 15.999 > 31 87 O 0.34732577179334 0.21686169816522 0.83228190564332 15.999 > 32 88 O 0.34732577179334 0.71686169816522 0.83228190564332 15.999 > 32 *89 O 0.00000000000000 0.43276264852035 0.25000000000000 15.999 > 33 90 O 0.00000000000000 0.93276264852035 0.25000000000000 15.999 > 33 91 O 0.00000000000000 0.06723735147965 0.75000000000000 15.999 > 34 92 O 0.00000000000000 0.56723735147965 0.75000000000000 15.999 > 34 93 O 0.25231671188392 0.02998724871159 0.37100603558389 15.999 > 13 94 O 0.25231671188392 0.52998724871159 0.37100603558389 15.999 > 13 95 O 0.24768328811608 0.27998724871159 0.12899396441611 15.999 > 14 96 O 0.24768328811608 0.77998724871159 0.12899396441611 15.999 > 14 97 O 0.74768328811608 0.47001275128841 0.62899396441611 15.999 > 15 98 O 0.74768328811608 0.97001275128841 0.62899396441611 15.999 > 15 99 O 0.75231671188392 0.22001275128841 0.87100603558389 15.999 > 16 100 O 0.75231671188392 0.72001275128841 0.87100603558389 15.999 > 16 101 O 0.70835312653229 0.02464132549891 0.44854965106514 15.999 > 17 102 O 0.70835312653229 0.52464132549891 0.44854965106514 15.999 > 17 103 O 0.29164687346771 0.02464132549891 0.05145034893486 15.999 > 18 104 O 0.29164687346771 0.52464132549891 0.05145034893486 15.999 > 18 105 O 0.29164687346771 0.47535867450109 0.55145034893486 15.999 > 19 106 O 0.29164687346771 0.97535867450109 0.55145034893486 15.999 > 19 107 O 0.70835312653229 0.47535867450109 0.94854965106514 15.999 > 20 108 O 0.70835312653229 0.97535867450109 0.94854965106514 15.999 > 20 109 O 0.56657192759833 0.30080966526482 0.45575765533408 15.999 > 21 110 O 0.56657192759833 0.80080966526482 0.45575765533408 15.999 > 21 111 O 0.43342807240167 0.30080966526482 0.04424234466592 15.999 > 22 112 O 0.43342807240167 0.80080966526482 0.04424234466592 15.999 > 22 113 O 0.43342807240167 0.19919033473518 0.54424234466592 15.999 > 23 114 O 0.43342807240167 0.69919033473518 0.54424234466592 15.999 > 23 115 O 0.56657192759833 0.19919033473518 0.95575765533408 15.999 > 24 116 O 0.56657192759833 0.69919033473518 0.95575765533408 15.999 > 24 117 O 0.47681528296281 0.03652784519618 0.40626795273025 15.999 > 25 118 O 0.47681528296281 0.53652784519618 0.40626795273025 15.999 > 25 119 O 0.52318471703719 0.03652784519618 0.09373204726975 15.999 > 26 120 O 0.52318471703719 0.53652784519618 0.09373204726975 15.999 > 26 121 O 0.52318471703719 0.46347215480382 0.59373204726975 15.999 > 27 122 O 0.52318471703719 0.96347215480382 0.59373204726975 15.999 > 27 123 O 0.47681528296281 0.46347215480382 0.90626795273025 15.999 > 28 124 O 0.47681528296281 0.96347215480382 0.90626795273025 15.999 > 28 125 O 0.34732577179334 0.28313830183478 0.33228190564332 15.999 > 29 126 O 0.34732577179334 0.78313830183478 0.33228190564332 15.999 > 29 127 O 0.15267422820666 0.03313830183478 0.16771809435668 15.999 > 30 128 O 0.15267422820666 0.53313830183478 0.16771809435668 15.999 > 30 129 O 0.65267422820666 0.21686169816522 0.66771809435668 15.999 > 31 130 O 0.65267422820666 0.71686169816522 0.66771809435668 15.999 > 31 131 O 0.84732577179334 0.46686169816522 0.83228190564332 15.999 > 32 132 O 0.84732577179334 0.96686169816522 0.83228190564332 15.999 > 32 133 O 0.50000000000000 0.18276264852035 0.25000000000000 15.999 > 33 134 O 0.50000000000000 0.68276264852035 0.25000000000000 15.999 > 33 135 O 0.50000000000000 0.31723735147965 0.75000000000000 15.999 > 34 136 O 0.50000000000000 0.81723735147965 0.75000000000000 15.999 > 34 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.6326735 0.0000000 -0.5358690 0.0000000 5.0429985 0.0000000 -0.5358673 0.0000000 4.7567461 -------------------------- Born effective charges -------------------------- 1 Lu 3.9008862 -0.1580185 -0.4146188 0.0220197 4.3884238 -0.2188435 -0.2345890 0.1144970 4.6416049 2 Lu 3.9008862 0.1580185 -0.4146188 -0.0220197 4.3884238 0.2188435 -0.2345890 -0.1144970 4.6416049 3 Lu 3.9008862 -0.1580185 -0.4146188 0.0220197 4.3884238 -0.2188435 -0.2345890 0.1144970 4.6416049 4 Lu 3.9008862 0.1580185 -0.4146188 -0.0220197 4.3884238 0.2188435 -0.2345890 -0.1144970 4.6416049 5 Te 5.0110068 -1.0769782 -0.3196684 -0.5662940 4.1844388 0.6449743 -0.3671166 0.6303808 3.0616986 6 Te 5.0110068 1.0769782 -0.3196684 0.5662940 4.1844388 -0.6449743 -0.3671166 -0.6303808 3.0616986 7 Te 5.0110068 -1.0769782 -0.3196684 -0.5662940 4.1844388 0.6449743 -0.3671166 0.6303808 3.0616986 8 Te 5.0110068 1.0769782 -0.3196684 0.5662940 4.1844388 -0.6449743 -0.3671166 -0.6303808 3.0616986 9 Te 5.9307663 -0.8369277 -0.9743340 -0.2316101 3.6147070 0.6514660 -1.0079572 0.9357097 3.7090676 10 Te 5.9307663 0.8369277 -0.9743340 0.2316101 3.6147070 -0.6514660 -1.0079572 -0.9357097 3.7090676 11 Te 5.9307663 -0.8369277 -0.9743340 -0.2316101 3.6147070 0.6514660 -1.0079572 0.9357097 3.7090676 12 Te 5.9307663 0.8369277 -0.9743340 0.2316101 3.6147070 -0.6514660 -1.0079572 -0.9357097 3.7090676 13 O -3.9459487 0.7076221 0.4490628 0.9427997 -1.9956745 0.2747289 0.7867205 0.0160972 -1.6954003 14 O -3.9459487 -0.7076221 0.4490628 -0.9427997 -1.9956745 -0.2747289 0.7867205 -0.0160972 -1.6954003 15 O -3.9459487 0.7076221 0.4490628 0.9427997 -1.9956745 0.2747289 0.7867205 0.0160972 -1.6954003 16 O -3.9459487 -0.7076221 0.4490628 -0.9427997 -1.9956745 -0.2747289 0.7867205 -0.0160972 -1.6954003 17 O -2.1156277 -0.3568931 -0.0728503 -0.2847349 -2.2995694 -1.1948386 -0.1205769 -0.8563545 -2.0690570 18 O -2.1156277 0.3568931 -0.0728503 0.2847349 -2.2995694 1.1948386 -0.1205769 0.8563545 -2.0690570 19 O -2.1156277 -0.3568931 -0.0728503 -0.2847349 -2.2995694 -1.1948386 -0.1205769 -0.8563545 -2.0690570 20 O -2.1156277 0.3568931 -0.0728503 0.2847349 -2.2995694 1.1948386 -0.1205769 0.8563545 -2.0690570 21 O -2.2505949 -0.2552218 0.8461559 -0.3636002 -2.2188531 1.0613881 0.4417397 0.9311738 -2.2396595 22 O -2.2505949 0.2552218 0.8461559 0.3636002 -2.2188531 -1.0613881 0.4417397 -0.9311738 -2.2396595 23 O -2.2505949 -0.2552218 0.8461559 -0.3636002 -2.2188531 1.0613881 0.4417397 0.9311738 -2.2396595 24 O -2.2505949 0.2552218 0.8461559 0.3636002 -2.2188531 -1.0613881 0.4417397 -0.9311738 -2.2396595 25 O -2.4920295 0.5328910 -0.3668244 0.4939342 -2.0060170 0.6025754 -0.3358903 0.4316502 -2.5922330 26 O -2.4920295 -0.5328910 -0.3668244 -0.4939342 -2.0060170 -0.6025754 -0.3358903 -0.4316502 -2.5922330 27 O -2.4920295 0.5328910 -0.3668244 0.4939342 -2.0060170 0.6025754 -0.3358903 0.4316502 -2.5922330 28 O -2.4920295 -0.5328910 -0.3668244 -0.4939342 -2.0060170 -0.6025754 -0.3358903 -0.4316502 -2.5922330 29 O -1.7610546 0.7160894 0.3547485 0.3113738 -2.7182758 -0.8474369 0.0663504 -0.4268602 -1.9586907 30 O -1.7610546 -0.7160894 0.3547485 -0.3113738 -2.7182758 0.8474369 0.0663504 0.4268602 -1.9586907 31 O -1.7610546 0.7160894 0.3547485 0.3113738 -2.7182758 -0.8474369 0.0663504 -0.4268602 -1.9586907 32 O -1.7610546 -0.7160894 0.3547485 -0.3113738 -2.7182758 0.8474369 0.0663504 0.4268602 -1.9586907 33 O -4.5548079 0.0000000 0.9966575 0.0000000 -1.8983596 0.0000000 1.5426388 0.0000000 -1.7146611 34 O -4.5548079 0.0000000 0.9966575 0.0000000 -1.8983596 0.0000000 1.5426388 0.0000000 -1.7146611 ---------------------------------------------------------------------------- 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) 153 eigenvectors found. (1) Complementary block size: 37 (1) Compute compressed projector. (1) Use standard solver. (1) 20 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) 238 eigenvectors found. (2) Block: 500 / 500 (2) 240 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 10 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 1152 / 1152 (1) 136 eigenvectors found. (1) Complementary block size: 44 (1) Compute compressed projector. (1) Use standard solver. (1) 28 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) 238 eigenvectors found. (2) Block: 500 / 500 (2) 240 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 10 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 1152 / 1152 (1) 136 eigenvectors found. (1) Complementary block size: 44 (1) Compute compressed projector. (1) Use standard solver. (1) 28 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, 28), data: (1152, 44) @ (44, 28) |-- (152, 136), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), 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, 28), data: (1152, 44) @ (44, 28) |-- (152, 136), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), 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, 20), data: (1160, 37) @ (37, 20) |-- (160, 153), 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: 2.766 Solver_block: 200 / 1040 - Time: 2.469 Solver_block: 300 / 1040 - Time: 3.151 Solver_block: 400 / 1040 - Time: 3.398 Solver_block: 500 / 1040 - Time: 2.601 Solver_block: 600 / 1040 - Time: 3.283 Solver_block: 700 / 1040 - Time: 2.955 Solver_block: 800 / 1040 - Time: 3.250 Solver_block: 900 / 1040 - Time: 3.108 Solver_block: 1000 / 1040 - Time: 3.124 Solver_block: 1040 / 1040 - Time: 1.160 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 32.654 --------------------------------- 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) 153 eigenvectors found. (1) Complementary block size: 37 (1) Compute compressed projector. (1) Use standard solver. (1) 20 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) 238 eigenvectors found. (2) Block: 500 / 500 (2) 240 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 10 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 1152 / 1152 (1) 136 eigenvectors found. (1) Complementary block size: 44 (1) Compute compressed projector. (1) Use standard solver. (1) 28 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) 238 eigenvectors found. (2) Block: 500 / 500 (2) 240 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 10 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 1152 / 1152 (1) 136 eigenvectors found. (1) Complementary block size: 44 (1) Compute compressed projector. (1) Use standard solver. (1) 28 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, 28), data: (1152, 44) @ (44, 28) |-- (152, 136), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), 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, 28), data: (1152, 44) @ (44, 28) |-- (152, 136), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), 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, 20), data: (1160, 37) @ (37, 20) |-- (160, 153), 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 10:36:52]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 10:36:52]------------------------- 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 6.063618720001768 -2.510442505000000 0.000000000000000 b 6.063618720001768 2.510442505000000 0.000000000000000 c -4.477639085396406 0.000000000000000 15.133371501011576 Atomic positions (fractional): 1 Lu 0.86863824976519 0.37059125602206 0.03623370908250 174.967 2 Lu 0.62940874397794 0.13136175023482 0.46376629091750 174.967 3 Lu 0.13136175023481 0.62940874397794 0.96376629091750 174.967 4 Lu 0.37059125602206 0.86863824976519 0.53623370908250 174.967 5 Te 0.83755237321907 0.40693363048702 0.37214422275556 127.600 6 Te 0.59306636951298 0.16244762678093 0.12785577724444 127.600 7 Te 0.16244762678093 0.59306636951298 0.62785577724444 127.600 8 Te 0.40693363048702 0.83755237321907 0.87214422275556 127.600 9 Te 0.40598152418059 0.84664584556384 0.20042118232232 127.600 10 Te 0.15335415443616 0.59401847581941 0.29957881767768 127.600 11 Te 0.59401847581941 0.15335415443616 0.79957881767768 127.600 12 Te 0.84664584556384 0.40598152418059 0.70042118232232 127.600 13 O 0.19234221446075 0.31229120930709 0.37100603558389 15.999 14 O 0.68770879069291 0.80765778553925 0.12899396441611 15.999 15 O 0.80765778553925 0.68770879069291 0.62899396441611 15.999 16 O 0.31229120930709 0.19234221446075 0.87100603558389 15.999 17 O 0.65907047553448 0.75763577753010 0.44854965106514 15.999 18 O 0.24236422246990 0.34092952446552 0.05145034893486 15.999 19 O 0.34092952446552 0.24236422246990 0.55145034893486 15.999 20 O 0.75763577753010 0.65907047553448 0.94854965106514 15.999 21 O 0.96495259706869 0.16819125812798 0.45575765533408 15.999 22 O 0.83180874187202 0.03504740293131 0.04424234466592 15.999 23 O 0.03504740293131 0.83180874187202 0.54424234466592 15.999 24 O 0.16819125812798 0.96495259706869 0.95575765533408 15.999 25 O 0.40375959257044 0.54987097335518 0.40626795273025 15.999 26 O 0.45012902664482 0.59624040742956 0.09373204726975 15.999 27 O 0.59624040742956 0.45012902664482 0.59373204726975 15.999 28 O 0.54987097335518 0.40375959257044 0.90626795273025 15.999 29 O 0.78104916812377 0.91360237546290 0.33228190564332 15.999 30 O 0.08639762453710 0.21895083187623 0.16771809435668 15.999 31 O 0.21895083187623 0.08639762453710 0.66771809435668 15.999 32 O 0.91360237546290 0.78104916812377 0.83228190564332 15.999 33 O 0.13447470295929 0.86552529704071 0.25000000000000 15.999 34 O 0.86552529704071 0.13447470295930 0.75000000000000 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.127237440003537 0.000000000000000 0.000000000000000 b 0.000000000000000 10.041770020000000 0.000000000000000 c -4.477639085396406 0.000000000000000 15.133371501011576 Atomic positions (fractional): 1 Lu 0.61961475289362 0.37548825156422 0.03623370908250 174.967 > 1 2 Lu 0.61961475289362 0.87548825156422 0.03623370908250 174.967 > 1 3 Lu 0.88038524710638 0.12548825156422 0.46376629091750 174.967 > 3 4 Lu 0.88038524710638 0.62548825156422 0.46376629091750 174.967 > 3 5 Lu 0.38038524710638 0.12451174843578 0.96376629091750 174.967 > 5 6 Lu 0.38038524710638 0.62451174843578 0.96376629091750 174.967 > 5 7 Lu 0.11961475289362 0.37451174843578 0.53623370908250 174.967 > 7 8 Lu 0.11961475289362 0.87451174843578 0.53623370908250 174.967 > 7 9 Lu 0.11961475289362 0.12548825156422 0.03623370908250 174.967 > 1 10 Lu 0.11961475289362 0.62548825156422 0.03623370908250 174.967 > 1 11 Lu 0.38038524710638 0.37548825156422 0.46376629091750 174.967 > 3 12 Lu 0.38038524710638 0.87548825156422 0.46376629091750 174.967 > 3 13 Lu 0.88038524710638 0.37451174843578 0.96376629091750 174.967 > 5 14 Lu 0.88038524710638 0.87451174843578 0.96376629091750 174.967 > 5 15 Lu 0.61961475289362 0.12451174843578 0.53623370908250 174.967 > 7 16 Lu 0.61961475289362 0.62451174843578 0.53623370908250 174.967 > 7 17 Te 0.12224300185304 0.14234531431699 0.37214422275556 127.600 > 17 18 Te 0.12224300185304 0.64234531431699 0.37214422275556 127.600 > 17 19 Te 0.87775699814695 0.14234531431699 0.12785577724444 127.600 > 19 20 Te 0.87775699814695 0.64234531431699 0.12785577724444 127.600 > 19 21 Te 0.87775699814695 0.35765468568301 0.62785577724444 127.600 > 21 22 Te 0.87775699814695 0.85765468568301 0.62785577724444 127.600 > 21 23 Te 0.12224300185304 0.35765468568301 0.87214422275556 127.600 > 23 24 Te 0.12224300185304 0.85765468568301 0.87214422275556 127.600 > 23 25 Te 0.62631368487221 0.11016608034581 0.20042118232232 127.600 > 25 26 Te 0.62631368487221 0.61016608034581 0.20042118232232 127.600 > 25 27 Te 0.87368631512779 0.36016608034581 0.29957881767768 127.600 > 27 28 Te 0.87368631512779 0.86016608034581 0.29957881767768 127.600 > 27 29 Te 0.37368631512779 0.38983391965419 0.79957881767768 127.600 > 29 30 Te 0.37368631512779 0.88983391965419 0.79957881767768 127.600 > 29 31 Te 0.12631368487221 0.13983391965419 0.70042118232232 127.600 > 31 32 Te 0.12631368487221 0.63983391965419 0.70042118232232 127.600 > 31 33 Te 0.62224300185305 0.39234531431699 0.37214422275556 127.600 > 17 34 Te 0.62224300185305 0.89234531431699 0.37214422275556 127.600 > 17 35 Te 0.37775699814696 0.39234531431699 0.12785577724444 127.600 > 19 36 Te 0.37775699814696 0.89234531431699 0.12785577724444 127.600 > 19 37 Te 0.37775699814696 0.10765468568301 0.62785577724444 127.600 > 21 38 Te 0.37775699814696 0.60765468568301 0.62785577724444 127.600 > 21 39 Te 0.62224300185305 0.10765468568301 0.87214422275556 127.600 > 23 40 Te 0.62224300185305 0.60765468568301 0.87214422275556 127.600 > 23 41 Te 0.12631368487221 0.36016608034581 0.20042118232232 127.600 > 25 42 Te 0.12631368487221 0.86016608034581 0.20042118232232 127.600 > 25 43 Te 0.37368631512779 0.11016608034581 0.29957881767768 127.600 > 27 44 Te 0.37368631512779 0.61016608034581 0.29957881767768 127.600 > 27 45 Te 0.87368631512779 0.13983391965419 0.79957881767768 127.600 > 29 46 Te 0.87368631512779 0.63983391965419 0.79957881767768 127.600 > 29 47 Te 0.62631368487221 0.38983391965419 0.70042118232232 127.600 > 31 48 Te 0.62631368487221 0.88983391965419 0.70042118232232 127.600 > 31 49 O 0.75231671188392 0.27998724871159 0.37100603558389 15.999 > 49 50 O 0.75231671188392 0.77998724871159 0.37100603558389 15.999 > 49 51 O 0.74768328811608 0.02998724871159 0.12899396441611 15.999 > 51 52 O 0.74768328811608 0.52998724871159 0.12899396441611 15.999 > 51 53 O 0.24768328811608 0.22001275128841 0.62899396441611 15.999 > 53 54 O 0.24768328811608 0.72001275128841 0.62899396441611 15.999 > 53 55 O 0.25231671188392 0.47001275128841 0.87100603558389 15.999 > 55 56 O 0.25231671188392 0.97001275128841 0.87100603558389 15.999 > 55 57 O 0.20835312653229 0.27464132549891 0.44854965106514 15.999 > 57 58 O 0.20835312653229 0.77464132549891 0.44854965106514 15.999 > 57 59 O 0.79164687346771 0.27464132549891 0.05145034893486 15.999 > 59 60 O 0.79164687346771 0.77464132549891 0.05145034893486 15.999 > 59 61 O 0.79164687346771 0.22535867450109 0.55145034893486 15.999 > 61 62 O 0.79164687346771 0.72535867450109 0.55145034893486 15.999 > 61 63 O 0.20835312653229 0.22535867450109 0.94854965106514 15.999 > 63 64 O 0.20835312653229 0.72535867450109 0.94854965106514 15.999 > 63 65 O 0.06657192759833 0.05080966526482 0.45575765533408 15.999 > 65 66 O 0.06657192759833 0.55080966526482 0.45575765533408 15.999 > 65 67 O 0.93342807240167 0.05080966526482 0.04424234466592 15.999 > 67 68 O 0.93342807240167 0.55080966526482 0.04424234466592 15.999 > 67 69 O 0.93342807240167 0.44919033473518 0.54424234466592 15.999 > 69 70 O 0.93342807240167 0.94919033473518 0.54424234466592 15.999 > 69 71 O 0.06657192759833 0.44919033473518 0.95575765533408 15.999 > 71 72 O 0.06657192759833 0.94919033473518 0.95575765533408 15.999 > 71 73 O 0.97681528296281 0.28652784519618 0.40626795273025 15.999 > 73 74 O 0.97681528296281 0.78652784519618 0.40626795273025 15.999 > 73 75 O 0.02318471703719 0.28652784519618 0.09373204726975 15.999 > 75 76 O 0.02318471703719 0.78652784519618 0.09373204726975 15.999 > 75 77 O 0.02318471703719 0.21347215480382 0.59373204726975 15.999 > 77 78 O 0.02318471703719 0.71347215480382 0.59373204726975 15.999 > 77 79 O 0.97681528296281 0.21347215480382 0.90626795273025 15.999 > 79 80 O 0.97681528296281 0.71347215480382 0.90626795273025 15.999 > 79 81 O 0.84732577179334 0.03313830183478 0.33228190564332 15.999 > 81 82 O 0.84732577179334 0.53313830183478 0.33228190564332 15.999 > 81 83 O 0.65267422820666 0.28313830183478 0.16771809435668 15.999 > 83 84 O 0.65267422820666 0.78313830183478 0.16771809435668 15.999 > 83 85 O 0.15267422820666 0.46686169816522 0.66771809435668 15.999 > 85 86 O 0.15267422820666 0.96686169816522 0.66771809435668 15.999 > 85 87 O 0.34732577179334 0.21686169816522 0.83228190564332 15.999 > 87 88 O 0.34732577179334 0.71686169816522 0.83228190564332 15.999 > 87 89 O 0.00000000000000 0.43276264852035 0.25000000000000 15.999 > 89 90 O 0.00000000000000 0.93276264852035 0.25000000000000 15.999 > 89 91 O 0.00000000000000 0.06723735147965 0.75000000000000 15.999 > 91 92 O 0.00000000000000 0.56723735147965 0.75000000000000 15.999 > 91 93 O 0.25231671188392 0.02998724871159 0.37100603558389 15.999 > 49 94 O 0.25231671188392 0.52998724871159 0.37100603558389 15.999 > 49 95 O 0.24768328811608 0.27998724871159 0.12899396441611 15.999 > 51 96 O 0.24768328811608 0.77998724871159 0.12899396441611 15.999 > 51 97 O 0.74768328811608 0.47001275128841 0.62899396441611 15.999 > 53 98 O 0.74768328811608 0.97001275128841 0.62899396441611 15.999 > 53 99 O 0.75231671188392 0.22001275128841 0.87100603558389 15.999 > 55 100 O 0.75231671188392 0.72001275128841 0.87100603558389 15.999 > 55 101 O 0.70835312653229 0.02464132549891 0.44854965106514 15.999 > 57 102 O 0.70835312653229 0.52464132549891 0.44854965106514 15.999 > 57 103 O 0.29164687346771 0.02464132549891 0.05145034893486 15.999 > 59 104 O 0.29164687346771 0.52464132549891 0.05145034893486 15.999 > 59 105 O 0.29164687346771 0.47535867450109 0.55145034893486 15.999 > 61 106 O 0.29164687346771 0.97535867450109 0.55145034893486 15.999 > 61 107 O 0.70835312653229 0.47535867450109 0.94854965106514 15.999 > 63 108 O 0.70835312653229 0.97535867450109 0.94854965106514 15.999 > 63 109 O 0.56657192759833 0.30080966526482 0.45575765533408 15.999 > 65 110 O 0.56657192759833 0.80080966526482 0.45575765533408 15.999 > 65 111 O 0.43342807240167 0.30080966526482 0.04424234466592 15.999 > 67 112 O 0.43342807240167 0.80080966526482 0.04424234466592 15.999 > 67 113 O 0.43342807240167 0.19919033473518 0.54424234466592 15.999 > 69 114 O 0.43342807240167 0.69919033473518 0.54424234466592 15.999 > 69 115 O 0.56657192759833 0.19919033473518 0.95575765533408 15.999 > 71 116 O 0.56657192759833 0.69919033473518 0.95575765533408 15.999 > 71 117 O 0.47681528296281 0.03652784519618 0.40626795273025 15.999 > 73 118 O 0.47681528296281 0.53652784519618 0.40626795273025 15.999 > 73 119 O 0.52318471703719 0.03652784519618 0.09373204726975 15.999 > 75 120 O 0.52318471703719 0.53652784519618 0.09373204726975 15.999 > 75 121 O 0.52318471703719 0.46347215480382 0.59373204726975 15.999 > 77 122 O 0.52318471703719 0.96347215480382 0.59373204726975 15.999 > 77 123 O 0.47681528296281 0.46347215480382 0.90626795273025 15.999 > 79 124 O 0.47681528296281 0.96347215480382 0.90626795273025 15.999 > 79 125 O 0.34732577179334 0.28313830183478 0.33228190564332 15.999 > 81 126 O 0.34732577179334 0.78313830183478 0.33228190564332 15.999 > 81 127 O 0.15267422820666 0.03313830183478 0.16771809435668 15.999 > 83 128 O 0.15267422820666 0.53313830183478 0.16771809435668 15.999 > 83 129 O 0.65267422820666 0.21686169816522 0.66771809435668 15.999 > 85 130 O 0.65267422820666 0.71686169816522 0.66771809435668 15.999 > 85 131 O 0.84732577179334 0.46686169816522 0.83228190564332 15.999 > 87 132 O 0.84732577179334 0.96686169816522 0.83228190564332 15.999 > 87 133 O 0.50000000000000 0.18276264852035 0.25000000000000 15.999 > 89 134 O 0.50000000000000 0.68276264852035 0.25000000000000 15.999 > 89 135 O 0.50000000000000 0.31723735147965 0.75000000000000 15.999 > 91 136 O 0.50000000000000 0.81723735147965 0.75000000000000 15.999 > 91 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.6326735 0.0000000 -0.5358690 0.0000000 5.0429985 0.0000000 -0.5358673 0.0000000 4.7567461 -------------------------- Born effective charges -------------------------- 1 Lu 3.9008862 -0.1580185 -0.4146188 0.0220197 4.3884238 -0.2188435 -0.2345890 0.1144970 4.6416049 2 Lu 3.9008862 0.1580185 -0.4146188 -0.0220197 4.3884238 0.2188435 -0.2345890 -0.1144970 4.6416049 3 Lu 3.9008862 -0.1580185 -0.4146188 0.0220197 4.3884238 -0.2188435 -0.2345890 0.1144970 4.6416049 4 Lu 3.9008862 0.1580185 -0.4146188 -0.0220197 4.3884238 0.2188435 -0.2345890 -0.1144970 4.6416049 5 Te 5.0110068 -1.0769782 -0.3196684 -0.5662940 4.1844388 0.6449743 -0.3671166 0.6303808 3.0616986 6 Te 5.0110068 1.0769782 -0.3196684 0.5662940 4.1844388 -0.6449743 -0.3671166 -0.6303808 3.0616986 7 Te 5.0110068 -1.0769782 -0.3196684 -0.5662940 4.1844388 0.6449743 -0.3671166 0.6303808 3.0616986 8 Te 5.0110068 1.0769782 -0.3196684 0.5662940 4.1844388 -0.6449743 -0.3671166 -0.6303808 3.0616986 9 Te 5.9307663 -0.8369277 -0.9743340 -0.2316101 3.6147070 0.6514660 -1.0079572 0.9357097 3.7090676 10 Te 5.9307663 0.8369277 -0.9743340 0.2316101 3.6147070 -0.6514660 -1.0079572 -0.9357097 3.7090676 11 Te 5.9307663 -0.8369277 -0.9743340 -0.2316101 3.6147070 0.6514660 -1.0079572 0.9357097 3.7090676 12 Te 5.9307663 0.8369277 -0.9743340 0.2316101 3.6147070 -0.6514660 -1.0079572 -0.9357097 3.7090676 13 O -3.9459487 0.7076221 0.4490628 0.9427997 -1.9956745 0.2747289 0.7867205 0.0160972 -1.6954003 14 O -3.9459487 -0.7076221 0.4490628 -0.9427997 -1.9956745 -0.2747289 0.7867205 -0.0160972 -1.6954003 15 O -3.9459487 0.7076221 0.4490628 0.9427997 -1.9956745 0.2747289 0.7867205 0.0160972 -1.6954003 16 O -3.9459487 -0.7076221 0.4490628 -0.9427997 -1.9956745 -0.2747289 0.7867205 -0.0160972 -1.6954003 17 O -2.1156277 -0.3568931 -0.0728503 -0.2847349 -2.2995694 -1.1948386 -0.1205769 -0.8563545 -2.0690570 18 O -2.1156277 0.3568931 -0.0728503 0.2847349 -2.2995694 1.1948386 -0.1205769 0.8563545 -2.0690570 19 O -2.1156277 -0.3568931 -0.0728503 -0.2847349 -2.2995694 -1.1948386 -0.1205769 -0.8563545 -2.0690570 20 O -2.1156277 0.3568931 -0.0728503 0.2847349 -2.2995694 1.1948386 -0.1205769 0.8563545 -2.0690570 21 O -2.2505949 -0.2552218 0.8461559 -0.3636002 -2.2188531 1.0613881 0.4417397 0.9311738 -2.2396595 22 O -2.2505949 0.2552218 0.8461559 0.3636002 -2.2188531 -1.0613881 0.4417397 -0.9311738 -2.2396595 23 O -2.2505949 -0.2552218 0.8461559 -0.3636002 -2.2188531 1.0613881 0.4417397 0.9311738 -2.2396595 24 O -2.2505949 0.2552218 0.8461559 0.3636002 -2.2188531 -1.0613881 0.4417397 -0.9311738 -2.2396595 25 O -2.4920295 0.5328910 -0.3668244 0.4939342 -2.0060170 0.6025754 -0.3358903 0.4316502 -2.5922330 26 O -2.4920295 -0.5328910 -0.3668244 -0.4939342 -2.0060170 -0.6025754 -0.3358903 -0.4316502 -2.5922330 27 O -2.4920295 0.5328910 -0.3668244 0.4939342 -2.0060170 0.6025754 -0.3358903 0.4316502 -2.5922330 28 O -2.4920295 -0.5328910 -0.3668244 -0.4939342 -2.0060170 -0.6025754 -0.3358903 -0.4316502 -2.5922330 29 O -1.7610546 0.7160894 0.3547485 0.3113738 -2.7182758 -0.8474369 0.0663504 -0.4268602 -1.9586907 30 O -1.7610546 -0.7160894 0.3547485 -0.3113738 -2.7182758 0.8474369 0.0663504 0.4268602 -1.9586907 31 O -1.7610546 0.7160894 0.3547485 0.3113738 -2.7182758 -0.8474369 0.0663504 -0.4268602 -1.9586907 32 O -1.7610546 -0.7160894 0.3547485 -0.3113738 -2.7182758 0.8474369 0.0663504 0.4268602 -1.9586907 33 O -4.5548079 0.0000000 0.9966575 0.0000000 -1.8983596 0.0000000 1.5426388 0.0000000 -1.7146611 34 O -4.5548079 0.0000000 0.9966575 0.0000000 -1.8983596 0.0000000 1.5426388 0.0000000 -1.7146611 ---------------------------------------------------------------------------- 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[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0028 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[ 57, 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[ 65, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0028 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] Computing fc3[ 81, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] Computing fc3[ 89, 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 (xyx) -0.00000000 (xyx) -0.00000000 (xxy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (xy) 0.00000000 (xy) 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 10:37:51]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 10:37:52]------------------------- 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 6.063618720001768 -2.510442505000000 0.000000000000000 b 6.063618720001768 2.510442505000000 0.000000000000000 c -4.477639085396406 0.000000000000000 15.133371501011576 Atomic positions (fractional): 1 Lu 0.86863824976519 0.37059125602206 0.03623370908250 174.967 2 Lu 0.62940874397794 0.13136175023482 0.46376629091750 174.967 3 Lu 0.13136175023481 0.62940874397794 0.96376629091750 174.967 4 Lu 0.37059125602206 0.86863824976519 0.53623370908250 174.967 5 Te 0.83755237321907 0.40693363048702 0.37214422275556 127.600 6 Te 0.59306636951298 0.16244762678093 0.12785577724444 127.600 7 Te 0.16244762678093 0.59306636951298 0.62785577724444 127.600 8 Te 0.40693363048702 0.83755237321907 0.87214422275556 127.600 9 Te 0.40598152418059 0.84664584556384 0.20042118232232 127.600 10 Te 0.15335415443616 0.59401847581941 0.29957881767768 127.600 11 Te 0.59401847581941 0.15335415443616 0.79957881767768 127.600 12 Te 0.84664584556384 0.40598152418059 0.70042118232232 127.600 13 O 0.19234221446075 0.31229120930709 0.37100603558389 15.999 14 O 0.68770879069291 0.80765778553925 0.12899396441611 15.999 15 O 0.80765778553925 0.68770879069291 0.62899396441611 15.999 16 O 0.31229120930709 0.19234221446075 0.87100603558389 15.999 17 O 0.65907047553448 0.75763577753010 0.44854965106514 15.999 18 O 0.24236422246990 0.34092952446552 0.05145034893486 15.999 19 O 0.34092952446552 0.24236422246990 0.55145034893486 15.999 20 O 0.75763577753010 0.65907047553448 0.94854965106514 15.999 21 O 0.96495259706869 0.16819125812798 0.45575765533408 15.999 22 O 0.83180874187202 0.03504740293131 0.04424234466592 15.999 23 O 0.03504740293131 0.83180874187202 0.54424234466592 15.999 24 O 0.16819125812798 0.96495259706869 0.95575765533408 15.999 25 O 0.40375959257044 0.54987097335518 0.40626795273025 15.999 26 O 0.45012902664482 0.59624040742956 0.09373204726975 15.999 27 O 0.59624040742956 0.45012902664482 0.59373204726975 15.999 28 O 0.54987097335518 0.40375959257044 0.90626795273025 15.999 29 O 0.78104916812377 0.91360237546290 0.33228190564332 15.999 30 O 0.08639762453710 0.21895083187623 0.16771809435668 15.999 31 O 0.21895083187623 0.08639762453710 0.66771809435668 15.999 32 O 0.91360237546290 0.78104916812377 0.83228190564332 15.999 33 O 0.13447470295929 0.86552529704071 0.25000000000000 15.999 34 O 0.86552529704071 0.13447470295930 0.75000000000000 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.127237440003537 0.000000000000000 0.000000000000000 b 0.000000000000000 10.041770020000000 0.000000000000000 c -4.477639085396406 0.000000000000000 15.133371501011576 Atomic positions (fractional): 1 Lu 0.61961475289362 0.37548825156422 0.03623370908250 174.967 > 1 2 Lu 0.61961475289362 0.87548825156422 0.03623370908250 174.967 > 1 3 Lu 0.88038524710638 0.12548825156422 0.46376629091750 174.967 > 3 4 Lu 0.88038524710638 0.62548825156422 0.46376629091750 174.967 > 3 5 Lu 0.38038524710638 0.12451174843578 0.96376629091750 174.967 > 5 6 Lu 0.38038524710638 0.62451174843578 0.96376629091750 174.967 > 5 7 Lu 0.11961475289362 0.37451174843578 0.53623370908250 174.967 > 7 8 Lu 0.11961475289362 0.87451174843578 0.53623370908250 174.967 > 7 9 Lu 0.11961475289362 0.12548825156422 0.03623370908250 174.967 > 1 10 Lu 0.11961475289362 0.62548825156422 0.03623370908250 174.967 > 1 11 Lu 0.38038524710638 0.37548825156422 0.46376629091750 174.967 > 3 12 Lu 0.38038524710638 0.87548825156422 0.46376629091750 174.967 > 3 13 Lu 0.88038524710638 0.37451174843578 0.96376629091750 174.967 > 5 14 Lu 0.88038524710638 0.87451174843578 0.96376629091750 174.967 > 5 15 Lu 0.61961475289362 0.12451174843578 0.53623370908250 174.967 > 7 16 Lu 0.61961475289362 0.62451174843578 0.53623370908250 174.967 > 7 17 Te 0.12224300185304 0.14234531431699 0.37214422275556 127.600 > 17 18 Te 0.12224300185304 0.64234531431699 0.37214422275556 127.600 > 17 19 Te 0.87775699814695 0.14234531431699 0.12785577724444 127.600 > 19 20 Te 0.87775699814695 0.64234531431699 0.12785577724444 127.600 > 19 21 Te 0.87775699814695 0.35765468568301 0.62785577724444 127.600 > 21 22 Te 0.87775699814695 0.85765468568301 0.62785577724444 127.600 > 21 23 Te 0.12224300185304 0.35765468568301 0.87214422275556 127.600 > 23 24 Te 0.12224300185304 0.85765468568301 0.87214422275556 127.600 > 23 25 Te 0.62631368487221 0.11016608034581 0.20042118232232 127.600 > 25 26 Te 0.62631368487221 0.61016608034581 0.20042118232232 127.600 > 25 27 Te 0.87368631512779 0.36016608034581 0.29957881767768 127.600 > 27 28 Te 0.87368631512779 0.86016608034581 0.29957881767768 127.600 > 27 29 Te 0.37368631512779 0.38983391965419 0.79957881767768 127.600 > 29 30 Te 0.37368631512779 0.88983391965419 0.79957881767768 127.600 > 29 31 Te 0.12631368487221 0.13983391965419 0.70042118232232 127.600 > 31 32 Te 0.12631368487221 0.63983391965419 0.70042118232232 127.600 > 31 33 Te 0.62224300185305 0.39234531431699 0.37214422275556 127.600 > 17 34 Te 0.62224300185305 0.89234531431699 0.37214422275556 127.600 > 17 35 Te 0.37775699814696 0.39234531431699 0.12785577724444 127.600 > 19 36 Te 0.37775699814696 0.89234531431699 0.12785577724444 127.600 > 19 37 Te 0.37775699814696 0.10765468568301 0.62785577724444 127.600 > 21 38 Te 0.37775699814696 0.60765468568301 0.62785577724444 127.600 > 21 39 Te 0.62224300185305 0.10765468568301 0.87214422275556 127.600 > 23 40 Te 0.62224300185305 0.60765468568301 0.87214422275556 127.600 > 23 41 Te 0.12631368487221 0.36016608034581 0.20042118232232 127.600 > 25 42 Te 0.12631368487221 0.86016608034581 0.20042118232232 127.600 > 25 43 Te 0.37368631512779 0.11016608034581 0.29957881767768 127.600 > 27 44 Te 0.37368631512779 0.61016608034581 0.29957881767768 127.600 > 27 45 Te 0.87368631512779 0.13983391965419 0.79957881767768 127.600 > 29 46 Te 0.87368631512779 0.63983391965419 0.79957881767768 127.600 > 29 47 Te 0.62631368487221 0.38983391965419 0.70042118232232 127.600 > 31 48 Te 0.62631368487221 0.88983391965419 0.70042118232232 127.600 > 31 49 O 0.75231671188392 0.27998724871159 0.37100603558389 15.999 > 49 50 O 0.75231671188392 0.77998724871159 0.37100603558389 15.999 > 49 51 O 0.74768328811608 0.02998724871159 0.12899396441611 15.999 > 51 52 O 0.74768328811608 0.52998724871159 0.12899396441611 15.999 > 51 53 O 0.24768328811608 0.22001275128841 0.62899396441611 15.999 > 53 54 O 0.24768328811608 0.72001275128841 0.62899396441611 15.999 > 53 55 O 0.25231671188392 0.47001275128841 0.87100603558389 15.999 > 55 56 O 0.25231671188392 0.97001275128841 0.87100603558389 15.999 > 55 57 O 0.20835312653229 0.27464132549891 0.44854965106514 15.999 > 57 58 O 0.20835312653229 0.77464132549891 0.44854965106514 15.999 > 57 59 O 0.79164687346771 0.27464132549891 0.05145034893486 15.999 > 59 60 O 0.79164687346771 0.77464132549891 0.05145034893486 15.999 > 59 61 O 0.79164687346771 0.22535867450109 0.55145034893486 15.999 > 61 62 O 0.79164687346771 0.72535867450109 0.55145034893486 15.999 > 61 63 O 0.20835312653229 0.22535867450109 0.94854965106514 15.999 > 63 64 O 0.20835312653229 0.72535867450109 0.94854965106514 15.999 > 63 65 O 0.06657192759833 0.05080966526482 0.45575765533408 15.999 > 65 66 O 0.06657192759833 0.55080966526482 0.45575765533408 15.999 > 65 67 O 0.93342807240167 0.05080966526482 0.04424234466592 15.999 > 67 68 O 0.93342807240167 0.55080966526482 0.04424234466592 15.999 > 67 69 O 0.93342807240167 0.44919033473518 0.54424234466592 15.999 > 69 70 O 0.93342807240167 0.94919033473518 0.54424234466592 15.999 > 69 71 O 0.06657192759833 0.44919033473518 0.95575765533408 15.999 > 71 72 O 0.06657192759833 0.94919033473518 0.95575765533408 15.999 > 71 73 O 0.97681528296281 0.28652784519618 0.40626795273025 15.999 > 73 74 O 0.97681528296281 0.78652784519618 0.40626795273025 15.999 > 73 75 O 0.02318471703719 0.28652784519618 0.09373204726975 15.999 > 75 76 O 0.02318471703719 0.78652784519618 0.09373204726975 15.999 > 75 77 O 0.02318471703719 0.21347215480382 0.59373204726975 15.999 > 77 78 O 0.02318471703719 0.71347215480382 0.59373204726975 15.999 > 77 79 O 0.97681528296281 0.21347215480382 0.90626795273025 15.999 > 79 80 O 0.97681528296281 0.71347215480382 0.90626795273025 15.999 > 79 81 O 0.84732577179334 0.03313830183478 0.33228190564332 15.999 > 81 82 O 0.84732577179334 0.53313830183478 0.33228190564332 15.999 > 81 83 O 0.65267422820666 0.28313830183478 0.16771809435668 15.999 > 83 84 O 0.65267422820666 0.78313830183478 0.16771809435668 15.999 > 83 85 O 0.15267422820666 0.46686169816522 0.66771809435668 15.999 > 85 86 O 0.15267422820666 0.96686169816522 0.66771809435668 15.999 > 85 87 O 0.34732577179334 0.21686169816522 0.83228190564332 15.999 > 87 88 O 0.34732577179334 0.71686169816522 0.83228190564332 15.999 > 87 89 O 0.00000000000000 0.43276264852035 0.25000000000000 15.999 > 89 90 O 0.00000000000000 0.93276264852035 0.25000000000000 15.999 > 89 91 O 0.00000000000000 0.06723735147965 0.75000000000000 15.999 > 91 92 O 0.00000000000000 0.56723735147965 0.75000000000000 15.999 > 91 93 O 0.25231671188392 0.02998724871159 0.37100603558389 15.999 > 49 94 O 0.25231671188392 0.52998724871159 0.37100603558389 15.999 > 49 95 O 0.24768328811608 0.27998724871159 0.12899396441611 15.999 > 51 96 O 0.24768328811608 0.77998724871159 0.12899396441611 15.999 > 51 97 O 0.74768328811608 0.47001275128841 0.62899396441611 15.999 > 53 98 O 0.74768328811608 0.97001275128841 0.62899396441611 15.999 > 53 99 O 0.75231671188392 0.22001275128841 0.87100603558389 15.999 > 55 100 O 0.75231671188392 0.72001275128841 0.87100603558389 15.999 > 55 101 O 0.70835312653229 0.02464132549891 0.44854965106514 15.999 > 57 102 O 0.70835312653229 0.52464132549891 0.44854965106514 15.999 > 57 103 O 0.29164687346771 0.02464132549891 0.05145034893486 15.999 > 59 104 O 0.29164687346771 0.52464132549891 0.05145034893486 15.999 > 59 105 O 0.29164687346771 0.47535867450109 0.55145034893486 15.999 > 61 106 O 0.29164687346771 0.97535867450109 0.55145034893486 15.999 > 61 107 O 0.70835312653229 0.47535867450109 0.94854965106514 15.999 > 63 108 O 0.70835312653229 0.97535867450109 0.94854965106514 15.999 > 63 109 O 0.56657192759833 0.30080966526482 0.45575765533408 15.999 > 65 110 O 0.56657192759833 0.80080966526482 0.45575765533408 15.999 > 65 111 O 0.43342807240167 0.30080966526482 0.04424234466592 15.999 > 67 112 O 0.43342807240167 0.80080966526482 0.04424234466592 15.999 > 67 113 O 0.43342807240167 0.19919033473518 0.54424234466592 15.999 > 69 114 O 0.43342807240167 0.69919033473518 0.54424234466592 15.999 > 69 115 O 0.56657192759833 0.19919033473518 0.95575765533408 15.999 > 71 116 O 0.56657192759833 0.69919033473518 0.95575765533408 15.999 > 71 117 O 0.47681528296281 0.03652784519618 0.40626795273025 15.999 > 73 118 O 0.47681528296281 0.53652784519618 0.40626795273025 15.999 > 73 119 O 0.52318471703719 0.03652784519618 0.09373204726975 15.999 > 75 120 O 0.52318471703719 0.53652784519618 0.09373204726975 15.999 > 75 121 O 0.52318471703719 0.46347215480382 0.59373204726975 15.999 > 77 122 O 0.52318471703719 0.96347215480382 0.59373204726975 15.999 > 77 123 O 0.47681528296281 0.46347215480382 0.90626795273025 15.999 > 79 124 O 0.47681528296281 0.96347215480382 0.90626795273025 15.999 > 79 125 O 0.34732577179334 0.28313830183478 0.33228190564332 15.999 > 81 126 O 0.34732577179334 0.78313830183478 0.33228190564332 15.999 > 81 127 O 0.15267422820666 0.03313830183478 0.16771809435668 15.999 > 83 128 O 0.15267422820666 0.53313830183478 0.16771809435668 15.999 > 83 129 O 0.65267422820666 0.21686169816522 0.66771809435668 15.999 > 85 130 O 0.65267422820666 0.71686169816522 0.66771809435668 15.999 > 85 131 O 0.84732577179334 0.46686169816522 0.83228190564332 15.999 > 87 132 O 0.84732577179334 0.96686169816522 0.83228190564332 15.999 > 87 133 O 0.50000000000000 0.18276264852035 0.25000000000000 15.999 > 89 134 O 0.50000000000000 0.68276264852035 0.25000000000000 15.999 > 89 135 O 0.50000000000000 0.31723735147965 0.75000000000000 15.999 > 91 136 O 0.50000000000000 0.81723735147965 0.75000000000000 15.999 > 91 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 5.6326735 0.0000000 -0.5358690 0.0000000 5.0429985 0.0000000 -0.5358673 0.0000000 4.7567461 -------------------------- Born effective charges -------------------------- 1 Lu 3.9008862 -0.1580185 -0.4146188 0.0220197 4.3884238 -0.2188435 -0.2345890 0.1144970 4.6416049 2 Lu 3.9008862 0.1580185 -0.4146188 -0.0220197 4.3884238 0.2188435 -0.2345890 -0.1144970 4.6416049 3 Lu 3.9008862 -0.1580185 -0.4146188 0.0220197 4.3884238 -0.2188435 -0.2345890 0.1144970 4.6416049 4 Lu 3.9008862 0.1580185 -0.4146188 -0.0220197 4.3884238 0.2188435 -0.2345890 -0.1144970 4.6416049 5 Te 5.0110068 -1.0769782 -0.3196684 -0.5662940 4.1844388 0.6449743 -0.3671166 0.6303808 3.0616986 6 Te 5.0110068 1.0769782 -0.3196684 0.5662940 4.1844388 -0.6449743 -0.3671166 -0.6303808 3.0616986 7 Te 5.0110068 -1.0769782 -0.3196684 -0.5662940 4.1844388 0.6449743 -0.3671166 0.6303808 3.0616986 8 Te 5.0110068 1.0769782 -0.3196684 0.5662940 4.1844388 -0.6449743 -0.3671166 -0.6303808 3.0616986 9 Te 5.9307663 -0.8369277 -0.9743340 -0.2316101 3.6147070 0.6514660 -1.0079572 0.9357097 3.7090676 10 Te 5.9307663 0.8369277 -0.9743340 0.2316101 3.6147070 -0.6514660 -1.0079572 -0.9357097 3.7090676 11 Te 5.9307663 -0.8369277 -0.9743340 -0.2316101 3.6147070 0.6514660 -1.0079572 0.9357097 3.7090676 12 Te 5.9307663 0.8369277 -0.9743340 0.2316101 3.6147070 -0.6514660 -1.0079572 -0.9357097 3.7090676 13 O -3.9459487 0.7076221 0.4490628 0.9427997 -1.9956745 0.2747289 0.7867205 0.0160972 -1.6954003 14 O -3.9459487 -0.7076221 0.4490628 -0.9427997 -1.9956745 -0.2747289 0.7867205 -0.0160972 -1.6954003 15 O -3.9459487 0.7076221 0.4490628 0.9427997 -1.9956745 0.2747289 0.7867205 0.0160972 -1.6954003 16 O -3.9459487 -0.7076221 0.4490628 -0.9427997 -1.9956745 -0.2747289 0.7867205 -0.0160972 -1.6954003 17 O -2.1156277 -0.3568931 -0.0728503 -0.2847349 -2.2995694 -1.1948386 -0.1205769 -0.8563545 -2.0690570 18 O -2.1156277 0.3568931 -0.0728503 0.2847349 -2.2995694 1.1948386 -0.1205769 0.8563545 -2.0690570 19 O -2.1156277 -0.3568931 -0.0728503 -0.2847349 -2.2995694 -1.1948386 -0.1205769 -0.8563545 -2.0690570 20 O -2.1156277 0.3568931 -0.0728503 0.2847349 -2.2995694 1.1948386 -0.1205769 0.8563545 -2.0690570 21 O -2.2505949 -0.2552218 0.8461559 -0.3636002 -2.2188531 1.0613881 0.4417397 0.9311738 -2.2396595 22 O -2.2505949 0.2552218 0.8461559 0.3636002 -2.2188531 -1.0613881 0.4417397 -0.9311738 -2.2396595 23 O -2.2505949 -0.2552218 0.8461559 -0.3636002 -2.2188531 1.0613881 0.4417397 0.9311738 -2.2396595 24 O -2.2505949 0.2552218 0.8461559 0.3636002 -2.2188531 -1.0613881 0.4417397 -0.9311738 -2.2396595 25 O -2.4920295 0.5328910 -0.3668244 0.4939342 -2.0060170 0.6025754 -0.3358903 0.4316502 -2.5922330 26 O -2.4920295 -0.5328910 -0.3668244 -0.4939342 -2.0060170 -0.6025754 -0.3358903 -0.4316502 -2.5922330 27 O -2.4920295 0.5328910 -0.3668244 0.4939342 -2.0060170 0.6025754 -0.3358903 0.4316502 -2.5922330 28 O -2.4920295 -0.5328910 -0.3668244 -0.4939342 -2.0060170 -0.6025754 -0.3358903 -0.4316502 -2.5922330 29 O -1.7610546 0.7160894 0.3547485 0.3113738 -2.7182758 -0.8474369 0.0663504 -0.4268602 -1.9586907 30 O -1.7610546 -0.7160894 0.3547485 -0.3113738 -2.7182758 0.8474369 0.0663504 0.4268602 -1.9586907 31 O -1.7610546 0.7160894 0.3547485 0.3113738 -2.7182758 -0.8474369 0.0663504 -0.4268602 -1.9586907 32 O -1.7610546 -0.7160894 0.3547485 -0.3113738 -2.7182758 0.8474369 0.0663504 0.4268602 -1.9586907 33 O -4.5548079 0.0000000 0.9966575 0.0000000 -1.8983596 0.0000000 1.5426388 0.0000000 -1.7146611 34 O -4.5548079 0.0000000 0.9966575 0.0000000 -1.8983596 0.0000000 1.5426388 0.0000000 -1.7146611 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (xyx) -0.00000000 (xyx) -0.00000000 (xxy) 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: 0.54, Number of G-points: 311, Lambda: 0.13 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: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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 1.110 ( 0.000 0.000 0.000) 0.000 1.273 ( 0.000 0.000 0.000) 0.000 1.693 ( 0.000 0.000 0.000) 0.000 1.805 ( 0.000 0.000 0.000) 0.000 2.247 ( 0.000 0.000 0.000) 0.000 2.346 ( 0.000 0.000 0.000) 0.000 2.493 ( 0.000 0.000 0.000) 0.000 2.634 ( 0.000 0.000 0.000) 0.000 2.884 ( 0.000 0.000 0.000) 0.000 2.982 ( 0.000 0.000 0.000) 0.000 3.039 ( 0.000 0.000 0.000) 0.000 3.226 ( 0.000 0.000 0.000) 0.000 3.334 ( 0.000 0.000 0.000) 0.000 3.403 ( 0.000 0.000 0.000) 0.000 3.445 ( 0.000 0.000 0.000) 0.000 3.525 ( 0.000 0.000 0.000) 0.000 3.736 ( 0.000 0.000 0.000) 0.000 3.761 ( 0.000 0.000 0.000) 0.000 3.868 ( 0.000 0.000 0.000) 0.000 3.985 ( 0.000 0.000 0.000) 0.000 4.094 ( 0.000 0.000 0.000) 0.000 4.290 ( 0.000 0.000 0.000) 0.000 4.452 ( 0.000 0.000 0.000) 0.000 4.667 ( 0.000 0.000 0.000) 0.000 4.710 ( 0.000 0.000 0.000) 0.000 4.761 ( 0.000 0.000 0.000) 0.000 4.809 ( 0.000 0.000 0.000) 0.000 4.956 ( 0.000 0.000 0.000) 0.000 4.987 ( 0.000 0.000 0.000) 0.000 5.012 ( 0.000 0.000 0.000) 0.000 5.014 ( 0.000 0.000 0.000) 0.000 5.123 ( 0.000 0.000 0.000) 0.000 5.417 ( 0.000 0.000 0.000) 0.000 5.504 ( 0.000 0.000 0.000) 0.000 5.720 ( 0.000 0.000 0.000) 0.000 5.730 ( 0.000 0.000 0.000) 0.000 5.804 ( 0.000 0.000 0.000) 0.000 5.935 ( 0.000 0.000 0.000) 0.000 6.021 ( 0.000 0.000 0.000) 0.000 6.251 ( 0.000 0.000 0.000) 0.000 6.314 ( 0.000 0.000 0.000) 0.000 6.797 ( 0.000 0.000 0.000) 0.000 7.061 ( 0.000 0.000 0.000) 0.000 7.157 ( 0.000 0.000 0.000) 0.000 7.261 ( 0.000 0.000 0.000) 0.000 7.320 ( 0.000 0.000 0.000) 0.000 7.652 ( 0.000 0.000 0.000) 0.000 7.983 ( 0.000 0.000 0.000) 0.000 8.164 ( 0.000 0.000 0.000) 0.000 8.200 ( 0.000 0.000 0.000) 0.000 8.556 ( 0.000 0.000 0.000) 0.000 8.816 ( 0.000 0.000 0.000) 0.000 8.978 ( 0.000 0.000 0.000) 0.000 9.214 ( 0.000 0.000 0.000) 0.000 9.351 ( 0.000 0.000 0.000) 0.000 9.444 ( 0.000 0.000 0.000) 0.000 9.701 ( 0.000 0.000 0.000) 0.000 9.905 ( 0.000 0.000 0.000) 0.000 10.137 ( 0.000 0.000 0.000) 0.000 10.818 ( 0.000 0.000 0.000) 0.000 10.841 ( 0.000 0.000 0.000) 0.000 10.857 ( 0.000 0.000 0.000) 0.000 11.118 ( 0.000 0.000 0.000) 0.000 11.122 ( 0.000 0.000 0.000) 0.000 11.213 ( 0.000 0.000 0.000) 0.000 11.270 ( 0.000 0.000 0.000) 0.000 11.398 ( 0.000 0.000 0.000) 0.000 11.548 ( 0.000 0.000 0.000) 0.000 11.620 ( 0.000 0.000 0.000) 0.000 12.694 ( 0.000 0.000 0.000) 0.000 12.731 ( 0.000 0.000 0.000) 0.000 12.784 ( 0.000 0.000 0.000) 0.000 12.903 ( 0.000 0.000 0.000) 0.000 13.417 ( 0.000 0.000 0.000) 0.000 13.423 ( 0.000 0.000 0.000) 0.000 14.234 ( 0.000 0.000 0.000) 0.000 14.255 ( 0.000 0.000 0.000) 0.000 15.646 ( 0.000 0.000 0.000) 0.000 15.931 ( 0.000 0.000 0.000) 0.000 17.009 ( 0.000 0.000 0.000) 0.000 17.127 ( 0.000 0.000 0.000) 0.000 17.381 ( 0.000 0.000 0.000) 0.000 17.831 ( 0.000 0.000 0.000) 0.000 19.071 ( 0.000 0.000 0.000) 0.000 19.519 ( 0.000 0.000 0.000) 0.000 19.573 ( 0.000 0.000 0.000) 0.000 19.660 ( 0.000 0.000 0.000) 0.000 20.058 ( 0.000 0.000 0.000) 0.000 20.116 ( 0.000 0.000 0.000) 0.000 20.993 ( 0.000 0.000 0.000) 0.000 21.014 ( 0.000 0.000 0.000) 0.000 21.648 ( 0.000 0.000 0.000) 0.000 21.856 ( 0.000 0.000 0.000) 0.000 21.890 ( 0.000 0.000 0.000) 0.000 22.330 ( 0.000 0.000 0.000) 0.000 22.409 ( 0.000 0.000 0.000) 0.000 22.959 ( 0.000 0.000 0.000) 0.000 23.240 ( 0.000 0.000 0.000) 0.000 23.260 ( 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: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.389 ( 14.475 -16.153 1.037) 21.714 0.584 ( 7.784 -27.196 7.210) 29.192 0.836 ( 20.944 -36.038 -3.474) 41.826 1.268 ( 3.029 -7.085 -12.242) 14.465 1.281 ( -1.605 -7.636 5.469) 9.529 1.725 ( 2.697 5.525 -2.534) 6.650 1.790 ( 8.291 -4.462 10.487) 14.093 2.193 ( 12.149 7.554 -8.142) 16.461 2.530 ( 3.707 -11.564 -2.459) 12.390 2.619 ( 0.802 -10.313 -1.770) 10.494 2.686 ( 2.427 -4.308 3.415) 6.010 2.810 ( -2.302 6.825 -1.381) 7.334 2.944 ( 1.422 -3.179 -0.093) 3.484 3.135 ( -4.523 0.614 0.542) 4.597 3.231 ( 8.068 0.557 -4.500) 9.255 3.338 ( 0.913 1.774 0.763) 2.136 3.376 ( -1.981 1.470 -0.054) 2.467 3.463 ( 1.321 -1.348 1.276) 2.279 3.529 ( -0.273 -1.016 -0.123) 1.059 3.747 ( -1.794 -1.038 -1.333) 2.464 3.842 ( 0.251 0.935 -0.493) 1.087 3.939 ( -0.782 4.262 0.983) 4.443 4.003 ( -10.181 -7.315 -2.389) 12.762 4.108 ( -3.954 -2.531 0.755) 4.755 4.254 ( -3.427 3.075 3.021) 5.507 4.481 ( 0.770 6.317 2.577) 6.866 4.520 ( 9.339 10.483 -7.080) 15.724 4.706 ( 0.926 4.106 -1.613) 4.508 4.737 ( 2.268 3.701 -0.182) 4.345 4.790 ( 3.069 4.422 0.460) 5.402 4.932 ( -4.863 0.626 0.501) 4.929 4.986 ( -0.982 -0.336 -0.653) 1.226 5.099 ( 4.327 -4.422 -1.586) 6.387 5.135 ( 0.365 -4.221 -0.526) 4.270 5.298 ( -7.563 -4.361 -1.351) 8.834 5.358 ( -0.951 0.496 -3.964) 4.106 5.486 ( -4.188 -0.564 -3.585) 5.541 5.665 ( -7.333 1.618 1.161) 7.598 5.817 ( -2.116 -1.316 4.262) 4.937 5.898 ( 9.168 3.998 -3.164) 10.490 6.052 ( 0.006 -3.405 -0.089) 3.406 6.100 ( 36.423 10.423 2.717) 37.983 6.250 ( -2.200 -1.386 -2.393) 3.533 6.483 ( 14.432 4.103 1.145) 15.047 6.802 ( 3.157 1.093 1.653) 3.727 7.044 ( -3.455 1.116 -3.266) 4.883 7.149 ( 1.606 1.550 2.932) 3.685 7.315 ( 1.659 -1.251 -0.850) 2.244 7.609 ( -3.506 -6.180 0.393) 7.116 7.983 ( 24.524 13.535 -5.677) 28.581 8.026 ( 3.458 -2.046 1.274) 4.215 8.183 ( 2.494 -1.628 -3.570) 4.649 8.402 ( 4.071 5.246 8.484) 10.774 8.522 ( -3.521 9.167 8.197) 12.791 8.835 ( 6.234 1.675 -6.731) 9.326 9.066 ( 1.119 -6.032 4.740) 7.753 9.198 ( -4.491 -0.055 -1.205) 4.650 9.285 ( 0.138 4.549 -3.674) 5.849 9.539 ( 6.261 -5.472 -2.495) 8.682 9.820 ( 27.839 10.040 -18.590) 34.948 9.959 ( 3.801 -1.903 1.200) 4.417 10.105 ( 6.924 5.758 -0.413) 9.015 10.758 ( 0.650 7.674 -1.581) 7.862 10.803 ( -0.662 1.376 0.119) 1.532 10.976 ( -0.419 8.996 0.927) 9.054 10.997 ( -13.553 0.114 7.232) 15.362 11.142 ( 6.563 1.632 -6.916) 9.673 11.239 ( -7.600 -2.290 -0.805) 7.978 11.392 ( 5.809 -5.312 1.821) 8.080 11.566 ( 2.863 -0.327 0.593) 2.942 11.685 ( 8.742 -1.968 1.186) 9.039 11.834 ( 1.404 -1.817 -13.794) 13.984 12.687 ( -1.425 3.723 7.691) 8.663 12.765 ( 2.817 1.842 -0.908) 3.487 12.794 ( 11.412 2.768 0.913) 11.778 12.882 ( -1.664 5.043 0.003) 5.310 13.401 ( -0.477 1.276 -0.176) 1.374 13.431 ( -0.638 -0.991 0.159) 1.190 14.204 ( -0.033 3.424 0.332) 3.440 14.401 ( -7.761 0.356 0.547) 7.788 15.736 ( 23.133 7.178 -14.556) 28.259 15.963 ( 2.431 -1.192 4.090) 4.904 17.064 ( 0.497 -3.999 3.240) 5.170 17.410 ( 1.733 -2.579 -1.411) 3.413 17.718 ( -15.590 1.595 -2.074) 15.808 18.174 ( 25.032 5.272 -4.833) 26.034 19.065 ( -1.460 4.198 8.664) 9.737 19.410 ( 10.451 13.796 2.034) 17.426 19.502 ( -1.746 14.064 -1.250) 14.227 19.665 ( 4.085 9.879 0.291) 10.694 20.153 ( -18.651 -14.175 2.734) 23.585 20.646 ( 10.735 5.189 -0.132) 11.924 20.956 ( 4.231 -0.791 -6.936) 8.163 21.057 ( 5.898 -2.105 0.328) 6.271 21.740 ( 0.218 -8.541 3.450) 9.214 21.898 ( 0.781 -3.863 -0.350) 3.956 22.338 ( 0.708 -1.088 -0.355) 1.346 22.434 ( -0.072 -2.045 0.170) 2.054 22.947 ( -3.268 -1.208 0.934) 3.607 23.233 ( -1.233 0.233 -0.406) 1.319 23.282 ( -1.855 -2.907 -0.170) 3.453 23.516 ( -32.992 -14.871 -9.622) 37.446 ======================= Grid point 2 (3/102) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.805 ( 13.683 -17.473 1.278) 22.229 1.104 ( 5.011 -18.337 7.020) 20.264 1.206 ( 4.733 -1.387 0.811) 4.998 1.578 ( 7.303 -18.684 -3.153) 20.307 1.618 ( 12.858 -25.751 -3.960) 29.054 1.757 ( 6.962 -7.442 -10.972) 14.974 1.972 ( 10.373 -4.556 13.190) 17.387 2.183 ( 9.344 0.563 -4.238) 10.276 2.706 ( 1.453 -1.564 -2.132) 3.017 2.757 ( -0.344 -3.610 -1.876) 4.083 2.786 ( -0.118 -9.861 2.189) 10.102 2.838 ( 3.984 -7.459 2.157) 8.727 2.995 ( -1.852 3.728 0.158) 4.166 3.060 ( 2.066 -1.358 0.816) 2.603 3.223 ( -3.876 0.791 -0.190) 3.961 3.342 ( 2.440 -0.245 -2.224) 3.310 3.346 ( -1.999 0.010 -0.106) 2.002 3.473 ( -0.077 1.923 2.336) 3.026 3.565 ( 0.712 -1.996 -0.506) 2.179 3.722 ( -3.938 0.347 -5.293) 6.607 3.844 ( -1.054 -0.081 1.524) 1.855 3.849 ( -2.470 3.713 2.568) 5.146 4.023 ( -2.959 -1.863 -1.272) 3.720 4.107 ( -8.322 -2.104 -0.469) 8.596 4.138 ( -5.836 6.228 3.174) 9.106 4.343 ( -1.129 6.650 1.337) 6.877 4.445 ( 6.323 6.689 -0.084) 9.205 4.612 ( 6.032 4.439 -4.192) 8.583 4.720 ( 2.646 0.666 -0.106) 2.731 4.766 ( 4.051 1.643 2.332) 4.954 4.857 ( -7.676 0.804 -0.695) 7.749 5.002 ( 0.918 -0.813 -1.461) 1.907 5.178 ( -4.743 -0.477 5.510) 7.286 5.230 ( 2.587 -2.903 -2.277) 4.506 5.235 ( 0.650 -1.095 -3.556) 3.777 5.372 ( -7.679 -0.907 1.191) 7.823 5.511 ( 3.218 -4.675 -7.326) 9.267 5.579 ( -7.658 1.125 1.658) 7.916 5.819 ( -4.046 0.010 4.800) 6.277 5.888 ( 4.762 1.471 -0.200) 4.988 6.096 ( -1.792 -1.472 -1.361) 2.688 6.214 ( 14.804 -0.551 3.712) 15.272 6.293 ( 4.404 -3.751 -2.601) 6.343 6.519 ( 11.134 3.074 1.207) 11.614 6.798 ( -0.669 1.655 3.937) 4.323 6.979 ( 0.287 1.663 -5.726) 5.969 7.169 ( 4.502 -0.672 2.426) 5.158 7.353 ( 6.754 2.029 0.329) 7.060 7.671 ( 6.319 0.680 -0.546) 6.378 7.876 ( 9.173 10.390 -1.279) 13.918 8.106 ( 7.376 -1.395 -0.091) 7.508 8.240 ( 5.958 -1.150 -6.186) 8.665 8.351 ( -3.032 7.719 4.667) 9.516 8.378 ( 0.624 0.409 5.035) 5.090 8.798 ( 1.702 3.661 -6.825) 7.929 9.076 ( -7.863 3.385 1.796) 8.747 9.206 ( -2.722 -3.844 1.879) 5.071 9.271 ( 4.891 -0.735 -1.934) 5.310 9.650 ( 1.883 -2.737 0.293) 3.335 9.772 ( 2.754 4.622 -4.353) 6.921 10.048 ( 9.751 4.429 -4.510) 11.621 10.059 ( 4.224 -1.683 3.940) 6.016 10.607 ( -2.161 7.672 -0.868) 8.017 10.760 ( 0.964 3.517 0.013) 3.646 10.821 ( 1.023 4.532 0.712) 4.700 10.943 ( -8.172 -0.626 4.720) 9.457 11.163 ( 1.898 0.058 -2.888) 3.457 11.209 ( -3.811 -1.315 -2.771) 4.892 11.481 ( 4.942 -0.097 0.533) 4.971 11.599 ( 4.998 0.494 0.313) 5.032 11.750 ( 3.361 0.371 0.968) 3.517 11.894 ( 8.060 -1.881 -1.002) 8.337 12.616 ( -0.412 5.003 3.436) 6.084 12.723 ( -2.672 4.376 -2.680) 5.786 12.760 ( 4.197 5.530 0.382) 6.953 12.846 ( 3.721 -0.983 0.320) 3.862 13.378 ( -0.825 0.320 -0.156) 0.899 13.446 ( -1.463 -1.527 0.042) 2.115 14.113 ( 0.062 6.493 0.433) 6.508 14.310 ( -6.147 3.934 0.536) 7.317 15.752 ( 10.609 2.506 -6.417) 12.649 15.998 ( 1.558 0.481 4.668) 4.944 17.168 ( -3.729 -6.918 3.346) 8.542 17.489 ( 2.216 -4.699 -2.115) 5.609 17.610 ( -7.601 -0.903 -3.024) 8.231 18.202 ( 19.227 9.033 -2.230) 21.360 18.952 ( -6.901 7.193 3.094) 10.438 19.163 ( 3.021 18.746 -1.597) 19.055 19.276 ( 8.516 10.820 4.765) 14.571 19.489 ( 3.150 11.139 -3.147) 11.996 20.232 ( -14.669 -6.951 1.449) 16.297 20.457 ( -8.303 12.367 1.138) 14.940 21.151 ( 10.357 -1.696 -0.730) 10.521 21.177 ( 9.986 -13.613 -3.248) 17.193 21.934 ( 0.630 -10.413 3.976) 11.164 21.989 ( 0.772 -5.589 -1.296) 5.789 22.382 ( 0.862 -2.968 -1.461) 3.419 22.465 ( -0.179 -1.407 1.098) 1.794 22.941 ( -4.472 -0.834 1.351) 4.746 23.212 ( -1.880 0.565 -1.309) 2.359 23.324 ( -4.122 -3.923 0.301) 5.698 23.514 ( -15.413 -6.439 -3.183) 17.004 ======================= Grid point 3 (4/102) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.195 ( 9.059 -10.980 1.250) 14.289 1.235 ( 9.481 -10.528 0.357) 14.172 1.568 ( 7.310 -15.046 5.471) 17.600 1.766 ( 2.875 -6.993 -5.332) 9.252 1.961 ( 7.471 -11.681 -6.791) 15.440 2.174 ( 6.862 -15.702 -1.469) 17.199 2.186 ( 8.713 -8.685 8.194) 14.781 2.325 ( 11.653 -11.446 -3.750) 16.759 2.691 ( 1.972 8.513 2.353) 9.049 2.753 ( -1.953 -1.741 -0.551) 2.674 2.912 ( -0.579 1.935 1.000) 2.253 2.921 ( -2.764 -3.363 2.572) 5.056 3.033 ( 7.511 -8.525 -4.153) 12.097 3.106 ( -2.699 -0.564 3.505) 4.460 3.211 ( -1.160 -2.031 -2.390) 3.344 3.336 ( -2.837 0.154 -1.706) 3.314 3.341 ( -5.007 -1.563 0.426) 5.262 3.424 ( -0.778 1.948 1.501) 2.579 3.558 ( -0.968 2.810 0.461) 3.008 3.675 ( -3.091 0.758 -4.821) 5.777 3.785 ( -1.677 2.635 2.277) 3.865 3.841 ( -3.014 -1.873 -0.055) 3.548 4.000 ( -4.544 3.803 5.672) 8.202 4.007 ( -3.055 2.215 0.279) 3.784 4.125 ( 0.018 -4.864 -2.667) 5.547 4.243 ( 0.988 4.468 -0.297) 4.586 4.356 ( 0.547 4.112 -0.972) 4.261 4.625 ( 5.702 1.693 -1.335) 6.096 4.707 ( 3.742 3.372 1.498) 5.255 4.790 ( 1.955 0.465 0.392) 2.047 4.825 ( -4.338 -3.746 0.136) 5.733 5.027 ( 3.618 -0.428 -2.685) 4.526 5.116 ( -9.077 0.078 5.476) 10.601 5.252 ( -3.994 -0.921 -4.205) 5.872 5.273 ( -0.688 -0.427 0.508) 0.956 5.336 ( -0.747 -0.226 -1.625) 1.802 5.551 ( -3.996 -2.649 0.964) 4.890 5.622 ( 3.051 -5.447 -2.648) 6.782 5.776 ( -4.488 1.493 2.544) 5.371 5.926 ( 3.434 -2.185 -1.553) 4.356 6.091 ( -1.530 0.350 2.325) 2.805 6.323 ( 1.971 -3.525 1.946) 4.483 6.440 ( 13.087 -4.585 -0.245) 13.869 6.542 ( 10.457 3.342 -0.157) 10.979 6.751 ( -3.662 0.622 0.591) 3.761 6.992 ( 7.365 -0.416 -3.338) 8.096 7.246 ( 3.953 -2.800 1.904) 5.205 7.331 ( 9.288 6.228 1.231) 11.251 7.664 ( 9.128 6.319 -3.394) 11.609 7.772 ( 0.960 4.702 1.680) 5.084 8.159 ( 2.386 1.951 -0.949) 3.225 8.224 ( 5.946 2.972 -1.807) 6.889 8.278 ( 2.936 1.992 1.575) 3.882 8.418 ( 2.033 -1.650 3.125) 4.077 8.716 ( 0.127 4.527 -4.979) 6.730 8.959 ( -8.554 2.443 1.378) 9.002 9.201 ( -1.629 2.310 -0.597) 2.889 9.320 ( -3.178 -3.149 -0.195) 4.478 9.654 ( -5.318 4.063 4.584) 8.112 9.699 ( 0.191 0.660 -2.930) 3.010 9.971 ( 4.543 8.573 -0.006) 9.702 10.121 ( 3.516 0.850 -2.595) 4.452 10.495 ( -2.545 1.092 1.301) 3.060 10.731 ( 5.071 2.311 -0.493) 5.595 10.847 ( 2.382 -5.600 -1.143) 6.192 10.915 ( -3.795 -0.441 1.597) 4.141 11.138 ( -1.888 0.511 0.023) 1.956 11.245 ( 3.877 -1.572 -1.372) 4.403 11.506 ( 5.340 0.891 -0.259) 5.420 11.608 ( 5.535 3.037 0.247) 6.318 11.750 ( 2.257 2.198 1.315) 3.414 11.955 ( 3.263 0.574 0.644) 3.375 12.505 ( 0.655 7.668 0.344) 7.704 12.588 ( -4.228 5.153 1.656) 6.868 12.752 ( 4.843 0.353 -2.873) 5.642 12.884 ( 1.502 -0.726 0.858) 1.876 13.385 ( -0.142 -1.674 0.170) 1.688 13.468 ( -1.723 -2.473 -0.377) 3.037 13.979 ( -0.295 8.147 0.766) 8.188 14.178 ( -6.019 5.361 -0.009) 8.061 15.771 ( 5.977 1.163 -3.562) 7.054 15.988 ( -0.596 1.847 3.330) 3.855 17.236 ( -7.482 -4.296 1.841) 8.821 17.594 ( 0.624 -5.930 -2.312) 6.395 17.642 ( 2.363 -4.911 -1.475) 5.646 18.145 ( 13.455 9.899 1.142) 16.743 18.676 ( -6.377 15.590 -1.538) 16.914 18.953 ( 3.412 7.822 1.608) 8.684 19.175 ( 5.292 7.988 3.053) 10.057 19.323 ( 3.217 8.089 -3.452) 9.365 20.109 ( -6.144 12.514 0.844) 13.966 20.262 ( -12.520 -1.353 -0.030) 12.593 21.243 ( 6.375 -1.692 0.416) 6.609 21.491 ( 9.127 -12.329 -1.359) 15.399 22.067 ( 0.601 -4.793 -2.626) 5.498 22.139 ( 0.943 -7.590 3.502) 8.412 22.412 ( -0.748 -0.195 -0.824) 1.130 22.529 ( 1.106 -5.860 1.126) 6.069 22.915 ( -4.392 0.277 1.612) 4.687 23.175 ( -2.086 1.629 -2.269) 3.486 23.357 ( -4.960 -3.389 0.481) 6.026 23.500 ( -9.307 -2.766 -0.911) 9.752 ======================= Grid point 4 (5/102) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.460 ( 6.594 -14.391 -1.630) 15.914 1.519 ( 9.944 -7.473 -1.694) 12.554 1.775 ( 5.159 -6.924 -1.122) 8.707 1.984 ( 4.793 -10.520 3.428) 12.058 2.198 ( 3.465 -11.171 -3.220) 12.131 2.338 ( 0.877 -1.883 5.527) 5.905 2.403 ( 3.240 -5.915 -0.581) 6.769 2.555 ( 4.770 4.620 2.132) 6.975 2.612 ( 5.888 -5.949 -1.771) 8.556 2.753 ( 0.567 1.297 -3.089) 3.398 2.868 ( -0.354 2.413 1.324) 2.774 2.915 ( -2.758 0.096 1.275) 3.040 3.077 ( -8.391 -1.403 3.480) 9.192 3.183 ( 1.262 -2.427 -2.739) 3.871 3.229 ( 2.369 -0.700 -1.313) 2.798 3.279 ( -4.415 1.274 -1.396) 4.803 3.370 ( -3.220 -3.278 -0.544) 4.627 3.396 ( 0.078 2.402 1.227) 2.698 3.509 ( 1.855 0.425 0.657) 2.013 3.644 ( -2.035 -1.740 -2.880) 3.932 3.733 ( 1.167 3.245 1.358) 3.707 3.874 ( -0.082 -3.088 -0.455) 3.123 3.891 ( -5.357 4.302 3.813) 7.858 4.007 ( -2.975 -3.078 -1.561) 4.557 4.184 ( 0.164 0.950 1.716) 1.968 4.244 ( 6.723 -3.638 -3.309) 8.329 4.319 ( -0.154 0.359 -2.163) 2.198 4.564 ( -3.918 4.756 0.738) 6.206 4.673 ( 1.953 3.354 3.304) 5.097 4.830 ( 3.340 -2.459 1.453) 4.395 4.869 ( -1.586 -2.922 -0.723) 3.402 5.019 ( 3.021 3.402 1.218) 4.710 5.100 ( -4.903 -2.557 -2.434) 6.042 5.196 ( -8.331 0.183 -2.160) 8.609 5.270 ( -0.757 -0.615 1.955) 2.184 5.371 ( 4.978 -1.134 -0.828) 5.172 5.573 ( -4.165 -2.199 0.534) 4.740 5.725 ( -0.892 -2.116 -1.034) 2.518 5.736 ( -0.272 -1.959 0.986) 2.210 5.979 ( 2.176 -0.160 -4.790) 5.264 6.072 ( -2.341 0.227 6.124) 6.560 6.388 ( 0.719 -2.243 0.922) 2.529 6.556 ( 11.043 1.630 -2.093) 11.357 6.596 ( 3.962 -2.993 -0.155) 4.968 6.808 ( 6.905 -6.123 -0.076) 9.229 7.052 ( 5.586 -0.020 -2.119) 5.974 7.220 ( 1.982 4.965 -0.124) 5.348 7.396 ( 7.584 -2.555 6.117) 10.073 7.583 ( 5.520 6.787 -4.672) 9.918 7.718 ( 0.368 2.924 1.552) 3.331 8.095 ( -4.170 1.092 -1.553) 4.582 8.256 ( 2.200 2.840 0.519) 3.630 8.284 ( 16.155 1.537 -1.221) 16.274 8.458 ( -1.814 -1.957 3.166) 4.141 8.614 ( 0.146 5.705 -3.074) 6.483 8.870 ( -8.667 0.899 2.520) 9.071 9.120 ( -3.021 3.531 -3.064) 5.566 9.339 ( -5.501 -2.958 0.046) 6.246 9.485 ( -10.335 7.265 3.658) 13.152 9.712 ( 4.075 0.590 -1.687) 4.450 9.832 ( -1.444 6.246 -0.417) 6.424 10.090 ( 2.767 3.626 -0.533) 4.592 10.511 ( -1.006 -2.386 0.726) 2.689 10.739 ( 2.830 0.090 -1.041) 3.017 10.905 ( -0.386 -0.431 -1.639) 1.738 11.014 ( 3.727 -8.465 -0.002) 9.249 11.143 ( 0.249 -1.800 0.503) 1.885 11.295 ( 3.781 -0.367 1.888) 4.242 11.531 ( 5.725 1.378 -0.502) 5.910 11.589 ( 3.622 2.279 1.563) 4.555 11.704 ( 1.469 4.363 -1.161) 4.748 11.924 ( -2.163 2.931 0.098) 3.644 12.381 ( 1.286 6.021 0.397) 6.170 12.490 ( -2.116 3.480 1.223) 4.252 12.791 ( 3.401 -1.655 -2.604) 4.592 12.896 ( -0.076 0.297 1.139) 1.179 13.436 ( 1.334 -3.201 0.503) 3.504 13.514 ( -1.084 -3.934 -0.896) 4.178 13.828 ( -1.063 7.930 1.079) 8.073 14.035 ( -5.063 5.550 -0.412) 7.524 15.782 ( 3.270 0.836 -2.099) 3.975 15.949 ( -1.765 1.824 2.052) 3.264 17.239 ( -5.356 -1.688 0.387) 5.629 17.689 ( -2.236 -5.378 -2.617) 6.385 17.769 ( 4.939 -4.819 -0.055) 6.900 18.082 ( 9.097 6.251 4.896) 12.075 18.375 ( -4.312 11.609 -3.756) 12.941 18.882 ( 3.698 4.076 3.222) 6.377 19.063 ( 1.509 6.787 -2.851) 7.514 19.245 ( 3.776 3.642 0.209) 5.250 19.852 ( -6.343 9.436 0.539) 11.382 20.202 ( -6.474 0.439 -0.423) 6.503 21.307 ( 3.631 -1.082 0.452) 3.816 21.742 ( 6.035 -9.226 0.198) 11.027 22.137 ( 0.348 -3.079 -2.667) 4.088 22.218 ( 0.141 0.039 -0.200) 0.248 22.415 ( -0.938 -1.371 2.327) 2.859 22.679 ( 1.724 -8.546 0.798) 8.755 22.877 ( -3.214 0.939 1.440) 3.645 23.107 ( -2.220 3.513 -2.480) 4.839 23.378 ( -3.495 -2.445 0.405) 4.284 23.472 ( -5.787 -0.567 -0.206) 5.818 ======================= Grid point 5 (6/102) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.612 ( 3.422 -0.957 -1.035) 3.701 1.775 ( 4.096 -11.087 -3.703) 12.386 1.952 ( 2.223 -8.245 1.875) 8.743 2.143 ( 3.923 -1.098 0.889) 4.169 2.292 ( 3.161 5.577 0.204) 6.414 2.324 ( -7.142 1.680 2.427) 7.727 2.416 ( 3.490 -3.934 0.834) 5.325 2.619 ( -2.443 -0.460 1.447) 2.877 2.684 ( 0.689 0.742 -2.934) 3.104 2.720 ( 1.994 -4.561 -1.779) 5.287 2.799 ( 1.023 3.609 1.382) 3.998 2.974 ( 1.733 -2.941 -0.325) 3.429 3.055 ( -4.170 -0.912 1.365) 4.481 3.124 ( -3.487 4.507 2.335) 6.159 3.245 ( 0.447 -0.176 -0.328) 0.582 3.276 ( 1.329 -1.766 -3.054) 3.770 3.322 ( -0.516 3.424 0.245) 3.471 3.405 ( -1.489 -1.433 0.208) 2.076 3.574 ( 3.392 -3.599 -1.578) 5.191 3.685 ( -3.044 -2.929 0.638) 4.272 3.690 ( 3.939 3.161 -0.854) 5.122 3.771 ( -4.831 3.805 3.581) 7.116 3.976 ( 4.723 -4.290 -2.417) 6.823 4.027 ( -4.144 -1.885 -1.148) 4.695 4.178 ( -0.950 -0.230 0.904) 1.332 4.295 ( 0.724 1.948 -0.228) 2.091 4.337 ( 7.461 0.397 -1.871) 7.702 4.459 ( -7.998 0.353 0.960) 8.063 4.642 ( 0.529 1.385 1.884) 2.398 4.886 ( -1.910 -1.421 4.095) 4.737 4.921 ( 4.186 -2.313 -1.099) 4.907 4.983 ( 2.067 2.850 -2.158) 4.129 5.089 ( -2.341 -0.204 -1.583) 2.834 5.137 ( -5.058 -0.166 -0.396) 5.076 5.301 ( 0.972 -1.696 0.021) 1.954 5.402 ( 2.384 1.363 1.724) 3.243 5.586 ( -2.250 -2.151 -0.585) 3.167 5.708 ( -1.322 0.277 -0.713) 1.528 5.809 ( 1.321 -2.630 1.017) 3.114 5.920 ( -1.537 3.607 -1.070) 4.064 6.097 ( 0.026 -1.314 1.173) 1.762 6.420 ( 0.311 -0.738 0.313) 0.860 6.616 ( 5.637 0.126 -1.082) 5.741 6.668 ( 1.842 -3.955 -2.007) 4.802 6.919 ( -0.146 2.372 4.348) 4.955 7.086 ( 6.465 -3.792 -4.111) 8.549 7.204 ( 1.735 -0.449 -0.174) 1.800 7.409 ( -2.306 4.878 4.021) 6.730 7.569 ( 4.353 -2.797 -1.893) 5.509 7.663 ( -0.016 3.626 0.333) 3.641 8.081 ( -2.168 -2.080 -0.565) 3.057 8.211 ( 2.407 3.376 -0.381) 4.164 8.382 ( 12.910 0.041 -3.428) 13.358 8.461 ( -8.240 -0.221 4.825) 9.552 8.533 ( 1.798 1.683 -1.095) 2.695 8.808 ( -4.042 0.875 2.426) 4.795 9.043 ( -2.174 1.152 -4.113) 4.793 9.308 ( -6.086 4.129 2.778) 7.862 9.350 ( -2.155 -1.245 -0.193) 2.497 9.707 ( 3.812 2.549 -1.733) 4.903 9.763 ( -2.693 -0.132 0.726) 2.792 10.055 ( 1.086 1.569 0.291) 1.930 10.539 ( -0.343 -0.996 -0.001) 1.054 10.754 ( 1.014 -0.140 -0.500) 1.139 10.910 ( 0.234 -0.251 -0.878) 0.943 11.156 ( 2.300 -3.683 -0.599) 4.383 11.202 ( 0.210 -3.522 0.419) 3.553 11.305 ( 0.650 1.663 1.995) 2.677 11.537 ( 4.398 1.561 -0.373) 4.682 11.595 ( -1.250 -0.712 4.046) 4.295 11.634 ( 1.412 2.884 -4.332) 5.392 11.852 ( -1.692 2.226 -0.027) 2.796 12.318 ( 0.731 2.018 0.379) 2.179 12.438 ( -0.700 1.269 0.295) 1.479 12.841 ( 2.394 -1.791 -1.848) 3.515 12.880 ( -1.353 1.145 1.353) 2.230 13.510 ( 1.642 -2.819 0.277) 3.274 13.582 ( -0.339 -3.598 -0.892) 3.722 13.695 ( -0.965 5.366 0.964) 5.537 13.918 ( -2.443 3.243 -0.268) 4.069 15.783 ( 1.087 0.387 -0.778) 1.392 15.916 ( -0.959 0.723 0.766) 1.424 17.231 ( -1.734 -0.456 0.040) 1.794 17.735 ( -1.999 -2.093 -1.575) 3.295 17.853 ( 3.024 -0.905 0.270) 3.168 18.092 ( 4.030 -0.185 6.965) 8.049 18.188 ( -2.552 5.051 -6.037) 8.275 18.868 ( 2.020 0.900 3.050) 3.767 18.964 ( 0.188 3.329 -3.336) 4.717 19.226 ( 1.579 1.094 0.478) 1.979 19.700 ( -2.813 3.268 0.199) 4.317 20.157 ( -2.100 0.534 -0.234) 2.180 21.339 ( 1.162 -0.359 0.197) 1.232 21.910 ( 2.855 -4.894 0.643) 5.702 22.146 ( -1.141 1.666 -0.886) 2.205 22.201 ( 0.331 -0.126 -1.258) 1.307 22.442 ( -0.212 -0.935 1.313) 1.625 22.843 ( -1.156 -5.976 7.054) 9.317 22.849 ( 1.814 -0.841 -5.337) 5.700 23.005 ( -2.058 5.250 -1.741) 5.902 23.397 ( -0.864 -1.316 0.238) 1.592 23.439 ( -2.393 0.453 -0.126) 2.439 ======================= Grid point 12 (7/102) ======================= q-point: ( 0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.343 ( 23.326 -0.000 -0.659) 23.335 0.406 ( 26.570 -0.000 0.403) 26.573 0.777 ( 49.538 -0.000 4.277) 49.722 1.169 ( 7.371 -0.000 -0.798) 7.414 1.217 ( 1.437 -0.000 -13.491) 13.568 1.811 ( 1.660 -0.000 9.562) 9.705 1.881 ( 14.356 -0.000 7.857) 16.366 2.379 ( 5.644 -0.000 -15.644) 16.631 2.455 ( 13.173 -0.000 -1.196) 13.227 2.510 ( 1.528 -0.000 0.453) 1.594 2.685 ( 4.671 -0.000 5.242) 7.021 2.836 ( -6.606 0.000 -2.594) 7.097 2.959 ( -0.228 0.000 -0.537) 0.583 3.067 ( -6.706 0.000 -3.919) 7.767 3.311 ( 8.608 -0.000 -4.596) 9.758 3.350 ( -0.872 0.000 2.846) 2.977 3.373 ( -3.347 0.000 -0.994) 3.492 3.462 ( 1.000 -0.000 3.311) 3.458 3.521 ( 0.201 -0.000 0.346) 0.401 3.767 ( 1.600 -0.000 -3.242) 3.616 3.828 ( -0.252 0.000 -3.853) 3.861 3.847 ( -2.201 0.000 0.270) 2.218 3.967 ( -1.633 0.000 -1.673) 2.338 4.075 ( -2.707 0.000 2.358) 3.590 4.259 ( -4.200 0.000 4.549) 6.192 4.536 ( -9.492 0.000 4.219) 10.387 4.626 ( -2.388 0.000 -4.308) 4.925 4.791 ( -3.189 0.000 -3.045) 4.409 4.839 ( 6.633 -0.000 -1.141) 6.731 4.841 ( 6.774 -0.000 -4.616) 8.197 4.958 ( -2.548 0.000 -0.891) 2.699 4.966 ( -4.250 0.000 -7.229) 8.386 5.021 ( 3.083 -0.000 0.623) 3.146 5.029 ( 0.782 -0.000 4.397) 4.466 5.205 ( 7.116 -0.000 -6.654) 9.742 5.333 ( -12.234 0.000 -0.239) 12.236 5.458 ( -0.976 0.000 -4.712) 4.812 5.593 ( -12.701 0.000 1.382) 12.776 5.789 ( -4.893 0.000 8.330) 9.661 5.963 ( 3.650 -0.000 -0.776) 3.732 5.998 ( -1.779 0.000 0.554) 1.863 6.215 ( -0.840 0.000 -6.273) 6.329 6.465 ( 16.344 -0.000 1.627) 16.424 6.826 ( -1.802 0.000 -3.633) 4.055 6.892 ( 1.662 -0.000 -2.561) 3.053 6.955 ( -8.412 0.000 -2.966) 8.920 7.199 ( 1.807 -0.000 8.083) 8.282 7.357 ( 3.631 -0.000 -2.450) 4.381 7.421 ( 16.829 -0.000 -4.805) 17.502 8.037 ( 6.407 -0.000 1.127) 6.505 8.171 ( 6.776 -0.000 -14.650) 16.141 8.216 ( 2.077 -0.000 -0.044) 2.078 8.508 ( -5.863 0.000 2.435) 6.349 8.718 ( -20.818 0.000 41.653) 46.566 8.902 ( 12.213 -0.000 -6.858) 14.007 9.038 ( 0.539 -0.000 7.257) 7.277 9.157 ( -7.001 0.000 0.809) 7.048 9.284 ( -6.239 0.000 -3.521) 7.164 9.554 ( 11.547 -0.000 -4.676) 12.458 9.964 ( 6.115 -0.000 1.672) 6.339 10.179 ( 4.883 -0.000 1.820) 5.211 10.714 ( -18.084 0.000 8.661) 20.051 10.784 ( -5.775 0.000 -5.683) 8.102 10.794 ( 7.696 -0.000 -32.881) 33.769 10.915 ( -2.118 0.000 0.824) 2.272 11.057 ( -5.177 0.000 0.801) 5.239 11.267 ( 4.830 -0.000 1.011) 4.935 11.330 ( 3.838 -0.000 1.486) 4.115 11.419 ( 2.034 -0.000 4.228) 4.692 11.455 ( 19.917 -0.000 -71.169) 73.903 11.636 ( 12.678 -0.000 -12.798) 18.015 11.792 ( 16.415 -0.000 3.317) 16.747 12.645 ( -10.503 0.000 4.935) 11.604 12.800 ( -2.717 0.000 1.192) 2.967 12.915 ( 7.734 -0.000 -2.794) 8.223 13.247 ( 4.947 -0.000 -1.780) 5.257 13.411 ( -0.489 0.000 -0.887) 1.013 13.451 ( 3.897 -0.000 1.199) 4.078 14.234 ( -2.577 0.000 -0.193) 2.584 14.238 ( -2.035 0.000 1.471) 2.511 15.991 ( 3.600 -0.000 9.140) 9.824 16.142 ( 10.278 -0.000 -57.222) 58.137 17.108 ( -0.437 0.000 -3.155) 3.185 17.397 ( 2.639 -0.000 -2.076) 3.358 17.881 ( 5.929 -0.000 0.623) 5.961 18.251 ( 9.078 -0.000 -25.175) 26.762 19.231 ( -22.947 0.000 25.604) 34.383 19.338 ( -14.049 0.000 -1.479) 14.127 19.694 ( 7.723 -0.000 -2.193) 8.028 19.795 ( 8.195 -0.000 12.402) 14.865 20.190 ( 9.267 -0.000 -0.311) 9.272 20.969 ( -3.006 0.000 0.235) 3.015 20.988 ( -1.327 0.000 -5.003) 5.176 21.496 ( 34.623 -0.000 -104.786) 110.358 21.741 ( -22.605 0.000 71.464) 74.954 21.877 ( 1.599 -0.000 3.287) 3.655 21.918 ( 3.641 -0.000 -0.511) 3.676 22.346 ( 1.464 -0.000 0.287) 1.492 22.409 ( -0.236 0.000 0.503) 0.556 22.917 ( -5.863 0.000 2.675) 6.445 23.227 ( -1.770 0.000 -0.176) 1.778 23.251 ( -1.625 0.000 0.705) 1.772 ======================= Grid point 13 (8/102) ======================= q-point: ( 0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.650 ( 18.213 -12.852 2.073) 22.387 0.814 ( 17.619 -18.892 3.606) 26.083 1.237 ( 4.983 -1.556 -5.693) 7.724 1.328 ( 37.929 -18.090 -1.183) 42.038 1.373 ( 10.162 -13.220 -2.608) 16.877 1.788 ( 5.959 4.177 1.392) 7.409 2.031 ( 14.961 -1.714 10.400) 18.301 2.330 ( 10.485 5.639 -9.487) 15.223 2.606 ( 3.522 -8.765 2.206) 9.700 2.638 ( 5.206 -7.309 -3.936) 9.799 2.726 ( -5.733 3.222 -1.765) 6.809 2.772 ( 5.583 -3.996 4.598) 8.263 2.967 ( 1.213 -2.482 -1.018) 2.944 3.059 ( -5.420 -1.549 0.352) 5.648 3.281 ( -0.109 5.370 0.129) 5.373 3.317 ( -4.576 1.715 -1.004) 4.989 3.371 ( 1.648 -0.809 -0.534) 1.912 3.491 ( 0.607 -0.201 1.387) 1.527 3.545 ( 3.041 -1.947 0.896) 3.720 3.712 ( -1.811 3.049 -2.161) 4.152 3.827 ( -2.411 0.301 0.557) 2.493 3.891 ( -3.519 -5.346 -4.670) 7.923 3.937 ( 0.533 2.840 -0.928) 3.035 4.046 ( -5.327 0.480 1.910) 5.680 4.200 ( -5.368 4.280 5.216) 8.622 4.420 ( -4.651 3.664 3.526) 6.891 4.626 ( 5.008 5.610 -5.114) 9.095 4.692 ( -3.014 -1.299 -2.388) 4.059 4.748 ( -0.002 5.173 -0.813) 5.236 4.802 ( -3.167 5.197 -1.719) 6.324 4.872 ( -0.481 3.295 0.936) 3.458 5.008 ( 2.059 2.021 -0.791) 2.992 5.121 ( -1.413 -6.264 2.875) 7.036 5.142 ( 2.638 -7.490 -0.969) 8.000 5.238 ( -7.413 0.974 0.985) 7.541 5.276 ( -1.805 -3.435 -2.325) 4.523 5.426 ( -1.350 -1.523 -7.971) 8.226 5.525 ( -9.654 -0.716 1.087) 9.741 5.778 ( -6.900 -1.347 7.021) 9.936 5.954 ( 2.277 2.536 1.428) 3.695 6.023 ( -1.992 -3.331 -1.295) 4.092 6.220 ( 0.441 -1.840 -2.796) 3.376 6.504 ( 18.619 9.523 -1.827) 20.992 6.679 ( 6.575 5.330 2.389) 8.795 6.837 ( -3.423 2.818 0.584) 4.472 6.975 ( 2.950 -1.619 -4.535) 5.647 7.206 ( 2.336 0.931 5.751) 6.277 7.389 ( 4.146 -1.566 -0.715) 4.489 7.637 ( 6.564 -6.840 -2.450) 9.791 8.109 ( 3.917 -0.248 5.842) 7.038 8.183 ( 9.178 5.501 -7.626) 13.140 8.234 ( 8.438 -3.133 -9.765) 13.280 8.426 ( -4.517 4.150 3.925) 7.282 8.514 ( -7.154 10.478 18.329) 22.292 8.891 ( 1.936 5.871 -5.904) 8.549 9.078 ( -9.551 1.712 0.303) 9.708 9.125 ( 3.714 -2.644 6.053) 7.578 9.279 ( 1.870 -2.865 -0.888) 3.534 9.648 ( 9.115 -1.638 -3.340) 9.845 10.032 ( 8.543 -0.189 -3.816) 9.358 10.073 ( 8.258 17.093 -5.016) 19.634 10.318 ( 13.608 15.374 -7.747) 21.944 10.701 ( -10.778 1.895 -3.029) 11.355 10.797 ( 1.804 3.545 -0.625) 4.027 10.832 ( -7.715 2.059 3.974) 8.919 10.979 ( -1.105 4.944 0.661) 5.109 11.198 ( 5.359 3.697 -5.425) 8.475 11.199 ( 5.727 4.083 -3.822) 8.005 11.481 ( 5.758 -5.775 1.587) 8.309 11.654 ( 5.943 -1.373 1.505) 6.283 11.746 ( 5.751 -3.651 -12.062) 13.853 11.930 ( 10.493 -1.381 2.931) 10.982 12.597 ( -9.360 -1.601 4.141) 10.359 12.746 ( -6.165 1.897 -0.086) 6.451 12.940 ( 13.367 6.044 -1.062) 14.708 13.079 ( 16.708 15.379 -0.303) 22.710 13.386 ( -1.099 1.398 -0.583) 1.871 13.425 ( 0.091 1.295 0.932) 1.598 14.195 ( -1.723 2.926 0.718) 3.471 14.275 ( -8.038 -2.173 0.254) 8.331 15.926 ( 7.058 9.012 -15.657) 19.395 16.050 ( 3.670 1.634 5.779) 7.038 17.074 ( 0.445 -0.092 0.460) 0.647 17.441 ( 3.330 -2.584 -3.129) 5.249 17.646 ( 5.798 10.289 0.943) 11.847 18.408 ( 10.772 -1.063 -9.056) 14.113 19.002 ( -10.284 5.253 6.187) 13.101 19.404 ( -11.456 -0.435 -1.896) 11.620 19.629 ( 8.202 10.634 -1.016) 13.468 19.823 ( 12.853 14.886 10.250) 22.178 19.943 ( -2.784 9.446 -0.325) 9.853 20.697 ( -2.708 16.559 1.039) 16.811 21.009 ( 4.956 -7.510 -5.544) 10.569 21.241 ( 18.232 -0.004 -7.715) 19.797 21.768 ( -0.394 -8.765 8.111) 11.949 21.920 ( 2.335 -2.461 -0.280) 3.404 22.356 ( 2.196 -0.626 -1.210) 2.584 22.433 ( -0.374 -2.160 0.338) 2.218 22.848 ( -14.190 -17.586 -4.713) 23.083 22.932 ( -20.922 -21.512 -2.427) 30.107 23.208 ( -2.776 0.004 -0.796) 2.888 23.275 ( -3.321 -4.326 1.779) 5.737 ======================= Grid point 14 (9/102) ======================= q-point: ( 0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.035 ( 14.582 -14.742 2.969) 20.948 1.236 ( 7.709 -2.166 2.795) 8.481 1.307 ( 8.104 -16.427 5.767) 19.204 1.672 ( 9.855 -9.530 -8.212) 15.981 1.844 ( 13.666 -7.491 -4.887) 16.333 1.939 ( 23.065 -17.362 -2.905) 29.015 2.190 ( 11.714 -2.674 7.079) 13.946 2.313 ( 9.301 1.089 -4.226) 10.273 2.693 ( -0.489 -2.752 -0.712) 2.885 2.763 ( 2.006 -2.842 -2.836) 4.488 2.787 ( -3.138 -7.646 5.508) 9.932 2.932 ( 5.860 -7.586 1.698) 9.735 2.964 ( -1.963 3.007 1.586) 3.926 3.094 ( 2.023 -4.158 -0.351) 4.637 3.165 ( -4.462 4.008 0.351) 6.008 3.261 ( -5.589 -0.578 -1.187) 5.743 3.373 ( -0.346 2.072 0.937) 2.300 3.463 ( -1.538 2.544 -0.623) 3.037 3.599 ( 3.671 1.495 0.074) 3.965 3.639 ( -3.649 -0.230 -4.350) 5.682 3.799 ( -3.466 0.351 0.717) 3.557 3.844 ( -1.274 5.032 1.801) 5.494 3.961 ( -4.556 -4.788 -5.188) 8.403 4.005 ( -5.023 -0.581 3.425) 6.107 4.084 ( -2.857 4.358 4.064) 6.608 4.335 ( -0.784 4.796 1.536) 5.096 4.508 ( 2.484 9.239 -1.977) 9.770 4.682 ( 4.046 -0.268 -2.478) 4.752 4.722 ( -6.476 -0.469 -0.421) 6.506 4.764 ( 4.048 -1.864 -1.933) 4.858 4.830 ( -0.266 1.416 2.100) 2.547 4.964 ( -5.306 -0.320 -1.150) 5.439 5.122 ( -4.612 2.799 6.411) 8.379 5.210 ( -2.582 -0.993 -4.195) 5.025 5.243 ( -2.243 -1.251 -0.223) 2.578 5.314 ( 2.372 -3.048 -1.205) 4.046 5.464 ( -6.470 -3.803 0.281) 7.510 5.516 ( 0.314 -5.599 -4.874) 7.430 5.752 ( -7.662 -0.404 4.596) 8.944 5.939 ( 3.628 1.207 -0.106) 3.825 6.067 ( -0.916 -2.593 -0.170) 2.755 6.264 ( -0.137 -2.838 1.633) 3.277 6.525 ( 16.536 1.199 -2.548) 16.774 6.672 ( 3.395 3.576 3.586) 6.097 6.769 ( 2.020 1.900 -1.304) 3.065 7.032 ( 7.453 -0.760 -3.743) 8.375 7.237 ( 1.592 -1.163 3.067) 3.646 7.432 ( 2.507 -0.396 2.173) 3.342 7.742 ( 3.516 -1.433 -1.598) 4.120 8.000 ( 5.077 13.726 2.925) 14.924 8.194 ( 4.112 -0.195 -5.163) 6.603 8.288 ( -1.669 4.032 0.011) 4.364 8.358 ( 2.535 0.447 3.649) 4.465 8.439 ( 6.784 -0.586 2.507) 7.256 8.785 ( 0.303 4.536 -6.045) 7.564 8.937 ( -12.001 3.410 2.269) 12.681 9.187 ( 0.444 -0.305 1.619) 1.707 9.328 ( 2.623 0.720 0.239) 2.730 9.710 ( 5.851 0.198 -2.524) 6.375 9.791 ( 2.787 13.744 -5.533) 15.076 10.127 ( 4.872 -1.939 0.147) 5.245 10.196 ( 7.890 10.018 -1.234) 12.811 10.549 ( -6.365 5.109 2.730) 8.607 10.764 ( -4.598 -1.525 0.395) 4.860 10.797 ( 0.917 -0.211 0.330) 0.997 10.896 ( 1.095 3.198 0.283) 3.392 11.167 ( 3.090 2.150 0.252) 3.773 11.236 ( 6.800 -1.650 -5.103) 8.660 11.592 ( 9.701 0.141 -0.102) 9.702 11.704 ( 7.654 1.831 1.341) 7.983 11.800 ( 4.760 -0.446 -2.404) 5.351 11.994 ( 2.654 0.831 3.302) 4.317 12.564 ( -6.101 -0.043 1.562) 6.298 12.647 ( -4.812 4.071 -0.013) 6.303 12.896 ( 12.585 8.716 -1.030) 15.343 12.986 ( 12.773 8.025 0.173) 15.086 13.361 ( -1.241 -0.276 0.039) 1.272 13.414 ( -2.815 -1.162 0.059) 3.046 14.102 ( -2.153 5.952 0.670) 6.365 14.200 ( -8.270 2.840 0.199) 8.746 15.838 ( 3.141 3.017 -6.899) 8.159 16.031 ( -1.571 2.679 5.737) 6.523 17.111 ( -2.690 -3.843 0.635) 4.734 17.514 ( 2.122 -3.609 -2.590) 4.923 17.625 ( 8.841 -0.030 0.509) 8.856 18.399 ( 8.760 7.342 -3.027) 11.824 18.841 ( -8.676 7.265 2.345) 11.557 19.204 ( 1.520 14.392 -0.734) 14.491 19.444 ( 7.063 14.358 -1.054) 16.036 19.548 ( 9.368 16.637 1.129) 19.127 19.981 ( -17.465 -11.423 2.590) 21.028 20.361 ( -4.904 17.133 0.094) 17.821 21.249 ( 5.323 -10.707 1.362) 12.034 21.386 ( 16.505 -3.229 -6.305) 17.961 21.970 ( 0.425 -9.504 7.568) 12.156 21.995 ( 1.169 -5.631 -2.329) 6.205 22.391 ( 1.710 -1.485 -3.283) 3.988 22.467 ( -0.436 -2.294 2.122) 3.156 22.866 ( -5.855 -1.601 2.265) 6.479 23.130 ( -13.353 -11.408 -4.230) 18.064 23.184 ( -6.334 -2.135 -2.497) 7.135 23.343 ( -6.250 -5.763 2.129) 8.764 ======================= Grid point 15 (10/102) ======================= q-point: ( 0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.316 ( 6.913 -6.705 0.421) 9.639 1.411 ( 11.479 -12.584 2.280) 17.185 1.713 ( 7.964 -14.507 6.477) 17.772 1.808 ( 6.388 -4.220 -7.334) 10.602 2.071 ( 9.883 -7.745 -5.346) 13.647 2.264 ( 6.336 -7.508 -2.051) 10.036 2.344 ( 7.201 -4.573 4.919) 9.847 2.515 ( 14.439 -10.964 -3.412) 18.448 2.707 ( -1.964 5.323 0.786) 5.728 2.762 ( 2.793 -0.643 2.792) 4.002 2.850 ( -7.284 -2.120 3.784) 8.477 2.904 ( -1.940 2.090 1.564) 3.252 3.045 ( -4.441 1.083 2.724) 5.321 3.117 ( 5.069 -4.555 -4.843) 8.360 3.214 ( 0.912 -4.992 -2.450) 5.635 3.263 ( -3.574 -3.600 0.409) 5.089 3.292 ( -2.165 4.672 0.408) 5.166 3.412 ( -0.741 0.484 -1.137) 1.441 3.552 ( -0.398 1.992 -1.387) 2.460 3.636 ( 0.924 1.491 -2.026) 2.680 3.771 ( -2.353 0.948 1.463) 2.928 3.804 ( -2.434 -2.202 1.931) 3.808 3.898 ( -6.710 1.718 0.578) 6.951 3.990 ( -2.021 2.489 1.804) 3.679 4.127 ( 0.857 -7.647 -0.224) 7.698 4.247 ( -0.239 4.392 -0.567) 4.434 4.383 ( 2.116 5.240 -0.646) 5.688 4.645 ( -4.065 5.117 0.634) 6.566 4.707 ( -1.798 0.002 -0.282) 1.820 4.825 ( 1.994 -2.391 -0.073) 3.115 4.838 ( 5.573 -0.540 -0.589) 5.630 4.966 ( -8.124 -4.658 0.372) 9.372 5.074 ( -0.271 0.697 0.194) 0.772 5.146 ( -7.469 1.336 -1.786) 7.795 5.241 ( -3.320 -0.991 1.491) 3.772 5.371 ( 4.576 -1.561 -1.808) 5.161 5.509 ( -2.266 -3.521 0.059) 4.188 5.640 ( 1.635 -6.765 -2.012) 7.245 5.710 ( -5.182 -0.057 2.545) 5.773 5.965 ( 3.042 -1.000 -1.564) 3.563 6.088 ( -0.810 0.311 2.487) 2.634 6.326 ( -0.433 -3.678 2.152) 4.283 6.603 ( 2.424 1.675 -2.863) 4.108 6.681 ( 13.271 -1.148 -1.202) 13.374 6.799 ( 8.698 -0.623 1.692) 8.883 7.087 ( 6.412 -0.231 -3.482) 7.300 7.258 ( -1.659 -0.127 0.535) 1.748 7.468 ( 4.650 0.294 6.371) 7.893 7.743 ( 1.682 3.076 -2.591) 4.359 7.791 ( 0.908 10.954 0.440) 11.000 8.127 ( -2.736 5.454 -1.457) 6.273 8.248 ( -2.289 -1.310 1.708) 3.142 8.408 ( 4.010 -1.279 1.772) 4.567 8.505 ( 10.655 2.874 -1.233) 11.105 8.704 ( 1.123 4.580 -2.914) 5.543 8.812 ( -10.393 0.416 1.426) 10.499 9.156 ( -2.739 2.378 -0.899) 3.737 9.295 ( -0.522 2.565 0.598) 2.685 9.562 ( -6.813 9.489 -0.865) 11.714 9.742 ( 5.689 0.345 -1.652) 5.934 9.996 ( -1.500 11.347 0.977) 11.487 10.184 ( 6.656 2.425 -2.833) 7.629 10.488 ( -0.565 0.135 3.592) 3.639 10.743 ( -3.840 -0.997 -1.497) 4.240 10.881 ( 2.864 -0.348 -1.271) 3.152 10.898 ( 3.743 -6.143 1.599) 7.369 11.164 ( 4.750 1.433 0.188) 4.965 11.310 ( 5.269 -1.880 -1.553) 5.806 11.629 ( 11.442 4.166 -1.383) 12.255 11.705 ( 5.830 3.987 1.791) 7.287 11.819 ( 6.534 3.405 0.628) 7.395 11.958 ( -2.839 2.670 0.966) 4.015 12.506 ( -1.445 3.560 -1.236) 4.036 12.538 ( -2.517 4.926 2.611) 6.117 12.842 ( 8.571 4.775 -2.219) 10.059 12.950 ( 6.207 4.469 0.803) 7.690 13.390 ( 0.597 -3.041 0.989) 3.253 13.429 ( -3.129 -3.197 -1.026) 4.589 13.955 ( -3.529 7.704 0.643) 8.499 14.076 ( -7.165 4.061 0.069) 8.236 15.809 ( 0.727 0.845 -3.907) 4.063 15.970 ( -4.325 2.354 3.583) 6.090 17.158 ( -2.325 -3.252 0.166) 4.001 17.583 ( -1.073 -3.798 -1.801) 4.338 17.734 ( 9.141 -3.376 0.855) 9.782 18.302 ( 6.817 8.568 0.455) 10.959 18.592 ( -3.889 14.087 -0.399) 14.620 19.014 ( 3.370 8.220 1.700) 9.045 19.243 ( 3.135 11.051 -3.738) 12.080 19.388 ( 6.478 8.717 1.744) 11.000 20.025 ( -7.723 12.569 -1.072) 14.791 20.037 ( -13.925 -5.766 1.577) 15.154 21.389 ( 11.315 1.220 1.034) 11.428 21.602 ( 6.866 -10.326 -1.980) 12.558 22.071 ( 1.808 -4.137 -4.086) 6.089 22.165 ( -0.390 -6.985 5.469) 8.880 22.394 ( -1.126 0.246 -1.065) 1.570 22.554 ( 1.526 -6.498 1.114) 6.767 22.853 ( -4.686 -0.739 2.776) 5.497 23.126 ( -2.524 1.343 -3.651) 4.637 23.234 ( -10.134 -8.502 -1.905) 13.365 23.384 ( -6.357 -3.599 1.840) 7.533 ======================= Grid point 16 (11/102) ======================= q-point: ( 0.45 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.542 ( 5.124 -11.553 -2.936) 12.975 1.658 ( 9.212 -4.816 -1.722) 10.536 1.854 ( 6.272 -4.432 -2.306) 8.019 2.066 ( 1.676 -12.346 7.628) 14.609 2.212 ( 1.056 -4.227 -2.822) 5.191 2.396 ( 2.627 -0.658 5.165) 5.832 2.466 ( 5.738 -1.559 -3.048) 6.682 2.595 ( -1.196 2.489 2.211) 3.538 2.651 ( -0.303 0.736 1.041) 1.311 2.747 ( -1.397 3.644 -3.383) 5.165 2.829 ( -2.651 -1.110 3.680) 4.670 2.935 ( 4.064 -3.044 -0.583) 5.111 3.015 ( 0.686 -1.039 0.022) 1.245 3.167 ( -4.063 3.302 3.526) 6.312 3.210 ( -0.679 -2.410 -5.138) 5.716 3.275 ( 3.976 -0.825 -2.722) 4.889 3.343 ( 0.253 -3.968 -0.502) 4.008 3.397 ( -0.744 1.908 -0.731) 2.174 3.548 ( 2.287 -1.441 -1.325) 3.010 3.620 ( -0.825 -0.492 1.291) 1.609 3.734 ( -1.644 1.416 1.549) 2.666 3.824 ( -4.561 2.861 2.395) 5.893 3.876 ( -1.715 -6.821 -0.598) 7.059 3.954 ( -1.484 -0.786 -0.548) 1.767 4.176 ( -1.741 1.941 -0.384) 2.635 4.267 ( -1.141 -4.773 -0.534) 4.936 4.363 ( 4.419 -1.845 -2.291) 5.308 4.484 ( -5.955 7.399 0.872) 9.538 4.676 ( -2.108 1.687 1.403) 3.042 4.864 ( -1.014 -0.673 6.602) 6.713 4.913 ( 5.144 -2.150 -0.743) 5.624 4.986 ( -5.345 -3.655 -2.619) 6.984 5.053 ( -1.381 1.247 -5.339) 5.654 5.100 ( -0.753 -0.542 0.608) 1.109 5.259 ( -2.570 -2.992 1.485) 4.215 5.437 ( 3.640 -2.050 -0.696) 4.235 5.525 ( -2.500 -0.421 0.942) 2.705 5.686 ( -2.121 -1.113 -0.184) 2.403 5.768 ( 3.527 -4.149 0.084) 5.446 5.974 ( -0.729 1.955 -2.181) 3.018 6.076 ( -0.071 -0.260 3.295) 3.306 6.388 ( -0.184 -2.298 2.273) 3.238 6.618 ( 3.790 -2.564 -5.521) 7.170 6.733 ( 9.772 4.473 -0.455) 10.757 6.937 ( 6.299 -3.779 4.320) 8.522 7.104 ( 3.470 1.308 -4.684) 5.974 7.229 ( 0.332 1.486 -0.178) 1.533 7.486 ( -0.340 2.837 8.497) 8.965 7.611 ( 0.644 7.002 -5.356) 8.839 7.693 ( -4.521 1.799 1.243) 5.022 8.037 ( -2.195 1.106 -2.056) 3.204 8.258 ( -2.676 -0.882 2.689) 3.895 8.424 ( -2.730 1.503 0.066) 3.117 8.486 ( 2.655 3.733 -2.256) 5.106 8.624 ( 5.083 4.817 -0.491) 7.020 8.795 ( -0.551 -1.320 2.734) 3.085 9.073 ( 0.279 3.835 -3.886) 5.467 9.277 ( -3.616 -1.925 2.104) 4.605 9.357 ( -6.461 6.077 0.837) 8.909 9.756 ( -1.555 1.623 -1.184) 2.540 9.824 ( 4.286 6.338 -0.136) 7.652 10.151 ( 5.814 5.206 -0.867) 7.852 10.510 ( -0.553 -1.691 1.575) 2.376 10.743 ( -1.728 -1.411 -2.419) 3.291 10.897 ( 1.418 -0.220 -0.193) 1.447 11.066 ( 4.019 -7.080 0.498) 8.156 11.191 ( 4.976 -0.374 0.285) 4.999 11.358 ( 2.775 0.514 1.134) 3.042 11.597 ( 3.143 5.792 -0.760) 6.634 11.660 ( 3.327 4.279 2.353) 5.909 11.773 ( 8.876 7.028 -1.346) 11.401 11.901 ( 0.646 2.631 -0.048) 2.710 12.407 ( 1.259 6.209 -0.358) 6.346 12.461 ( -2.375 2.204 1.198) 3.454 12.846 ( 5.247 0.446 -1.975) 5.624 12.914 ( 1.505 2.911 1.118) 3.463 13.464 ( 0.739 -3.668 -0.401) 3.763 13.490 ( -0.303 -5.220 -0.000) 5.229 13.792 ( -3.935 6.821 0.487) 7.889 13.954 ( -5.525 3.881 0.321) 6.759 15.791 ( -0.685 0.519 -2.726) 2.859 15.913 ( -4.259 0.699 2.443) 4.959 17.197 ( -0.134 -2.133 0.011) 2.137 17.623 ( -5.136 -3.742 -1.112) 6.451 17.859 ( 6.460 -3.006 0.992) 7.194 18.215 ( 4.661 5.805 1.241) 7.548 18.330 ( 1.534 12.647 -1.383) 12.815 18.934 ( 1.555 3.918 3.886) 5.733 19.082 ( 2.941 8.404 -5.156) 10.289 19.310 ( 4.638 5.458 1.318) 7.282 19.766 ( -5.437 8.290 -0.084) 9.914 20.048 ( -12.771 -5.687 -0.091) 13.980 21.423 ( 10.443 3.815 0.584) 11.134 21.811 ( 3.066 -8.400 0.561) 8.959 22.136 ( 1.340 -2.233 -3.733) 4.551 22.212 ( -0.674 1.058 -0.796) 1.486 22.403 ( -2.441 -2.475 3.540) 4.962 22.713 ( 2.266 -8.575 1.035) 8.930 22.839 ( -2.747 -0.284 2.337) 3.617 23.061 ( -2.061 3.074 -3.706) 5.237 23.307 ( -5.288 -6.241 -0.963) 8.237 23.396 ( -4.754 -2.204 1.300) 5.399 ======================= Grid point 17 (12/102) ======================= q-point: ( 0.55 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.631 ( 0.327 1.937 -2.669) 3.314 1.831 ( 5.316 -5.785 -2.840) 8.354 1.984 ( 1.556 -4.353 -1.282) 4.797 2.183 ( 0.226 4.971 2.036) 5.377 2.210 ( -9.718 -0.463 8.962) 13.227 2.369 ( 6.179 3.529 -2.575) 7.568 2.446 ( -0.766 0.116 2.364) 2.488 2.623 ( 2.295 -1.984 0.875) 3.157 2.660 ( -1.731 1.379 -2.225) 3.138 2.697 ( -1.890 -3.808 -2.144) 4.761 2.834 ( 1.496 3.603 2.154) 4.456 2.993 ( 2.105 -1.243 -2.000) 3.158 3.065 ( 2.490 -0.974 -0.911) 2.825 3.078 ( -2.289 -0.790 0.855) 2.568 3.233 ( -2.176 -0.672 -0.712) 2.386 3.290 ( 2.509 2.444 0.159) 3.506 3.347 ( 3.897 0.724 -2.593) 4.737 3.416 ( 2.091 -1.925 -1.497) 3.213 3.590 ( -1.456 -2.025 0.828) 2.628 3.614 ( -6.478 1.124 5.268) 8.425 3.721 ( 0.610 0.041 -0.050) 0.613 3.771 ( 3.928 0.104 -3.073) 4.989 3.941 ( -6.362 -3.861 2.136) 7.743 4.033 ( 3.148 -3.987 -0.248) 5.086 4.156 ( -1.435 -1.760 -1.870) 2.942 4.254 ( -5.861 1.287 0.552) 6.026 4.326 ( -5.755 3.609 1.422) 6.941 4.485 ( 7.952 -3.715 -3.937) 9.620 4.633 ( -2.042 1.351 0.666) 2.537 4.879 ( -4.421 -1.999 7.925) 9.292 4.946 ( 1.147 0.922 -3.352) 3.661 4.960 ( -1.839 2.765 -1.026) 3.475 5.066 ( 1.747 -3.507 -1.317) 4.134 5.141 ( 3.520 -2.228 -0.992) 4.282 5.286 ( -3.163 -1.513 -0.115) 3.509 5.443 ( 2.960 3.765 -0.174) 4.792 5.549 ( -3.011 -4.252 0.726) 5.261 5.704 ( 0.879 -1.284 0.762) 1.732 5.839 ( 2.254 -0.311 -1.278) 2.609 5.918 ( 1.207 1.595 0.871) 2.182 6.096 ( -0.227 -0.606 0.380) 0.750 6.410 ( -1.103 -0.376 1.323) 1.763 6.673 ( 2.001 4.276 -0.394) 4.737 6.705 ( 4.123 0.573 -3.614) 5.513 6.906 ( -3.447 3.876 3.092) 6.039 7.131 ( -0.108 2.056 -0.350) 2.089 7.215 ( 0.186 1.015 -1.566) 1.875 7.396 ( -0.449 3.618 1.972) 4.145 7.553 ( -4.419 -2.109 -2.001) 5.289 7.616 ( -5.800 2.852 0.955) 6.534 8.046 ( -1.619 -3.167 -1.402) 3.823 8.239 ( -1.940 1.878 3.715) 4.592 8.324 ( -7.940 4.403 2.524) 9.424 8.445 ( -2.265 -1.533 -1.973) 3.372 8.593 ( 5.979 4.177 -5.129) 8.916 8.819 ( 3.070 -0.783 -0.073) 3.169 9.064 ( 4.169 -0.223 2.847) 5.053 9.274 ( 2.245 -2.292 -1.224) 3.434 9.337 ( -0.154 -2.970 1.952) 3.557 9.678 ( -4.783 1.580 1.410) 5.231 9.809 ( 6.228 2.260 -2.057) 6.938 10.098 ( 4.721 4.543 -1.004) 6.628 10.538 ( -0.619 -1.382 1.196) 1.929 10.745 ( -1.594 -0.605 -2.229) 2.806 10.904 ( 0.738 0.417 0.280) 0.893 11.174 ( 0.302 -1.751 1.149) 2.116 11.235 ( 2.635 0.065 0.447) 2.673 11.335 ( 2.371 3.018 -0.153) 3.841 11.489 ( -7.666 2.842 0.048) 8.176 11.639 ( 4.780 1.839 2.170) 5.562 11.705 ( 6.966 6.942 -2.123) 10.061 11.874 ( 4.765 1.931 -0.094) 5.143 12.325 ( 0.166 2.934 -0.220) 2.947 12.428 ( -0.816 0.196 0.062) 0.842 12.872 ( -0.517 2.456 1.300) 2.827 12.878 ( 3.283 -0.510 -1.250) 3.550 13.532 ( 0.937 -1.853 -0.672) 2.183 13.565 ( -1.072 -3.031 -0.802) 3.313 13.674 ( -2.084 3.109 1.034) 3.883 13.883 ( -2.157 -0.511 0.656) 2.311 15.768 ( -2.237 0.191 -1.123) 2.511 15.897 ( -1.934 -1.039 0.903) 2.374 17.237 ( 2.496 -1.365 -0.017) 2.845 17.647 ( -7.625 -4.578 0.160) 8.895 17.921 ( 4.266 1.425 0.872) 4.582 18.134 ( -1.197 5.459 -6.121) 8.289 18.203 ( 6.857 3.587 4.963) 9.193 18.885 ( -1.708 4.182 3.150) 5.507 18.975 ( 3.075 2.975 -3.159) 5.318 19.248 ( 1.164 4.040 0.185) 4.209 19.672 ( -0.814 -0.612 -0.258) 1.051 20.067 ( -9.078 -5.763 0.100) 10.753 21.418 ( 8.413 4.579 0.291) 9.583 21.928 ( -1.026 -1.759 0.611) 2.126 22.131 ( -0.441 0.401 -0.260) 0.650 22.203 ( 1.180 -0.416 -2.704) 2.979 22.431 ( -2.136 -1.375 2.055) 3.268 22.835 ( -1.802 -1.144 5.005) 5.441 22.883 ( 3.373 -5.876 -3.211) 7.498 22.971 ( -1.347 3.835 -1.770) 4.433 23.371 ( -2.061 -3.617 -0.769) 4.234 23.413 ( -1.516 -2.700 0.857) 3.213 ======================= Grid point 18 (13/102) ======================= q-point: (-0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.550 ( -4.262 4.547 -0.617) 6.263 1.733 ( -3.708 15.938 3.366) 16.706 1.908 ( -1.992 8.800 -2.806) 9.449 2.083 ( -3.479 5.891 1.851) 7.087 2.251 ( -2.199 -8.607 0.579) 8.902 2.357 ( -3.244 5.639 0.329) 6.514 2.419 ( 5.871 2.040 -1.846) 6.484 2.642 ( -1.875 9.633 -1.097) 9.875 2.663 ( -1.310 2.609 1.341) 3.212 2.671 ( -2.321 -5.406 -0.150) 5.885 2.797 ( 0.639 -4.136 0.166) 4.189 2.950 ( -1.506 3.564 0.471) 3.897 3.130 ( 2.964 -3.556 -1.368) 4.827 3.174 ( 5.559 -3.609 -4.295) 7.898 3.242 ( 0.756 -0.652 -0.428) 1.086 3.268 ( -0.793 -0.395 3.407) 3.521 3.349 ( 1.953 1.205 -0.182) 2.302 3.442 ( 1.929 0.825 -2.661) 3.389 3.541 ( 0.523 3.070 2.354) 3.904 3.615 ( -6.283 -3.988 3.403) 8.183 3.725 ( 2.671 1.396 -0.667) 3.087 3.837 ( 5.349 -3.043 -4.216) 7.460 3.934 ( -2.160 1.898 3.516) 4.542 4.064 ( -0.292 0.404 2.966) 3.008 4.167 ( -3.445 0.400 -2.406) 4.221 4.205 ( -4.383 -1.283 -0.604) 4.607 4.301 ( -2.089 -2.745 2.633) 4.340 4.564 ( 4.743 -0.628 -2.701) 5.494 4.605 ( -2.718 -0.434 -0.989) 2.925 4.871 ( -0.089 3.711 -2.497) 4.473 4.912 ( -1.664 -1.777 3.546) 4.301 4.943 ( 0.715 0.171 -1.358) 1.544 5.130 ( 1.510 -1.679 2.120) 3.098 5.214 ( 1.832 -3.299 0.041) 3.773 5.273 ( -2.019 -0.261 -1.867) 2.762 5.392 ( 4.296 3.993 -1.621) 6.085 5.596 ( -2.512 -2.682 2.020) 4.194 5.740 ( 1.516 -0.769 1.647) 2.367 5.802 ( 0.777 4.068 -1.367) 4.362 5.956 ( 1.373 -2.066 2.803) 3.743 6.084 ( -0.135 1.155 -3.562) 3.747 6.393 ( -2.169 0.911 -0.161) 2.358 6.534 ( -5.862 6.914 3.795) 9.827 6.661 ( 0.079 4.700 -2.014) 5.114 6.884 ( -2.108 3.394 -1.298) 4.201 6.997 ( -6.750 1.200 2.292) 7.229 7.160 ( -4.291 2.385 -0.814) 4.976 7.407 ( -0.306 1.319 -4.699) 4.890 7.475 ( -6.954 0.470 3.150) 7.648 7.625 ( -3.803 -5.257 0.351) 6.498 8.091 ( -0.223 -2.938 -3.333) 4.449 8.179 ( -8.142 1.707 2.978) 8.836 8.218 ( -3.076 1.253 4.460) 5.560 8.509 ( -0.439 -5.942 0.265) 5.964 8.531 ( 2.377 4.494 -3.967) 6.449 8.891 ( 6.761 -2.517 -3.543) 8.037 9.111 ( 2.682 -1.526 4.050) 5.091 9.395 ( 3.153 -1.805 1.036) 3.778 9.422 ( 9.625 -6.743 -2.011) 11.923 9.653 ( -3.781 -1.870 2.919) 5.130 9.810 ( 3.219 0.828 -1.640) 3.706 10.062 ( 2.412 1.738 -1.481) 3.321 10.553 ( 1.102 0.243 1.057) 1.547 10.733 ( -1.330 0.319 -0.612) 1.499 10.892 ( -1.756 0.575 1.101) 2.151 11.114 ( -4.362 5.894 2.784) 7.843 11.210 ( 1.211 3.826 -1.737) 4.373 11.309 ( 1.822 2.511 -4.058) 5.108 11.413 ( -8.937 -2.482 1.801) 9.448 11.623 ( 1.501 4.630 -1.301) 5.038 11.675 ( 4.453 -0.873 2.311) 5.092 11.907 ( 4.699 -0.778 -0.346) 4.775 12.310 ( 0.109 -1.323 0.056) 1.328 12.443 ( 0.367 -2.298 -1.162) 2.601 12.821 ( -1.473 2.685 1.774) 3.539 12.902 ( 2.208 -0.041 -0.901) 2.385 13.489 ( -0.945 3.723 0.080) 3.842 13.583 ( -0.013 2.697 -0.660) 2.777 13.687 ( -1.762 -6.644 -0.135) 6.875 13.957 ( 2.370 -6.081 0.754) 6.570 15.748 ( -3.315 -0.327 0.311) 3.346 15.919 ( -0.156 -1.907 -0.444) 1.964 17.287 ( 5.674 -0.819 -0.276) 5.740 17.676 ( -8.631 -4.790 2.117) 10.096 17.868 ( 2.671 6.976 0.749) 7.507 18.022 ( -1.567 4.381 -6.161) 7.721 18.271 ( 5.462 -4.688 4.234) 8.351 18.796 ( -5.747 0.622 -1.842) 6.067 19.001 ( 3.358 -1.907 1.785) 4.255 19.194 ( -2.619 0.951 -0.306) 2.803 19.755 ( 4.863 -6.343 -0.638) 8.018 20.127 ( -5.753 -6.917 0.483) 9.010 21.385 ( 6.841 5.332 -0.094) 8.674 21.840 ( -6.131 6.722 -0.316) 9.103 22.171 ( 1.475 -1.769 1.098) 2.551 22.203 ( 0.236 0.218 -0.195) 0.376 22.428 ( -1.372 0.319 -0.508) 1.498 22.817 ( -1.476 7.523 0.592) 7.689 22.866 ( 1.667 -1.621 -1.546) 2.792 23.043 ( 1.995 -5.781 1.015) 6.199 23.399 ( -0.139 -1.061 -0.551) 1.204 23.478 ( 2.233 -3.299 0.453) 4.009 ======================= Grid point 19 (14/102) ======================= q-point: (-0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.373 ( -5.124 13.754 -0.700) 14.694 1.395 ( -6.521 13.295 1.843) 14.922 1.712 ( -3.507 9.395 0.512) 10.041 1.918 ( -2.500 9.274 -0.392) 9.613 2.157 ( -3.240 11.975 4.108) 13.068 2.286 ( -2.848 8.034 -5.179) 9.974 2.390 ( 1.343 11.366 -2.565) 11.729 2.483 ( -2.872 -8.917 -1.755) 9.531 2.528 ( -5.553 12.892 4.675) 14.795 2.765 ( 0.249 -3.951 0.931) 4.067 2.854 ( -0.450 -3.200 -0.450) 3.262 2.939 ( 0.374 -0.607 -2.114) 2.231 3.134 ( -3.364 6.553 2.628) 7.821 3.183 ( 2.857 3.793 -0.946) 4.842 3.221 ( 1.762 -1.803 -0.145) 2.526 3.344 ( 2.310 -2.493 1.790) 3.842 3.396 ( -0.632 -0.637 -0.165) 0.912 3.406 ( 2.878 -0.282 -2.913) 4.105 3.529 ( 3.753 0.136 -0.315) 3.769 3.699 ( 0.625 -6.878 3.375) 7.687 3.711 ( 2.822 1.337 -0.281) 3.135 3.896 ( 2.057 1.319 1.143) 2.697 3.930 ( 1.836 -3.558 -4.152) 5.768 4.030 ( -1.684 2.506 -0.706) 3.100 4.144 ( -3.346 -0.823 2.831) 4.460 4.185 ( -1.307 -0.125 -1.486) 1.982 4.348 ( 0.843 -1.911 3.910) 4.433 4.584 ( -0.676 0.597 -0.136) 0.912 4.603 ( -3.709 -3.296 -2.402) 5.512 4.803 ( 0.349 3.186 -2.085) 3.823 4.915 ( 2.224 2.931 1.300) 3.902 4.957 ( -3.034 -2.859 -1.605) 4.467 5.166 ( 2.652 -0.499 1.030) 2.888 5.259 ( -4.069 -1.403 1.159) 4.457 5.292 ( 4.184 -2.645 -1.177) 5.088 5.375 ( 7.824 2.918 -0.641) 8.375 5.610 ( -1.395 0.433 1.479) 2.078 5.705 ( -0.231 6.134 -1.163) 6.248 5.755 ( -1.827 -1.031 0.849) 2.263 5.959 ( -2.552 2.663 6.885) 7.810 6.074 ( 0.987 -1.695 -7.951) 8.190 6.350 ( -1.539 2.320 -2.011) 3.434 6.416 ( -6.828 1.336 2.403) 7.360 6.511 ( -7.784 7.975 0.792) 11.172 6.799 ( 4.740 1.887 -0.409) 5.119 6.973 ( -5.191 2.364 0.892) 5.774 7.128 ( -9.402 -6.165 -0.279) 11.247 7.285 ( -3.516 5.193 -0.458) 6.288 7.511 ( -4.642 -4.783 0.916) 6.728 7.691 ( -1.766 -4.265 -0.676) 4.665 8.094 ( -8.259 -1.039 0.180) 8.326 8.159 ( 3.520 -1.855 -0.447) 4.004 8.227 ( -2.730 -2.484 2.472) 4.443 8.456 ( 0.017 3.935 -2.199) 4.508 8.625 ( 0.109 -6.212 1.245) 6.337 8.969 ( 4.910 -1.867 -1.469) 5.454 9.174 ( 2.680 -2.103 1.069) 3.570 9.422 ( 4.515 2.521 0.491) 5.194 9.601 ( 6.397 -5.994 -2.798) 9.202 9.691 ( -0.064 -2.296 1.902) 2.983 9.836 ( -0.606 -3.276 -0.780) 3.422 10.070 ( -0.491 -1.804 0.643) 1.977 10.547 ( 3.901 2.474 -0.117) 4.621 10.704 ( -1.274 2.177 0.963) 2.700 10.879 ( -5.429 -2.023 -0.392) 5.807 10.944 ( -4.728 7.302 2.728) 9.117 11.167 ( 2.832 1.413 -1.164) 3.372 11.257 ( 0.102 2.205 -3.605) 4.227 11.429 ( -6.658 -3.665 1.944) 7.844 11.570 ( 0.024 1.317 -0.345) 1.362 11.724 ( 3.211 -0.583 0.687) 3.335 11.929 ( -1.498 0.252 -0.491) 1.596 12.377 ( 0.466 -5.484 0.333) 5.514 12.514 ( 2.084 -4.928 -1.898) 5.678 12.763 ( -1.855 2.652 2.058) 3.835 12.907 ( 1.518 0.952 -0.579) 1.883 13.424 ( -0.325 2.745 -0.009) 2.764 13.526 ( 0.350 2.962 0.135) 2.985 13.820 ( -1.126 -8.676 -0.640) 8.772 14.102 ( 3.312 -6.819 0.359) 7.589 15.728 ( -3.990 -0.173 1.138) 4.152 15.953 ( 0.107 -1.863 -1.163) 2.199 17.342 ( 8.220 1.027 -1.448) 8.409 17.682 ( -5.493 -0.644 4.675) 7.242 17.739 ( 0.620 8.169 0.705) 8.223 17.934 ( -6.667 -0.316 -5.027) 8.356 18.474 ( 6.546 -11.690 2.782) 13.683 18.793 ( -6.245 -5.636 -2.143) 8.680 19.066 ( 1.179 -2.293 -1.005) 2.767 19.194 ( -3.365 -4.144 1.976) 5.692 19.951 ( 6.948 -10.018 -0.752) 12.215 20.231 ( -2.314 -7.788 0.521) 8.142 21.325 ( 5.764 6.606 -0.359) 8.775 21.628 ( -8.856 10.161 0.143) 13.480 22.149 ( 0.518 3.599 1.356) 3.881 22.212 ( -0.543 1.470 -0.094) 1.570 22.413 ( 0.021 -0.126 -1.117) 1.125 22.657 ( -0.846 8.658 -0.370) 8.707 22.914 ( 2.122 -2.057 -0.654) 3.027 23.145 ( 1.537 -3.686 1.181) 4.164 23.410 ( 1.300 0.353 -0.638) 1.491 23.555 ( 4.332 -2.198 0.561) 4.890 ======================= Grid point 20 (15/102) ======================= q-point: (-0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.062 ( -5.545 18.029 -0.756) 18.878 1.147 ( -2.751 5.484 -0.147) 6.137 1.467 ( -3.237 17.046 -1.926) 17.457 1.763 ( -0.381 6.683 2.432) 7.122 1.924 ( -1.708 12.393 8.395) 15.065 2.020 ( -5.549 12.590 -10.351) 17.217 2.111 ( -2.958 26.398 1.778) 26.623 2.221 ( -3.796 8.451 1.390) 9.368 2.670 ( 0.051 -10.114 -1.127) 10.177 2.769 ( -0.050 3.451 -0.805) 3.544 2.910 ( -0.297 -1.078 -0.431) 1.198 2.920 ( -1.094 1.842 0.690) 2.251 2.965 ( -2.405 6.792 1.452) 7.350 3.106 ( 0.011 4.984 -0.886) 5.062 3.266 ( 3.219 0.654 0.581) 3.335 3.357 ( -0.546 2.969 0.874) 3.143 3.388 ( 1.264 -0.194 -0.508) 1.376 3.429 ( 0.662 -1.248 -0.432) 1.477 3.577 ( 1.189 -1.172 -0.407) 1.718 3.728 ( 1.110 -1.340 1.618) 2.376 3.829 ( 4.401 -2.418 0.630) 5.061 3.876 ( 0.728 2.143 -0.583) 2.338 3.993 ( -0.675 -3.801 -2.676) 4.697 4.034 ( 0.210 -5.872 -1.139) 5.986 4.162 ( 2.347 -2.783 2.353) 4.335 4.222 ( -1.474 -4.886 -0.636) 5.143 4.396 ( 4.040 0.490 1.256) 4.259 4.541 ( -4.191 0.795 0.640) 4.313 4.649 ( -2.564 -4.063 -0.858) 4.880 4.731 ( -3.976 2.719 -1.024) 4.924 4.900 ( 3.557 0.166 0.323) 3.575 4.973 ( -2.816 -1.791 -0.163) 3.341 5.202 ( 4.169 -0.517 -2.648) 4.966 5.248 ( -3.131 0.157 2.229) 3.847 5.328 ( 5.101 6.292 1.118) 8.176 5.404 ( 4.784 -2.875 -0.032) 5.581 5.548 ( -5.081 3.267 0.813) 6.095 5.622 ( 3.398 2.706 -0.484) 4.371 5.772 ( -5.566 -3.938 -0.054) 6.818 5.899 ( 0.975 3.717 1.099) 3.997 6.103 ( -0.141 -1.714 -1.683) 2.407 6.223 ( -4.481 8.769 -1.780) 10.008 6.346 ( -2.285 2.871 0.155) 3.673 6.408 ( -5.752 -2.142 1.989) 6.452 6.807 ( 2.791 2.810 -5.124) 6.476 6.930 ( -2.225 -3.317 4.349) 5.904 7.167 ( -2.389 0.377 3.090) 3.924 7.220 ( -5.569 -4.091 -2.758) 7.440 7.561 ( -4.415 -4.159 1.106) 6.165 7.752 ( -0.632 -3.683 -0.705) 3.803 8.062 ( -4.659 -0.646 0.366) 4.717 8.227 ( 0.873 -1.805 0.832) 2.171 8.256 ( -0.674 -3.174 0.050) 3.246 8.386 ( -0.664 2.592 -1.875) 3.267 8.731 ( -0.011 -4.880 1.820) 5.208 9.041 ( 2.829 -3.721 -0.527) 4.704 9.219 ( 0.831 -1.138 0.156) 1.417 9.361 ( 1.406 6.796 0.216) 6.943 9.705 ( 3.492 1.101 -0.663) 3.721 9.725 ( 1.197 -3.059 -0.496) 3.322 9.893 ( -4.153 -4.645 -0.464) 6.248 10.092 ( -1.534 0.569 1.401) 2.154 10.559 ( 6.013 -0.966 -0.155) 6.092 10.650 ( -5.835 -0.872 0.607) 5.931 10.800 ( -2.954 1.823 0.377) 3.491 10.949 ( 1.202 -3.710 -0.996) 4.025 11.169 ( 0.100 1.019 0.934) 1.386 11.241 ( 3.179 -0.591 -1.052) 3.401 11.440 ( -4.030 -1.843 0.692) 4.485 11.567 ( -0.080 -0.456 -0.192) 0.501 11.738 ( 0.821 1.018 -0.450) 1.383 11.877 ( -5.026 1.880 0.025) 5.366 12.490 ( -0.758 -6.380 -0.548) 6.448 12.639 ( 2.702 -6.810 -1.033) 7.399 12.716 ( -1.599 1.210 1.658) 2.602 12.885 ( 0.863 2.336 -0.245) 2.502 13.389 ( 0.170 1.093 0.047) 1.107 13.486 ( 0.541 1.989 0.054) 2.062 13.970 ( -0.603 -8.551 -0.281) 8.577 14.244 ( 2.461 -6.309 -0.084) 6.773 15.698 ( -3.786 0.511 1.428) 4.079 15.975 ( -0.365 -0.842 -1.293) 1.585 17.318 ( 3.489 6.701 -2.214) 7.873 17.595 ( -0.199 7.426 0.791) 7.471 17.701 ( 8.667 -0.455 4.755) 9.896 17.912 ( -15.325 -6.316 -2.796) 16.809 18.785 ( 6.846 -15.585 1.294) 17.071 18.890 ( -4.775 -10.081 -0.852) 11.187 19.098 ( -2.278 -3.114 -2.761) 4.744 19.302 ( -1.463 -8.399 2.239) 8.815 20.187 ( 3.602 -10.537 -0.357) 11.141 20.382 ( 3.348 -8.540 -0.060) 9.173 21.226 ( 4.548 8.799 -0.398) 9.912 21.346 ( -10.205 12.628 0.832) 16.257 22.076 ( 0.375 5.107 1.408) 5.310 22.111 ( -0.973 8.168 -1.700) 8.399 22.423 ( 0.282 0.234 0.292) 0.469 22.513 ( -0.429 5.653 -0.442) 5.687 22.959 ( 1.776 -1.155 -0.528) 2.184 23.205 ( 0.848 -1.751 0.774) 2.093 23.397 ( 1.231 2.139 -0.544) 2.527 23.621 ( 4.656 -1.180 0.807) 4.870 ======================= Grid point 21 (16/102) ======================= q-point: (-0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.680 ( 0.000 20.318 -0.000) 20.318 1.051 ( 0.000 25.886 -0.000) 25.886 1.162 ( -0.000 -5.107 0.000) 5.107 1.502 ( 0.000 34.868 -0.000) 34.868 1.559 ( 0.000 16.037 -0.000) 16.037 1.762 ( 0.000 9.421 -0.000) 9.421 1.824 ( 0.000 3.395 -0.000) 3.395 2.113 ( 0.000 1.919 -0.000) 1.919 2.694 ( 0.000 3.912 -0.000) 3.912 2.750 ( 0.000 3.145 -0.000) 3.145 2.797 ( 0.000 7.540 -0.000) 7.540 2.805 ( 0.000 7.918 -0.000) 7.918 3.020 ( 0.000 4.361 -0.000) 4.361 3.029 ( -0.000 -8.372 0.000) 8.372 3.273 ( 0.000 4.308 -0.000) 4.308 3.287 ( -0.000 -1.938 0.000) 1.938 3.379 ( 0.000 0.963 -0.000) 0.963 3.465 ( -0.000 -1.040 0.000) 1.040 3.562 ( 0.000 2.156 -0.000) 2.156 3.777 ( -0.000 -1.313 0.000) 1.313 3.833 ( 0.000 0.944 -0.000) 0.944 3.871 ( -0.000 -1.752 0.000) 1.752 4.054 ( -0.000 -2.633 0.000) 2.633 4.174 ( -0.000 -7.041 0.000) 7.041 4.265 ( 0.000 5.125 -0.000) 5.125 4.301 ( -0.000 -8.102 0.000) 8.102 4.367 ( -0.000 -4.281 0.000) 4.281 4.583 ( -0.000 -6.358 0.000) 6.358 4.676 ( -0.000 -1.363 0.000) 1.363 4.718 ( -0.000 -2.859 0.000) 2.859 4.940 ( -0.000 -1.592 0.000) 1.592 4.986 ( -0.000 -0.787 0.000) 0.787 5.170 ( 0.000 5.611 -0.000) 5.611 5.203 ( 0.000 3.690 -0.000) 3.690 5.285 ( -0.000 -1.669 0.000) 1.669 5.434 ( 0.000 3.312 -0.000) 3.312 5.500 ( -0.000 -1.097 0.000) 1.097 5.643 ( -0.000 -2.574 0.000) 2.574 5.809 ( -0.000 -2.063 0.000) 2.063 5.849 ( 0.000 2.364 -0.000) 2.364 6.026 ( 0.000 7.536 -0.000) 7.536 6.115 ( 0.000 1.789 -0.000) 1.789 6.298 ( 0.000 2.154 -0.000) 2.154 6.418 ( -0.000 -0.839 0.000) 0.839 6.772 ( 0.000 0.091 -0.000) 0.091 7.016 ( -0.000 -4.342 0.000) 4.342 7.131 ( 0.000 1.290 -0.000) 1.290 7.281 ( -0.000 -3.680 0.000) 3.680 7.604 ( -0.000 -2.633 0.000) 2.633 7.807 ( -0.000 -2.899 0.000) 2.899 8.043 ( 0.000 0.971 -0.000) 0.971 8.212 ( 0.000 1.969 -0.000) 1.969 8.351 ( -0.000 -2.232 0.000) 2.232 8.374 ( -0.000 -5.862 0.000) 5.862 8.799 ( -0.000 -2.267 0.000) 2.267 9.150 ( -0.000 -6.587 0.000) 6.587 9.212 ( 0.000 9.217 -0.000) 9.217 9.232 ( -0.000 -0.275 0.000) 0.275 9.642 ( 0.000 6.127 -0.000) 6.127 9.757 ( 0.000 0.534 -0.000) 0.534 9.970 ( -0.000 -6.162 0.000) 6.162 10.021 ( 0.000 5.190 -0.000) 5.190 10.628 ( -0.000 -5.144 0.000) 5.144 10.749 ( -0.000 -8.181 0.000) 8.181 10.804 ( -0.000 -4.494 0.000) 4.494 11.015 ( -0.000 -2.429 0.000) 2.429 11.135 ( 0.000 1.931 -0.000) 1.931 11.291 ( -0.000 -1.578 0.000) 1.578 11.430 ( 0.000 1.771 -0.000) 1.771 11.568 ( 0.000 0.333 -0.000) 0.333 11.694 ( 0.000 2.961 -0.000) 2.961 11.834 ( 0.000 0.140 -0.000) 0.140 12.585 ( -0.000 -4.862 0.000) 4.862 12.715 ( -0.000 -1.728 0.000) 1.728 12.770 ( -0.000 -5.272 0.000) 5.272 12.840 ( 0.000 2.043 -0.000) 2.043 13.385 ( -0.000 -0.498 0.000) 0.498 13.457 ( 0.000 1.513 -0.000) 1.513 14.109 ( -0.000 -6.762 0.000) 6.762 14.359 ( -0.000 -5.126 0.000) 5.126 15.667 ( 0.000 1.059 -0.000) 1.059 15.972 ( 0.000 0.721 -0.000) 0.721 17.182 ( 0.000 8.057 -0.000) 8.057 17.477 ( 0.000 5.281 -0.000) 5.281 17.802 ( -0.000 -0.774 0.000) 0.774 17.934 ( -0.000 -7.321 0.000) 7.321 18.997 ( -0.000 -5.329 0.000) 5.329 19.171 ( -0.000 -20.019 0.000) 20.019 19.176 ( -0.000 -8.421 0.000) 8.421 19.469 ( -0.000 -10.167 0.000) 10.167 20.341 ( -0.000 -3.201 0.000) 3.201 20.552 ( -0.000 -6.054 0.000) 6.054 21.024 ( 0.000 11.491 -0.000) 11.491 21.126 ( 0.000 7.265 -0.000) 7.265 21.920 ( 0.000 11.041 -0.000) 11.041 21.985 ( 0.000 5.371 -0.000) 5.371 22.379 ( 0.000 3.435 -0.000) 3.435 22.464 ( 0.000 1.151 -0.000) 1.151 22.973 ( 0.000 0.341 -0.000) 0.341 23.229 ( -0.000 -0.675 0.000) 0.675 23.348 ( 0.000 3.507 -0.000) 3.507 23.663 ( -0.000 -0.759 0.000) 0.759 ======================= Grid point 24 (17/102) ======================= q-point: ( 0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.693 ( 23.502 -0.000 -0.678) 23.512 0.793 ( 24.968 -0.000 -1.151) 24.995 1.266 ( 11.574 -0.000 -9.595) 15.035 1.319 ( 12.679 -0.000 0.186) 12.681 1.506 ( 44.477 -0.000 2.782) 44.564 1.883 ( 3.658 -0.000 8.204) 8.982 2.163 ( 15.885 -0.000 7.867) 17.726 2.420 ( 7.322 -0.000 -9.405) 11.920 2.532 ( 1.565 -0.000 -1.341) 2.061 2.612 ( -0.612 0.000 -0.910) 1.097 2.756 ( 7.277 -0.000 -6.238) 9.585 2.779 ( 2.209 -0.000 5.269) 5.713 2.955 ( -5.498 0.000 0.489) 5.519 2.974 ( 1.540 -0.000 0.339) 1.577 3.286 ( -9.395 0.000 4.961) 10.624 3.304 ( -4.061 0.000 -2.933) 5.009 3.414 ( 6.696 -0.000 -3.741) 7.670 3.489 ( -0.472 0.000 5.307) 5.328 3.545 ( 1.419 -0.000 1.417) 2.005 3.771 ( -4.780 0.000 -0.774) 4.842 3.779 ( 2.776 -0.000 -6.021) 6.630 3.816 ( -3.176 0.000 1.438) 3.487 3.941 ( 0.889 -0.000 -4.174) 4.267 4.048 ( -2.079 0.000 1.663) 2.662 4.228 ( -2.442 0.000 4.602) 5.209 4.430 ( -6.653 0.000 3.038) 7.314 4.568 ( -2.769 0.000 -3.663) 4.591 4.699 ( -6.089 0.000 1.086) 6.185 4.826 ( -5.684 0.000 -7.779) 9.634 4.883 ( -0.372 0.000 0.688) 0.782 4.927 ( -1.183 0.000 -0.648) 1.349 4.942 ( 1.221 -0.000 0.919) 1.528 5.036 ( -8.172 0.000 6.889) 10.689 5.119 ( 11.185 -0.000 -3.096) 11.606 5.160 ( -4.392 0.000 -1.674) 4.701 5.244 ( 0.535 -0.000 -3.396) 3.438 5.415 ( -11.481 0.000 2.130) 11.677 5.424 ( -1.728 0.000 -3.298) 3.723 5.722 ( -7.529 0.000 4.699) 8.875 5.972 ( -0.877 0.000 -0.875) 1.239 6.012 ( 2.409 -0.000 4.601) 5.194 6.199 ( 1.688 -0.000 -4.548) 4.851 6.711 ( -6.661 0.000 -3.958) 7.748 6.727 ( 13.760 -0.000 4.067) 14.348 6.828 ( -4.559 0.000 -5.762) 7.347 6.990 ( 7.714 -0.000 -0.548) 7.734 7.251 ( -0.292 0.000 9.440) 9.445 7.376 ( 0.180 -0.000 -1.768) 1.777 7.630 ( 12.557 -0.000 -5.839) 13.848 8.150 ( 5.192 -0.000 4.856) 7.109 8.227 ( 9.727 -0.000 -16.048) 18.766 8.260 ( 3.371 -0.000 0.626) 3.429 8.427 ( -4.610 0.000 -2.171) 5.096 8.576 ( -16.482 0.000 22.987) 28.285 8.912 ( -15.129 0.000 6.352) 16.408 9.046 ( 5.473 -0.000 -9.894) 11.307 9.210 ( 4.759 -0.000 7.723) 9.071 9.215 ( 4.328 -0.000 -1.730) 4.661 9.706 ( 11.233 -0.000 -4.596) 12.137 10.073 ( 6.980 -0.000 1.637) 7.169 10.281 ( 5.032 -0.000 1.761) 5.331 10.480 ( -15.790 0.000 11.701) 19.653 10.584 ( -14.068 0.000 -6.868) 15.655 10.785 ( 6.304 -0.000 -22.034) 22.918 10.934 ( 1.262 -0.000 7.841) 7.942 10.979 ( -5.434 0.000 1.336) 5.596 11.344 ( 6.671 -0.000 -2.690) 7.193 11.400 ( 4.845 -0.000 2.033) 5.255 11.469 ( 11.072 -0.000 -29.233) 31.260 11.492 ( 4.475 -0.000 5.468) 7.066 11.786 ( 10.886 -0.000 -1.365) 10.971 12.006 ( 8.478 -0.000 3.056) 9.012 12.518 ( -7.764 0.000 3.338) 8.451 12.711 ( -7.403 0.000 0.725) 7.438 13.117 ( 15.529 -0.000 1.399) 15.592 13.275 ( 0.245 -0.000 -3.006) 3.016 13.407 ( 1.886 -0.000 -1.538) 2.434 13.549 ( 8.213 -0.000 -1.393) 8.330 14.182 ( -4.036 0.000 0.000) 4.036 14.200 ( -3.663 0.000 0.942) 3.782 16.003 ( -5.072 0.000 -21.490) 22.081 16.048 ( -4.385 0.000 12.224) 12.987 17.138 ( 7.477 -0.000 -2.714) 7.954 17.439 ( 4.307 -0.000 -3.095) 5.303 17.992 ( 7.710 -0.000 1.513) 7.857 18.286 ( 6.391 -0.000 -11.868) 13.479 19.002 ( -17.391 0.000 9.803) 19.964 19.118 ( -13.919 0.000 -2.337) 14.114 19.768 ( 4.016 -0.000 -3.643) 5.422 19.943 ( 4.538 -0.000 8.381) 9.531 20.353 ( 11.047 -0.000 0.813) 11.077 20.912 ( -4.150 0.000 -0.729) 4.213 20.952 ( -0.178 0.000 -4.117) 4.120 21.548 ( 15.697 -0.000 -43.824) 46.550 21.717 ( -10.488 0.000 30.338) 32.100 21.929 ( 3.668 -0.000 1.863) 4.114 21.986 ( 5.486 -0.000 -0.920) 5.563 22.383 ( 3.366 -0.000 -0.061) 3.367 22.406 ( -0.658 0.000 1.160) 1.334 22.830 ( -6.844 0.000 3.746) 7.802 23.185 ( -3.555 0.000 -0.518) 3.593 23.216 ( -3.392 0.000 1.043) 3.548 ======================= Grid point 25 (18/102) ======================= q-point: ( 0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.938 ( 17.949 -8.477 2.944) 20.068 1.110 ( 20.569 -13.018 -1.219) 24.373 1.322 ( 8.489 1.292 -0.926) 8.636 1.544 ( 14.054 -10.807 -3.731) 18.117 1.888 ( 22.379 -2.442 0.416) 22.516 1.925 ( 21.679 -4.655 2.921) 22.365 2.283 ( 13.025 0.409 4.652) 13.837 2.407 ( 3.875 3.925 -7.665) 9.443 2.622 ( -3.008 -7.611 3.860) 9.049 2.626 ( 0.604 -4.332 -3.241) 5.444 2.751 ( 1.745 0.788 0.549) 1.992 2.868 ( 7.340 -4.319 -1.562) 8.659 2.962 ( -0.210 -2.115 1.080) 2.384 3.025 ( -0.374 -3.001 2.024) 3.639 3.188 ( -10.349 2.928 4.964) 11.845 3.257 ( -2.594 1.674 -3.361) 4.563 3.413 ( 3.764 3.041 -1.469) 5.057 3.491 ( -1.394 0.848 -0.628) 1.748 3.578 ( -2.505 -2.517 4.781) 5.955 3.681 ( 0.080 3.778 -1.779) 4.177 3.788 ( -3.785 0.745 2.394) 4.540 3.838 ( 0.093 -3.908 -5.820) 7.011 3.949 ( 2.589 1.863 -3.914) 5.049 3.973 ( -4.712 3.997 0.100) 6.180 4.167 ( -1.619 4.995 6.192) 8.119 4.385 ( -1.924 1.231 0.822) 2.428 4.607 ( -4.983 -4.249 -1.045) 6.631 4.650 ( -0.560 2.248 -2.207) 3.200 4.690 ( -4.758 3.332 -2.589) 6.359 4.785 ( 1.486 3.443 -2.977) 4.788 4.872 ( -2.143 3.595 3.151) 5.239 4.940 ( -9.368 1.319 2.785) 9.861 5.107 ( -2.893 -7.611 -0.588) 8.163 5.150 ( -3.329 0.867 2.649) 4.342 5.232 ( 1.758 0.150 -0.646) 1.879 5.264 ( 6.424 -3.548 -1.689) 7.531 5.330 ( -6.624 -3.641 -0.957) 7.619 5.425 ( -4.647 -1.837 -2.724) 5.691 5.682 ( -8.078 -0.952 3.397) 8.814 6.002 ( 0.668 -3.085 -1.690) 3.580 6.017 ( 4.967 2.402 2.581) 6.091 6.227 ( 0.873 -2.065 -0.624) 2.327 6.638 ( 2.390 1.604 -2.872) 4.066 6.720 ( -6.160 2.825 0.727) 6.816 6.851 ( 12.274 1.236 -0.093) 12.337 7.058 ( 6.981 -1.287 -3.127) 7.757 7.252 ( 1.068 0.932 4.628) 4.840 7.402 ( -1.440 -2.699 2.059) 3.688 7.723 ( 5.366 -2.414 -4.542) 7.433 8.178 ( 2.149 1.939 5.877) 6.551 8.239 ( 1.780 2.913 -8.409) 9.076 8.321 ( 5.531 -1.102 -3.827) 6.816 8.360 ( -5.491 1.626 1.677) 5.967 8.479 ( -2.871 1.601 9.276) 9.841 8.802 ( -11.962 0.948 4.147) 12.696 8.947 ( -6.751 6.440 -2.787) 9.737 9.250 ( 9.235 1.391 1.622) 9.479 9.321 ( 2.697 -2.839 0.774) 3.991 9.770 ( 9.312 0.927 -5.351) 10.780 10.104 ( -4.885 14.980 1.046) 15.791 10.143 ( 7.862 -0.587 -2.003) 8.135 10.390 ( 0.051 6.074 1.092) 6.172 10.498 ( -9.973 -2.005 2.225) 10.413 10.749 ( -0.025 2.831 -10.233) 10.617 10.872 ( 3.838 5.529 2.977) 7.360 10.967 ( 0.556 1.560 2.527) 3.021 11.272 ( 7.000 5.886 1.034) 9.204 11.323 ( 11.463 5.829 -9.505) 15.991 11.591 ( 7.876 -7.310 1.581) 10.861 11.712 ( 3.730 -7.634 -1.829) 8.691 11.850 ( 9.668 1.427 -1.639) 9.909 12.042 ( 2.472 1.405 2.110) 3.541 12.495 ( -5.203 -1.675 1.490) 5.665 12.648 ( -6.024 1.107 0.589) 6.153 13.179 ( 14.649 6.272 2.064) 16.068 13.231 ( 4.150 4.525 -2.737) 6.722 13.375 ( 1.341 3.773 -0.659) 4.058 13.471 ( 6.568 10.024 0.220) 11.986 14.149 ( -5.716 1.316 0.866) 5.929 14.169 ( -5.426 0.868 -0.157) 5.497 15.868 ( -5.965 2.993 -8.032) 10.443 16.044 ( -8.178 -0.416 5.894) 10.089 17.140 ( 8.850 4.819 -0.611) 10.096 17.483 ( 3.886 -1.715 -2.585) 4.972 17.808 ( 13.000 11.336 0.955) 17.275 18.478 ( 4.139 -4.231 -5.617) 8.160 18.859 ( -10.770 2.953 3.727) 11.773 19.171 ( -16.880 -11.768 -0.918) 20.598 19.675 ( 1.700 10.393 -3.372) 11.057 19.859 ( -2.057 8.495 3.705) 9.494 20.166 ( 15.514 29.192 3.779) 33.274 20.653 ( -1.948 16.840 -0.217) 16.953 21.049 ( 3.038 -10.768 -3.127) 11.617 21.459 ( 14.926 -0.868 -9.338) 17.628 21.789 ( -1.857 -9.435 8.685) 12.957 21.965 ( 3.311 -0.671 1.118) 3.558 22.392 ( 3.542 0.179 -2.332) 4.244 22.420 ( -1.484 -4.294 -1.672) 4.841 22.565 ( -11.872 -30.090 -3.544) 32.541 22.804 ( -5.983 -1.340 3.923) 7.278 23.151 ( -4.275 0.263 -1.305) 4.477 23.226 ( -4.256 -3.563 1.884) 5.861 ======================= Grid point 26 (19/102) ======================= q-point: ( 0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.235 ( 7.847 -10.344 6.105) 14.347 1.352 ( 7.830 -0.829 2.257) 8.190 1.502 ( 14.677 -14.881 1.225) 20.937 1.800 ( 11.856 -6.183 -8.881) 16.052 2.026 ( 12.468 -5.376 -2.077) 13.735 2.221 ( 10.016 -2.339 -3.359) 10.820 2.367 ( 8.738 -0.310 2.091) 8.990 2.444 ( 14.409 -7.817 -3.716) 16.808 2.692 ( -4.199 -4.182 4.941) 7.716 2.748 ( -4.123 -3.375 2.877) 6.055 2.759 ( -1.073 -2.503 1.513) 3.116 2.954 ( -0.469 3.512 2.412) 4.286 3.014 ( 1.743 -3.364 2.885) 4.762 3.083 ( -0.042 -5.163 -4.042) 6.557 3.117 ( -0.088 -1.281 0.711) 1.468 3.213 ( -0.048 0.195 -2.086) 2.095 3.369 ( 0.031 3.600 1.651) 3.961 3.435 ( -1.248 3.230 -2.004) 4.001 3.547 ( -6.445 0.610 -2.048) 6.790 3.673 ( 4.397 0.457 0.536) 4.453 3.746 ( -4.457 0.556 1.542) 4.749 3.823 ( -2.688 4.686 0.333) 5.413 3.884 ( -0.730 0.210 -4.801) 4.861 3.976 ( -0.523 -3.844 1.267) 4.081 4.088 ( 0.368 4.170 4.169) 5.908 4.323 ( -1.741 4.083 0.059) 4.439 4.499 ( -1.633 6.596 -2.026) 7.091 4.647 ( -3.183 -0.158 -1.017) 3.345 4.720 ( 2.370 -2.246 -0.850) 3.374 4.743 ( -7.808 -0.921 0.552) 7.882 4.848 ( 4.389 -2.623 -0.849) 5.183 4.888 ( -3.907 0.092 1.039) 4.044 5.068 ( -7.574 2.333 1.237) 8.021 5.116 ( -5.650 1.175 0.327) 5.780 5.207 ( -2.377 -0.612 0.454) 2.496 5.375 ( 1.602 -1.471 -1.054) 2.417 5.398 ( -1.922 -5.919 -0.580) 6.250 5.504 ( 3.292 -8.823 -2.608) 9.772 5.654 ( -6.690 -1.576 2.848) 7.440 6.012 ( 5.948 2.511 -0.486) 6.475 6.064 ( -0.503 -2.417 0.579) 2.536 6.281 ( 2.349 -2.998 1.210) 3.997 6.630 ( -4.434 1.771 -1.513) 5.008 6.706 ( 9.511 -3.742 -2.018) 10.418 6.907 ( 10.860 2.371 2.375) 11.367 7.113 ( 4.515 -0.634 -4.502) 6.407 7.253 ( 0.525 0.622 1.548) 1.749 7.457 ( -0.665 -3.434 5.001) 6.103 7.755 ( -0.460 0.068 -3.410) 3.441 8.039 ( -2.748 12.890 4.190) 13.829 8.186 ( -1.159 1.900 -3.537) 4.179 8.242 ( -4.524 3.509 3.426) 6.672 8.396 ( 1.858 -2.022 0.599) 2.811 8.553 ( 6.632 -3.373 -4.354) 8.621 8.733 ( -9.646 -1.096 2.055) 9.924 8.771 ( -6.692 5.444 1.560) 8.766 9.241 ( 5.069 5.658 0.878) 7.647 9.340 ( -1.105 1.417 0.513) 1.869 9.739 ( 0.247 10.788 -8.599) 13.798 9.834 ( 4.232 6.675 1.243) 8.001 10.157 ( -5.259 7.021 4.142) 9.701 10.274 ( 7.663 2.439 -6.273) 10.198 10.496 ( -0.999 0.411 5.679) 5.781 10.677 ( -3.635 0.361 -2.791) 4.597 10.881 ( 7.177 -1.028 0.624) 7.277 10.944 ( 5.172 2.967 0.552) 5.988 11.247 ( 6.095 3.120 2.190) 7.188 11.342 ( 9.386 0.644 -4.960) 10.636 11.751 ( 10.528 -2.169 -0.660) 10.769 11.824 ( 7.693 1.273 2.395) 8.157 11.884 ( 7.378 -0.300 -2.503) 7.796 11.998 ( -2.767 3.752 1.800) 4.997 12.486 ( -4.014 -0.670 -0.232) 4.076 12.592 ( -2.960 1.695 1.067) 3.574 13.090 ( 12.151 12.300 -0.475) 17.296 13.189 ( 13.647 10.407 0.099) 17.162 13.344 ( -1.170 -0.843 0.597) 1.560 13.365 ( -3.383 0.897 -0.022) 3.500 14.051 ( -5.204 6.239 0.195) 8.127 14.075 ( -7.910 2.117 0.296) 8.194 15.790 ( -5.439 -0.210 -3.577) 6.513 15.973 ( -8.688 1.656 3.027) 9.348 17.138 ( 5.911 1.189 0.008) 6.029 17.530 ( 1.064 -1.593 -1.461) 2.409 17.812 ( 14.285 2.043 0.906) 14.459 18.467 ( 2.703 5.361 -2.048) 6.344 18.729 ( -7.159 5.344 1.909) 9.135 19.170 ( -6.641 2.539 0.873) 7.164 19.453 ( -0.243 12.257 -4.397) 13.024 19.725 ( 1.220 10.204 -0.188) 10.278 19.806 ( 0.865 10.302 3.378) 10.876 20.314 ( -1.464 18.909 0.433) 18.971 21.322 ( 3.625 -14.078 0.712) 14.555 21.593 ( 14.445 -1.366 -6.191) 15.775 21.994 ( -1.551 -10.864 5.557) 12.301 22.015 ( 1.931 -3.208 1.793) 4.152 22.402 ( 1.995 0.969 -4.630) 5.134 22.471 ( -0.229 -3.932 1.954) 4.397 22.801 ( -4.397 -1.676 3.656) 5.959 22.895 ( -12.151 -18.419 -3.878) 22.404 23.108 ( -4.092 0.312 -3.110) 5.149 23.271 ( -5.435 -4.315 2.768) 7.471 ======================= Grid point 27 (20/102) ======================= q-point: ( 0.45 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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 ( 3.250 -7.336 0.173) 8.025 1.570 ( 7.005 -10.688 4.729) 13.626 1.854 ( 7.622 -13.282 4.019) 15.832 1.895 ( 10.479 1.088 -9.861) 14.430 2.170 ( 4.067 -2.955 -2.285) 5.522 2.332 ( 3.689 -7.270 -2.832) 8.630 2.443 ( 4.695 -2.301 0.555) 5.258 2.666 ( -1.809 1.435 3.671) 4.336 2.687 ( 1.611 2.393 4.180) 5.079 2.739 ( -0.440 -4.623 0.681) 4.694 2.784 ( -5.621 -0.370 2.138) 6.025 2.929 ( 3.717 -1.345 0.946) 4.065 3.020 ( 0.396 0.324 3.244) 3.284 3.140 ( 1.106 -2.661 -3.768) 4.744 3.243 ( 2.512 -3.693 -2.673) 5.205 3.251 ( 5.340 -3.041 -3.230) 6.942 3.282 ( -0.226 4.505 1.207) 4.669 3.384 ( -1.814 -0.125 -2.873) 3.400 3.514 ( -3.059 -1.829 -2.874) 4.579 3.681 ( 4.184 3.195 1.168) 5.393 3.719 ( -4.610 -1.275 1.785) 5.105 3.776 ( -2.635 -0.610 0.475) 2.746 3.825 ( -4.895 1.355 2.005) 5.460 3.972 ( -0.524 3.540 1.573) 3.910 4.151 ( 2.293 -7.076 -0.519) 7.457 4.225 ( -1.902 4.033 -0.714) 4.516 4.385 ( -1.674 3.987 -0.508) 4.354 4.556 ( -7.248 5.388 1.104) 9.099 4.679 ( -1.509 0.418 -0.693) 1.713 4.853 ( -2.332 -5.871 -3.925) 7.437 4.864 ( -2.084 -0.099 3.524) 4.095 4.917 ( 3.378 -1.409 1.889) 4.119 5.009 ( -4.354 -1.811 -3.155) 5.674 5.091 ( -1.320 -1.548 1.962) 2.826 5.190 ( -3.148 -0.803 -0.151) 3.253 5.419 ( 1.805 -2.161 -2.079) 3.500 5.476 ( -1.565 -3.984 -0.644) 4.328 5.624 ( -4.146 -3.417 1.986) 5.728 5.714 ( 5.981 -5.696 -0.411) 8.270 6.001 ( 1.520 2.385 0.491) 2.870 6.080 ( -0.751 -0.479 0.462) 1.003 6.371 ( 5.053 -2.450 2.537) 6.162 6.594 ( -0.132 -0.860 -4.557) 4.639 6.847 ( 8.694 -1.712 -2.398) 9.180 6.953 ( 8.859 0.354 5.069) 10.213 7.124 ( 0.896 0.179 -4.870) 4.955 7.244 ( 0.453 0.906 0.420) 1.096 7.529 ( 0.758 -2.107 5.981) 6.387 7.694 ( -6.913 3.416 -0.801) 7.752 7.779 ( -2.426 12.493 -0.872) 12.757 8.082 ( -2.492 5.131 -1.128) 5.814 8.213 ( -3.310 -0.764 3.902) 5.173 8.431 ( 1.553 -0.327 -2.633) 3.075 8.530 ( -7.307 4.510 -3.130) 9.140 8.690 ( 0.146 -0.861 -0.994) 1.323 8.760 ( -2.498 -3.039 5.764) 6.979 9.161 ( 3.334 5.581 0.027) 6.501 9.282 ( -0.534 3.037 -0.679) 3.158 9.479 ( -2.596 11.578 -2.463) 12.119 9.805 ( 2.039 4.008 -2.758) 5.275 9.965 ( -2.215 7.107 2.971) 8.015 10.294 ( 9.582 3.914 -3.402) 10.895 10.485 ( -2.027 0.032 3.499) 4.044 10.672 ( -3.280 -2.569 -1.840) 4.555 10.946 ( 6.789 2.126 -0.037) 7.114 10.999 ( 7.031 -5.076 0.628) 8.695 11.249 ( 5.084 1.996 2.038) 5.829 11.384 ( 4.806 0.319 -1.720) 5.114 11.756 ( 1.052 8.075 -0.417) 8.154 11.819 ( 11.789 6.411 -1.458) 13.499 11.926 ( 0.825 0.834 1.810) 2.157 11.949 ( 9.121 1.818 0.525) 9.315 12.458 ( -2.799 0.736 -1.165) 3.120 12.528 ( -1.529 4.507 1.565) 5.010 12.971 ( 8.576 8.435 -0.454) 12.038 13.057 ( 7.265 10.743 -0.007) 12.969 13.367 ( -4.219 -4.195 -1.517) 6.140 13.415 ( 1.815 -4.878 1.865) 5.529 13.882 ( -6.000 7.001 -0.288) 9.225 13.973 ( -6.556 3.190 0.643) 7.319 15.764 ( -4.116 -1.242 -2.867) 5.168 15.889 ( -7.617 0.924 2.331) 8.019 17.176 ( 4.248 -0.922 0.057) 4.347 17.544 ( -3.412 -1.203 -0.741) 3.693 17.896 ( 11.124 0.269 1.040) 11.175 18.356 ( 1.206 7.576 -2.137) 7.963 18.565 ( -0.275 9.552 2.109) 9.786 19.052 ( -0.179 6.349 3.533) 7.268 19.251 ( 1.221 9.208 -5.446) 10.768 19.516 ( 8.845 12.684 1.252) 15.514 19.787 ( -14.787 -7.245 -1.565) 16.540 19.970 ( -3.718 15.981 1.578) 16.484 21.550 ( 7.781 -4.127 2.037) 9.041 21.696 ( 8.011 -3.631 -2.876) 9.254 22.083 ( 2.646 -3.787 -5.353) 7.071 22.171 ( -2.695 -6.197 7.113) 9.811 22.369 ( -1.575 1.162 -1.049) 2.220 22.584 ( 2.073 -7.386 0.227) 7.675 22.810 ( -3.065 -1.269 4.410) 5.518 23.051 ( -6.932 -3.505 -4.197) 8.829 23.100 ( -3.615 -8.275 -3.043) 9.529 23.305 ( -5.887 -3.531 2.698) 7.376 ======================= Grid point 28 (21/102) ======================= q-point: ( 0.55 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.577 ( 1.340 -8.458 -3.086) 9.103 1.770 ( 6.143 -5.265 -0.329) 8.097 1.937 ( 6.636 -2.134 -4.775) 8.449 2.086 ( -3.169 -7.273 9.076) 12.055 2.217 ( -0.102 -1.142 -2.049) 2.348 2.422 ( -0.820 -0.260 1.201) 1.478 2.493 ( -0.802 -1.051 1.678) 2.136 2.628 ( -0.047 3.466 2.257) 4.136 2.645 ( 5.326 0.252 0.412) 5.348 2.691 ( -3.945 1.685 -0.964) 4.397 2.851 ( 2.332 -3.066 0.639) 3.904 2.980 ( 4.499 -0.820 -4.055) 6.112 3.067 ( 1.467 -1.514 3.183) 3.818 3.126 ( -1.044 7.151 1.296) 7.342 3.194 ( -0.118 -1.802 -1.664) 2.455 3.334 ( -0.396 -1.589 -1.613) 2.299 3.342 ( 2.027 -4.065 -1.046) 4.661 3.370 ( 0.875 -0.234 -4.496) 4.586 3.565 ( 1.714 -3.475 -1.468) 4.143 3.620 ( -0.828 4.399 3.754) 5.842 3.723 ( 0.319 0.006 -0.006) 0.319 3.781 ( -2.866 -1.198 1.434) 3.421 3.797 ( -6.231 -4.284 1.005) 7.628 3.976 ( 2.510 -3.431 0.321) 4.263 4.126 ( -3.899 1.471 -1.396) 4.395 4.251 ( -0.905 1.209 1.235) 1.951 4.338 ( -6.514 1.415 0.846) 6.720 4.449 ( 1.641 -1.554 -4.200) 4.770 4.649 ( -1.353 1.604 -0.283) 2.117 4.810 ( -8.503 -1.529 5.264) 10.117 4.942 ( 0.079 -2.570 -0.806) 2.694 4.991 ( 2.812 -0.406 -0.165) 2.846 5.014 ( 1.605 -2.495 -0.725) 3.054 5.129 ( 1.265 -1.778 -0.376) 2.214 5.212 ( -2.517 -3.050 0.770) 4.029 5.463 ( 0.419 -2.631 -2.795) 3.862 5.504 ( 0.098 0.022 -1.253) 1.257 5.668 ( -1.611 -3.364 3.483) 5.104 5.833 ( 4.710 -2.127 -2.912) 5.932 5.954 ( -1.137 2.112 3.028) 3.863 6.095 ( 1.657 -0.642 -0.439) 1.831 6.427 ( 3.502 0.707 3.907) 5.294 6.640 ( 2.710 -3.832 -7.354) 8.724 6.843 ( 4.862 5.392 -1.095) 7.342 6.982 ( -2.791 4.949 6.914) 8.950 7.154 ( 6.399 -1.974 -5.127) 8.434 7.225 ( -1.329 1.114 0.090) 1.736 7.466 ( -6.737 5.986 5.156) 10.383 7.571 ( -1.500 7.005 -3.640) 8.036 7.622 ( -4.159 1.456 1.081) 4.537 8.005 ( -1.498 0.813 -1.094) 2.025 8.205 ( -5.430 -0.515 4.738) 7.224 8.395 ( -5.256 2.699 0.979) 5.990 8.414 ( -0.465 2.645 -5.565) 6.179 8.686 ( 3.281 2.453 -4.758) 6.278 8.799 ( -3.989 -2.478 5.424) 7.175 9.109 ( 0.146 2.188 2.862) 3.606 9.261 ( 4.387 -0.238 -1.645) 4.691 9.335 ( 2.867 2.945 -0.628) 4.158 9.689 ( -5.635 4.211 0.332) 7.043 9.911 ( 5.786 3.147 -1.118) 6.680 10.254 ( 8.033 6.862 -1.088) 10.621 10.492 ( -2.790 -2.065 1.853) 3.935 10.692 ( -2.602 -2.329 -2.414) 4.245 10.958 ( 6.196 2.120 0.036) 6.549 11.137 ( 4.639 -4.178 -0.044) 6.243 11.259 ( 2.615 0.690 2.545) 3.713 11.385 ( -0.023 1.306 -0.663) 1.465 11.561 ( -4.272 9.960 -0.290) 10.841 11.765 ( 7.022 6.340 0.821) 9.497 11.915 ( 9.256 7.968 -0.073) 12.214 11.962 ( 7.409 2.071 -0.453) 7.707 12.407 ( 0.134 5.031 -2.428) 5.588 12.429 ( -3.392 1.824 2.412) 4.544 12.920 ( 4.247 2.980 -0.257) 5.194 12.945 ( 2.654 5.487 0.144) 6.097 13.426 ( -2.857 -5.668 -2.329) 6.761 13.534 ( 3.288 -4.422 2.529) 6.063 13.726 ( -4.399 5.234 -0.566) 6.861 13.875 ( -5.199 2.373 0.738) 5.762 15.746 ( -3.195 -0.294 -2.512) 4.075 15.852 ( -4.768 -1.524 2.088) 5.424 17.231 ( 4.332 -1.577 0.021) 4.610 17.530 ( -6.742 -2.034 -0.078) 7.043 17.961 ( 6.034 0.158 1.518) 6.224 18.215 ( -1.295 6.630 -4.222) 7.966 18.414 ( 6.336 9.850 2.646) 12.007 18.974 ( 0.690 4.504 7.007) 8.358 19.092 ( 2.021 8.138 -7.547) 11.281 19.398 ( 6.399 8.822 0.598) 10.915 19.684 ( -5.275 5.531 -0.777) 7.682 19.852 ( -12.553 -7.377 0.638) 14.574 21.594 ( 11.160 5.385 0.741) 12.413 21.841 ( 0.702 -6.985 0.465) 7.036 22.140 ( 0.903 -0.395 -3.182) 3.331 22.194 ( -0.619 0.040 -1.723) 1.831 22.373 ( -3.532 -2.911 3.800) 5.949 22.753 ( 2.511 -8.619 0.581) 8.996 22.820 ( -1.500 -0.928 3.364) 3.798 23.012 ( -2.140 1.624 -4.180) 4.969 23.237 ( -2.533 -8.473 -1.613) 8.990 23.332 ( -4.828 -3.703 1.925) 6.382 ======================= Grid point 29 (22/102) ======================= q-point: (-0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.610 ( -1.192 3.231 -2.263) 4.121 1.898 ( 4.082 -0.504 -0.786) 4.188 1.987 ( 1.729 1.472 -6.786) 7.156 2.120 ( -8.384 -2.391 11.998) 14.831 2.178 ( -1.205 4.665 0.898) 4.901 2.412 ( -1.203 -0.395 1.599) 2.040 2.469 ( 5.143 3.419 -1.492) 6.353 2.625 ( -0.183 3.409 -3.715) 5.046 2.648 ( -0.432 -4.616 1.428) 4.851 2.694 ( 0.758 -0.732 -0.439) 1.142 2.862 ( 1.827 6.056 2.199) 6.697 2.995 ( -4.783 2.310 1.534) 5.529 3.034 ( 2.657 -3.371 -2.624) 5.031 3.152 ( 7.180 -2.921 -3.469) 8.492 3.185 ( -3.812 -1.486 1.579) 4.385 3.334 ( 2.277 1.486 -1.114) 2.938 3.382 ( -2.239 -2.667 -3.139) 4.688 3.402 ( 0.127 0.070 -0.087) 0.170 3.557 ( -1.784 1.005 2.936) 3.580 3.592 ( -0.229 1.020 2.776) 2.967 3.737 ( 2.144 -1.056 -0.217) 2.400 3.822 ( 4.876 -2.815 -3.847) 6.819 3.885 ( -2.775 -6.152 3.984) 7.837 4.047 ( -3.446 -1.780 0.368) 3.896 4.127 ( -0.332 -3.261 -1.571) 3.635 4.169 ( -2.772 3.695 -0.376) 4.635 4.254 ( -5.331 0.146 1.762) 5.617 4.540 ( 1.881 -4.178 -4.049) 6.115 4.603 ( -1.683 2.068 -0.020) 2.667 4.823 ( -5.030 -3.973 3.947) 7.528 4.948 ( 1.512 2.715 -2.388) 3.919 4.987 ( 4.629 0.657 0.235) 4.681 5.098 ( -0.105 -2.615 2.755) 3.800 5.165 ( -0.518 -2.752 -0.673) 2.880 5.234 ( -1.462 -1.253 -0.604) 2.018 5.466 ( -3.546 1.098 -1.775) 4.114 5.535 ( 6.108 -2.040 -1.476) 6.606 5.723 ( -1.566 -2.499 4.939) 5.752 5.834 ( -1.334 1.230 -3.804) 4.214 5.957 ( 2.340 -0.263 2.611) 3.516 6.109 ( 1.947 0.887 -1.225) 2.466 6.423 ( 2.031 2.678 1.866) 3.844 6.673 ( -1.116 4.114 -1.985) 4.702 6.742 ( 2.047 7.354 -1.081) 7.710 6.862 ( -3.170 0.908 1.622) 3.675 7.082 ( -5.550 9.202 2.214) 10.972 7.192 ( -1.723 2.822 -2.893) 4.394 7.418 ( 2.086 0.313 0.503) 2.168 7.475 ( -3.300 -0.764 -1.740) 3.808 7.538 ( -4.330 3.382 1.204) 5.625 8.020 ( -1.016 -3.181 -1.158) 3.534 8.150 ( -7.412 2.435 3.042) 8.374 8.308 ( 0.205 5.761 3.675) 6.836 8.398 ( -1.655 -4.599 -3.441) 5.978 8.624 ( 1.581 4.804 -3.825) 6.341 8.859 ( 2.133 -4.394 -1.012) 4.988 9.100 ( -0.973 -1.222 3.546) 3.875 9.337 ( 1.571 -4.609 1.135) 5.000 9.397 ( 9.213 -3.516 -0.353) 9.868 9.612 ( -4.740 0.096 0.789) 4.806 9.885 ( 4.485 3.883 -1.600) 6.144 10.174 ( 5.344 6.848 -1.225) 8.772 10.524 ( -1.874 -2.952 1.833) 3.948 10.704 ( -1.794 -1.385 -2.022) 3.037 10.954 ( 5.397 3.424 -0.121) 6.392 11.177 ( -1.047 2.451 1.508) 3.062 11.261 ( 0.546 1.147 1.559) 2.011 11.332 ( -6.580 2.418 -1.643) 7.200 11.392 ( -0.092 4.448 -0.315) 4.460 11.723 ( 3.754 2.500 2.313) 5.069 11.783 ( 4.518 10.730 -1.924) 11.800 11.977 ( 7.781 2.821 -0.267) 8.281 12.325 ( -0.154 2.495 0.526) 2.555 12.409 ( -1.478 -0.810 -0.835) 1.881 12.871 ( -0.279 3.275 0.968) 3.427 12.924 ( 2.942 0.829 -0.655) 3.126 13.519 ( -1.122 -6.752 -2.587) 7.317 13.558 ( -0.235 3.686 1.152) 3.869 13.649 ( -1.792 1.816 1.053) 2.761 13.863 ( -0.924 -4.590 0.566) 4.716 15.722 ( -2.739 -0.107 -0.834) 2.865 15.872 ( -1.663 -2.610 0.597) 3.152 17.301 ( 5.783 -2.006 -0.092) 6.122 17.527 ( -8.332 -3.846 0.504) 9.190 17.979 ( 2.646 2.393 1.543) 3.887 18.093 ( -1.237 4.823 -4.267) 6.557 18.327 ( 6.660 5.023 2.291) 8.651 18.847 ( -3.929 8.589 1.165) 9.516 19.025 ( 4.241 0.860 -0.965) 4.434 19.258 ( -0.020 7.990 -0.053) 7.990 19.680 ( 2.448 -4.901 -0.630) 5.515 19.917 ( -10.117 -8.805 0.450) 13.420 21.562 ( 9.609 6.537 0.310) 11.626 21.886 ( -4.463 2.188 0.105) 4.972 22.130 ( 0.030 -1.979 0.530) 2.048 22.213 ( 1.743 -0.524 -2.917) 3.438 22.401 ( -2.707 -1.706 1.939) 3.742 22.836 ( -0.737 -1.496 3.991) 4.326 22.912 ( 2.591 -2.022 -4.259) 5.380 22.950 ( -0.957 -0.881 0.327) 1.342 23.342 ( -1.145 -4.391 -0.690) 4.590 23.395 ( -1.271 -5.966 0.732) 6.143 ======================= Grid point 30 (23/102) ======================= q-point: (-0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.497 ( -1.944 6.844 -0.613) 7.141 1.700 ( -1.664 18.203 1.318) 18.326 1.875 ( -1.117 9.161 -0.887) 9.272 2.060 ( -0.789 7.909 0.887) 7.997 2.230 ( -0.838 -9.502 0.559) 9.555 2.324 ( -1.115 8.016 -0.124) 8.094 2.484 ( 3.069 6.190 -0.128) 6.910 2.584 ( -2.884 3.238 -0.688) 4.390 2.636 ( -1.697 -2.070 1.101) 2.895 2.681 ( 1.203 4.569 -1.099) 4.851 2.810 ( 0.892 -0.404 -0.325) 1.031 2.931 ( -1.319 0.128 0.317) 1.363 3.127 ( -1.148 -5.585 0.955) 5.781 3.216 ( 1.547 1.164 -2.699) 3.321 3.250 ( -0.017 -5.099 0.210) 5.103 3.299 ( 2.497 4.095 1.275) 4.963 3.358 ( -0.930 -0.295 -0.172) 0.990 3.450 ( 3.423 -3.033 -3.826) 5.963 3.529 ( -5.588 0.258 2.765) 6.240 3.613 ( 3.428 -2.184 0.961) 4.177 3.773 ( 3.127 0.879 1.248) 3.480 3.892 ( 4.222 -1.720 -3.871) 5.980 3.932 ( 0.292 0.470 3.369) 3.414 4.019 ( -7.586 0.010 -0.190) 7.589 4.101 ( -1.146 -1.371 1.797) 2.534 4.189 ( 0.574 0.067 -2.322) 2.393 4.278 ( -1.701 -4.768 1.524) 5.287 4.557 ( -1.304 0.897 -0.960) 1.851 4.587 ( -0.514 -1.023 -0.637) 1.310 4.872 ( -2.015 -1.809 0.595) 2.772 4.897 ( 3.240 2.744 -1.996) 4.691 4.995 ( 2.447 2.917 0.799) 3.890 5.124 ( -2.849 -3.188 1.939) 4.695 5.214 ( -0.075 -1.373 0.127) 1.381 5.266 ( 2.597 -2.530 -1.381) 3.880 5.434 ( -1.807 -1.627 -2.211) 3.287 5.597 ( 5.297 0.819 1.061) 5.464 5.733 ( -6.073 0.083 3.744) 7.135 5.788 ( 0.054 2.230 -2.197) 3.131 5.984 ( 0.443 -1.096 2.897) 3.129 6.073 ( 0.964 3.807 -3.615) 5.337 6.377 ( 0.080 2.570 -0.402) 2.603 6.489 ( -1.929 8.941 2.149) 9.395 6.642 ( -1.161 8.311 -0.785) 8.428 6.871 ( 0.307 3.352 2.463) 4.171 6.920 ( -3.144 -3.059 -2.638) 5.119 7.082 ( -3.976 6.098 -0.425) 7.292 7.377 ( -1.278 6.716 -0.076) 6.837 7.429 ( -0.829 -1.886 -0.294) 2.081 7.583 ( -1.648 -5.957 0.428) 6.195 8.053 ( -2.367 1.298 -1.829) 3.261 8.100 ( -2.119 -4.785 1.807) 5.536 8.232 ( 0.338 3.273 1.750) 3.727 8.504 ( -0.221 -7.006 0.026) 7.009 8.538 ( 0.494 4.810 -1.542) 5.075 8.949 ( 2.314 -3.245 -1.479) 4.251 9.149 ( 0.962 -2.873 1.090) 3.221 9.436 ( 1.455 -3.919 0.706) 4.239 9.538 ( 5.317 -4.972 -0.779) 7.321 9.618 ( -2.423 -3.699 1.692) 4.735 9.839 ( 1.279 2.729 -0.862) 3.135 10.097 ( 2.042 4.035 -0.981) 4.627 10.574 ( 0.786 -2.159 0.923) 2.476 10.716 ( -0.573 -1.885 -0.162) 1.977 10.889 ( 0.935 7.047 -0.504) 7.126 11.058 ( -3.748 7.609 2.157) 8.752 11.211 ( 0.012 2.455 -2.568) 3.553 11.270 ( -3.247 0.277 1.065) 3.429 11.363 ( 0.155 0.082 -0.620) 0.644 11.634 ( 0.623 6.502 -0.152) 6.533 11.742 ( 2.469 -0.867 0.926) 2.776 11.961 ( 2.204 3.206 -0.473) 3.919 12.321 ( 0.717 -1.454 0.660) 1.750 12.439 ( -0.006 -3.623 -1.131) 3.795 12.812 ( -0.503 3.177 0.794) 3.314 12.928 ( 1.250 0.452 -0.301) 1.363 13.482 ( -0.252 3.847 0.145) 3.858 13.582 ( 0.404 2.881 -1.018) 3.083 13.654 ( -1.943 -7.997 0.579) 8.250 13.987 ( 1.073 -7.541 0.321) 7.623 15.706 ( -1.800 -0.087 0.067) 1.803 15.913 ( -0.270 -2.443 -0.145) 2.462 17.389 ( 7.534 -1.873 -0.629) 7.789 17.546 ( -8.780 -5.290 1.283) 10.331 17.901 ( 1.048 7.730 0.691) 7.831 17.987 ( -0.552 5.775 -2.403) 6.279 18.370 ( 4.538 -4.773 1.666) 6.793 18.703 ( -4.540 2.204 -0.915) 5.129 19.068 ( 4.305 -1.354 0.468) 4.537 19.144 ( -3.682 2.571 0.017) 4.491 19.835 ( 5.318 -8.084 -0.634) 9.697 20.024 ( -6.527 -10.018 0.508) 11.968 21.506 ( 7.368 6.806 -0.020) 10.030 21.736 ( -6.378 8.323 -0.083) 10.486 22.192 ( 0.398 -2.719 1.082) 2.953 22.207 ( 0.680 1.605 -0.913) 1.968 22.405 ( -1.060 -0.321 -0.081) 1.111 22.806 ( -0.426 7.824 0.318) 7.842 22.879 ( 0.686 -2.498 -0.592) 2.657 23.068 ( 0.822 -5.988 0.315) 6.052 23.394 ( -0.171 -2.260 -0.228) 2.278 23.504 ( 0.869 -5.353 0.188) 5.426 ======================= Grid point 31 (24/102) ======================= q-point: (-0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.324 ( 0.000 12.016 -0.000) 12.016 1.353 ( 0.000 17.342 -0.000) 17.342 1.685 ( 0.000 10.383 -0.000) 10.383 1.901 ( 0.000 8.710 -0.000) 8.710 2.143 ( 0.000 11.248 -0.000) 11.248 2.246 ( 0.000 12.871 -0.000) 12.871 2.394 ( 0.000 11.735 -0.000) 11.735 2.458 ( -0.000 -9.545 0.000) 9.545 2.500 ( 0.000 14.629 -0.000) 14.629 2.767 ( -0.000 -5.705 0.000) 5.705 2.852 ( -0.000 -3.436 0.000) 3.436 2.928 ( 0.000 1.128 -0.000) 1.128 3.105 ( 0.000 7.273 -0.000) 7.273 3.203 ( 0.000 5.070 -0.000) 5.070 3.245 ( -0.000 -4.277 0.000) 4.277 3.360 ( -0.000 -3.928 0.000) 3.928 3.381 ( -0.000 -0.271 0.000) 0.271 3.434 ( 0.000 1.922 -0.000) 1.922 3.551 ( -0.000 -2.185 0.000) 2.185 3.706 ( -0.000 -4.041 0.000) 4.041 3.775 ( -0.000 -2.002 0.000) 2.002 3.919 ( -0.000 -1.699 0.000) 1.699 3.936 ( 0.000 2.447 -0.000) 2.447 3.970 ( -0.000 -0.945 0.000) 0.945 4.149 ( -0.000 -3.049 0.000) 3.049 4.163 ( 0.000 1.689 -0.000) 1.689 4.363 ( -0.000 -4.623 0.000) 4.623 4.567 ( -0.000 -2.905 0.000) 2.905 4.577 ( 0.000 1.965 -0.000) 1.965 4.801 ( 0.000 5.514 -0.000) 5.514 4.928 ( -0.000 -1.961 0.000) 1.961 4.937 ( 0.000 3.053 -0.000) 3.053 5.192 ( -0.000 -4.046 0.000) 4.046 5.215 ( 0.000 0.095 -0.000) 0.095 5.342 ( -0.000 -4.270 0.000) 4.270 5.462 ( 0.000 1.475 -0.000) 1.475 5.577 ( 0.000 2.785 -0.000) 2.785 5.685 ( -0.000 -0.418 0.000) 0.418 5.724 ( 0.000 5.249 -0.000) 5.249 5.981 ( 0.000 4.637 -0.000) 4.637 6.040 ( -0.000 -3.724 0.000) 3.724 6.360 ( -0.000 -0.637 0.000) 0.637 6.367 ( 0.000 5.171 -0.000) 5.171 6.432 ( 0.000 10.901 -0.000) 10.901 6.868 ( -0.000 -1.761 0.000) 1.761 6.917 ( 0.000 6.852 -0.000) 6.852 7.038 ( -0.000 -7.443 0.000) 7.443 7.261 ( 0.000 5.434 -0.000) 5.434 7.476 ( -0.000 -3.634 0.000) 3.634 7.674 ( -0.000 -4.701 0.000) 4.701 8.032 ( -0.000 -0.509 0.000) 0.509 8.188 ( -0.000 -4.236 0.000) 4.236 8.208 ( -0.000 -0.485 0.000) 0.485 8.450 ( 0.000 4.591 -0.000) 4.591 8.628 ( -0.000 -6.470 0.000) 6.470 9.001 ( -0.000 -2.095 0.000) 2.095 9.199 ( -0.000 -1.816 0.000) 1.816 9.459 ( 0.000 2.525 -0.000) 2.525 9.643 ( -0.000 -5.114 0.000) 5.114 9.702 ( -0.000 -4.172 0.000) 4.172 9.825 ( -0.000 -1.118 0.000) 1.118 10.070 ( -0.000 -0.697 0.000) 0.697 10.588 ( 0.000 0.846 -0.000) 0.846 10.723 ( 0.000 8.851 -0.000) 8.851 10.788 ( -0.000 -3.951 0.000) 3.951 10.919 ( 0.000 4.297 -0.000) 4.297 11.192 ( 0.000 0.809 -0.000) 0.809 11.248 ( 0.000 0.507 -0.000) 0.507 11.380 ( -0.000 -2.096 0.000) 2.096 11.570 ( 0.000 1.155 -0.000) 1.155 11.765 ( 0.000 0.227 -0.000) 0.227 11.904 ( 0.000 3.161 -0.000) 3.161 12.383 ( -0.000 -4.846 0.000) 4.846 12.529 ( -0.000 -5.977 0.000) 5.977 12.753 ( 0.000 2.981 -0.000) 2.981 12.920 ( 0.000 1.109 -0.000) 1.109 13.422 ( 0.000 2.577 -0.000) 2.577 13.529 ( 0.000 2.616 -0.000) 2.616 13.806 ( -0.000 -8.993 0.000) 8.993 14.129 ( -0.000 -7.283 0.000) 7.283 15.697 ( 0.000 0.365 -0.000) 0.365 15.950 ( -0.000 -1.717 0.000) 1.717 17.422 ( 0.000 2.562 -0.000) 2.562 17.631 ( -0.000 -8.050 0.000) 8.050 17.747 ( 0.000 8.996 -0.000) 8.996 17.869 ( 0.000 5.683 -0.000) 5.683 18.553 ( -0.000 -12.405 0.000) 12.405 18.718 ( -0.000 -5.742 0.000) 5.742 19.076 ( 0.000 0.976 -0.000) 0.976 19.170 ( -0.000 -5.745 0.000) 5.745 20.019 ( -0.000 -9.611 0.000) 9.611 20.193 ( -0.000 -11.183 0.000) 11.183 21.414 ( 0.000 7.274 -0.000) 7.274 21.519 ( 0.000 11.858 -0.000) 11.858 22.158 ( 0.000 3.694 -0.000) 3.694 22.206 ( 0.000 2.303 -0.000) 2.303 22.410 ( -0.000 -0.891 0.000) 0.891 22.650 ( 0.000 8.745 -0.000) 8.745 22.929 ( -0.000 -2.497 0.000) 2.497 23.160 ( -0.000 -3.748 0.000) 3.748 23.417 ( -0.000 -0.226 0.000) 0.226 23.591 ( -0.000 -3.617 0.000) 3.617 ======================= Grid point 36 (25/102) ======================= q-point: ( 0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.033 ( 22.220 -0.000 -1.540) 22.274 1.136 ( 21.837 -0.000 -3.527) 22.120 1.436 ( 13.420 -0.000 -3.652) 13.908 1.527 ( 13.423 -0.000 2.489) 13.652 1.988 ( 5.138 -0.000 8.018) 9.523 2.102 ( 32.293 -0.000 0.604) 32.299 2.364 ( 4.614 -0.000 0.224) 4.619 2.480 ( 0.583 -0.000 1.938) 2.024 2.541 ( -0.285 0.000 0.042) 0.288 2.557 ( 4.556 -0.000 -9.058) 10.139 2.762 ( -0.202 0.000 -0.527) 0.565 2.870 ( 3.827 -0.000 -5.600) 6.782 2.947 ( -0.418 0.000 4.867) 4.885 3.003 ( 1.447 -0.000 3.322) 3.623 3.176 ( -5.522 0.000 6.206) 8.307 3.239 ( -1.703 0.000 -4.541) 4.850 3.449 ( -1.976 0.000 -1.527) 2.497 3.494 ( -1.044 0.000 5.369) 5.469 3.550 ( -1.561 0.000 1.752) 2.347 3.698 ( -4.421 0.000 -0.743) 4.483 3.782 ( -1.752 0.000 4.757) 5.069 3.791 ( 2.573 -0.000 -7.926) 8.333 3.979 ( 4.691 -0.000 -2.927) 5.529 4.005 ( -1.786 0.000 -6.376) 6.621 4.244 ( 1.178 -0.000 8.341) 8.423 4.361 ( -3.744 0.000 -0.279) 3.754 4.522 ( -1.120 0.000 -2.531) 2.768 4.625 ( -4.775 0.000 1.674) 5.060 4.698 ( -6.573 0.000 -5.806) 8.770 4.875 ( -0.450 0.000 -0.116) 0.464 4.881 ( -10.846 0.000 4.005) 11.562 4.899 ( -3.013 0.000 1.413) 3.328 4.937 ( -1.495 0.000 -0.195) 1.508 5.147 ( -0.943 0.000 -0.709) 1.180 5.195 ( -5.417 0.000 -0.854) 5.484 5.259 ( -10.698 0.000 4.124) 11.466 5.314 ( 15.484 -0.000 -5.193) 16.332 5.383 ( -2.968 0.000 1.496) 3.324 5.621 ( -7.633 0.000 2.149) 7.930 5.966 ( 0.808 -0.000 -1.389) 1.607 6.100 ( 6.538 -0.000 2.888) 7.148 6.208 ( 1.325 -0.000 -2.040) 2.433 6.626 ( -2.079 0.000 -2.978) 3.632 6.689 ( -8.410 0.000 0.399) 8.419 6.962 ( 11.841 -0.000 1.241) 11.906 7.088 ( 6.484 -0.000 -4.026) 7.632 7.287 ( 1.147 -0.000 5.611) 5.727 7.362 ( -1.167 0.000 0.630) 1.326 7.732 ( 4.627 -0.000 -5.180) 6.945 8.201 ( 0.967 -0.000 -9.353) 9.403 8.276 ( -2.445 0.000 10.103) 10.395 8.304 ( -0.618 0.000 3.065) 3.127 8.357 ( -0.011 0.000 -8.879) 8.879 8.486 ( -2.055 0.000 7.790) 8.057 8.708 ( -15.542 0.000 7.550) 17.279 8.970 ( -5.999 0.000 -5.270) 7.985 9.288 ( 0.907 -0.000 6.956) 7.015 9.369 ( 12.390 -0.000 -5.458) 13.539 9.842 ( 9.728 -0.000 -6.922) 11.939 10.148 ( -18.901 0.000 10.688) 21.714 10.189 ( 6.788 -0.000 -0.375) 6.798 10.347 ( -13.977 0.000 -1.686) 14.079 10.536 ( 11.827 -0.000 4.168) 12.540 10.772 ( 3.130 -0.000 -16.083) 16.384 10.926 ( -2.050 0.000 1.779) 2.714 11.021 ( 6.306 -0.000 5.270) 8.218 11.469 ( 12.785 -0.000 -6.671) 14.420 11.495 ( 6.663 -0.000 1.280) 6.785 11.507 ( 5.344 -0.000 -9.645) 11.027 11.596 ( 5.865 -0.000 5.782) 8.236 11.927 ( 6.378 -0.000 3.582) 7.315 12.073 ( 0.560 -0.000 -1.265) 1.383 12.459 ( -1.022 0.000 0.110) 1.028 12.614 ( -5.448 0.000 0.881) 5.518 13.240 ( -3.260 0.000 -1.758) 3.704 13.255 ( 0.997 -0.000 1.687) 1.960 13.525 ( 13.518 -0.000 1.127) 13.565 13.662 ( 7.805 -0.000 -2.952) 8.344 14.121 ( -4.066 0.000 0.621) 4.113 14.136 ( -5.208 0.000 0.455) 5.227 15.815 ( -10.378 0.000 -8.929) 13.690 15.955 ( -12.859 0.000 7.899) 15.091 17.298 ( 12.890 -0.000 0.925) 12.923 17.494 ( 4.755 -0.000 -2.969) 5.606 18.117 ( 7.668 -0.000 2.251) 7.992 18.333 ( 5.415 -0.000 -7.222) 9.027 18.808 ( -12.813 0.000 5.824) 14.075 18.905 ( -12.951 0.000 -2.720) 13.233 19.788 ( 0.930 -0.000 -3.165) 3.299 20.000 ( -0.495 0.000 4.693) 4.719 20.500 ( 6.884 -0.000 2.685) 7.389 20.850 ( -2.547 0.000 -2.984) 3.924 20.954 ( 1.842 -0.000 -1.240) 2.220 21.569 ( 6.180 -0.000 -20.494) 21.405 21.700 ( -4.600 0.000 13.431) 14.197 21.995 ( 4.139 -0.000 0.755) 4.207 22.061 ( 4.835 -0.000 -1.167) 4.974 22.399 ( -1.080 0.000 1.770) 2.074 22.447 ( 5.286 -0.000 -0.359) 5.298 22.764 ( -3.540 0.000 3.082) 4.694 23.116 ( -5.135 0.000 -0.946) 5.221 23.164 ( -4.082 0.000 1.237) 4.265 ======================= Grid point 37 (26/102) ======================= q-point: ( 0.36 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.191 ( 13.559 -2.709 2.058) 13.979 1.406 ( 20.235 -10.525 -4.728) 23.293 1.452 ( 7.411 4.446 3.193) 9.213 1.738 ( 12.547 -8.290 -1.994) 15.170 2.051 ( 8.907 -1.446 2.167) 9.280 2.286 ( 6.129 2.113 -2.892) 7.099 2.407 ( 8.625 -4.819 0.834) 9.915 2.471 ( 9.281 2.155 -2.245) 9.789 2.575 ( -4.266 -6.401 -0.343) 7.700 2.614 ( -2.935 -2.723 2.550) 4.747 2.772 ( 2.698 0.949 -0.539) 2.911 2.943 ( 0.125 -4.512 -2.777) 5.300 2.968 ( 1.343 -4.326 1.832) 4.886 3.040 ( 1.210 -1.111 3.913) 4.244 3.123 ( 0.159 3.364 4.837) 5.894 3.224 ( 1.479 0.499 -4.128) 4.413 3.423 ( -8.064 -0.675 0.677) 8.120 3.455 ( 2.619 3.885 -1.528) 4.928 3.525 ( -4.511 1.936 4.025) 6.348 3.685 ( -0.549 -1.415 -0.174) 1.527 3.742 ( -2.391 2.103 0.353) 3.203 3.855 ( 4.955 -3.809 -4.492) 7.697 3.890 ( -5.531 4.976 -2.899) 7.985 3.994 ( 5.016 3.903 -1.920) 6.640 4.203 ( 1.597 5.428 5.781) 8.090 4.354 ( -2.652 0.808 -0.424) 2.805 4.550 ( -0.925 -1.625 -1.274) 2.263 4.591 ( -5.563 0.341 -2.896) 6.281 4.644 ( 0.012 -1.788 -1.087) 2.092 4.762 ( -4.279 3.936 1.796) 6.085 4.835 ( -2.092 -0.275 -0.369) 2.142 4.866 ( -1.877 0.486 2.194) 2.927 5.015 ( -8.258 -2.107 -1.956) 8.744 5.111 ( -4.568 1.610 -0.543) 4.874 5.171 ( -4.172 -2.598 3.931) 6.293 5.249 ( -4.458 -5.639 1.484) 7.340 5.343 ( -4.797 0.490 -1.029) 4.931 5.453 ( 14.465 -3.356 -2.793) 15.110 5.580 ( -6.892 -1.302 2.291) 7.378 6.004 ( -1.246 -3.279 0.599) 3.558 6.122 ( 7.345 3.419 0.212) 8.105 6.244 ( 2.847 -3.055 -1.510) 4.440 6.600 ( -6.540 0.595 -0.495) 6.585 6.678 ( 2.512 -4.185 -1.197) 5.026 7.031 ( 10.026 1.659 2.682) 10.510 7.125 ( 4.346 -0.127 -5.001) 6.627 7.290 ( 2.188 1.442 1.729) 3.140 7.392 ( -1.314 -3.263 3.630) 5.054 7.744 ( 0.347 0.098 -4.366) 4.381 8.142 ( -9.693 2.697 -1.225) 10.136 8.233 ( 1.097 4.001 6.061) 7.345 8.265 ( -5.446 2.344 -2.691) 6.511 8.378 ( 2.189 -1.712 0.865) 2.911 8.526 ( 3.995 -2.511 -0.924) 4.808 8.632 ( -10.786 -1.551 3.903) 11.575 8.842 ( -6.080 6.735 -1.127) 9.143 9.318 ( -1.849 -0.707 4.815) 5.206 9.401 ( 8.482 3.945 -5.161) 10.684 9.861 ( 4.756 3.713 -7.796) 9.858 9.961 ( -12.498 6.106 6.670) 15.426 10.206 ( -7.386 3.286 3.169) 8.683 10.289 ( 3.038 -2.555 -2.815) 4.866 10.590 ( 11.127 4.296 2.145) 12.118 10.713 ( 0.525 4.314 -7.648) 8.796 10.917 ( 1.457 0.249 1.880) 2.391 11.054 ( 8.358 2.896 2.049) 9.079 11.396 ( 6.992 7.035 0.800) 9.951 11.446 ( 10.042 4.176 -4.833) 11.901 11.714 ( 7.401 -7.844 -0.532) 10.797 11.787 ( 7.069 -8.911 1.650) 11.493 11.967 ( 5.097 1.103 2.067) 5.610 12.036 ( -2.776 2.484 -1.627) 4.065 12.462 ( 0.471 -0.010 -0.851) 0.973 12.582 ( -3.302 0.033 0.954) 3.437 13.216 ( -3.108 -0.844 -1.799) 3.689 13.276 ( -0.790 -2.217 1.181) 2.634 13.491 ( 10.875 13.008 0.796) 16.974 13.606 ( 10.656 11.798 -0.512) 15.906 14.049 ( -6.994 1.955 0.307) 7.269 14.097 ( -5.075 2.631 0.323) 5.725 15.717 ( -9.604 -0.236 -3.491) 10.221 15.893 ( -12.972 -1.698 3.236) 13.477 17.302 ( 11.309 7.882 0.643) 13.799 17.530 ( 3.335 -0.226 -1.499) 3.663 18.015 ( 13.721 8.033 0.691) 15.915 18.500 ( 1.578 -3.959 -3.262) 5.367 18.728 ( -8.257 1.227 2.339) 8.669 18.922 ( -15.445 -12.750 -0.232) 20.029 19.670 ( -0.542 11.267 -2.175) 11.488 19.838 ( -2.256 12.797 1.495) 13.080 20.335 ( 5.406 23.575 1.674) 24.245 20.660 ( 2.951 16.732 0.149) 16.990 21.074 ( 1.914 -12.929 -2.004) 13.222 21.597 ( 8.625 -5.322 -7.707) 12.732 21.791 ( -2.345 -9.629 6.967) 12.115 22.022 ( 3.253 0.242 1.650) 3.656 22.356 ( -3.512 -15.261 -5.607) 16.633 22.427 ( 1.414 -2.552 -2.298) 3.714 22.490 ( 0.458 -6.049 3.744) 7.128 22.761 ( -1.595 -0.939 2.532) 3.136 23.070 ( -5.459 0.183 -1.632) 5.701 23.169 ( -4.250 -3.214 1.730) 5.603 ======================= Grid point 38 (27/102) ======================= q-point: ( 0.45 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.312 ( 0.217 -3.584 4.893) 6.069 1.488 ( 7.431 -3.540 2.609) 8.635 1.738 ( 16.528 -10.783 -2.838) 19.937 1.929 ( 9.045 -4.077 -6.454) 11.836 2.162 ( 3.991 -0.808 -0.103) 4.073 2.253 ( 2.467 -2.487 -4.937) 6.054 2.464 ( 2.953 0.304 1.837) 3.490 2.599 ( -6.818 -3.732 4.685) 9.076 2.648 ( -3.872 -7.265 1.118) 8.308 2.678 ( 6.181 -3.763 -1.275) 7.347 2.781 ( 4.060 0.907 2.903) 5.073 2.928 ( -5.322 0.166 3.031) 6.127 3.069 ( 6.625 1.808 3.621) 7.763 3.094 ( -2.547 -1.891 0.334) 3.190 3.136 ( 3.678 -6.552 -3.629) 8.344 3.251 ( 5.847 -1.157 -2.567) 6.489 3.361 ( -3.679 0.711 -0.994) 3.877 3.427 ( -4.412 3.461 -0.997) 5.696 3.448 ( 3.369 1.145 -1.591) 3.898 3.680 ( -5.588 1.314 1.465) 5.925 3.719 ( 0.793 -1.586 0.809) 1.949 3.769 ( -4.201 2.199 -0.771) 4.804 3.879 ( 1.928 6.458 -2.912) 7.342 4.034 ( 8.173 -4.825 0.232) 9.494 4.107 ( -0.435 5.432 3.490) 6.471 4.274 ( -4.823 4.187 0.349) 6.396 4.462 ( -2.519 5.431 -2.614) 6.532 4.582 ( -5.683 2.368 2.502) 6.646 4.662 ( -1.627 -1.203 -0.296) 2.044 4.750 ( 1.605 -3.342 -2.267) 4.346 4.831 ( -5.638 -0.295 -0.129) 5.647 4.907 ( 2.606 -3.122 1.766) 4.434 4.934 ( -5.353 -1.294 -0.047) 5.507 5.052 ( -4.320 0.244 -0.008) 4.327 5.181 ( -1.743 0.820 0.941) 2.144 5.340 ( -3.131 -5.411 -3.356) 7.096 5.365 ( -0.937 -6.561 -0.755) 6.670 5.543 ( -4.866 -2.255 4.982) 7.321 5.662 ( 10.527 -5.870 -2.177) 12.248 6.033 ( -4.423 -1.443 2.165) 5.132 6.096 ( 4.954 3.622 -0.490) 6.156 6.359 ( 7.340 -4.669 -1.052) 8.762 6.553 ( -4.672 -0.880 -1.463) 4.974 6.815 ( 5.798 -6.086 -0.879) 8.451 7.069 ( 8.686 2.567 2.982) 9.536 7.125 ( 0.953 0.946 -3.352) 3.611 7.282 ( 2.364 1.617 -0.423) 2.895 7.466 ( -1.010 -4.776 4.334) 6.528 7.698 ( -4.758 2.633 -3.468) 6.450 7.960 ( -7.708 9.368 2.054) 12.304 8.142 ( -3.490 4.257 -1.318) 5.660 8.218 ( -0.574 1.654 4.208) 4.557 8.421 ( 1.973 -1.553 -2.509) 3.550 8.539 ( -7.275 2.143 -0.848) 7.632 8.644 ( 1.262 -2.850 -3.068) 4.374 8.703 ( -5.813 1.296 5.205) 7.910 9.274 ( -3.441 4.452 3.613) 6.687 9.361 ( 6.946 4.365 -5.198) 9.711 9.666 ( -6.818 11.008 0.845) 12.976 9.894 ( 4.548 2.971 -5.525) 7.749 10.048 ( -9.267 6.165 5.479) 12.406 10.369 ( 5.885 -1.488 -2.962) 6.755 10.556 ( 6.044 5.765 -0.672) 8.380 10.645 ( 0.434 2.209 -0.242) 2.264 10.966 ( 3.078 -2.937 2.793) 5.089 11.067 ( 10.261 3.127 -0.793) 10.756 11.347 ( 5.242 4.060 1.100) 6.721 11.442 ( 4.930 2.769 -1.130) 5.766 11.870 ( 6.208 -1.693 -1.082) 6.525 11.925 ( -1.942 3.178 -0.722) 3.794 11.979 ( 10.838 -0.740 0.744) 10.889 11.997 ( 3.530 -1.537 0.601) 3.897 12.452 ( -0.376 0.968 -0.430) 1.124 12.559 ( -2.126 0.909 0.422) 2.350 13.210 ( 2.567 2.765 -2.158) 4.347 13.307 ( 1.599 8.938 0.841) 9.119 13.333 ( -0.553 -2.857 1.575) 3.310 13.413 ( 11.037 16.322 0.380) 19.708 13.940 ( -7.794 4.641 -0.501) 9.085 13.987 ( -5.111 3.678 0.612) 6.326 15.677 ( -7.130 -2.643 -1.330) 7.719 15.831 ( -9.927 -0.734 0.904) 9.995 17.258 ( 8.946 4.722 0.180) 10.117 17.525 ( -1.403 1.261 -0.478) 1.947 18.034 ( 14.181 3.675 0.736) 14.668 18.479 ( 0.519 4.997 -2.637) 5.674 18.650 ( -4.402 2.227 2.146) 5.380 19.028 ( -11.463 -7.790 1.421) 13.932 19.434 ( -0.420 12.033 -1.682) 12.157 19.639 ( -5.130 4.527 -0.228) 6.846 19.928 ( 6.696 23.430 -1.039) 24.390 20.320 ( 1.482 21.757 1.344) 21.849 21.365 ( 1.880 -15.478 0.311) 15.595 21.752 ( 10.086 -3.467 -6.039) 12.256 21.988 ( -2.541 -10.758 5.660) 12.419 22.052 ( 1.652 -1.672 2.387) 3.350 22.406 ( 0.829 2.764 -3.498) 4.535 22.483 ( 1.577 -5.196 -0.909) 5.506 22.722 ( -8.681 -13.349 5.222) 16.758 22.795 ( 0.340 -5.014 -2.636) 5.675 23.031 ( -4.029 -0.930 -3.233) 5.249 23.205 ( -4.670 -3.548 2.343) 6.316 ======================= Grid point 39 (28/102) ======================= q-point: ( 0.55 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.414 ( -0.548 -8.221 0.285) 8.244 1.659 ( 2.730 -8.751 3.395) 9.776 1.966 ( 6.259 -2.281 -2.225) 7.023 2.027 ( 10.209 -2.780 -4.572) 11.526 2.156 ( -3.895 -2.055 -0.589) 4.443 2.361 ( 2.577 -4.911 -1.213) 5.677 2.490 ( 0.981 0.266 1.446) 1.767 2.585 ( -8.697 -2.863 4.225) 10.084 2.698 ( -2.241 -0.655 0.033) 2.335 2.753 ( 2.795 4.799 3.251) 6.436 2.789 ( 1.767 -4.928 0.716) 5.283 2.978 ( 5.678 -3.868 -2.683) 7.376 3.064 ( 1.525 0.531 2.886) 3.307 3.156 ( 0.634 -2.866 1.438) 3.268 3.238 ( -3.423 -3.636 -1.170) 5.129 3.277 ( -0.539 6.672 -0.443) 6.708 3.301 ( -0.262 -1.634 -0.445) 1.713 3.394 ( 7.685 0.051 -6.633) 10.152 3.495 ( 5.262 -4.125 -4.752) 8.203 3.643 ( -7.260 -2.747 2.811) 8.256 3.729 ( -4.957 -0.772 4.093) 6.474 3.742 ( 2.459 4.279 -1.577) 5.181 3.759 ( -3.458 1.965 1.791) 4.362 3.996 ( 2.484 4.098 1.318) 4.970 4.139 ( -4.122 3.464 1.068) 5.489 4.248 ( 5.395 -5.878 -1.382) 8.097 4.333 ( -3.754 5.138 -2.345) 6.782 4.466 ( -4.110 4.909 1.389) 6.551 4.666 ( -0.177 0.825 -1.049) 1.347 4.731 ( -8.995 -0.157 1.741) 9.164 4.841 ( -3.409 -5.852 -0.494) 6.790 4.989 ( 2.488 -2.511 3.397) 4.903 4.997 ( 3.340 -1.774 -1.155) 3.954 5.058 ( -3.100 -3.997 -0.349) 5.070 5.185 ( 3.305 -1.646 -0.683) 3.755 5.385 ( -4.109 -3.826 -4.644) 7.286 5.470 ( 1.121 -3.957 -1.321) 4.320 5.583 ( -3.434 -4.474 5.915) 8.173 5.824 ( 8.622 -3.618 -3.271) 9.906 5.995 ( -3.880 2.146 4.860) 6.579 6.091 ( 2.637 -0.062 -2.248) 3.466 6.473 ( 5.375 -1.390 4.080) 6.890 6.567 ( -0.188 -3.650 -6.053) 7.071 6.910 ( 1.180 0.153 -1.372) 1.816 7.091 ( 5.361 3.933 6.030) 8.976 7.117 ( 1.771 -2.656 -3.013) 4.389 7.263 ( 2.439 2.024 -1.780) 3.635 7.547 ( -10.200 7.246 -0.899) 12.544 7.560 ( 0.058 -4.299 3.184) 5.350 7.733 ( -2.533 10.613 -0.730) 10.935 8.044 ( -1.901 4.055 -0.380) 4.495 8.195 ( -1.108 1.243 3.751) 4.104 8.394 ( -7.000 4.254 -2.781) 8.650 8.453 ( 3.016 0.458 -2.830) 4.161 8.680 ( -3.551 -3.395 1.120) 5.039 8.719 ( -2.377 -2.145 2.188) 3.879 9.158 ( -3.675 4.842 2.698) 6.650 9.341 ( 7.990 3.328 -5.176) 10.085 9.455 ( -0.791 7.641 1.557) 7.838 9.767 ( -4.404 8.830 -0.618) 9.887 9.973 ( 1.156 0.614 0.417) 1.374 10.404 ( 3.921 0.923 -1.035) 4.159 10.490 ( 3.389 5.485 0.108) 6.448 10.635 ( -1.119 -1.360 -0.675) 1.886 11.035 ( 2.995 -0.380 1.769) 3.499 11.118 ( 9.489 -1.132 -0.767) 9.587 11.320 ( 2.855 2.792 1.266) 4.189 11.401 ( -2.696 2.511 -0.372) 3.703 11.740 ( -0.513 10.580 -0.966) 10.636 11.922 ( 3.020 4.445 0.345) 5.385 12.034 ( 10.677 -0.419 -1.611) 10.806 12.083 ( 6.763 1.793 1.741) 7.210 12.423 ( -2.000 1.195 0.573) 2.399 12.499 ( -2.006 4.256 -0.721) 4.760 13.072 ( 4.530 10.528 0.329) 11.466 13.151 ( 4.801 14.285 -0.215) 15.071 13.299 ( -3.540 -4.989 -1.261) 6.246 13.459 ( 2.702 -6.081 1.845) 6.905 13.789 ( -5.356 5.624 -0.696) 7.797 13.892 ( -4.307 3.298 0.523) 5.450 15.687 ( -3.972 -2.853 -1.644) 5.160 15.788 ( -6.009 -1.290 1.209) 6.263 17.266 ( 7.071 1.234 -0.002) 7.178 17.474 ( -5.576 0.918 0.031) 5.651 18.056 ( 8.684 3.853 1.313) 9.591 18.338 ( -1.281 8.623 -3.459) 9.379 18.586 ( 1.260 4.596 1.747) 5.076 19.052 ( -1.908 -0.511 5.776) 6.104 19.238 ( 0.173 9.360 -4.874) 10.554 19.596 ( -8.257 -2.479 -1.807) 8.808 19.642 ( 6.237 10.493 -0.479) 12.217 19.929 ( -2.726 20.385 1.633) 20.631 21.627 ( 2.229 -11.008 1.249) 11.301 21.814 ( 7.826 2.726 -2.043) 8.535 22.101 ( 3.132 -3.771 -6.295) 7.979 22.149 ( -4.384 -5.318 7.970) 10.537 22.340 ( -1.481 2.357 -0.839) 2.908 22.617 ( 2.326 -7.997 -0.795) 8.367 22.801 ( -1.349 -1.666 6.541) 6.883 22.926 ( -5.808 -7.797 -5.006) 10.936 23.070 ( 0.534 -6.790 -3.107) 7.486 23.233 ( -4.885 -3.128 2.424) 6.286 ======================= Grid point 40 (29/102) ======================= q-point: ( 0.64 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.568 ( -0.495 -7.029 -1.230) 7.153 1.834 ( 2.129 -7.966 0.401) 8.256 2.007 ( 7.139 0.543 -10.165) 12.434 2.063 ( -6.489 -0.287 12.222) 13.840 2.188 ( -1.469 -1.935 -0.955) 2.610 2.416 ( -0.008 2.672 -0.437) 2.708 2.522 ( 4.721 -5.855 -0.686) 7.553 2.609 ( -6.332 -4.859 1.453) 8.112 2.650 ( 1.349 6.299 1.734) 6.671 2.707 ( 0.735 2.523 -0.239) 2.639 2.891 ( 2.563 -4.133 -0.167) 4.866 3.045 ( 4.793 3.730 -3.605) 7.063 3.080 ( 1.622 3.609 1.324) 4.172 3.141 ( -2.139 -0.389 0.971) 2.381 3.169 ( 0.779 0.650 0.897) 1.355 3.257 ( -6.968 -2.903 -0.007) 7.548 3.324 ( -0.635 -1.707 -1.110) 2.132 3.445 ( 6.056 0.298 -3.071) 6.796 3.592 ( 2.195 -1.443 -2.175) 3.410 3.614 ( -2.716 4.256 3.640) 6.224 3.721 ( -2.832 -6.742 2.132) 7.617 3.736 ( 1.396 0.021 -2.220) 2.623 3.773 ( -0.208 -6.101 1.605) 6.312 3.991 ( -0.924 -0.169 -0.718) 1.182 4.089 ( 0.264 -1.536 0.905) 1.802 4.227 ( -3.592 2.711 -2.158) 4.991 4.262 ( -1.783 5.979 2.810) 6.843 4.458 ( 1.441 -4.753 -3.002) 5.803 4.634 ( -0.470 1.919 -0.317) 2.001 4.720 ( -4.532 -3.660 2.282) 6.256 4.935 ( 0.192 -5.001 -1.192) 5.145 5.021 ( 2.225 -0.486 0.787) 2.410 5.049 ( -0.234 -2.490 1.696) 3.022 5.097 ( -2.855 -1.931 -0.570) 3.493 5.240 ( 3.348 0.384 1.168) 3.566 5.426 ( -2.200 -3.413 -3.049) 5.078 5.523 ( 2.661 -2.815 -3.075) 4.946 5.654 ( -2.679 -3.615 5.077) 6.783 5.865 ( 1.856 2.545 -3.392) 4.630 5.973 ( 0.405 -0.422 3.807) 3.852 6.114 ( 1.197 -0.946 -1.584) 2.199 6.510 ( 3.835 2.175 4.426) 6.247 6.628 ( -0.175 -3.903 -6.036) 7.190 6.861 ( -0.723 2.950 -0.688) 3.114 6.980 ( -0.437 11.189 3.486) 11.727 7.193 ( -0.630 -1.674 -1.204) 2.156 7.227 ( 3.201 7.487 -0.587) 8.164 7.368 ( -5.806 -0.665 1.017) 5.932 7.543 ( -0.719 7.868 -1.590) 8.059 7.600 ( -0.279 2.255 1.128) 2.537 7.982 ( -0.856 0.703 -0.223) 1.130 8.165 ( -1.861 2.168 2.499) 3.796 8.312 ( -3.174 -0.953 -1.208) 3.527 8.421 ( 1.095 4.614 -1.398) 4.943 8.698 ( 1.098 2.570 -3.210) 4.256 8.758 ( -2.831 -6.205 3.105) 7.494 9.086 ( -2.116 0.950 1.838) 2.960 9.311 ( 1.308 1.129 -0.375) 1.768 9.435 ( 8.149 -0.117 -1.067) 8.219 9.601 ( -5.916 4.142 0.802) 7.266 9.968 ( 2.195 1.996 -0.781) 3.068 10.353 ( 4.326 8.216 -0.426) 9.295 10.461 ( -1.548 -2.071 0.856) 2.724 10.658 ( -0.769 -1.941 -1.070) 2.346 11.049 ( 4.230 1.802 0.169) 4.601 11.197 ( 3.748 -0.433 0.431) 3.797 11.293 ( 0.844 2.070 1.308) 2.590 11.321 ( -6.337 1.672 -1.172) 6.658 11.536 ( 0.301 10.674 0.054) 10.679 11.835 ( 2.048 6.455 0.346) 6.781 12.017 ( 3.729 9.877 -0.014) 10.558 12.090 ( 7.365 2.400 -0.485) 7.761 12.372 ( -4.270 2.565 1.657) 5.249 12.405 ( 0.516 2.931 -1.642) 3.399 12.948 ( 0.466 5.596 0.411) 5.630 12.995 ( 2.441 5.715 -0.277) 6.221 13.381 ( -1.564 -6.391 -1.018) 6.658 13.593 ( 2.762 -4.325 2.215) 5.589 13.665 ( -2.965 4.104 -1.354) 5.241 13.816 ( -2.408 1.439 0.299) 2.822 15.696 ( -1.766 -0.867 -1.032) 2.222 15.804 ( -2.068 -3.288 0.825) 3.971 17.315 ( 6.418 -1.021 -0.118) 6.500 17.426 ( -7.025 -1.042 0.257) 7.106 18.041 ( 3.201 2.733 1.566) 4.491 18.173 ( -1.515 6.757 -2.878) 7.499 18.497 ( 2.961 7.314 0.934) 7.946 19.011 ( -0.627 9.271 7.623) 12.019 19.083 ( 1.620 3.610 -7.458) 8.443 19.493 ( 5.022 14.844 -0.225) 15.672 19.614 ( -2.441 -2.016 -0.768) 3.258 19.701 ( -7.359 -5.459 1.012) 9.218 21.742 ( 7.332 4.836 0.692) 8.810 21.831 ( -2.289 -4.696 -0.164) 5.227 22.130 ( -0.656 1.842 -0.776) 2.103 22.189 ( 0.698 -2.649 -1.669) 3.208 22.341 ( -2.037 -2.909 1.935) 4.044 22.786 ( 1.464 -8.808 -0.659) 8.953 22.821 ( -0.373 -0.517 3.089) 3.154 22.965 ( -1.567 -0.909 -2.453) 3.049 23.225 ( 1.676 -8.312 -1.848) 8.679 23.271 ( -4.121 -4.786 1.933) 6.604 ======================= Grid point 41 (30/102) ======================= q-point: (-0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.593 ( 0.000 3.484 -0.000) 3.484 1.928 ( 0.000 3.888 -0.000) 3.888 1.988 ( 0.000 3.422 -0.000) 3.422 2.076 ( -0.000 -5.184 0.000) 5.184 2.169 ( 0.000 3.480 -0.000) 3.480 2.403 ( -0.000 -1.602 0.000) 1.602 2.516 ( 0.000 5.408 -0.000) 5.408 2.622 ( 0.000 5.822 -0.000) 5.822 2.644 ( -0.000 -2.760 0.000) 2.760 2.688 ( -0.000 -4.032 0.000) 4.032 2.904 ( 0.000 7.562 -0.000) 7.562 2.937 ( 0.000 1.012 -0.000) 1.012 3.058 ( -0.000 -0.024 0.000) 0.024 3.153 ( -0.000 -4.176 0.000) 4.176 3.219 ( -0.000 -1.005 0.000) 1.005 3.321 ( -0.000 -7.768 0.000) 7.768 3.343 ( -0.000 -0.286 0.000) 0.286 3.414 ( 0.000 4.602 -0.000) 4.602 3.550 ( 0.000 2.160 -0.000) 2.160 3.604 ( -0.000 -0.393 0.000) 0.393 3.770 ( -0.000 -2.353 0.000) 2.353 3.840 ( -0.000 -6.338 0.000) 6.338 3.916 ( -0.000 -6.017 0.000) 6.017 3.962 ( 0.000 0.959 -0.000) 0.959 4.133 ( 0.000 4.221 -0.000) 4.221 4.182 ( -0.000 -3.883 0.000) 3.883 4.184 ( -0.000 -0.153 0.000) 0.153 4.539 ( -0.000 -3.646 0.000) 3.646 4.590 ( 0.000 2.610 -0.000) 2.610 4.790 ( -0.000 -4.936 0.000) 4.936 4.962 ( 0.000 1.702 -0.000) 1.702 5.044 ( 0.000 0.742 -0.000) 0.742 5.089 ( 0.000 0.116 -0.000) 0.116 5.136 ( -0.000 -6.573 0.000) 6.573 5.245 ( -0.000 -0.564 0.000) 0.564 5.412 ( 0.000 1.751 -0.000) 1.751 5.635 ( -0.000 -5.925 0.000) 5.925 5.674 ( 0.000 0.605 -0.000) 0.605 5.814 ( 0.000 2.147 -0.000) 2.147 5.984 ( 0.000 0.161 -0.000) 0.161 6.122 ( 0.000 0.763 -0.000) 0.763 6.458 ( 0.000 5.223 -0.000) 5.223 6.647 ( 0.000 3.708 -0.000) 3.708 6.755 ( 0.000 9.459 -0.000) 9.459 6.840 ( -0.000 -1.204 0.000) 1.204 7.037 ( 0.000 11.325 -0.000) 11.325 7.166 ( 0.000 3.604 -0.000) 3.604 7.433 ( 0.000 3.231 -0.000) 3.231 7.458 ( -0.000 -6.924 0.000) 6.924 7.504 ( 0.000 7.005 -0.000) 7.005 8.009 ( -0.000 -3.570 0.000) 3.570 8.098 ( 0.000 3.938 -0.000) 3.938 8.321 ( 0.000 5.778 -0.000) 5.778 8.375 ( -0.000 -6.341 0.000) 6.341 8.626 ( 0.000 4.712 -0.000) 4.712 8.872 ( -0.000 -5.965 0.000) 5.965 9.098 ( -0.000 -2.484 0.000) 2.484 9.350 ( -0.000 -4.487 0.000) 4.487 9.502 ( -0.000 -2.334 0.000) 2.334 9.550 ( -0.000 -1.582 0.000) 1.582 9.917 ( 0.000 4.326 -0.000) 4.326 10.217 ( 0.000 7.796 -0.000) 7.796 10.512 ( -0.000 -3.788 0.000) 3.788 10.686 ( -0.000 -1.428 0.000) 1.428 11.018 ( 0.000 4.479 -0.000) 4.479 11.158 ( 0.000 4.706 -0.000) 4.706 11.255 ( 0.000 3.371 -0.000) 3.371 11.270 ( 0.000 0.846 -0.000) 0.846 11.401 ( 0.000 4.086 -0.000) 4.086 11.756 ( 0.000 2.359 -0.000) 2.359 11.815 ( 0.000 12.193 -0.000) 12.193 12.048 ( 0.000 4.531 -0.000) 4.531 12.325 ( 0.000 1.135 -0.000) 1.135 12.390 ( -0.000 -1.156 0.000) 1.156 12.871 ( 0.000 3.515 -0.000) 3.515 12.947 ( 0.000 1.390 -0.000) 1.390 13.501 ( -0.000 -7.516 0.000) 7.516 13.559 ( 0.000 4.665 -0.000) 4.665 13.636 ( 0.000 2.059 -0.000) 2.059 13.858 ( -0.000 -6.439 0.000) 6.439 15.697 ( -0.000 -0.246 0.000) 0.246 15.860 ( -0.000 -3.226 0.000) 3.226 17.389 ( -0.000 -2.428 0.000) 2.428 17.421 ( -0.000 -3.229 0.000) 3.229 18.007 ( 0.000 3.262 -0.000) 3.262 18.069 ( 0.000 4.223 -0.000) 4.223 18.390 ( 0.000 4.686 -0.000) 4.686 18.811 ( 0.000 10.473 -0.000) 10.473 19.062 ( -0.000 -0.149 0.000) 0.149 19.254 ( 0.000 10.345 -0.000) 10.345 19.722 ( -0.000 -7.025 0.000) 7.025 19.814 ( -0.000 -9.424 0.000) 9.424 21.657 ( 0.000 6.627 -0.000) 6.627 21.832 ( 0.000 4.068 -0.000) 4.068 22.132 ( -0.000 -2.954 0.000) 2.954 22.222 ( -0.000 -0.545 0.000) 0.545 22.382 ( -0.000 -1.846 0.000) 1.846 22.841 ( -0.000 -1.645 0.000) 1.645 22.921 ( 0.000 4.656 -0.000) 4.656 22.944 ( -0.000 -7.888 0.000) 7.888 23.333 ( -0.000 -4.149 0.000) 4.149 23.386 ( -0.000 -7.662 0.000) 7.662 ======================= Grid point 48 (31/102) ======================= q-point: ( 0.36 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.332 ( 18.491 -0.000 -3.329) 18.788 1.402 ( 15.539 -0.000 -5.616) 16.523 1.600 ( 8.266 -0.000 2.514) 8.640 1.709 ( 6.971 -0.000 5.824) 9.084 2.098 ( 6.294 -0.000 2.136) 6.647 2.320 ( -4.935 0.000 -1.938) 5.302 2.382 ( 0.480 -0.000 1.990) 2.047 2.501 ( 2.446 -0.000 -2.725) 3.662 2.567 ( -2.872 0.000 1.889) 3.438 2.579 ( 12.189 -0.000 -3.739) 12.750 2.854 ( 5.086 -0.000 -6.310) 8.104 2.859 ( 0.995 -0.000 -0.393) 1.070 2.924 ( -1.850 0.000 5.981) 6.260 3.026 ( -0.448 0.000 2.690) 2.727 3.202 ( 3.765 -0.000 5.175) 6.400 3.231 ( 3.146 -0.000 -5.160) 6.043 3.340 ( -12.309 0.000 4.648) 13.157 3.520 ( 1.851 -0.000 2.563) 3.161 3.534 ( -0.407 0.000 -0.495) 0.640 3.640 ( -2.485 0.000 -0.441) 2.524 3.776 ( -0.776 0.000 -5.667) 5.720 3.835 ( 7.170 -0.000 2.700) 7.661 3.876 ( -7.903 0.000 -4.952) 9.326 4.096 ( 8.245 -0.000 -2.770) 8.698 4.300 ( -4.379 0.000 -0.732) 4.440 4.313 ( 2.239 -0.000 7.211) 7.551 4.524 ( 2.604 -0.000 -2.510) 3.617 4.544 ( -6.386 0.000 -0.275) 6.392 4.629 ( 0.194 -0.000 -2.056) 2.065 4.773 ( -3.631 0.000 0.413) 3.654 4.862 ( -2.839 0.000 1.671) 3.294 4.879 ( -7.217 0.000 -2.277) 7.568 4.885 ( 1.831 -0.000 -0.047) 1.831 5.071 ( -7.564 0.000 2.307) 7.908 5.107 ( -2.739 0.000 -2.591) 3.770 5.158 ( -5.490 0.000 1.852) 5.794 5.336 ( -6.320 0.000 5.125) 8.137 5.523 ( -5.925 0.000 1.942) 6.235 5.530 ( 15.400 -0.000 -4.253) 15.976 5.953 ( -3.476 0.000 1.451) 3.767 6.219 ( 8.384 -0.000 -0.608) 8.406 6.223 ( 2.021 -0.000 -2.576) 3.274 6.566 ( -8.383 0.000 1.685) 8.550 6.628 ( 3.489 -0.000 -1.985) 4.014 7.123 ( 8.593 -0.000 3.535) 9.292 7.149 ( 4.680 -0.000 -5.367) 7.120 7.330 ( 1.822 -0.000 1.513) 2.368 7.353 ( -0.962 0.000 2.302) 2.495 7.741 ( -0.034 0.000 -4.026) 4.026 8.080 ( -10.634 0.000 0.072) 10.634 8.235 ( -5.091 0.000 -4.220) 6.613 8.300 ( -0.234 0.000 7.645) 7.649 8.374 ( 2.662 -0.000 -2.243) 3.481 8.490 ( -8.877 0.000 5.238) 10.307 8.586 ( 2.759 -0.000 -0.285) 2.774 8.869 ( -4.533 0.000 -3.085) 5.483 9.302 ( -2.204 0.000 5.274) 5.716 9.490 ( 7.634 -0.000 -6.148) 9.802 9.899 ( -18.046 0.000 8.733) 20.048 9.920 ( 4.967 -0.000 -8.205) 9.591 10.176 ( -8.246 0.000 1.399) 8.364 10.303 ( 6.807 -0.000 0.666) 6.840 10.735 ( 10.935 -0.000 4.410) 11.791 10.742 ( 0.652 -0.000 -8.922) 8.946 10.928 ( 1.130 -0.000 -0.134) 1.138 11.156 ( 8.750 -0.000 2.521) 9.106 11.516 ( 1.053 -0.000 -5.542) 5.641 11.600 ( 6.167 -0.000 1.047) 6.255 11.674 ( 15.046 -0.000 -1.799) 15.153 11.715 ( 6.779 -0.000 4.294) 8.024 11.996 ( 0.676 -0.000 4.212) 4.266 12.029 ( -4.322 0.000 -3.547) 5.591 12.480 ( 3.411 -0.000 -1.197) 3.615 12.561 ( -2.219 0.000 0.804) 2.361 13.169 ( -4.997 0.000 -1.114) 5.120 13.241 ( -2.083 0.000 0.614) 2.172 13.722 ( 10.231 -0.000 1.719) 10.374 13.756 ( 6.520 -0.000 -2.729) 7.069 14.052 ( -6.019 0.000 0.203) 6.023 14.071 ( -3.016 0.000 1.212) 3.251 15.633 ( -9.524 0.000 -3.338) 10.093 15.779 ( -12.420 0.000 3.436) 12.887 17.487 ( 10.304 -0.000 1.978) 10.492 17.549 ( 3.869 -0.000 -2.075) 4.390 18.243 ( 7.851 -0.000 2.491) 8.236 18.377 ( 3.633 -0.000 -4.547) 5.820 18.675 ( -7.721 0.000 3.985) 8.688 18.708 ( -11.694 0.000 -2.682) 11.997 19.777 ( -0.696 0.000 -1.674) 1.813 19.986 ( -2.694 0.000 1.981) 3.344 20.573 ( 1.207 -0.000 3.195) 3.415 20.820 ( 0.603 -0.000 -3.937) 3.983 20.986 ( 2.297 -0.000 0.581) 2.369 21.560 ( 1.591 -0.000 -8.541) 8.688 21.695 ( -1.503 0.000 4.542) 4.784 22.052 ( 2.845 -0.000 0.507) 2.889 22.114 ( 2.790 -0.000 -0.928) 2.940 22.388 ( -1.345 0.000 1.521) 2.030 22.533 ( 6.117 -0.000 -0.332) 6.126 22.754 ( 0.466 -0.000 1.757) 1.818 23.028 ( -5.777 0.000 -1.114) 5.883 23.110 ( -3.615 0.000 1.217) 3.814 ======================= Grid point 49 (32/102) ======================= q-point: ( 0.45 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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 ( 5.154 4.369 0.814) 6.805 1.560 ( 4.946 4.784 3.361) 7.658 1.659 ( 15.815 -10.840 -7.030) 20.422 1.874 ( 4.825 -7.250 2.976) 9.203 2.175 ( 6.781 -2.744 -0.845) 7.364 2.242 ( -4.233 2.699 -1.907) 5.370 2.425 ( -5.552 -4.707 3.645) 8.140 2.523 ( -3.561 -0.727 1.830) 4.070 2.541 ( 1.622 -1.386 -2.592) 3.357 2.702 ( 12.423 -1.212 -4.186) 13.165 2.819 ( 1.750 -0.445 -1.202) 2.169 2.873 ( -4.452 -0.814 6.085) 7.584 3.013 ( 0.004 -4.393 -0.917) 4.487 3.056 ( 1.352 -2.993 -0.478) 3.318 3.203 ( 5.531 3.571 1.986) 6.876 3.264 ( -12.504 -1.282 3.809) 13.134 3.266 ( 4.249 -1.589 -0.870) 4.619 3.470 ( 1.062 3.880 -3.010) 5.025 3.526 ( 1.297 2.010 1.974) 3.101 3.674 ( -0.243 -3.270 -0.553) 3.325 3.702 ( -3.150 3.982 0.117) 5.079 3.777 ( -5.999 3.164 -3.603) 7.680 3.965 ( 10.829 -3.673 -3.047) 11.834 4.070 ( 4.954 5.626 0.170) 7.499 4.224 ( -2.214 4.714 3.372) 6.204 4.315 ( -1.440 3.254 1.874) 4.022 4.489 ( -6.034 1.484 -2.079) 6.552 4.567 ( 1.402 -2.699 0.039) 3.042 4.628 ( -1.809 0.686 1.006) 2.181 4.749 ( 0.263 1.020 -3.962) 4.100 4.802 ( -2.393 0.677 0.897) 2.643 4.858 ( -2.476 -1.620 -1.205) 3.195 4.886 ( -1.959 -0.831 3.205) 3.847 5.039 ( -3.001 1.086 -1.742) 3.636 5.149 ( -2.450 -4.076 1.762) 5.071 5.195 ( -2.100 -6.933 -2.102) 7.543 5.270 ( -5.586 -0.240 2.493) 6.121 5.488 ( -4.941 -0.157 3.052) 5.810 5.665 ( 13.692 -3.347 -3.395) 14.498 5.952 ( -6.591 -2.805 2.840) 7.706 6.207 ( 3.509 3.753 0.177) 5.141 6.313 ( 7.163 -4.630 -4.288) 9.546 6.500 ( -6.546 -0.007 1.562) 6.730 6.730 ( 3.990 -6.504 -0.738) 7.666 7.152 ( 2.826 1.836 -4.061) 5.277 7.181 ( 7.586 1.190 3.687) 8.518 7.323 ( 1.192 1.249 -0.421) 1.777 7.388 ( -1.592 -3.201 2.676) 4.466 7.709 ( -2.082 2.099 -3.161) 4.327 7.992 ( -9.011 1.929 1.936) 9.416 8.171 ( -4.321 2.265 -2.836) 5.643 8.275 ( 1.116 3.000 3.644) 4.850 8.398 ( 0.335 -1.282 -0.411) 1.387 8.468 ( -7.151 -2.895 2.627) 8.149 8.629 ( 4.794 -1.098 -2.125) 5.357 8.763 ( -3.858 6.740 -0.107) 7.767 9.295 ( -2.766 0.533 2.986) 4.105 9.490 ( 7.177 4.171 -5.985) 10.234 9.743 ( -13.198 5.107 6.493) 15.570 9.932 ( 2.723 -0.026 -6.432) 6.984 10.093 ( -6.145 4.195 3.207) 8.102 10.369 ( 4.707 -1.816 -0.486) 5.069 10.679 ( 0.884 4.794 -4.546) 6.666 10.769 ( 7.936 5.236 2.384) 9.802 10.946 ( 1.387 -1.500 0.715) 2.164 11.192 ( 8.242 2.793 0.663) 8.727 11.451 ( 0.838 4.335 -1.052) 4.539 11.572 ( 6.311 6.281 0.727) 8.934 11.817 ( 7.151 -6.656 -0.409) 9.778 11.907 ( 5.557 -7.846 1.542) 9.737 11.967 ( -3.874 1.993 -2.936) 5.253 12.025 ( 2.135 -1.884 1.875) 3.409 12.488 ( 2.711 1.622 -0.432) 3.189 12.551 ( -1.512 -0.007 0.162) 1.520 13.150 ( -4.047 -2.175 -0.978) 4.698 13.255 ( -1.582 -2.984 0.554) 3.422 13.623 ( 6.638 13.678 -0.507) 15.212 13.762 ( 9.244 9.545 0.588) 13.301 13.950 ( -6.103 3.680 0.012) 7.127 14.021 ( -4.977 3.488 0.486) 6.097 15.578 ( -6.823 -1.674 -1.043) 7.102 15.728 ( -8.970 -2.276 1.010) 9.309 17.453 ( 8.024 8.018 0.270) 11.347 17.560 ( 0.821 2.452 -0.296) 2.603 18.219 ( 12.921 4.707 0.886) 13.781 18.500 ( 0.264 -3.100 -2.381) 3.918 18.622 ( -8.135 -0.482 0.558) 8.168 18.727 ( -9.310 -11.127 1.025) 14.545 19.648 ( -1.126 11.558 -0.861) 11.645 19.811 ( -1.709 13.273 0.552) 13.394 20.373 ( 0.498 20.408 -0.064) 20.414 20.717 ( 3.377 16.411 0.607) 16.765 21.089 ( 0.948 -13.747 -0.992) 13.815 21.658 ( 3.397 -9.397 -4.171) 10.828 21.786 ( -1.421 -9.278 3.740) 10.104 22.069 ( 1.982 0.213 0.962) 2.213 22.299 ( -1.528 -13.748 -2.811) 14.115 22.421 ( -0.838 -4.161 0.225) 4.250 22.546 ( 4.014 1.748 1.086) 4.511 22.769 ( 1.001 -0.616 1.065) 1.586 22.982 ( -4.845 -0.077 -1.312) 5.020 23.120 ( -2.945 -2.987 1.140) 4.347 ======================= Grid point 50 (33/102) ======================= q-point: ( 0.55 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.314 ( -0.998 -1.287 1.750) 2.391 1.576 ( 2.821 -2.625 1.051) 3.995 1.934 ( 9.395 -9.130 -4.478) 13.845 1.996 ( 2.155 -2.683 0.188) 3.446 2.163 ( 0.185 2.678 -1.580) 3.115 2.284 ( 0.728 -5.451 0.126) 5.501 2.447 ( -6.220 -1.757 2.799) 7.043 2.541 ( -0.162 -1.901 2.493) 3.139 2.615 ( 4.468 -4.659 -4.030) 7.610 2.714 ( -6.401 -0.773 1.698) 6.668 2.858 ( 2.752 2.383 2.885) 4.645 2.938 ( 8.165 -4.927 -2.014) 9.747 3.043 ( -4.581 -3.129 1.544) 5.759 3.138 ( -2.144 -4.240 -1.252) 4.913 3.173 ( 2.937 3.351 1.868) 4.832 3.243 ( -4.855 -3.765 1.012) 6.226 3.328 ( 3.468 -0.002 -1.474) 3.769 3.435 ( 3.461 0.470 -3.384) 4.863 3.509 ( 3.346 0.281 -0.875) 3.470 3.613 ( -1.895 3.031 0.541) 3.615 3.674 ( -7.216 2.011 1.395) 7.620 3.727 ( -0.018 -2.113 0.160) 2.119 3.912 ( 2.677 9.310 -1.831) 9.859 4.115 ( 0.583 5.118 1.323) 5.318 4.173 ( 3.442 -4.824 0.297) 5.933 4.213 ( 1.697 5.800 1.585) 6.247 4.381 ( -5.518 4.024 -3.218) 7.550 4.568 ( 1.750 5.597 3.252) 6.706 4.643 ( -0.934 -3.586 -0.222) 3.712 4.686 ( -9.428 1.406 -0.489) 9.545 4.745 ( -0.673 0.118 -0.391) 0.787 4.933 ( 1.014 -5.311 -0.760) 5.460 4.971 ( 1.199 -3.342 2.689) 4.454 5.016 ( 3.931 0.130 -1.669) 4.273 5.139 ( -4.487 -3.333 -0.639) 5.626 5.280 ( -2.096 -3.670 -1.975) 4.665 5.370 ( 1.143 -7.604 -0.546) 7.709 5.489 ( -3.575 -3.467 3.523) 6.100 5.822 ( 10.833 -3.858 -2.830) 11.843 5.952 ( -7.800 -2.304 3.054) 8.688 6.153 ( 2.350 4.108 -0.185) 4.736 6.451 ( 4.544 -5.433 -2.076) 7.381 6.490 ( -2.875 -2.472 0.553) 3.831 6.870 ( 1.898 -5.421 -0.305) 5.752 7.114 ( 0.583 2.094 -1.682) 2.748 7.207 ( 5.216 2.782 3.804) 7.030 7.302 ( 0.835 1.168 -2.089) 2.535 7.455 ( -2.124 -4.992 1.601) 5.657 7.615 ( -3.168 5.309 -1.706) 6.413 7.875 ( -3.531 6.413 0.842) 7.369 8.094 ( -1.793 3.034 -0.342) 3.541 8.239 ( 0.773 2.552 2.219) 3.469 8.412 ( -1.691 0.830 -3.060) 3.593 8.468 ( -0.907 -0.523 1.056) 1.487 8.619 ( -2.721 2.735 0.422) 3.882 8.684 ( 0.633 -1.621 0.291) 1.765 9.235 ( -2.105 4.607 1.310) 5.232 9.452 ( 7.964 3.891 -6.032) 10.721 9.563 ( -8.320 6.943 5.561) 12.180 9.917 ( 2.425 7.645 -7.061) 10.686 9.968 ( -4.385 0.678 5.949) 7.421 10.412 ( 1.280 -0.287 -0.495) 1.402 10.611 ( 1.585 2.199 -1.645) 3.170 10.689 ( 3.419 7.799 0.565) 8.534 11.005 ( 0.751 -3.112 1.635) 3.594 11.208 ( 7.701 1.604 -0.806) 7.907 11.376 ( -1.855 3.535 0.020) 3.992 11.481 ( 1.012 6.782 0.726) 6.896 11.885 ( -0.618 5.310 -1.248) 5.490 11.955 ( 3.195 -2.138 0.543) 3.883 12.032 ( 0.875 -5.573 -0.060) 5.642 12.119 ( 5.773 -2.754 0.068) 6.397 12.457 ( 0.209 3.048 1.005) 3.217 12.531 ( -1.048 1.102 -0.932) 1.784 13.185 ( -1.868 -4.142 -0.745) 4.604 13.318 ( -0.184 -2.970 0.072) 2.976 13.371 ( 2.493 16.337 0.574) 16.536 13.552 ( 5.737 17.114 0.503) 18.057 13.840 ( -4.437 4.142 -0.368) 6.081 13.929 ( -2.415 3.215 0.232) 4.027 15.591 ( -3.147 -3.831 -0.280) 4.965 15.720 ( -4.204 -2.060 0.108) 4.683 17.385 ( 7.454 5.422 -0.073) 9.218 17.480 ( -4.539 3.879 0.093) 5.972 18.217 ( 8.054 6.029 0.875) 10.098 18.461 ( -1.030 5.333 -2.589) 6.017 18.615 ( -1.487 -1.186 1.473) 2.406 18.888 ( -6.180 -12.143 0.905) 13.656 19.424 ( -0.282 11.040 -0.283) 11.047 19.588 ( -1.615 8.338 -0.189) 8.495 19.982 ( 1.701 21.180 -1.042) 21.273 20.351 ( 1.215 24.154 0.781) 24.197 21.384 ( 0.572 -16.013 0.091) 16.024 21.837 ( 3.941 -6.270 -3.472) 8.179 21.973 ( -1.847 -10.424 3.596) 11.181 22.080 ( 0.908 -0.407 0.846) 1.306 22.400 ( 0.035 2.643 -1.160) 2.886 22.504 ( 1.601 -5.805 -1.941) 6.326 22.650 ( -3.260 -12.191 3.114) 12.998 22.802 ( 0.742 -1.981 -0.562) 2.189 22.972 ( -1.853 -2.886 -1.551) 3.765 23.160 ( -2.022 -2.871 0.982) 3.646 ======================= Grid point 51 (34/102) ======================= q-point: ( 0.64 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.406 ( -0.000 -8.455 0.000) 8.455 1.687 ( -0.000 -7.875 0.000) 7.875 2.012 ( -0.000 -0.586 0.000) 0.586 2.103 ( -0.000 -3.396 0.000) 3.396 2.113 ( 0.000 1.275 -0.000) 1.275 2.419 ( -0.000 -8.062 0.000) 8.062 2.452 ( -0.000 -1.693 0.000) 1.693 2.521 ( 0.000 2.393 -0.000) 2.393 2.708 ( -0.000 -1.870 0.000) 1.870 2.730 ( -0.000 -1.401 0.000) 1.401 2.839 ( -0.000 -0.588 0.000) 0.588 3.052 ( -0.000 -4.047 0.000) 4.047 3.085 ( -0.000 -2.424 0.000) 2.424 3.149 ( 0.000 0.346 -0.000) 0.346 3.164 ( -0.000 -0.502 0.000) 0.502 3.275 ( 0.000 4.995 -0.000) 4.995 3.298 ( -0.000 -1.887 0.000) 1.887 3.469 ( -0.000 -0.946 0.000) 0.946 3.563 ( -0.000 -3.492 0.000) 3.492 3.587 ( 0.000 0.739 -0.000) 0.739 3.642 ( -0.000 -4.998 0.000) 4.998 3.746 ( -0.000 -0.029 0.000) 0.029 3.762 ( 0.000 7.193 -0.000) 7.193 4.036 ( 0.000 4.120 -0.000) 4.120 4.090 ( 0.000 3.287 -0.000) 3.287 4.275 ( 0.000 4.217 -0.000) 4.217 4.317 ( -0.000 -3.938 0.000) 3.938 4.444 ( 0.000 6.472 -0.000) 6.472 4.638 ( -0.000 -1.140 0.000) 1.140 4.674 ( 0.000 0.629 -0.000) 0.629 4.810 ( -0.000 -6.979 0.000) 6.979 5.004 ( -0.000 -1.761 0.000) 1.761 5.018 ( -0.000 -2.177 0.000) 2.177 5.044 ( -0.000 -2.444 0.000) 2.444 5.275 ( -0.000 -9.331 0.000) 9.331 5.279 ( 0.000 0.898 -0.000) 0.898 5.480 ( -0.000 -3.691 0.000) 3.691 5.570 ( -0.000 -5.324 0.000) 5.324 5.909 ( 0.000 0.599 -0.000) 0.599 5.951 ( -0.000 -2.154 0.000) 2.154 6.111 ( 0.000 0.994 -0.000) 0.994 6.536 ( -0.000 -1.946 0.000) 1.946 6.542 ( -0.000 -4.024 0.000) 4.024 6.908 ( 0.000 1.835 -0.000) 1.835 7.127 ( -0.000 -3.657 0.000) 3.657 7.148 ( 0.000 6.460 -0.000) 6.460 7.302 ( -0.000 -0.634 0.000) 0.634 7.432 ( 0.000 8.624 -0.000) 8.624 7.571 ( -0.000 -3.572 0.000) 3.572 7.711 ( 0.000 9.807 -0.000) 9.807 8.028 ( 0.000 3.649 -0.000) 3.649 8.203 ( 0.000 2.115 -0.000) 2.115 8.326 ( 0.000 4.223 -0.000) 4.223 8.478 ( 0.000 1.019 -0.000) 1.019 8.637 ( -0.000 -4.995 0.000) 4.995 8.714 ( -0.000 -0.840 0.000) 0.840 9.132 ( 0.000 4.855 -0.000) 4.855 9.394 ( 0.000 6.813 -0.000) 6.813 9.460 ( 0.000 0.113 -0.000) 0.113 9.721 ( 0.000 10.661 -0.000) 10.661 9.983 ( -0.000 -0.797 0.000) 0.797 10.418 ( -0.000 -0.626 0.000) 0.626 10.537 ( 0.000 8.323 -0.000) 8.323 10.626 ( -0.000 -0.877 0.000) 0.877 11.057 ( -0.000 -1.868 0.000) 1.868 11.236 ( 0.000 0.223 -0.000) 0.223 11.303 ( 0.000 2.163 -0.000) 2.163 11.370 ( 0.000 5.321 -0.000) 5.321 11.739 ( 0.000 10.362 -0.000) 10.362 11.945 ( 0.000 3.830 -0.000) 3.830 12.123 ( -0.000 -2.265 0.000) 2.265 12.147 ( 0.000 2.456 -0.000) 2.456 12.399 ( 0.000 2.878 -0.000) 2.878 12.483 ( 0.000 3.993 -0.000) 3.993 13.107 ( 0.000 11.962 -0.000) 11.962 13.188 ( 0.000 14.172 -0.000) 14.172 13.266 ( -0.000 -5.419 0.000) 5.419 13.491 ( -0.000 -5.971 0.000) 5.971 13.741 ( 0.000 4.912 -0.000) 4.912 13.859 ( 0.000 3.492 -0.000) 3.492 15.650 ( -0.000 -3.358 0.000) 3.358 15.742 ( -0.000 -2.297 0.000) 2.297 17.360 ( 0.000 2.013 -0.000) 2.013 17.393 ( 0.000 1.681 -0.000) 1.681 18.135 ( 0.000 5.564 -0.000) 5.564 18.311 ( 0.000 9.120 -0.000) 9.120 18.602 ( 0.000 2.850 -0.000) 2.850 19.052 ( -0.000 -6.280 0.000) 6.280 19.224 ( 0.000 11.325 -0.000) 11.325 19.525 ( -0.000 -1.826 0.000) 1.826 19.694 ( 0.000 9.498 -0.000) 9.498 19.909 ( 0.000 23.988 -0.000) 23.988 21.645 ( -0.000 -12.192 0.000) 12.192 21.875 ( 0.000 3.298 -0.000) 3.298 22.118 ( -0.000 -4.882 0.000) 4.882 22.124 ( -0.000 -3.790 0.000) 3.790 22.325 ( 0.000 3.003 -0.000) 3.003 22.636 ( -0.000 -8.047 0.000) 8.047 22.821 ( -0.000 -0.208 0.000) 0.208 22.853 ( -0.000 -9.692 0.000) 9.692 23.072 ( -0.000 -8.196 0.000) 8.196 23.197 ( -0.000 -2.329 0.000) 2.329 ======================= Grid point 61 (35/102) ======================= q-point: ( 0.45 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.532 ( 8.857 -0.000 -3.371) 9.477 1.532 ( 4.524 -0.000 -2.894) 5.371 1.703 ( 3.484 -0.000 2.584) 4.337 1.772 ( -0.729 0.000 5.101) 5.153 2.186 ( 4.979 -0.000 -3.046) 5.837 2.252 ( -3.210 0.000 0.946) 3.347 2.340 ( -2.964 0.000 0.408) 2.992 2.497 ( -4.395 0.000 1.397) 4.612 2.557 ( 7.821 -0.000 -1.264) 7.923 2.732 ( -7.929 0.000 -0.383) 7.939 2.823 ( 13.758 -0.000 -3.385) 14.168 2.880 ( -0.152 0.000 2.432) 2.437 2.970 ( -1.017 0.000 -1.181) 1.558 3.033 ( 0.852 -0.000 -0.644) 1.068 3.163 ( -11.047 0.000 5.105) 12.170 3.257 ( 1.264 -0.000 -1.633) 2.065 3.292 ( 4.278 -0.000 2.820) 5.124 3.528 ( -0.329 0.000 -1.356) 1.395 3.551 ( 0.890 -0.000 0.669) 1.113 3.619 ( -0.531 0.000 0.059) 0.534 3.719 ( -3.951 0.000 0.098) 3.952 3.770 ( -2.217 0.000 -3.944) 4.524 4.010 ( 12.481 -0.000 -0.658) 12.499 4.169 ( 2.050 -0.000 -0.091) 2.052 4.230 ( -4.696 0.000 0.977) 4.797 4.371 ( 2.311 -0.000 2.418) 3.345 4.455 ( -4.868 0.000 -0.154) 4.870 4.539 ( -0.026 0.000 -0.626) 0.626 4.644 ( 1.064 -0.000 0.179) 1.079 4.729 ( -7.357 0.000 -1.693) 7.550 4.774 ( 2.595 -0.000 -2.159) 3.376 4.830 ( -2.207 0.000 1.707) 2.791 4.930 ( 2.763 -0.000 0.612) 2.830 5.038 ( 0.596 -0.000 1.047) 1.204 5.074 ( 1.947 -0.000 -4.711) 5.097 5.090 ( -3.919 0.000 0.446) 3.944 5.228 ( -9.377 0.000 4.972) 10.614 5.478 ( -1.353 0.000 1.195) 1.805 5.723 ( 12.296 -0.000 -4.092) 12.959 5.872 ( -8.401 0.000 3.627) 9.150 6.238 ( 0.910 -0.000 -1.446) 1.708 6.336 ( 7.714 -0.000 -2.533) 8.119 6.456 ( -7.341 0.000 2.696) 7.821 6.682 ( 3.033 -0.000 -0.829) 3.144 7.183 ( 1.993 -0.000 -2.458) 3.165 7.253 ( 6.505 -0.000 2.826) 7.093 7.334 ( -1.959 0.000 -0.685) 2.075 7.351 ( -0.420 0.000 1.185) 1.258 7.715 ( -0.912 0.000 -1.805) 2.023 7.952 ( -5.525 0.000 1.310) 5.678 8.158 ( -2.436 0.000 -2.306) 3.354 8.323 ( 0.304 -0.000 2.032) 2.055 8.385 ( -4.953 0.000 2.429) 5.517 8.394 ( 0.802 -0.000 -0.452) 0.921 8.648 ( 3.049 -0.000 -0.700) 3.128 8.814 ( -1.446 0.000 -1.171) 1.861 9.286 ( -1.565 0.000 2.067) 2.592 9.571 ( 7.544 -0.000 -6.138) 9.726 9.704 ( -12.262 0.000 7.053) 14.146 9.930 ( 0.696 -0.000 -3.513) 3.581 10.109 ( -1.962 0.000 0.747) 2.099 10.379 ( 2.657 -0.000 0.277) 2.671 10.721 ( 0.025 -0.000 -2.775) 2.775 10.877 ( 4.548 -0.000 5.038) 6.787 10.939 ( 0.813 -0.000 -3.338) 3.435 11.279 ( 5.407 -0.000 0.774) 5.462 11.490 ( -1.749 0.000 -1.295) 2.177 11.677 ( 3.034 -0.000 0.868) 3.156 11.813 ( 3.517 -0.000 1.500) 3.824 11.867 ( 10.085 -0.000 -1.424) 10.185 11.945 ( -3.600 0.000 -2.188) 4.212 11.990 ( -3.172 0.000 2.345) 3.945 12.522 ( 1.965 -0.000 -0.472) 2.021 12.546 ( -0.400 0.000 0.275) 0.486 13.100 ( -2.864 0.000 -0.470) 2.902 13.217 ( -1.012 0.000 0.225) 1.037 13.831 ( 3.546 -0.000 0.427) 3.571 13.833 ( 4.528 -0.000 -1.390) 4.736 13.968 ( -4.617 0.000 0.348) 4.630 14.044 ( -1.169 0.000 0.795) 1.414 15.520 ( -3.834 0.000 -0.801) 3.917 15.651 ( -5.054 0.000 0.869) 5.128 17.585 ( 1.535 -0.000 -0.743) 1.706 17.602 ( 3.804 -0.000 0.840) 3.896 18.378 ( 8.791 -0.000 2.421) 9.118 18.397 ( 1.035 -0.000 -1.682) 1.974 18.532 ( -10.226 0.000 -2.470) 10.520 18.613 ( -2.329 0.000 1.579) 2.814 19.761 ( -0.483 0.000 -0.439) 0.653 19.957 ( -1.396 0.000 0.481) 1.476 20.583 ( -0.451 0.000 1.144) 1.230 20.823 ( 0.850 -0.000 -1.560) 1.777 21.016 ( 0.985 -0.000 0.494) 1.102 21.548 ( 0.244 -0.000 -2.409) 2.421 21.694 ( -0.353 0.000 1.027) 1.086 22.082 ( 0.965 -0.000 0.217) 0.989 22.139 ( 0.883 -0.000 -0.321) 0.940 22.376 ( -0.696 0.000 0.542) 0.882 22.611 ( 3.469 -0.000 -0.050) 3.470 22.776 ( 1.072 -0.000 0.528) 1.195 22.949 ( -3.305 0.000 -0.583) 3.356 23.073 ( -1.652 0.000 0.559) 1.744 ======================= Grid point 62 (36/102) ======================= q-point: ( 0.55 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.373 ( 0.000 7.370 -0.000) 7.370 1.610 ( 0.000 4.747 -0.000) 4.747 1.771 ( -0.000 -11.665 0.000) 11.665 1.918 ( -0.000 -8.234 0.000) 8.234 2.188 ( 0.000 1.198 -0.000) 1.198 2.235 ( -0.000 -0.120 0.000) 0.120 2.378 ( -0.000 -4.296 0.000) 4.296 2.482 ( -0.000 -0.811 0.000) 0.811 2.619 ( -0.000 -1.798 0.000) 1.798 2.675 ( 0.000 1.019 -0.000) 1.019 2.889 ( -0.000 -0.420 0.000) 0.420 2.936 ( -0.000 -3.240 0.000) 3.240 2.942 ( -0.000 -0.984 0.000) 0.984 3.064 ( -0.000 -2.810 0.000) 2.810 3.151 ( -0.000 -3.028 0.000) 3.028 3.245 ( 0.000 2.058 -0.000) 2.058 3.328 ( -0.000 -1.451 0.000) 1.451 3.465 ( 0.000 3.349 -0.000) 3.349 3.539 ( 0.000 1.593 -0.000) 1.593 3.668 ( 0.000 3.278 -0.000) 3.278 3.673 ( -0.000 -3.680 0.000) 3.680 3.719 ( 0.000 3.867 -0.000) 3.867 4.074 ( 0.000 3.520 -0.000) 3.520 4.122 ( 0.000 0.867 -0.000) 0.867 4.189 ( 0.000 2.389 -0.000) 2.389 4.339 ( 0.000 4.828 -0.000) 4.828 4.406 ( 0.000 2.708 -0.000) 2.708 4.559 ( -0.000 -3.043 0.000) 3.043 4.649 ( 0.000 0.172 -0.000) 0.172 4.680 ( 0.000 2.535 -0.000) 2.535 4.782 ( 0.000 2.216 -0.000) 2.216 4.852 ( -0.000 -3.296 0.000) 3.296 4.925 ( -0.000 -2.138 0.000) 2.138 5.032 ( -0.000 -0.894 0.000) 0.894 5.089 ( 0.000 1.048 -0.000) 1.048 5.196 ( -0.000 -3.024 0.000) 3.024 5.214 ( -0.000 -9.419 0.000) 9.419 5.458 ( 0.000 0.857 -0.000) 0.857 5.821 ( -0.000 -3.339 0.000) 3.339 5.850 ( -0.000 -2.501 0.000) 2.501 6.234 ( 0.000 2.525 -0.000) 2.525 6.376 ( -0.000 -2.960 0.000) 2.960 6.437 ( -0.000 -1.654 0.000) 1.654 6.763 ( -0.000 -6.329 0.000) 6.329 7.164 ( 0.000 2.449 -0.000) 2.449 7.278 ( 0.000 1.598 -0.000) 1.598 7.311 ( 0.000 0.460 -0.000) 0.460 7.375 ( -0.000 -2.772 0.000) 2.772 7.681 ( 0.000 3.099 -0.000) 3.099 7.923 ( 0.000 1.307 -0.000) 1.307 8.129 ( 0.000 1.756 -0.000) 1.756 8.295 ( 0.000 2.661 -0.000) 2.661 8.387 ( -0.000 -1.716 0.000) 1.716 8.425 ( -0.000 -2.409 0.000) 2.409 8.666 ( -0.000 -0.789 0.000) 0.789 8.732 ( 0.000 7.351 -0.000) 7.351 9.278 ( 0.000 0.950 -0.000) 0.950 9.563 ( 0.000 4.219 -0.000) 4.219 9.621 ( 0.000 3.454 -0.000) 3.454 9.935 ( -0.000 -0.827 0.000) 0.827 10.056 ( 0.000 5.119 -0.000) 5.119 10.404 ( -0.000 -1.192 0.000) 1.192 10.674 ( 0.000 4.039 -0.000) 4.039 10.842 ( 0.000 6.209 -0.000) 6.209 10.958 ( -0.000 -2.294 0.000) 2.294 11.269 ( 0.000 2.405 -0.000) 2.405 11.442 ( 0.000 3.792 -0.000) 3.792 11.622 ( 0.000 7.023 -0.000) 7.023 11.892 ( -0.000 -7.393 0.000) 7.393 11.919 ( -0.000 -0.264 0.000) 0.264 11.941 ( -0.000 -1.327 0.000) 1.327 12.055 ( -0.000 -6.050 0.000) 6.050 12.519 ( 0.000 2.685 -0.000) 2.685 12.532 ( -0.000 -0.129 0.000) 0.129 13.112 ( -0.000 -2.589 0.000) 2.589 13.244 ( -0.000 -3.203 0.000) 3.203 13.677 ( 0.000 13.918 -0.000) 13.918 13.871 ( 0.000 11.597 -0.000) 11.597 13.871 ( 0.000 1.300 -0.000) 1.300 13.973 ( 0.000 3.617 -0.000) 3.617 15.522 ( -0.000 -2.061 0.000) 2.061 15.660 ( -0.000 -2.487 0.000) 2.487 17.533 ( 0.000 5.504 -0.000) 5.504 17.548 ( 0.000 6.017 -0.000) 6.017 18.369 ( 0.000 5.750 -0.000) 5.750 18.480 ( -0.000 -1.253 0.000) 1.253 18.518 ( -0.000 -8.443 0.000) 8.443 18.670 ( -0.000 -6.935 0.000) 6.935 19.637 ( 0.000 11.690 -0.000) 11.690 19.798 ( 0.000 13.051 -0.000) 13.051 20.374 ( 0.000 19.576 -0.000) 19.576 20.746 ( 0.000 16.067 -0.000) 16.067 21.094 ( -0.000 -13.883 0.000) 13.883 21.672 ( -0.000 -10.864 0.000) 10.864 21.783 ( -0.000 -9.050 0.000) 9.050 22.087 ( 0.000 0.046 -0.000) 0.046 22.282 ( -0.000 -12.352 0.000) 12.352 22.414 ( -0.000 -4.080 0.000) 4.080 22.585 ( 0.000 3.133 -0.000) 3.133 22.782 ( -0.000 -0.450 0.000) 0.450 22.937 ( -0.000 -0.351 0.000) 0.351 23.098 ( -0.000 -2.942 0.000) 2.942 ======================= Grid point 125 (37/102) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.475 ( -4.813 0.000 21.178) 21.718 0.513 ( 15.037 -0.000 22.767) 27.284 0.759 ( -17.654 0.000 30.807) 35.507 0.916 ( 2.332 -0.000 -13.603) 13.802 0.988 ( -13.419 0.000 -19.562) 23.722 1.437 ( 16.637 -0.000 -25.302) 30.282 1.959 ( 8.802 -0.000 14.177) 16.687 2.269 ( -13.109 0.000 -13.215) 18.614 2.412 ( -0.894 0.000 4.411) 4.500 2.491 ( -1.304 0.000 -1.961) 2.355 2.801 ( -0.732 0.000 8.743) 8.773 2.928 ( -0.171 0.000 -1.964) 1.971 3.033 ( -5.135 0.000 7.394) 9.002 3.187 ( 4.409 -0.000 -4.235) 6.114 3.212 ( -13.666 0.000 3.118) 14.017 3.293 ( 4.545 -0.000 -3.227) 5.574 3.411 ( -3.634 0.000 1.161) 3.815 3.482 ( 3.357 -0.000 -3.862) 5.117 3.486 ( 1.615 -0.000 6.089) 6.299 3.657 ( -1.589 0.000 -7.673) 7.836 3.858 ( -11.497 0.000 5.964) 12.951 3.899 ( -2.769 0.000 3.478) 4.445 3.983 ( 1.678 -0.000 -5.275) 5.536 4.002 ( 5.088 -0.000 -3.810) 6.356 4.279 ( 2.114 -0.000 2.558) 3.319 4.414 ( -0.029 0.000 -7.483) 7.483 4.743 ( -5.911 0.000 3.861) 7.060 4.760 ( -2.312 0.000 2.265) 3.237 4.820 ( -3.442 0.000 4.296) 5.505 4.841 ( -2.351 0.000 2.750) 3.618 4.919 ( 1.131 -0.000 -3.121) 3.319 4.934 ( 2.616 -0.000 -3.916) 4.710 5.035 ( 2.965 -0.000 1.968) 3.559 5.092 ( -0.844 0.000 -2.577) 2.712 5.444 ( -1.492 0.000 1.783) 2.325 5.445 ( -25.981 0.000 2.047) 26.062 5.566 ( -6.964 0.000 4.923) 8.528 5.677 ( 6.737 -0.000 -4.130) 7.902 5.698 ( -15.374 0.000 -1.063) 15.411 5.742 ( 18.139 -0.000 -4.264) 18.633 6.017 ( 7.490 -0.000 0.100) 7.491 6.020 ( -3.181 0.000 -0.121) 3.184 6.317 ( 4.119 -0.000 0.183) 4.123 6.319 ( -3.182 0.000 0.027) 3.182 6.856 ( 1.259 -0.000 5.050) 5.204 6.998 ( -1.912 0.000 -7.282) 7.529 7.149 ( 5.036 -0.000 5.265) 7.285 7.268 ( -2.917 0.000 -4.472) 5.339 7.421 ( -5.218 0.000 8.812) 10.241 7.588 ( 5.220 -0.000 -5.695) 7.725 8.038 ( -4.512 0.000 4.523) 6.389 8.149 ( 2.764 -0.000 -4.517) 5.295 8.537 ( 0.568 -0.000 0.682) 0.888 8.607 ( 10.638 -0.000 -4.889) 11.708 8.941 ( -9.730 0.000 8.365) 12.831 9.040 ( 2.626 -0.000 2.171) 3.407 9.281 ( 18.016 -0.000 -5.996) 18.987 9.294 ( -6.552 0.000 -4.198) 7.781 9.647 ( -3.311 0.000 7.239) 7.960 9.799 ( 4.402 -0.000 -6.691) 8.009 10.286 ( 3.000 -0.000 10.086) 10.522 10.511 ( -22.991 0.000 -9.413) 24.843 10.858 ( -19.948 0.000 1.503) 20.005 10.865 ( 13.158 -0.000 0.441) 13.165 11.076 ( -11.300 0.000 2.085) 11.490 11.111 ( 5.687 -0.000 -0.816) 5.745 11.227 ( -1.686 0.000 1.011) 1.966 11.254 ( 0.135 -0.000 -1.302) 1.309 11.308 ( -49.835 0.000 1.947) 49.873 11.365 ( 13.304 -0.000 -2.616) 13.559 11.567 ( -2.230 0.000 1.581) 2.733 11.604 ( 1.803 -0.000 -1.415) 2.292 12.739 ( 0.168 -0.000 0.765) 0.783 12.764 ( -0.020 0.000 -1.356) 1.356 12.927 ( -4.969 0.000 1.666) 5.241 12.959 ( 14.801 -0.000 -1.102) 14.842 13.419 ( -1.118 0.000 0.124) 1.125 13.422 ( 1.073 -0.000 -0.113) 1.079 14.245 ( 0.893 -0.000 0.284) 0.937 14.251 ( -0.317 0.000 -0.275) 0.420 15.935 ( 16.244 -0.000 0.305) 16.247 15.942 ( -50.352 0.000 -0.300) 50.353 17.170 ( -6.423 0.000 3.722) 7.423 17.281 ( 12.341 -0.000 -5.984) 13.716 17.657 ( 6.909 -0.000 6.473) 9.467 17.782 ( 1.086 -0.000 -4.283) 4.419 19.541 ( -6.036 0.000 1.787) 6.295 19.578 ( 28.676 -0.000 -1.163) 28.700 19.590 ( -1.540 0.000 1.470) 2.128 19.632 ( -2.824 0.000 -2.112) 3.526 20.116 ( 0.026 -0.000 0.059) 0.065 20.117 ( -9.955 0.000 0.003) 9.955 20.998 ( 0.441 -0.000 0.456) 0.635 21.009 ( -0.468 0.000 -0.424) 0.631 21.864 ( 0.364 -0.000 0.662) 0.756 21.881 ( -0.408 0.000 -0.743) 0.847 22.349 ( -1.169 0.000 1.676) 2.044 22.389 ( 1.074 -0.000 -1.622) 1.946 22.972 ( 4.682 -0.000 1.053) 4.799 22.998 ( -15.643 0.000 -1.087) 15.681 23.246 ( -1.311 0.000 0.463) 1.390 23.256 ( 1.144 -0.000 -0.372) 1.203 ======================= Grid point 126 (38/102) ======================= q-point: ( 0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.554 ( 5.499 -7.459 14.693) 17.372 0.871 ( 7.785 -8.662 -1.386) 11.728 0.912 ( 15.893 -10.892 2.945) 19.491 1.079 ( -2.848 -26.936 13.887) 30.438 1.102 ( 3.696 -14.942 -14.928) 21.442 1.556 ( 13.752 -6.083 -12.668) 19.662 2.056 ( -0.715 -0.232 4.088) 4.156 2.109 ( 1.511 -1.501 2.557) 3.328 2.483 ( 1.883 -4.253 1.547) 4.902 2.574 ( 5.626 -6.858 -2.926) 9.341 2.796 ( -4.835 4.172 4.948) 8.079 2.891 ( 0.719 1.204 5.916) 6.080 2.987 ( -1.465 -3.641 1.814) 4.324 3.077 ( -0.267 7.610 -5.863) 9.610 3.200 ( -4.513 -4.600 2.888) 7.062 3.322 ( 3.134 1.075 -1.056) 3.478 3.386 ( -2.175 0.853 0.799) 2.469 3.472 ( 4.325 0.895 -1.429) 4.642 3.557 ( -1.185 -2.551 4.571) 5.367 3.686 ( -1.823 -2.009 -7.921) 8.373 3.822 ( -2.264 -1.119 4.448) 5.115 3.928 ( -5.414 -4.032 -0.997) 6.824 4.001 ( 0.240 2.462 0.636) 2.554 4.038 ( -2.714 -5.982 -4.209) 7.801 4.267 ( 3.161 4.950 -0.049) 5.873 4.386 ( 8.174 4.063 -4.551) 10.199 4.615 ( -5.460 5.010 6.362) 9.766 4.700 ( -1.737 7.383 1.427) 7.718 4.777 ( 1.914 3.553 2.307) 4.649 4.811 ( 1.795 3.157 2.744) 4.552 4.909 ( -0.874 -0.758 -2.364) 2.632 4.944 ( -7.466 -0.457 -1.898) 7.717 5.076 ( 4.872 -1.114 0.376) 5.012 5.112 ( 5.837 -3.261 -4.672) 8.157 5.312 ( -16.956 -6.256 6.017) 19.048 5.403 ( -10.209 -0.882 3.856) 10.948 5.507 ( -9.599 0.477 4.115) 10.455 5.635 ( -2.994 2.382 -3.027) 4.879 5.794 ( 11.843 -1.344 -5.421) 13.093 5.873 ( 14.143 0.928 1.003) 14.209 6.021 ( -2.123 -2.165 -2.061) 3.666 6.085 ( 12.443 -0.290 -1.180) 12.502 6.293 ( 1.555 0.563 3.474) 3.848 6.440 ( 13.387 -1.667 -2.985) 13.817 6.878 ( 3.390 0.494 4.779) 5.880 6.952 ( -7.459 0.807 -5.984) 9.597 7.198 ( 1.792 2.307 0.531) 2.969 7.287 ( 7.082 -3.455 -0.086) 7.880 7.540 ( 3.230 -9.654 -1.463) 10.285 7.617 ( 10.746 3.193 -6.024) 12.726 8.047 ( 1.556 -1.803 3.318) 4.084 8.162 ( 2.296 -0.095 -2.881) 3.686 8.483 ( 2.838 6.081 -0.394) 6.722 8.563 ( 7.891 10.221 -4.795) 13.774 8.909 ( -9.183 -0.144 7.238) 11.693 9.134 ( 7.231 -4.641 0.155) 8.594 9.196 ( -6.290 2.964 -2.128) 7.272 9.381 ( 8.501 3.706 -4.868) 10.474 9.635 ( -7.034 -1.798 8.868) 11.460 9.812 ( 1.224 0.347 -1.506) 1.972 9.987 ( -20.807 7.549 16.644) 27.693 10.247 ( 3.978 8.605 8.353) 12.635 10.651 ( -5.241 4.125 -4.104) 7.831 10.865 ( 0.167 5.808 1.769) 6.073 10.956 ( 0.880 2.259 -3.011) 3.866 10.978 ( 7.213 12.608 -2.763) 14.786 11.197 ( -9.383 -4.024 5.755) 11.720 11.238 ( -7.624 -1.056 0.617) 7.721 11.438 ( 1.775 -5.848 1.114) 6.212 11.568 ( 4.732 -2.216 -1.675) 5.487 11.609 ( 0.517 -6.509 -1.886) 6.796 11.752 ( 22.004 -3.945 3.674) 22.654 12.733 ( -0.258 4.175 -1.939) 4.610 12.762 ( -1.751 -1.993 0.721) 2.750 12.841 ( 1.839 4.614 0.363) 4.980 12.874 ( 5.919 11.367 -0.102) 12.816 13.410 ( -1.449 0.337 0.606) 1.606 13.432 ( 0.286 -0.325 -0.134) 0.453 14.229 ( -0.720 2.166 1.912) 2.978 14.301 ( -0.880 -1.824 -5.321) 5.693 15.716 ( -8.609 -0.074 6.520) 10.800 16.039 ( 16.931 4.254 2.661) 17.659 17.178 ( -6.890 -6.127 5.092) 10.533 17.356 ( 1.564 -3.807 -4.644) 6.206 17.629 ( -10.353 3.197 -1.475) 10.935 17.979 ( 25.088 -5.369 -5.677) 26.276 19.241 ( -11.528 11.018 2.662) 16.167 19.446 ( 6.191 16.786 -1.524) 17.956 19.508 ( 6.568 10.112 3.966) 12.693 19.595 ( 6.675 12.709 -5.056) 15.219 20.184 ( -18.187 -12.037 -1.329) 21.850 20.472 ( 20.357 -12.425 -4.281) 24.230 20.936 ( -8.594 0.732 2.057) 8.867 21.065 ( 5.972 -3.106 0.257) 6.736 21.876 ( 2.459 -3.202 3.766) 5.521 21.893 ( 0.493 -2.492 -0.530) 2.595 22.349 ( -0.936 -0.529 1.410) 1.773 22.406 ( 1.305 -1.635 -2.045) 2.926 23.011 ( -5.387 -4.133 4.272) 8.022 23.111 ( -9.480 -11.197 -8.151) 16.783 23.263 ( -5.280 -4.506 0.528) 6.962 23.320 ( -0.871 -6.882 -1.193) 7.039 ======================= Grid point 127 (39/102) ======================= q-point: ( 0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.860 ( 10.867 -15.639 3.827) 19.425 1.004 ( 10.364 -5.134 -10.984) 15.951 1.299 ( 10.128 -12.403 -3.873) 16.475 1.387 ( 11.269 -16.672 0.275) 20.125 1.664 ( 6.638 -28.129 7.618) 29.889 1.800 ( 5.341 -11.053 5.519) 13.459 2.090 ( 1.191 -5.202 -2.492) 5.889 2.251 ( 8.664 -3.578 8.241) 12.481 2.552 ( 2.190 -2.732 -5.735) 6.719 2.709 ( 0.967 -0.180 -1.166) 1.525 2.736 ( 5.267 -4.425 -4.769) 8.371 2.947 ( 2.758 4.104 -4.260) 6.527 2.973 ( 0.266 -4.215 6.315) 7.597 3.083 ( 1.817 -5.374 -0.332) 5.682 3.236 ( -4.164 -1.244 1.086) 4.480 3.326 ( -3.060 -1.682 0.185) 3.497 3.355 ( 0.306 1.409 1.025) 1.769 3.493 ( 5.307 1.059 -1.365) 5.581 3.571 ( -3.215 -0.136 3.395) 4.677 3.631 ( -4.367 3.579 -3.141) 6.461 3.818 ( -2.673 -0.353 -1.217) 2.958 3.929 ( -1.570 3.270 1.764) 4.033 3.951 ( -6.309 -2.987 -3.518) 7.816 4.108 ( -5.377 -2.488 0.411) 5.939 4.157 ( 1.312 4.780 -1.425) 5.157 4.357 ( 0.725 3.493 0.849) 3.667 4.526 ( 2.981 9.340 -1.651) 9.942 4.565 ( 1.550 1.871 6.361) 6.809 4.747 ( -0.038 1.795 2.391) 2.990 4.793 ( 5.222 2.626 -0.803) 5.900 4.831 ( -4.526 1.051 -0.949) 4.743 4.963 ( -0.563 -1.522 -2.423) 2.916 5.125 ( 4.068 -2.339 -3.418) 5.805 5.204 ( -0.894 -2.831 1.252) 3.222 5.301 ( -5.941 1.162 2.409) 6.515 5.394 ( -7.749 -1.664 -0.589) 7.948 5.458 ( -6.509 -5.488 3.999) 9.406 5.560 ( -1.266 2.307 -2.161) 3.405 5.858 ( 4.926 -0.734 -1.967) 5.355 5.886 ( 0.778 3.172 0.749) 3.351 6.081 ( 1.607 -4.470 -0.341) 4.763 6.222 ( 14.084 -3.543 -2.366) 14.715 6.324 ( 1.042 -1.761 3.825) 4.338 6.527 ( 12.467 2.157 -0.381) 12.658 6.828 ( -9.571 2.649 -6.014) 11.610 6.933 ( 4.706 -1.067 5.949) 7.659 7.184 ( 7.053 2.026 -1.515) 7.493 7.359 ( 13.382 5.187 -0.063) 14.352 7.620 ( 6.719 2.327 -2.611) 7.575 7.693 ( 2.594 -4.527 -4.947) 7.190 8.127 ( 6.024 -1.448 1.409) 6.354 8.185 ( 2.139 -1.744 -0.233) 2.769 8.381 ( 5.599 9.695 -1.048) 11.245 8.428 ( 2.709 4.658 -2.284) 5.852 8.827 ( -10.483 1.909 7.270) 12.900 9.077 ( -4.866 4.477 -2.347) 7.016 9.257 ( 2.316 -2.541 1.333) 3.687 9.318 ( -0.838 1.367 2.043) 2.597 9.701 ( -4.276 -4.785 4.469) 7.820 9.823 ( -0.703 0.192 6.684) 6.724 9.950 ( 5.150 -0.202 -0.633) 5.192 10.114 ( 4.807 9.921 -0.706) 11.047 10.533 ( -2.880 3.541 -3.846) 5.969 10.756 ( 3.615 5.816 -0.499) 6.866 10.834 ( 1.970 5.918 0.201) 6.241 10.930 ( -0.987 0.803 -3.389) 3.620 11.175 ( -5.597 1.358 0.667) 5.798 11.245 ( -4.089 -4.923 5.738) 8.595 11.510 ( 4.101 0.047 1.303) 4.303 11.592 ( 4.069 1.036 -0.586) 4.239 11.719 ( 4.544 -2.496 -2.601) 5.800 11.929 ( 14.292 1.026 2.684) 14.578 12.628 ( -1.462 4.360 -4.688) 6.567 12.679 ( -2.232 7.727 2.090) 8.310 12.790 ( 2.022 2.952 1.492) 3.877 12.840 ( 4.913 -0.273 -0.795) 4.984 13.396 ( -1.570 -0.090 1.454) 2.141 13.435 ( -0.840 -0.573 -0.964) 1.401 14.155 ( -1.810 5.417 3.067) 6.483 14.252 ( -2.630 3.679 -4.794) 6.590 15.728 ( 0.600 -1.451 3.789) 4.101 16.045 ( 9.681 5.550 -0.968) 11.201 17.239 ( -11.607 -6.537 -0.191) 13.323 17.465 ( 2.343 -6.506 0.937) 6.978 17.545 ( -2.061 -0.510 0.269) 2.140 18.154 ( 22.024 4.350 -1.020) 22.473 18.983 ( -8.932 12.933 -0.901) 15.743 19.151 ( 3.022 14.242 0.678) 14.574 19.349 ( 2.151 13.449 -4.171) 14.244 19.417 ( 9.247 10.022 2.750) 13.911 20.237 ( -15.052 -7.537 -1.169) 16.874 20.450 ( -4.685 13.489 -1.326) 14.341 21.107 ( 8.632 -10.843 0.260) 13.862 21.198 ( 7.353 -8.177 2.090) 11.194 21.952 ( -0.892 -4.454 -1.198) 4.697 22.036 ( 4.362 -8.849 2.268) 10.123 22.361 ( -1.473 -1.487 0.278) 2.111 22.450 ( 2.075 -2.076 -1.841) 3.465 23.026 ( -6.757 -1.838 4.685) 8.426 23.150 ( -2.704 -1.075 -4.061) 4.996 23.318 ( -9.830 -6.930 0.120) 12.028 23.426 ( -3.555 -5.894 -1.767) 7.106 ======================= Grid point 128 (40/102) ======================= q-point: ( 0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.190 ( 7.812 -10.015 -1.622) 12.805 1.246 ( 10.582 -16.133 0.493) 19.301 1.558 ( 7.935 -11.067 -5.683) 14.756 1.767 ( 13.109 -10.666 4.569) 17.507 1.967 ( -0.069 -6.046 6.360) 8.776 2.164 ( 5.107 -18.721 0.371) 19.409 2.240 ( 2.114 -10.152 -1.739) 10.515 2.391 ( 7.056 -5.727 6.886) 11.402 2.622 ( 6.455 3.291 -6.062) 9.447 2.706 ( 1.444 -1.916 -3.843) 4.530 2.830 ( 4.200 -4.918 -4.748) 8.023 2.957 ( 0.832 -0.687 0.743) 1.310 3.041 ( -0.152 -1.821 0.971) 2.069 3.167 ( 0.902 0.032 2.287) 2.458 3.202 ( -4.693 -1.910 1.434) 5.266 3.316 ( -3.317 -0.408 -0.742) 3.424 3.351 ( -2.823 -0.065 1.848) 3.375 3.460 ( -0.495 2.853 0.172) 2.901 3.519 ( -0.123 2.253 -1.881) 2.938 3.608 ( -2.176 -2.521 -1.003) 3.478 3.800 ( -2.044 -0.082 -2.282) 3.065 3.851 ( -2.956 3.798 3.194) 5.777 3.930 ( -4.735 -0.890 -4.702) 6.732 4.054 ( -3.028 0.259 -1.625) 3.446 4.168 ( 1.760 -0.275 4.020) 4.397 4.304 ( -3.149 0.788 3.924) 5.093 4.368 ( 0.857 8.303 1.338) 8.453 4.593 ( 5.754 1.775 -0.536) 6.045 4.716 ( -1.576 0.638 -1.889) 2.542 4.749 ( 1.840 1.653 -0.674) 2.564 4.886 ( 4.235 -3.400 1.723) 5.698 4.964 ( -0.773 -0.349 -1.689) 1.890 5.177 ( -10.207 -2.074 -0.836) 10.450 5.198 ( 0.790 -0.352 -2.099) 2.270 5.264 ( 0.492 0.254 2.895) 2.947 5.326 ( -6.862 0.280 0.561) 6.890 5.523 ( -1.114 -1.608 -2.464) 3.146 5.606 ( 2.428 -6.856 0.950) 7.336 5.813 ( -2.464 3.774 0.135) 4.509 5.905 ( 2.722 -1.462 0.308) 3.105 6.168 ( -0.371 -3.866 2.073) 4.402 6.379 ( 2.251 -1.885 3.183) 4.330 6.392 ( 10.617 -4.861 -5.128) 12.753 6.560 ( 10.689 3.795 2.552) 11.626 6.711 ( -5.050 1.116 -3.595) 6.298 7.017 ( 4.541 -2.549 5.179) 7.345 7.226 ( 6.016 -0.833 -3.473) 6.996 7.329 ( 20.008 9.821 -2.096) 22.387 7.612 ( 2.103 2.219 1.175) 3.275 7.728 ( 0.984 0.328 -3.685) 3.828 8.166 ( 3.626 0.700 0.837) 3.787 8.202 ( -1.734 3.622 1.046) 4.150 8.286 ( 12.104 4.550 -0.913) 12.963 8.420 ( 2.927 -0.621 -3.213) 4.390 8.736 ( -9.401 1.574 5.985) 11.255 8.955 ( -5.683 3.707 -2.050) 7.088 9.246 ( -3.086 2.626 4.084) 5.753 9.329 ( -1.053 -1.011 -1.301) 1.956 9.703 ( -7.869 0.970 3.296) 8.586 9.796 ( -2.388 2.998 7.413) 8.345 9.912 ( 4.075 9.227 -5.380) 11.432 10.025 ( 4.562 1.055 -3.890) 6.088 10.504 ( 0.035 -1.587 -0.801) 1.778 10.734 ( 4.961 2.180 1.151) 5.540 10.795 ( 0.018 -1.803 -2.603) 3.166 10.912 ( 0.441 -1.048 -0.484) 1.236 11.130 ( -1.856 0.162 -0.487) 1.925 11.329 ( 0.515 -3.800 5.566) 6.759 11.526 ( 5.626 1.962 1.434) 6.128 11.592 ( 5.907 2.943 -1.197) 6.707 11.742 ( 3.884 3.140 -2.030) 5.392 11.963 ( 3.567 2.060 -0.253) 4.127 12.498 ( 0.089 8.208 -0.781) 8.245 12.582 ( -0.701 2.649 -1.781) 3.268 12.760 ( 0.275 1.207 3.335) 3.558 12.878 ( 2.992 -0.556 -1.341) 3.326 13.406 ( -0.324 -1.589 1.407) 2.147 13.444 ( -1.247 -1.888 -1.385) 2.653 14.024 ( -3.071 7.526 2.310) 8.451 14.136 ( -2.951 5.384 -2.927) 6.801 15.766 ( 0.899 -0.952 2.987) 3.262 16.000 ( 4.070 4.327 -2.402) 6.408 17.242 ( -9.860 -3.585 -1.569) 10.609 17.578 ( -1.983 -5.928 1.245) 6.373 17.635 ( 6.243 -5.508 1.335) 8.432 18.177 ( 16.945 8.407 0.644) 18.927 18.637 ( -7.768 15.748 -0.746) 17.576 19.011 ( 3.664 6.265 3.116) 7.898 19.117 ( 0.588 10.822 -6.930) 12.864 19.332 ( 6.468 6.999 3.126) 10.029 20.130 ( -7.520 13.818 0.315) 15.735 20.235 ( -10.875 -2.566 -1.465) 11.270 21.249 ( 6.673 -2.204 -0.089) 7.028 21.493 ( 8.573 -12.518 1.442) 15.241 22.034 ( -2.428 -6.028 -0.260) 6.504 22.201 ( 2.589 -3.677 1.142) 4.639 22.397 ( -0.150 -4.327 -0.220) 4.336 22.500 ( 2.750 -2.111 -2.635) 4.354 23.012 ( -6.031 -1.069 4.612) 7.667 23.118 ( -2.650 1.346 -2.125) 3.654 23.356 ( -8.731 -4.947 -0.004) 10.035 23.466 ( -3.694 -2.182 -1.191) 4.453 ======================= Grid point 129 (41/102) ======================= q-point: ( 0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.465 ( 4.043 -14.287 2.188) 15.008 1.551 ( 5.606 -8.937 3.499) 11.115 1.786 ( 3.134 -9.842 1.700) 10.468 1.930 ( 10.283 -2.758 -5.424) 11.949 2.179 ( 8.397 -9.745 -0.185) 12.865 2.364 ( -1.342 -4.874 -1.481) 5.268 2.448 ( 4.173 -4.346 -0.902) 6.093 2.542 ( 5.523 -0.963 -2.234) 6.035 2.603 ( 3.766 -4.499 4.304) 7.277 2.719 ( -1.594 1.051 -0.516) 1.978 2.895 ( 1.817 1.600 0.759) 2.537 2.937 ( -3.183 1.643 0.432) 3.608 3.049 ( -4.010 -3.052 -5.345) 7.346 3.150 ( -0.277 -1.635 1.272) 2.090 3.231 ( 0.595 3.026 1.449) 3.407 3.294 ( -2.615 -2.139 1.307) 3.623 3.351 ( -2.228 -1.084 0.030) 2.478 3.429 ( -2.242 -0.398 -1.297) 2.621 3.517 ( 0.012 -0.610 2.309) 2.388 3.599 ( -1.123 0.815 -1.011) 1.717 3.770 ( 0.913 1.193 -0.665) 1.643 3.809 ( -1.139 0.046 -1.195) 1.652 3.923 ( -3.627 -2.349 -2.300) 4.895 4.012 ( -2.717 2.503 2.391) 4.401 4.202 ( 3.424 -0.685 -0.299) 3.504 4.256 ( 1.819 3.437 1.867) 4.314 4.325 ( -1.605 -1.875 3.903) 4.618 4.546 ( 0.172 4.823 -1.939) 5.201 4.716 ( -2.067 -2.287 -3.155) 4.411 4.764 ( 5.178 0.240 -0.461) 5.204 4.956 ( -2.504 -2.875 3.555) 5.213 4.982 ( 3.491 -0.683 -2.172) 4.168 5.120 ( -6.543 0.541 0.913) 6.628 5.162 ( -5.192 0.559 0.770) 5.278 5.289 ( -2.525 -0.086 -0.175) 2.533 5.333 ( 4.238 -3.655 -1.439) 5.778 5.552 ( -0.623 -2.347 -1.646) 2.933 5.720 ( -3.869 1.933 0.449) 4.348 5.746 ( 3.833 -3.755 -0.103) 5.367 5.941 ( 1.147 -0.236 0.643) 1.336 6.193 ( -5.744 -0.099 2.381) 6.219 6.426 ( 3.017 0.285 1.549) 3.403 6.482 ( 6.044 -1.579 -2.839) 6.861 6.601 ( 5.359 -0.802 1.542) 5.634 6.767 ( 9.449 -5.969 -2.564) 11.467 7.097 ( 1.689 -1.400 5.111) 5.562 7.209 ( 3.243 4.441 -0.505) 5.522 7.370 ( 14.215 0.898 -7.911) 16.293 7.585 ( 2.913 3.016 4.480) 6.136 7.702 ( 0.409 2.087 -2.282) 3.119 8.108 ( -3.422 1.743 2.701) 4.695 8.195 ( 5.533 0.935 -2.943) 6.336 8.303 ( 12.273 4.967 1.204) 13.295 8.456 ( 3.542 -1.909 -3.761) 5.507 8.644 ( -9.599 2.048 5.498) 11.250 8.864 ( -5.011 1.134 -3.610) 6.279 9.140 ( -8.069 5.779 5.086) 11.153 9.324 ( -1.464 -0.548 -2.725) 3.142 9.541 ( -10.826 7.262 0.539) 13.047 9.749 ( 2.062 3.528 3.974) 5.700 9.813 ( 0.598 2.262 0.060) 2.340 10.027 ( 3.084 1.427 -3.936) 5.200 10.540 ( -0.615 -1.799 0.802) 2.063 10.727 ( -0.804 -0.302 0.656) 1.081 10.848 ( 2.857 -2.274 -1.683) 4.021 11.005 ( 5.289 -5.277 -0.487) 7.487 11.145 ( -0.871 -3.076 -0.363) 3.218 11.396 ( 1.285 -1.387 4.731) 5.095 11.524 ( 9.931 5.607 -1.211) 11.469 11.583 ( 3.856 1.688 -1.866) 4.605 11.675 ( -0.494 3.406 -0.162) 3.446 11.921 ( -2.335 2.830 -0.242) 3.677 12.367 ( 1.098 6.161 -1.032) 6.342 12.526 ( -0.548 2.736 0.387) 2.817 12.774 ( 0.738 -1.318 1.715) 2.286 12.896 ( 1.338 0.100 -1.032) 1.693 13.449 ( 0.640 -2.649 0.058) 2.726 13.491 ( 0.125 -3.910 -0.278) 3.922 13.861 ( -3.906 7.468 0.802) 8.466 14.011 ( -2.380 5.559 -0.937) 6.120 15.787 ( -0.113 -0.514 2.505) 2.560 15.946 ( 1.298 3.180 -2.325) 4.147 17.230 ( -5.263 -1.847 -0.819) 5.638 17.674 ( -2.118 -5.708 1.681) 6.316 17.774 ( 3.866 -4.768 0.232) 6.143 18.128 ( 12.987 9.231 -2.928) 16.200 18.349 ( -7.332 8.553 3.121) 11.689 18.931 ( 6.343 8.801 -3.486) 11.395 18.982 ( -1.058 1.337 1.428) 2.224 19.270 ( 3.802 4.604 1.156) 6.082 19.855 ( -7.053 9.600 -0.387) 11.919 20.192 ( -5.915 0.014 -0.130) 5.917 21.318 ( 3.932 -1.022 0.128) 4.065 21.745 ( 7.043 -8.677 -0.027) 11.176 22.124 ( -3.007 -5.584 1.665) 6.558 22.200 ( -1.289 2.438 -0.677) 2.840 22.483 ( 1.178 -1.672 3.396) 3.964 22.581 ( 4.520 -5.609 -7.268) 10.233 22.999 ( -4.419 -0.593 5.706) 7.241 23.060 ( -3.318 1.918 -1.429) 4.090 23.372 ( -5.568 -2.937 -0.448) 6.311 23.456 ( -2.750 0.058 -0.847) 2.878 ======================= Grid point 130 (42/102) ======================= q-point: ( 0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.674 ( -1.670 -3.339 6.598) 7.581 1.726 ( 1.574 -10.354 -0.343) 10.478 1.933 ( 3.350 -2.559 -5.477) 6.911 2.093 ( 9.776 -7.171 -1.012) 12.166 2.273 ( 0.405 7.186 -0.283) 7.203 2.379 ( 0.587 -0.991 -2.145) 2.435 2.452 ( 3.191 1.338 1.551) 3.792 2.580 ( -2.829 2.719 -1.399) 4.165 2.698 ( -3.951 -6.485 2.460) 7.982 2.729 ( 2.177 -2.788 1.261) 3.755 2.844 ( 1.647 3.856 3.000) 5.156 2.936 ( 1.742 -2.016 -2.648) 3.757 3.061 ( -5.317 -1.311 -1.614) 5.710 3.165 ( -1.614 1.179 -1.747) 2.655 3.206 ( 3.141 -0.098 -1.791) 3.617 3.254 ( -3.066 2.283 4.475) 5.885 3.337 ( -0.299 1.322 -0.203) 1.371 3.447 ( -3.090 -2.006 2.381) 4.386 3.520 ( 1.449 -1.396 -1.470) 2.492 3.624 ( 2.965 -1.725 -1.653) 3.807 3.756 ( -1.071 3.436 1.595) 3.937 3.797 ( -1.516 -1.083 -3.155) 3.664 3.933 ( 3.368 0.994 1.769) 3.932 3.985 ( -2.234 -2.930 -1.224) 3.882 4.215 ( -3.097 -1.277 1.795) 3.800 4.267 ( 5.107 1.280 -2.304) 5.747 4.352 ( 2.558 -0.149 2.635) 3.676 4.458 ( -5.710 0.855 -0.868) 5.838 4.715 ( -2.460 0.788 0.536) 2.638 4.787 ( 4.527 1.407 -1.943) 5.123 4.978 ( 0.575 0.534 -1.114) 1.363 5.033 ( 0.723 -3.475 1.159) 3.733 5.077 ( -2.656 -0.077 3.697) 4.553 5.134 ( -3.472 -0.721 0.934) 3.667 5.271 ( -1.066 0.374 -2.416) 2.667 5.424 ( 3.394 -1.623 -0.320) 3.775 5.567 ( -0.969 -0.272 -0.420) 1.091 5.658 ( -0.883 1.035 -1.825) 2.276 5.845 ( 3.160 -3.320 0.586) 4.621 5.915 ( -2.645 2.431 0.883) 3.700 6.141 ( -2.709 1.170 1.300) 3.225 6.437 ( 1.378 0.486 0.668) 1.606 6.576 ( 6.315 -3.035 -0.851) 7.058 6.639 ( -0.755 -1.315 -0.283) 1.542 6.979 ( 9.551 -8.054 -3.608) 13.005 7.049 ( -2.443 6.484 4.882) 8.476 7.204 ( 0.548 -1.211 0.286) 1.360 7.383 ( 0.818 2.617 -4.792) 5.521 7.582 ( 3.148 0.555 1.804) 3.671 7.658 ( -0.055 2.039 -0.460) 2.091 8.112 ( -2.745 -2.826 2.589) 4.714 8.197 ( 4.211 2.000 -0.710) 4.716 8.315 ( 10.069 2.430 -1.634) 10.486 8.497 ( 2.123 1.043 -0.953) 2.550 8.580 ( -8.741 -2.068 3.466) 9.627 8.830 ( 0.044 -0.640 -3.325) 3.386 8.962 ( -7.042 5.306 1.214) 8.900 9.329 ( 1.432 -0.173 -2.301) 2.716 9.367 ( -6.222 3.942 1.924) 7.613 9.720 ( 3.553 2.223 1.640) 4.501 9.808 ( -2.856 -1.253 3.527) 4.707 10.007 ( 0.845 1.123 -3.930) 4.174 10.559 ( -0.087 -0.430 1.164) 1.243 10.738 ( -1.229 -1.394 -0.415) 1.904 10.904 ( 1.771 -1.649 0.498) 2.471 11.118 ( 3.313 -3.464 -1.078) 4.913 11.197 ( 0.080 -1.228 -1.150) 1.684 11.398 ( -1.936 2.761 4.567) 5.677 11.492 ( 7.060 2.206 -5.137) 9.005 11.552 ( -0.110 1.666 -0.906) 1.899 11.671 ( 0.112 -1.281 2.432) 2.751 11.850 ( -1.758 2.083 -0.052) 2.726 12.291 ( 0.500 2.418 -1.432) 2.855 12.487 ( -0.779 1.250 2.033) 2.511 12.811 ( 1.312 -1.441 -0.359) 1.982 12.893 ( -0.119 0.496 -0.087) 0.518 13.509 ( 0.893 -2.873 -0.367) 3.031 13.563 ( 0.631 -2.790 -0.106) 2.863 13.720 ( -2.515 4.743 0.420) 5.385 13.910 ( -0.902 3.230 -0.168) 3.358 15.800 ( -0.791 -0.998 2.176) 2.521 15.900 ( 0.688 2.061 -2.102) 3.023 17.227 ( -1.544 -0.622 -0.257) 1.685 17.756 ( -1.471 -4.287 3.328) 5.623 17.851 ( 1.105 -1.672 -0.554) 2.079 18.011 ( 3.485 7.937 -6.826) 11.034 18.267 ( -1.196 -0.417 5.434) 5.579 18.831 ( 2.790 4.610 -3.733) 6.555 18.989 ( 0.265 -1.081 3.242) 3.427 19.228 ( 1.157 2.148 -0.389) 2.470 19.695 ( -3.052 3.414 -0.464) 4.603 20.158 ( -1.905 0.186 0.277) 1.934 21.347 ( 1.255 -0.120 0.290) 1.293 21.910 ( 4.041 -4.323 -0.673) 5.956 22.114 ( -1.854 2.645 -0.867) 3.344 22.208 ( -2.049 -3.535 1.685) 4.420 22.494 ( 0.633 1.234 2.441) 2.808 22.684 ( 3.650 -2.499 -6.923) 8.215 23.001 ( -2.111 -0.959 4.832) 5.360 23.002 ( -2.509 1.295 0.731) 2.917 23.379 ( -1.918 -1.163 -1.188) 2.538 23.433 ( -0.753 0.569 -0.362) 1.011 ======================= Grid point 132 (43/102) ======================= q-point: (-0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.691 ( -4.698 1.366 4.358) 6.552 1.829 ( -1.173 2.050 1.143) 2.624 1.871 ( -0.469 5.947 -7.982) 9.965 2.065 ( -5.128 9.299 0.454) 10.629 2.285 ( 5.780 -2.616 -0.063) 6.345 2.317 ( -4.590 5.562 0.825) 7.258 2.435 ( -3.511 -3.345 1.475) 5.069 2.601 ( 4.921 -1.709 -0.704) 5.256 2.718 ( -0.449 7.407 0.409) 7.432 2.743 ( -2.434 -0.964 -0.284) 2.633 2.838 ( -0.454 -2.821 4.120) 5.014 2.946 ( -0.910 0.602 -2.842) 3.044 3.030 ( 0.256 2.619 -0.316) 2.651 3.123 ( 1.722 -0.742 1.624) 2.480 3.209 ( -2.526 -1.710 -1.771) 3.527 3.305 ( 2.880 -2.732 0.384) 3.988 3.338 ( -1.084 -2.538 -0.334) 2.780 3.432 ( -0.698 1.390 1.967) 2.508 3.573 ( 1.658 0.238 -2.325) 2.866 3.610 ( 3.026 4.478 -1.763) 5.684 3.716 ( 1.359 -0.159 1.060) 1.731 3.782 ( -3.292 -1.353 1.446) 3.841 3.984 ( -2.337 1.712 -1.262) 3.159 3.995 ( 7.192 -0.833 -2.357) 7.614 4.203 ( -3.875 1.006 2.897) 4.942 4.260 ( -0.627 -1.721 -2.536) 3.129 4.404 ( 5.707 -2.313 -0.219) 6.162 4.433 ( -4.752 -0.830 0.889) 4.905 4.665 ( -1.478 2.442 2.338) 3.689 4.782 ( 2.346 1.293 -0.897) 2.825 4.955 ( -0.361 1.774 1.295) 2.226 5.034 ( -3.166 0.248 -0.376) 3.198 5.132 ( 1.364 -0.876 -0.914) 1.861 5.154 ( 3.165 -2.910 3.470) 5.525 5.250 ( 0.601 0.950 -3.293) 3.479 5.397 ( -3.685 2.730 1.338) 4.778 5.575 ( 3.481 1.564 -1.051) 3.958 5.669 ( 2.554 -1.870 -2.345) 3.940 5.833 ( -4.124 3.017 1.509) 5.327 5.932 ( 2.915 -3.041 -0.234) 4.219 6.119 ( 0.409 1.060 2.450) 2.700 6.426 ( -0.309 1.399 0.821) 1.651 6.628 ( -5.565 -0.330 -0.783) 5.630 6.645 ( 0.208 -0.884 -3.287) 3.410 6.897 ( -5.613 6.264 2.571) 8.795 7.139 ( -0.927 -5.113 -1.106) 5.313 7.211 ( -1.125 0.099 0.269) 1.161 7.314 ( -0.878 2.992 -1.172) 3.332 7.600 ( -3.635 -2.767 0.180) 4.572 7.654 ( 0.904 -1.044 -0.089) 1.383 8.126 ( -3.157 -1.099 2.306) 4.061 8.194 ( 0.294 0.949 -1.412) 1.727 8.349 ( 3.385 -0.950 -4.284) 5.542 8.458 ( -10.782 0.956 2.909) 11.208 8.586 ( 3.702 -2.783 2.634) 5.328 8.775 ( -1.540 1.706 -0.258) 2.312 9.044 ( 12.201 -7.373 -3.561) 14.693 9.280 ( -1.130 1.588 0.911) 2.151 9.372 ( 4.152 -1.055 1.289) 4.474 9.739 ( 2.134 -1.841 -0.257) 2.830 9.812 ( -4.254 -0.991 4.754) 6.456 9.996 ( -0.795 -1.252 -3.986) 4.253 10.557 ( 1.017 1.466 1.133) 2.114 10.750 ( -0.915 -0.901 -0.881) 1.558 10.918 ( -0.140 1.146 -0.405) 1.224 11.145 ( -0.169 5.365 -2.821) 6.064 11.162 ( -0.834 0.243 0.770) 1.161 11.360 ( -4.860 -1.128 5.045) 7.095 11.503 ( 1.176 -0.769 -4.115) 4.349 11.544 ( -1.895 -1.469 0.287) 2.415 11.692 ( -0.890 -0.800 0.740) 1.407 11.851 ( 1.594 -2.162 -0.078) 2.687 12.286 ( -0.201 -2.078 -1.074) 2.348 12.479 ( -1.142 -0.659 2.338) 2.685 12.837 ( 1.291 -0.569 -2.202) 2.615 12.878 ( -1.361 0.697 1.272) 1.989 13.504 ( -0.772 3.334 -0.077) 3.423 13.577 ( -1.669 1.465 -0.974) 2.425 13.705 ( 2.211 -3.681 1.345) 4.499 13.915 ( 2.434 -3.177 -0.434) 4.025 15.826 ( -1.437 -2.210 2.286) 3.489 15.874 ( 1.234 1.013 -2.224) 2.737 17.226 ( 1.542 0.666 -0.217) 1.694 17.808 ( 4.758 2.429 3.840) 6.579 17.837 ( 1.254 4.097 -1.891) 4.683 17.944 ( -9.986 -6.617 -3.510) 12.483 18.304 ( 1.886 -2.104 2.578) 3.825 18.801 ( -1.506 -1.507 -1.499) 2.605 19.024 ( -1.277 -2.349 0.711) 2.767 19.218 ( -1.120 -1.447 0.087) 1.831 19.692 ( 2.690 -3.270 -0.265) 4.243 20.162 ( 2.164 -0.451 0.043) 2.211 21.344 ( -1.353 0.555 0.487) 1.542 21.899 ( -3.489 4.923 -0.030) 6.034 22.129 ( 2.882 -3.423 -1.731) 4.798 22.232 ( -0.522 0.496 0.414) 0.830 22.469 ( -0.758 2.058 3.610) 4.224 22.674 ( 0.235 3.157 -5.957) 6.746 22.963 ( 0.314 2.153 3.915) 4.479 23.052 ( 0.809 -3.666 0.790) 3.836 23.377 ( 1.350 0.850 -0.959) 1.862 23.433 ( 2.175 -0.070 -0.474) 2.227 ======================= Grid point 133 (44/102) ======================= q-point: (-0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.515 ( -6.782 13.298 0.828) 14.951 1.563 ( -6.867 15.490 1.291) 16.993 1.792 ( -10.422 10.987 0.843) 15.167 1.916 ( 1.096 -2.352 -2.679) 3.730 2.177 ( -6.216 6.706 -1.795) 9.319 2.292 ( -0.499 2.497 1.761) 3.096 2.456 ( -6.450 9.760 -1.170) 11.757 2.493 ( -3.952 -0.109 1.847) 4.363 2.669 ( -2.386 1.188 3.646) 4.516 2.728 ( 1.170 1.574 -5.324) 5.673 2.896 ( -2.500 1.122 1.183) 2.984 2.913 ( 2.618 -0.838 2.569) 3.762 3.005 ( 6.197 1.910 -2.324) 6.888 3.185 ( 5.154 -2.351 -1.432) 5.843 3.237 ( -5.434 -3.366 0.411) 6.406 3.311 ( 0.700 3.417 0.134) 3.491 3.376 ( 1.453 0.002 -0.633) 1.585 3.429 ( 1.915 -1.514 -0.316) 2.462 3.492 ( -2.689 3.053 2.270) 4.659 3.611 ( 3.330 0.017 -2.027) 3.899 3.756 ( 5.139 -0.934 -1.766) 5.514 3.811 ( -0.596 -2.338 1.389) 2.785 3.904 ( 1.461 3.983 -0.215) 4.248 4.018 ( 2.221 2.363 0.803) 3.341 4.184 ( -2.517 -2.113 0.994) 3.433 4.297 ( -5.471 -3.571 -0.764) 6.578 4.384 ( 2.990 4.666 1.912) 5.862 4.517 ( 2.508 -6.286 -1.594) 6.953 4.646 ( -1.337 -1.077 1.236) 2.116 4.770 ( -0.619 0.463 -1.210) 1.436 4.920 ( -0.828 2.176 2.420) 3.358 4.998 ( -2.478 1.051 -0.310) 2.709 5.158 ( 1.887 -0.436 0.441) 1.987 5.195 ( 4.842 2.526 -3.122) 6.291 5.258 ( 4.969 -0.612 2.499) 5.596 5.342 ( -3.300 -0.282 -2.345) 4.058 5.545 ( 3.749 3.736 -1.120) 5.410 5.725 ( 1.356 -2.327 -0.090) 2.695 5.744 ( -2.153 4.355 0.371) 4.872 5.976 ( -0.204 0.236 -2.598) 2.617 6.126 ( 2.000 0.159 6.958) 7.242 6.384 ( -1.880 2.608 0.984) 3.363 6.551 ( -8.658 1.737 -3.791) 9.610 6.609 ( -8.356 0.248 1.921) 8.578 6.764 ( -2.206 4.621 -2.838) 5.855 7.166 ( -8.688 0.583 5.402) 10.247 7.215 ( -6.214 -6.844 0.509) 9.258 7.249 ( -1.372 2.894 -5.531) 6.391 7.646 ( -5.863 -5.638 0.069) 8.134 7.676 ( 0.277 -0.786 -0.795) 1.152 8.140 ( -0.390 -0.340 2.132) 2.194 8.180 ( -3.167 -3.689 -3.581) 6.038 8.342 ( -8.430 0.708 0.223) 8.463 8.387 ( -2.553 -0.554 -0.529) 2.665 8.715 ( 6.276 -4.665 3.558) 8.591 8.802 ( 5.559 -2.386 -2.319) 6.478 9.209 ( 2.804 -2.668 3.827) 5.443 9.298 ( 5.987 -1.613 -4.833) 7.862 9.473 ( 7.308 -5.495 4.381) 10.139 9.782 ( -1.926 -0.696 1.787) 2.717 9.834 ( -2.169 -5.255 0.700) 5.728 10.029 ( -0.174 -3.726 -4.883) 6.145 10.522 ( 1.067 3.494 1.495) 3.948 10.754 ( -0.071 -0.229 -0.237) 0.338 10.863 ( -1.873 3.169 -3.129) 4.832 11.017 ( -2.236 6.829 -0.957) 7.249 11.128 ( -0.343 1.612 0.466) 1.713 11.367 ( -9.517 -3.515 6.239) 11.910 11.533 ( -0.508 -2.116 -2.634) 3.416 11.557 ( -4.747 -2.867 0.944) 5.626 11.697 ( -1.392 -1.134 -1.430) 2.295 11.919 ( 2.170 -2.663 -0.144) 3.438 12.359 ( -0.125 -6.292 -0.620) 6.324 12.503 ( -0.942 -2.302 1.623) 2.970 12.841 ( 1.070 0.384 -2.579) 2.819 12.856 ( -2.762 0.225 1.770) 3.288 13.436 ( -0.227 3.086 0.529) 3.140 13.510 ( -0.598 3.545 -1.139) 3.772 13.839 ( 2.783 -7.562 1.828) 8.262 14.021 ( 3.867 -5.235 -1.299) 6.637 15.862 ( -3.574 -2.237 4.256) 5.991 15.871 ( 2.093 -0.567 -4.122) 4.658 17.224 ( 4.743 2.161 -0.433) 5.231 17.728 ( 3.252 7.306 -1.082) 8.071 17.768 ( -0.926 4.877 0.238) 4.970 18.040 ( -14.350 -12.442 2.367) 19.140 18.418 ( 5.940 -7.924 -0.950) 9.949 18.851 ( -3.970 -6.166 1.240) 7.438 19.051 ( -3.285 -2.996 -2.858) 5.286 19.270 ( -2.411 -5.455 1.298) 6.104 19.845 ( 6.503 -9.515 0.152) 11.526 20.200 ( 6.396 0.154 -0.553) 6.422 21.309 ( -4.011 1.194 0.580) 4.225 21.742 ( -6.543 7.805 0.173) 10.186 22.174 ( 1.349 5.119 -1.414) 5.479 22.202 ( 1.460 -0.944 -0.520) 1.815 22.429 ( -1.767 1.954 4.561) 5.267 22.578 ( -1.104 4.806 -5.275) 7.221 22.949 ( 2.898 1.771 5.303) 6.298 23.127 ( 2.159 -3.080 -2.082) 4.299 23.367 ( 4.056 2.348 0.023) 4.687 23.457 ( 5.163 0.439 -1.083) 5.294 ======================= Grid point 134 (45/102) ======================= q-point: (-0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.191 ( -7.903 16.171 -0.601) 18.009 1.222 ( -9.175 13.364 0.975) 16.240 1.466 ( -8.537 16.085 -0.211) 18.211 1.936 ( -13.031 5.632 -9.534) 17.100 1.969 ( -4.982 4.778 9.289) 11.573 2.164 ( -6.035 12.799 2.892) 14.443 2.192 ( -0.401 9.953 0.985) 10.010 2.447 ( -12.113 9.743 5.001) 16.330 2.567 ( -0.540 -1.494 -3.986) 4.291 2.669 ( -0.780 1.775 -5.477) 5.810 2.854 ( 1.305 3.380 -4.129) 5.493 2.934 ( -0.298 1.246 2.782) 3.063 3.044 ( 4.441 -0.765 -0.972) 4.610 3.137 ( -6.662 6.235 4.100) 10.003 3.273 ( 2.886 -2.630 -0.252) 3.913 3.288 ( 4.268 2.936 -1.180) 5.313 3.368 ( 1.412 0.247 1.052) 1.778 3.460 ( -1.590 -0.115 3.135) 3.517 3.513 ( 2.359 -4.475 -3.429) 6.112 3.649 ( 1.560 -3.067 -4.890) 5.979 3.795 ( 4.126 0.118 -1.747) 4.482 3.826 ( 5.407 2.641 3.952) 7.199 3.917 ( 2.658 -2.890 -2.419) 4.611 4.005 ( 2.173 -0.717 1.981) 3.026 4.199 ( -0.690 2.283 1.512) 2.824 4.297 ( -0.531 -2.325 3.617) 4.333 4.385 ( -0.285 -2.878 0.522) 2.939 4.626 ( -3.534 -5.576 -1.853) 6.857 4.678 ( -0.695 -3.095 0.034) 3.172 4.761 ( -2.499 -1.368 -1.075) 3.045 4.864 ( -1.264 3.332 2.210) 4.193 4.977 ( -0.413 -0.670 -3.136) 3.233 5.125 ( 1.282 4.818 3.352) 6.008 5.222 ( 7.365 -1.043 -3.115) 8.065 5.325 ( 7.345 -0.848 1.200) 7.491 5.334 ( -0.929 -0.064 -1.917) 2.131 5.502 ( 1.999 3.022 -1.540) 3.937 5.644 ( -1.918 3.458 -1.804) 4.347 5.781 ( 2.028 -1.535 2.871) 3.835 5.916 ( -2.410 3.639 -0.965) 4.470 6.147 ( 0.165 0.496 4.323) 4.354 6.299 ( -6.282 3.946 0.905) 7.473 6.441 ( -8.579 1.921 -1.401) 8.902 6.548 ( -8.295 -0.245 2.047) 8.548 6.712 ( 0.808 -0.138 -2.709) 2.831 7.108 ( -7.873 -0.741 5.699) 9.748 7.155 ( -2.667 3.463 -5.464) 6.997 7.306 ( -11.324 -8.911 -0.631) 14.423 7.681 ( -0.309 -0.015 -1.681) 1.709 7.700 ( -4.782 -4.641 -2.838) 7.243 8.150 ( -1.724 -1.908 0.180) 2.578 8.263 ( 3.279 -1.430 -1.666) 3.946 8.271 ( -12.026 -4.745 1.470) 13.011 8.356 ( -3.544 1.662 -0.202) 3.920 8.849 ( 4.627 -5.186 3.049) 7.589 8.894 ( 7.262 -2.327 -2.630) 8.067 9.258 ( -0.111 -1.287 3.866) 4.076 9.333 ( 3.397 1.417 -2.087) 4.231 9.661 ( 3.541 -7.008 6.166) 9.983 9.789 ( -3.486 -3.389 4.343) 6.519 9.923 ( -2.894 -5.713 -3.674) 7.383 10.086 ( 0.543 -2.535 -6.227) 6.745 10.474 ( 2.596 2.031 0.571) 3.345 10.747 ( -4.745 0.350 0.951) 4.852 10.798 ( 0.746 0.273 -3.621) 3.707 10.903 ( -1.180 3.358 0.614) 3.611 11.129 ( 2.521 -0.899 -0.469) 2.717 11.358 ( -6.480 -0.490 4.422) 7.860 11.529 ( -5.779 -1.443 0.912) 6.026 11.590 ( -3.938 -2.957 -0.651) 4.968 11.710 ( -2.868 -2.067 -0.892) 3.646 11.951 ( -2.541 -0.986 0.389) 2.753 12.491 ( -0.675 -7.113 -0.431) 7.158 12.561 ( 2.394 -4.338 -0.195) 4.959 12.828 ( -4.178 -0.017 3.122) 5.216 12.840 ( -0.261 0.054 -3.078) 3.089 13.400 ( 0.618 1.304 1.301) 1.943 13.454 ( 0.999 2.280 -1.487) 2.899 14.006 ( 1.918 -7.825 2.814) 8.534 14.140 ( 4.435 -4.818 -2.674) 7.073 15.866 ( 0.875 0.145 -2.843) 2.978 15.904 ( -6.140 -3.978 3.197) 7.984 17.210 ( 7.102 4.509 0.286) 8.417 17.625 ( 3.235 5.801 -1.497) 6.809 17.653 ( -3.162 5.503 0.285) 6.353 18.158 ( -18.626 -12.805 1.776) 22.673 18.662 ( 8.596 -12.246 -2.275) 15.134 18.979 ( -2.578 -10.566 4.311) 11.700 19.087 ( -5.092 -5.863 -3.898) 8.688 19.374 ( -4.049 -8.210 0.099) 9.155 20.111 ( 7.520 -12.593 1.086) 14.707 20.239 ( 11.363 2.401 -1.422) 11.700 21.242 ( -6.365 2.137 0.328) 6.723 21.518 ( -9.775 10.270 0.082) 14.179 22.050 ( 3.046 9.033 -1.998) 9.740 22.169 ( -3.632 4.579 3.789) 6.965 22.409 ( 1.332 0.433 -1.173) 1.827 22.481 ( -1.963 3.625 -1.413) 4.358 22.962 ( 4.842 1.443 4.899) 7.037 23.179 ( 2.079 -1.443 -3.136) 4.030 23.350 ( 5.750 3.793 0.556) 6.910 23.481 ( 7.806 2.187 -2.113) 8.378 ======================= Grid point 135 (46/102) ======================= q-point: (-0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.823 ( -11.501 15.351 3.779) 19.550 1.011 ( -4.264 4.165 -7.602) 9.660 1.093 ( -7.947 18.092 3.417) 20.054 1.633 ( -11.723 11.075 -12.876) 20.637 1.715 ( -10.384 17.468 4.675) 20.852 1.780 ( -13.406 25.773 6.458) 29.760 2.019 ( 0.346 8.420 6.319) 10.533 2.273 ( -9.947 -0.669 3.235) 10.481 2.590 ( 0.049 -0.977 -4.556) 4.660 2.669 ( -2.360 -0.669 -5.050) 5.615 2.781 ( 2.778 3.621 -4.224) 6.219 2.872 ( -2.100 3.288 3.210) 5.053 3.016 ( -1.844 2.139 3.278) 4.327 3.058 ( -1.804 1.493 -0.662) 2.433 3.242 ( 3.684 2.570 1.067) 4.617 3.334 ( 3.862 -0.971 -0.979) 4.101 3.370 ( -1.014 0.329 -0.279) 1.102 3.467 ( -3.831 -1.209 1.230) 4.201 3.569 ( 0.395 -0.157 1.410) 1.472 3.711 ( 3.204 -2.409 -7.499) 8.503 3.818 ( 3.671 0.407 0.566) 3.737 3.860 ( 5.010 -1.990 2.683) 6.022 3.977 ( 2.732 -1.168 -2.955) 4.190 4.098 ( 3.274 -5.471 1.743) 6.609 4.140 ( 6.312 5.584 -0.230) 8.430 4.340 ( 0.426 -0.888 1.680) 1.947 4.485 ( -7.775 -10.957 1.745) 13.548 4.688 ( -4.432 -5.648 -1.903) 7.427 4.725 ( -0.362 -2.196 2.839) 3.608 4.759 ( -3.795 -1.362 1.998) 4.500 4.851 ( 2.589 -1.691 -1.142) 3.296 4.993 ( 4.135 -0.357 -6.907) 8.058 5.053 ( -1.280 3.306 2.429) 4.298 5.245 ( -3.798 4.817 -0.738) 6.178 5.327 ( 9.184 -0.331 0.758) 9.221 5.389 ( 6.109 0.118 2.064) 6.450 5.500 ( 5.144 -1.509 -3.153) 6.220 5.606 ( 0.690 0.123 -3.151) 3.228 5.772 ( -0.753 4.751 4.471) 6.567 5.882 ( -2.440 -3.366 -0.017) 4.157 6.105 ( -3.961 3.844 -2.109) 5.909 6.172 ( -10.578 1.913 1.458) 10.848 6.369 ( -5.496 0.212 1.699) 5.757 6.492 ( -7.643 0.715 0.732) 7.712 6.751 ( 1.388 -3.147 -0.110) 3.441 7.070 ( -3.049 1.472 -4.463) 5.602 7.109 ( -1.074 -1.002 3.644) 3.929 7.347 ( -12.294 -5.185 0.166) 13.344 7.651 ( -2.513 2.084 -1.623) 3.646 7.714 ( -4.064 -1.128 -8.016) 9.058 8.133 ( -6.222 0.865 1.476) 6.453 8.224 ( -4.195 1.757 -5.024) 6.777 8.330 ( -1.747 -5.307 4.062) 6.907 8.383 ( -0.995 -6.100 0.744) 6.225 8.969 ( 0.436 -3.270 5.527) 6.436 8.992 ( 9.241 -3.432 -5.111) 11.104 9.255 ( -0.650 2.621 4.019) 4.842 9.304 ( 0.085 1.821 -0.396) 1.866 9.708 ( -1.396 1.616 3.874) 4.424 9.905 ( -4.014 -2.418 -1.304) 4.864 9.997 ( -8.608 -13.838 5.916) 17.338 10.092 ( -2.195 -2.436 -3.658) 4.912 10.537 ( 9.485 -3.869 -4.943) 11.374 10.737 ( -5.263 -4.810 0.121) 7.131 10.836 ( 0.093 -3.302 0.500) 3.341 10.879 ( -1.053 -1.485 0.510) 1.890 11.187 ( 6.457 -1.287 -0.258) 6.590 11.311 ( -0.441 3.026 1.695) 3.496 11.500 ( -5.642 1.135 1.858) 6.047 11.588 ( -4.692 -0.659 -0.151) 4.741 11.701 ( -5.755 -0.328 -1.804) 6.040 11.948 ( -10.529 -4.499 1.774) 11.587 12.564 ( 1.929 -2.134 0.036) 2.877 12.714 ( 3.969 -8.239 -1.343) 9.243 12.799 ( -5.748 -0.659 1.628) 6.011 12.830 ( -2.967 -0.534 -0.772) 3.112 13.401 ( 0.641 -0.293 1.468) 1.628 13.433 ( 1.542 1.044 -1.092) 2.159 14.146 ( 0.634 -5.454 3.401) 6.459 14.245 ( 4.984 -3.397 -4.164) 7.330 15.858 ( 2.772 1.097 -6.343) 7.008 15.946 ( -14.857 -8.645 7.419) 18.722 17.163 ( 6.902 6.673 3.127) 10.097 17.523 ( -3.773 5.024 -0.684) 6.320 17.598 ( 9.252 2.264 -3.202) 10.049 18.186 ( -25.967 -7.508 -3.295) 27.231 18.933 ( 9.539 -9.216 2.248) 13.453 19.180 ( -2.782 -11.110 -1.426) 11.541 19.237 ( -4.065 -17.111 2.976) 17.837 19.497 ( -5.971 -9.495 -2.299) 11.450 20.210 ( 17.414 9.581 0.290) 19.878 20.435 ( 3.879 -13.232 -0.216) 13.791 21.130 ( -5.145 6.153 -1.211) 8.112 21.240 ( -13.228 8.962 -0.412) 15.983 21.908 ( 2.013 8.111 1.879) 8.566 22.033 ( -3.682 6.924 1.877) 8.064 22.400 ( 0.552 2.284 -1.614) 2.851 22.419 ( -0.898 1.002 -0.305) 1.380 22.979 ( 5.943 2.662 4.471) 7.899 23.198 ( 1.974 0.065 -3.714) 4.207 23.317 ( 5.259 4.483 0.392) 6.921 23.474 ( 9.870 5.553 -4.997) 12.378 ======================= Grid point 136 (47/102) ======================= q-point: (-0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.520 ( -11.623 9.091 13.486) 19.990 0.704 ( -6.686 18.079 15.382) 24.661 0.949 ( -1.535 1.641 -17.289) 17.435 1.166 ( -18.741 25.931 18.482) 36.949 1.287 ( -16.505 12.543 -14.386) 25.233 1.439 ( 8.297 8.449 -12.535) 17.244 1.920 ( 4.584 4.940 8.241) 10.645 2.266 ( -8.262 -5.608 -3.754) 10.668 2.506 ( -5.745 5.715 1.234) 8.197 2.578 ( -1.754 5.628 -4.911) 7.672 2.804 ( -2.010 2.372 8.451) 9.005 2.868 ( 2.013 -9.168 1.934) 9.584 2.988 ( -0.338 2.783 1.702) 3.280 3.087 ( 1.841 -6.109 -4.186) 7.631 3.259 ( 2.683 -0.864 -1.661) 3.271 3.316 ( -5.308 1.889 -0.394) 5.648 3.392 ( 2.067 -2.278 1.169) 3.290 3.451 ( -2.398 0.094 -0.355) 2.426 3.537 ( 1.779 4.077 2.941) 5.332 3.721 ( 1.239 1.598 -7.569) 7.834 3.848 ( -2.010 -2.521 4.037) 5.166 3.940 ( 5.318 1.848 1.481) 5.822 3.966 ( 3.174 0.824 -5.455) 6.364 4.065 ( 3.210 5.859 -2.175) 7.026 4.227 ( -0.043 -4.654 3.299) 5.704 4.385 ( -0.853 -4.670 -5.454) 7.231 4.644 ( -4.086 -9.635 3.594) 11.066 4.743 ( -0.925 -3.576 -1.909) 4.158 4.780 ( -2.951 -5.314 2.973) 6.766 4.796 ( -3.365 -3.909 3.115) 6.025 4.921 ( 2.727 -1.750 -0.299) 3.254 4.993 ( 6.539 4.625 -7.485) 10.962 5.005 ( -2.523 -0.124 1.897) 3.159 5.115 ( -3.894 2.785 -1.785) 5.109 5.407 ( 8.574 0.038 1.753) 8.751 5.435 ( 9.161 1.077 1.808) 9.400 5.588 ( 7.444 -2.934 -4.516) 9.188 5.606 ( -2.037 0.553 3.407) 4.008 5.703 ( 5.587 3.276 -2.141) 6.821 5.929 ( -26.361 -7.926 -3.859) 27.796 5.974 ( -2.260 2.160 0.917) 3.258 6.075 ( -6.072 2.328 0.030) 6.503 6.346 ( -6.174 -1.155 2.618) 6.805 6.396 ( -7.995 3.082 -2.906) 9.047 6.822 ( 0.981 -2.296 3.584) 4.368 7.032 ( 0.164 0.461 -7.601) 7.617 7.135 ( 3.970 0.894 4.466) 6.042 7.314 ( -8.307 -0.317 -0.570) 8.333 7.546 ( -4.704 6.592 -1.237) 8.192 7.632 ( -7.238 1.960 -7.940) 10.921 8.076 ( -6.930 0.252 3.684) 7.852 8.157 ( 0.184 1.484 -5.173) 5.385 8.461 ( -0.595 -7.173 2.621) 7.660 8.494 ( 2.328 -5.583 0.285) 6.056 9.005 ( -6.732 -0.707 7.095) 9.806 9.053 ( 4.409 2.038 -2.494) 5.460 9.203 ( 7.062 3.719 0.765) 8.018 9.311 ( 0.092 -2.034 -1.065) 2.298 9.671 ( -3.867 0.967 5.917) 7.134 9.823 ( -0.968 3.386 -6.698) 7.568 10.173 ( 1.518 -6.725 2.479) 7.327 10.318 ( -17.749 -27.339 6.679) 33.272 10.686 ( 13.568 -3.553 -5.798) 15.177 10.833 ( -6.762 -9.352 0.737) 11.564 10.905 ( 0.329 -6.305 2.500) 6.791 10.964 ( -1.134 -7.980 -0.939) 8.115 11.239 ( 3.708 0.440 0.570) 3.777 11.271 ( 6.171 3.742 0.123) 7.218 11.395 ( -5.233 6.060 2.849) 8.499 11.555 ( -3.535 0.434 -0.381) 3.582 11.641 ( -4.526 1.384 -2.441) 5.325 11.903 ( -32.204 -3.767 -8.315) 33.473 12.661 ( 8.370 -5.375 4.786) 11.038 12.773 ( -1.914 -0.096 -0.254) 1.933 12.804 ( -2.612 -0.319 1.760) 3.166 12.881 ( -1.748 -7.590 -0.086) 7.789 13.416 ( 0.485 -0.342 0.479) 0.762 13.427 ( 0.436 0.412 -0.031) 0.601 14.221 ( 0.550 -1.794 2.061) 2.787 14.297 ( 3.985 1.235 -4.690) 6.277 15.857 ( 7.374 0.879 -5.617) 9.311 16.042 ( -34.518 -20.023 4.919) 40.207 17.115 ( 7.575 4.396 7.144) 11.302 17.400 ( -2.352 5.904 -4.950) 8.055 17.665 ( 15.731 1.052 -3.915) 16.246 17.975 ( -29.504 6.714 -7.544) 31.184 19.171 ( 13.231 -9.017 9.118) 18.425 19.403 ( -5.735 -15.448 1.269) 16.527 19.521 ( -1.437 -13.444 1.114) 13.567 19.603 ( -5.026 -6.827 -3.988) 9.369 20.138 ( 18.444 12.111 1.448) 22.113 20.507 ( -15.922 6.465 -5.868) 18.158 20.982 ( 4.737 3.152 -2.085) 6.059 21.069 ( -9.018 2.456 0.065) 9.346 21.831 ( 0.122 0.736 5.489) 5.539 21.908 ( -1.888 4.080 0.140) 4.497 22.361 ( -1.500 0.908 1.575) 2.357 22.398 ( 1.034 1.402 -2.403) 2.968 22.969 ( 6.552 4.224 2.860) 8.304 23.188 ( 2.641 2.694 -6.581) 7.585 23.275 ( 2.529 3.149 -0.115) 4.040 23.366 ( 5.357 12.258 -8.166) 15.673 ======================= Grid point 138 (48/102) ======================= q-point: ( 0.09 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.629 ( 11.466 -0.000 16.180) 19.831 0.740 ( -1.890 0.000 25.588) 25.658 0.867 ( 8.841 -0.000 -16.414) 18.644 0.978 ( 14.286 -0.000 -12.601) 19.050 1.038 ( 35.772 -0.000 15.132) 38.841 1.604 ( 20.042 -0.000 -21.713) 29.549 2.033 ( 0.494 -0.000 -10.119) 10.131 2.158 ( 8.945 -0.000 12.120) 15.064 2.481 ( 6.424 -0.000 3.172) 7.164 2.559 ( 8.178 -0.000 -0.765) 8.214 2.857 ( 3.126 -0.000 7.209) 7.858 2.904 ( -11.452 0.000 3.808) 12.069 2.938 ( -0.096 0.000 0.601) 0.609 3.031 ( -10.701 0.000 2.138) 10.912 3.233 ( 4.682 -0.000 -0.488) 4.707 3.355 ( -3.832 0.000 0.408) 3.853 3.380 ( 5.895 -0.000 -0.276) 5.902 3.488 ( -0.787 0.000 -2.602) 2.718 3.544 ( 3.827 -0.000 5.438) 6.650 3.608 ( 0.951 -0.000 -9.190) 9.239 3.818 ( 0.312 -0.000 3.912) 3.924 3.883 ( -1.773 0.000 2.156) 2.792 3.941 ( -4.396 0.000 -2.649) 5.132 4.022 ( 0.192 -0.000 -4.109) 4.114 4.342 ( 1.998 -0.000 2.599) 3.278 4.510 ( 13.353 -0.000 -8.941) 16.070 4.635 ( -8.509 0.000 4.174) 9.478 4.675 ( -10.385 0.000 6.112) 12.050 4.834 ( -3.102 0.000 0.109) 3.104 4.858 ( 4.513 -0.000 2.112) 4.982 4.908 ( -2.741 0.000 0.012) 2.741 4.935 ( -0.472 0.000 -0.488) 0.679 5.090 ( 2.735 -0.000 0.891) 2.876 5.090 ( 0.857 -0.000 -0.153) 0.871 5.110 ( -4.360 0.000 2.538) 5.044 5.353 ( -9.180 0.000 1.637) 9.325 5.432 ( -9.574 0.000 2.435) 9.879 5.587 ( -9.229 0.000 -1.768) 9.397 5.882 ( 11.846 -0.000 -7.442) 13.990 5.916 ( -2.754 0.000 2.867) 3.975 6.073 ( -1.792 0.000 -4.897) 5.215 6.080 ( 10.500 -0.000 8.234) 13.344 6.478 ( 14.483 -0.000 -0.645) 14.498 6.504 ( 20.000 -0.000 -9.788) 22.267 6.892 ( -6.821 0.000 -2.873) 7.401 6.916 ( 3.563 -0.000 3.508) 5.000 7.213 ( 2.230 -0.000 -7.593) 7.914 7.314 ( 14.570 -0.000 1.278) 14.626 7.464 ( 1.986 -0.000 9.081) 9.296 7.761 ( 15.814 -0.000 -10.543) 19.006 8.060 ( 5.506 -0.000 1.953) 5.842 8.180 ( 3.036 -0.000 -2.139) 3.713 8.554 ( 0.011 -0.000 -0.355) 0.355 8.754 ( 10.695 -0.000 -12.330) 16.322 8.860 ( -4.222 0.000 4.015) 5.826 9.137 ( 5.655 -0.000 1.736) 5.915 9.177 ( -4.127 0.000 -5.791) 7.111 9.492 ( 12.269 -0.000 -5.917) 13.621 9.671 ( -0.311 0.000 -3.310) 3.324 9.860 ( 7.901 -0.000 -6.957) 10.527 9.865 ( -27.071 0.000 24.918) 36.793 10.381 ( 2.622 -0.000 12.398) 12.672 10.644 ( -3.412 0.000 -7.437) 8.183 10.857 ( -11.030 0.000 3.647) 11.617 10.993 ( -1.599 0.000 2.062) 2.609 11.069 ( -4.782 0.000 0.162) 4.785 11.115 ( -3.557 0.000 3.860) 5.249 11.309 ( 5.263 -0.000 -2.238) 5.719 11.311 ( 4.545 -0.000 2.638) 5.256 11.530 ( 4.654 -0.000 4.228) 6.288 11.658 ( 9.928 -0.000 2.639) 10.272 11.914 ( 22.862 -0.000 9.836) 24.888 12.715 ( -6.157 0.000 2.268) 6.561 12.802 ( -4.253 0.000 -1.316) 4.452 12.878 ( 12.108 -0.000 -0.356) 12.113 13.105 ( 8.934 -0.000 -6.136) 10.838 13.399 ( -1.429 0.000 -0.110) 1.433 13.445 ( 2.517 -0.000 -0.424) 2.553 14.229 ( -2.359 0.000 -0.287) 2.377 14.243 ( -1.296 0.000 -0.287) 1.327 15.697 ( 2.060 -0.000 2.540) 3.270 16.271 ( 16.874 -0.000 18.205) 24.822 17.057 ( -5.467 0.000 -1.838) 5.767 17.318 ( 1.426 -0.000 -4.799) 5.006 17.859 ( 10.598 -0.000 -2.617) 10.916 17.876 ( 16.030 -0.000 -5.874) 17.072 19.290 ( -16.828 0.000 -3.463) 17.181 19.393 ( -18.677 0.000 -0.287) 18.680 19.676 ( 4.097 -0.000 0.043) 4.097 19.930 ( 12.724 -0.000 -4.305) 13.432 20.226 ( 11.968 -0.000 4.632) 12.833 20.278 ( 26.821 -0.000 -11.373) 29.133 20.984 ( -2.924 0.000 0.941) 3.072 21.004 ( 1.154 -0.000 -1.506) 1.897 21.881 ( 1.141 -0.000 1.552) 1.926 21.895 ( 2.777 -0.000 -1.389) 3.105 22.343 ( -1.089 0.000 1.637) 1.967 22.400 ( 1.166 -0.000 -1.180) 1.659 22.669 ( -24.941 0.000 15.142) 29.178 22.975 ( -5.044 0.000 2.328) 5.555 23.223 ( -2.173 0.000 0.073) 2.174 23.258 ( -1.105 0.000 -0.176) 1.118 ======================= Grid point 139 (49/102) ======================= q-point: ( 0.18 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.763 ( 14.134 -6.422 9.339) 18.117 0.980 ( 15.345 -5.612 -10.386) 19.361 1.099 ( 4.126 -21.053 14.858) 26.097 1.177 ( 15.013 -9.825 -12.794) 22.036 1.447 ( 32.270 -11.638 9.282) 35.538 1.741 ( 17.042 -3.589 -7.637) 19.017 2.065 ( 8.855 -1.422 -9.760) 13.255 2.268 ( 8.910 -2.830 6.502) 11.387 2.560 ( 6.185 -0.465 0.939) 6.273 2.651 ( -1.555 -2.154 2.565) 3.693 2.743 ( 1.052 0.882 0.600) 1.498 2.929 ( -0.374 -1.653 6.988) 7.190 2.982 ( -1.489 -4.331 1.410) 4.792 3.002 ( -2.506 -1.246 -5.939) 6.566 3.224 ( 2.689 1.466 -1.845) 3.576 3.303 ( -2.132 2.189 -0.358) 3.076 3.407 ( 0.834 1.238 2.325) 2.763 3.483 ( -1.697 -1.076 -2.208) 2.985 3.578 ( 2.219 0.573 1.427) 2.699 3.656 ( 2.217 -1.438 -2.021) 3.327 3.795 ( -3.520 1.675 0.338) 3.913 3.848 ( -4.274 0.030 -0.352) 4.289 3.966 ( -3.727 -2.634 2.563) 5.234 3.996 ( -1.717 -0.893 -4.994) 5.356 4.283 ( -1.468 7.613 0.126) 7.754 4.461 ( 1.577 6.057 -2.688) 6.812 4.585 ( -0.702 0.436 4.417) 4.493 4.677 ( -2.933 -1.847 1.668) 3.847 4.757 ( -5.497 7.344 2.214) 9.437 4.785 ( -8.114 0.987 0.680) 8.202 4.905 ( 5.349 1.408 1.188) 5.657 4.941 ( 6.243 1.565 -3.965) 7.559 5.119 ( -4.718 -2.999 -0.283) 5.598 5.153 ( 3.036 -3.372 -1.200) 4.693 5.215 ( 2.124 -9.179 -2.649) 9.787 5.286 ( -8.841 0.077 3.001) 9.337 5.364 ( -7.797 0.884 3.355) 8.534 5.533 ( -7.063 -1.238 -0.373) 7.180 5.867 ( -2.671 0.361 -0.526) 2.746 5.967 ( -2.613 1.662 -2.040) 3.708 6.005 ( 4.334 -0.719 0.692) 4.447 6.209 ( 5.475 -3.821 3.186) 7.397 6.460 ( 11.908 6.598 -0.620) 13.628 6.649 ( 12.278 -1.016 -4.986) 13.291 6.806 ( -5.747 3.412 -1.503) 6.850 6.963 ( 4.184 -1.097 3.267) 5.421 7.227 ( 4.396 0.311 -4.595) 6.367 7.459 ( 11.392 -2.239 3.278) 12.064 7.574 ( 0.433 -7.451 0.843) 7.511 7.802 ( 15.006 4.536 -11.534) 19.462 8.142 ( 8.244 -2.329 0.463) 8.579 8.193 ( 2.917 0.219 -0.479) 2.964 8.510 ( -1.406 3.300 1.203) 3.783 8.663 ( 7.160 12.109 -6.567) 15.524 8.813 ( -4.807 3.310 2.453) 6.331 9.079 ( -8.456 3.131 -0.872) 9.059 9.234 ( 2.671 -3.982 0.250) 4.801 9.440 ( 3.901 11.335 2.238) 12.194 9.590 ( -0.740 -4.645 4.626) 6.597 9.859 ( 4.450 1.055 6.406) 7.871 9.964 ( 9.378 -2.313 -6.316) 11.541 10.349 ( 4.557 8.466 7.942) 12.471 10.573 ( -3.044 2.910 -7.371) 8.489 10.822 ( -11.569 -3.371 1.244) 12.114 10.885 ( -2.525 6.549 0.528) 7.039 11.013 ( 0.190 6.758 0.572) 6.785 11.143 ( -1.174 -2.618 3.260) 4.343 11.206 ( 4.333 3.450 1.070) 5.641 11.497 ( 5.319 -6.068 -0.235) 8.073 11.642 ( 5.737 -4.262 -0.737) 7.185 11.710 ( 9.862 1.709 3.317) 10.544 12.061 ( 8.213 -0.132 7.702) 11.260 12.671 ( -9.312 -0.306 2.567) 9.664 12.694 ( -4.319 4.689 -4.921) 8.053 12.947 ( 17.449 6.819 1.836) 18.823 13.041 ( 12.501 10.161 -2.296) 16.272 13.386 ( -1.862 0.259 0.387) 1.919 13.436 ( 0.487 1.775 -0.140) 1.846 14.212 ( -2.535 2.020 0.741) 3.325 14.236 ( -4.609 -1.069 -2.693) 5.444 15.733 ( 3.759 -0.438 0.336) 3.799 16.278 ( 5.011 10.141 10.720) 15.584 17.059 ( -2.843 -3.067 -1.581) 4.471 17.374 ( 2.398 -4.695 -1.620) 5.515 17.639 ( 8.530 9.460 -0.742) 12.759 18.283 ( 15.939 -8.777 -0.501) 18.203 19.055 ( -12.405 6.271 -1.395) 13.970 19.374 ( -10.013 -0.578 -0.209) 10.032 19.599 ( 3.060 10.755 -1.566) 11.291 19.844 ( 22.844 26.132 -4.503) 35.000 19.964 ( -8.722 0.135 -0.708) 8.752 20.683 ( 4.806 10.023 -1.800) 11.260 20.877 ( 3.579 -15.615 0.762) 16.038 21.160 ( 6.715 -6.881 -0.315) 9.620 21.897 ( 1.353 -3.053 0.482) 3.374 21.953 ( 4.753 -2.755 1.732) 5.761 22.344 ( -0.362 0.082 0.427) 0.566 22.416 ( 0.622 -2.144 -0.848) 2.388 22.788 ( -17.874 -18.048 1.068) 25.424 22.989 ( -8.353 -5.894 4.054) 10.997 23.202 ( -3.928 0.010 0.375) 3.946 23.294 ( -2.933 -5.108 -0.231) 5.894 ======================= Grid point 140 (50/102) ======================= q-point: ( 0.27 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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 ( 15.647 -12.994 1.422) 20.389 1.149 ( 13.684 -3.462 -8.256) 16.352 1.436 ( 14.166 -9.474 -10.149) 19.835 1.559 ( 4.595 -21.118 13.810) 25.648 1.901 ( 12.238 -11.224 5.597) 17.524 1.949 ( 16.726 -8.105 3.880) 18.987 2.140 ( 7.635 -2.890 -5.978) 10.119 2.393 ( 3.948 -1.316 6.908) 8.065 2.567 ( 6.051 -5.675 -8.664) 11.995 2.718 ( 3.602 -3.073 1.342) 4.921 2.838 ( 5.851 -0.422 -5.285) 7.896 2.922 ( -3.241 -1.201 0.553) 3.501 3.018 ( 1.001 -1.863 1.458) 2.569 3.103 ( 0.999 -6.898 -0.196) 6.973 3.201 ( -1.730 4.181 2.079) 4.979 3.251 ( -5.033 -1.951 -0.049) 5.398 3.389 ( 2.567 2.592 0.770) 3.729 3.502 ( -6.485 -3.793 2.747) 7.999 3.553 ( -1.961 7.558 0.009) 7.809 3.571 ( 2.721 2.244 -2.123) 4.116 3.783 ( -1.208 -0.359 -1.636) 2.065 3.850 ( -4.334 -3.060 -4.264) 6.806 3.900 ( -3.278 3.767 2.023) 5.388 4.051 ( -3.095 -2.463 0.260) 3.964 4.118 ( -3.589 3.302 -0.816) 4.945 4.370 ( 0.614 4.863 0.512) 4.929 4.528 ( -3.720 8.457 2.886) 9.679 4.636 ( 4.386 -1.304 -0.270) 4.584 4.717 ( -4.893 1.899 0.755) 5.303 4.761 ( 0.496 -3.868 1.466) 4.166 4.906 ( 3.323 1.503 2.891) 4.654 4.922 ( -2.084 1.178 -2.593) 3.529 5.088 ( -6.265 0.671 -4.338) 7.650 5.207 ( -0.642 -0.088 -0.560) 0.856 5.250 ( -6.633 -1.971 0.625) 6.948 5.298 ( 1.934 0.622 1.149) 2.334 5.407 ( -1.874 -8.406 -0.380) 8.621 5.534 ( -2.131 -3.355 2.083) 4.488 5.822 ( -7.156 0.667 0.594) 7.212 5.919 ( 4.099 1.828 -0.725) 4.547 6.082 ( -1.635 -4.703 0.316) 4.989 6.321 ( 2.505 -4.366 2.120) 5.462 6.464 ( 11.340 2.206 -1.601) 11.663 6.685 ( -5.078 0.662 -2.954) 5.912 6.741 ( 13.782 3.946 0.346) 14.340 7.029 ( 4.554 -1.637 3.267) 5.838 7.242 ( 2.675 0.073 -2.182) 3.453 7.556 ( 7.535 -0.212 6.307) 9.829 7.679 ( -0.984 -3.973 -3.632) 5.472 7.769 ( 14.587 9.121 -11.994) 20.972 8.178 ( 0.409 0.698 1.515) 1.718 8.260 ( 5.609 -0.021 -0.855) 5.674 8.437 ( -0.690 2.807 -2.206) 3.636 8.512 ( 9.274 7.577 2.543) 12.243 8.713 ( -4.894 3.472 2.104) 6.359 8.949 ( -10.545 2.914 -0.972) 10.983 9.272 ( -1.711 0.769 1.931) 2.692 9.368 ( 6.604 4.014 0.967) 7.789 9.641 ( -6.622 -1.839 3.026) 7.509 9.855 ( 0.688 3.573 8.089) 8.869 10.035 ( 7.551 0.189 -4.982) 9.049 10.192 ( 5.490 12.857 -1.656) 14.078 10.514 ( 2.454 0.830 -3.693) 4.511 10.760 ( -10.471 1.126 -0.362) 10.538 10.814 ( 2.349 -0.002 0.492) 2.400 10.911 ( 2.895 4.398 0.560) 5.295 11.139 ( 1.176 1.445 -0.706) 1.992 11.280 ( 4.484 -4.006 5.488) 8.141 11.600 ( 7.391 0.027 0.786) 7.432 11.696 ( 9.528 2.189 -1.852) 9.950 11.795 ( 5.424 -1.809 1.515) 5.915 12.063 ( 1.193 4.632 1.532) 5.023 12.592 ( -6.494 1.597 -0.160) 6.689 12.598 ( -1.302 3.223 -2.661) 4.378 12.907 ( 11.784 9.342 1.803) 15.145 12.976 ( 12.547 7.153 -0.945) 14.474 13.378 ( -1.534 -1.126 1.120) 2.208 13.407 ( -2.390 0.080 -0.689) 2.488 14.125 ( -3.736 5.699 1.070) 6.898 14.168 ( -6.013 2.537 -2.458) 6.974 15.761 ( 0.808 -0.691 0.803) 1.333 16.129 ( -0.536 7.888 1.521) 8.051 17.101 ( -3.256 -4.152 -1.164) 5.403 17.478 ( 1.479 -4.778 0.274) 5.010 17.639 ( 9.821 -0.201 0.605) 9.841 18.413 ( 10.292 3.841 3.841) 11.638 18.840 ( -8.484 10.020 -2.460) 13.358 19.212 ( 3.502 12.820 1.620) 13.388 19.365 ( 3.235 14.973 -4.061) 15.848 19.579 ( 10.390 15.085 0.895) 18.339 19.977 ( -16.753 -9.837 -2.716) 19.616 20.366 ( -5.121 17.167 0.179) 17.916 21.266 ( 11.020 -13.142 -1.836) 17.249 21.326 ( 7.895 -6.505 3.764) 10.900 21.945 ( 1.138 -2.132 -2.194) 3.264 22.116 ( 4.538 -8.541 2.669) 10.033 22.342 ( -1.145 -0.753 -0.380) 1.422 22.469 ( 1.138 -2.847 -0.964) 3.214 22.900 ( -9.864 -6.640 -1.084) 11.940 23.069 ( -7.602 -7.228 1.452) 10.590 23.171 ( -8.285 -2.163 1.236) 8.652 23.365 ( -4.554 -5.149 -0.418) 6.887 ======================= Grid point 141 (51/102) ======================= q-point: ( 0.36 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.313 ( 8.987 -7.380 -1.569) 11.734 1.428 ( 13.323 -12.407 -0.513) 18.213 1.666 ( 7.154 -7.431 -2.180) 10.543 1.953 ( 7.359 -9.055 7.690) 13.974 2.008 ( 2.411 -8.094 2.948) 8.945 2.198 ( 3.253 -8.040 -2.296) 8.972 2.359 ( 10.058 -9.111 -3.211) 13.946 2.511 ( 7.290 -7.486 2.766) 10.809 2.710 ( 5.618 6.159 -3.035) 8.872 2.724 ( 4.162 -1.870 -1.980) 4.974 2.878 ( 2.574 -3.457 -3.900) 5.813 2.932 ( -1.856 -0.600 2.041) 2.823 3.018 ( -2.052 1.897 -5.086) 5.803 3.109 ( -5.271 1.236 4.244) 6.880 3.209 ( -1.351 -4.493 1.350) 4.882 3.276 ( -2.288 -2.843 1.067) 3.802 3.338 ( 0.330 5.483 5.326) 7.651 3.432 ( -1.401 0.892 -3.311) 3.704 3.509 ( -3.773 -0.573 3.894) 5.452 3.599 ( 3.482 -0.770 -2.838) 4.557 3.777 ( 0.898 0.577 -3.532) 3.690 3.804 ( -4.863 0.651 -0.708) 4.957 3.844 ( -3.760 -0.602 -0.945) 3.923 4.019 ( -1.787 0.851 -0.658) 2.086 4.174 ( -1.785 -6.095 2.547) 6.842 4.290 ( -2.136 3.920 2.784) 5.261 4.380 ( 0.181 5.889 0.675) 5.930 4.660 ( 1.101 2.119 -3.052) 3.875 4.670 ( -0.197 2.889 1.265) 3.160 4.784 ( 0.173 -0.972 -1.510) 1.804 4.889 ( -3.741 -1.731 2.582) 4.864 4.962 ( 3.067 -3.162 0.243) 4.411 5.035 ( -7.917 -1.604 -2.121) 8.352 5.159 ( -4.233 1.682 1.206) 4.712 5.236 ( -4.841 -2.017 -1.464) 5.445 5.346 ( 7.106 -0.380 0.402) 7.128 5.491 ( -1.937 -3.633 -0.960) 4.227 5.638 ( 0.101 -6.171 1.157) 6.279 5.762 ( -3.301 0.891 0.970) 3.553 5.941 ( 3.337 -0.475 0.039) 3.371 6.129 ( -4.587 -2.488 -0.010) 5.219 6.412 ( -0.129 -4.489 2.793) 5.288 6.495 ( 6.205 2.448 -3.054) 7.336 6.682 ( 5.570 -1.446 1.123) 5.863 6.794 ( 13.943 1.404 -1.826) 14.132 7.095 ( 2.468 -1.538 3.553) 4.591 7.252 ( 0.798 0.137 -0.712) 1.078 7.612 ( 15.170 9.352 -3.691) 18.199 7.645 ( 0.959 3.311 1.190) 3.647 7.697 ( -2.429 -0.763 -4.050) 4.783 8.137 ( -4.531 3.653 3.093) 6.591 8.235 ( 3.140 1.881 -3.207) 4.866 8.425 ( -0.693 -0.975 -2.247) 2.546 8.525 ( 10.414 2.593 3.790) 11.381 8.631 ( 0.740 3.861 -1.399) 4.172 8.823 ( -10.021 1.390 -0.602) 10.135 9.206 ( -4.731 4.497 3.341) 7.332 9.335 ( 2.194 3.254 0.036) 3.925 9.557 ( -12.302 3.631 3.257) 13.233 9.790 ( -1.660 3.567 3.705) 5.404 9.982 ( 6.076 9.982 -1.166) 11.744 10.089 ( 6.716 2.151 -4.294) 8.257 10.533 ( 3.366 0.144 -0.785) 3.459 10.694 ( -7.276 -1.450 -0.709) 7.452 10.858 ( 7.548 0.936 -0.469) 7.621 10.931 ( 1.749 -5.438 0.665) 5.751 11.131 ( 3.495 0.940 -1.286) 3.841 11.389 ( 3.576 -2.835 5.261) 6.964 11.625 ( 7.644 3.209 0.924) 8.342 11.721 ( 9.391 2.821 -0.483) 9.818 11.806 ( 6.075 6.415 -1.630) 8.984 11.964 ( -1.979 4.199 -0.693) 4.693 12.482 ( -2.722 5.250 -0.677) 5.952 12.564 ( 0.063 1.755 -0.681) 1.884 12.831 ( 7.224 6.014 1.723) 9.556 12.949 ( 6.771 4.052 -0.795) 7.931 13.400 ( -2.238 -2.056 -1.032) 3.210 13.422 ( 0.067 -3.679 1.247) 3.885 13.964 ( -5.337 7.599 -0.156) 9.287 14.064 ( -5.434 3.726 -0.720) 6.628 15.773 ( -1.603 -0.777 1.085) 2.086 16.009 ( -2.541 4.306 -0.579) 5.033 17.148 ( -1.692 -3.271 -0.704) 3.749 17.566 ( -0.812 -4.485 0.758) 4.620 17.743 ( 8.298 -2.743 -0.271) 8.744 18.372 ( 5.471 6.963 4.169) 9.788 18.550 ( -1.508 15.885 -2.650) 16.175 19.055 ( 2.270 7.314 -0.140) 7.660 19.149 ( 5.470 10.992 -1.219) 12.338 19.425 ( 4.784 8.964 0.772) 10.190 19.982 ( -14.068 1.795 -1.777) 14.293 20.065 ( -7.701 4.738 0.443) 9.052 21.403 ( 12.677 1.634 -0.378) 12.787 21.607 ( 5.397 -12.352 2.411) 13.693 22.004 ( -0.840 -4.863 -1.573) 5.180 22.229 ( 0.506 0.610 0.413) 0.894 22.406 ( 1.055 -7.274 1.243) 7.454 22.524 ( 1.870 -2.607 -2.674) 4.176 22.929 ( -5.908 -3.785 0.621) 7.044 23.069 ( -3.552 1.704 0.734) 4.007 23.209 ( -10.157 -8.266 0.701) 13.114 23.401 ( -4.648 -2.877 -0.676) 5.508 ======================= Grid point 143 (52/102) ======================= q-point: ( 0.45 0.09 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.538 ( 4.118 -11.057 1.426) 11.885 1.640 ( 3.348 -2.450 3.347) 5.331 1.835 ( 4.619 -8.978 -1.378) 10.190 2.078 ( 10.950 -3.384 -3.978) 12.132 2.282 ( -1.968 -11.138 5.556) 12.602 2.335 ( 5.935 -3.988 -5.326) 8.916 2.508 ( 0.065 -4.193 2.259) 4.764 2.589 ( 4.090 6.344 -3.933) 8.511 2.651 ( -0.203 3.924 -1.393) 4.169 2.716 ( 1.941 -1.269 2.281) 3.253 2.911 ( -2.712 -0.634 -1.608) 3.216 2.924 ( 0.211 2.108 3.096) 3.752 2.981 ( 2.181 -1.244 -2.751) 3.724 3.119 ( -0.730 -3.272 -0.765) 3.439 3.251 ( -1.356 0.758 2.357) 2.823 3.279 ( -1.637 1.119 3.376) 3.915 3.326 ( -0.956 -3.859 0.224) 3.982 3.413 ( 0.507 0.446 -1.979) 2.091 3.502 ( -2.371 -0.392 2.543) 3.499 3.611 ( 2.769 0.300 -1.893) 3.367 3.748 ( -0.659 -0.478 -5.836) 5.893 3.797 ( -1.892 1.041 1.950) 2.910 3.873 ( -3.000 -5.649 -0.603) 6.425 3.985 ( -0.992 1.534 1.711) 2.503 4.194 ( -4.018 2.084 2.228) 5.044 4.284 ( 0.579 -4.706 -0.900) 4.826 4.327 ( 0.116 1.417 1.405) 1.999 4.530 ( -3.510 7.543 2.989) 8.840 4.670 ( -1.538 -2.185 -3.158) 4.137 4.828 ( 3.349 -1.193 -4.770) 5.950 4.924 ( -0.874 -2.947 -1.180) 3.293 4.995 ( -2.636 -0.876 0.690) 2.862 5.041 ( -1.983 -2.675 6.398) 7.212 5.125 ( -0.803 0.260 0.778) 1.148 5.249 ( -2.237 -2.483 -2.043) 3.917 5.406 ( 4.071 -1.706 -1.035) 4.534 5.525 ( -2.249 -1.818 -1.127) 3.103 5.665 ( -2.287 0.640 -0.330) 2.398 5.808 ( 2.850 -3.900 1.563) 5.077 5.954 ( 1.864 1.986 0.518) 2.772 6.117 ( -4.132 -1.168 -0.477) 4.320 6.480 ( 3.357 0.880 -3.969) 5.272 6.505 ( 0.127 -3.371 6.137) 7.003 6.728 ( 8.411 3.324 -0.140) 9.045 6.927 ( 11.690 -5.168 -3.807) 13.337 7.121 ( -1.580 0.959 4.499) 4.864 7.237 ( 0.943 2.386 1.411) 2.928 7.456 ( 3.464 7.802 -8.279) 11.892 7.646 ( -0.543 3.518 5.122) 6.237 7.668 ( -3.048 0.877 -2.679) 4.152 8.058 ( -4.612 0.230 3.828) 5.999 8.234 ( 2.064 0.446 -4.740) 5.189 8.416 ( -0.667 0.816 -0.634) 1.230 8.496 ( -10.414 1.140 3.291) 10.981 8.604 ( 11.631 5.996 -0.699) 13.104 8.794 ( 3.062 -2.995 -3.086) 5.280 9.052 ( -5.315 8.052 2.676) 10.012 9.314 ( 1.104 -0.354 -0.928) 1.485 9.393 ( -9.436 4.395 2.067) 10.613 9.745 ( -3.101 -0.057 0.357) 3.122 9.877 ( 5.125 6.873 4.619) 9.738 10.077 ( 6.442 3.929 -4.671) 8.874 10.548 ( 0.771 -0.547 0.373) 1.016 10.691 ( -3.736 -2.418 -0.246) 4.457 10.893 ( 3.625 -0.214 0.020) 3.631 11.080 ( 3.560 -6.991 0.224) 7.849 11.152 ( 4.453 -0.169 -1.980) 4.876 11.450 ( 2.241 0.000 4.306) 4.855 11.589 ( 0.069 4.773 -0.202) 4.778 11.666 ( 4.275 9.666 -3.166) 11.033 11.739 ( 11.174 4.262 0.388) 11.966 11.901 ( 0.959 2.806 0.018) 2.965 12.370 ( -0.205 5.403 -1.298) 5.560 12.517 ( -1.329 2.584 1.506) 3.273 12.821 ( 4.719 0.949 0.373) 4.828 12.922 ( 2.374 2.477 -0.381) 3.452 13.439 ( -1.527 -3.964 -0.679) 4.301 13.515 ( 2.669 -4.532 1.093) 5.372 13.792 ( -5.098 6.520 -0.522) 8.292 13.953 ( -4.989 3.795 -0.392) 6.281 15.774 ( -2.672 -0.964 1.350) 3.145 15.930 ( -2.494 2.183 -1.070) 3.482 17.192 ( 0.355 -2.257 -0.297) 2.303 17.630 ( -4.988 -4.742 1.590) 7.064 17.837 ( 5.820 -1.646 -2.235) 6.448 18.265 ( -3.036 10.992 1.031) 11.450 18.311 ( 9.297 7.420 0.830) 11.924 18.948 ( 1.503 6.254 -4.866) 8.065 19.047 ( 4.440 5.219 4.790) 8.361 19.321 ( 3.110 6.102 -0.580) 6.874 19.758 ( -5.836 7.889 -0.360) 9.820 20.047 ( -12.168 -5.662 0.045) 13.421 21.438 ( 10.924 3.996 0.226) 11.634 21.830 ( 4.283 -7.994 0.465) 9.080 22.090 ( -2.167 -5.183 0.695) 5.660 22.171 ( -1.950 3.164 -1.359) 3.957 22.507 ( -0.599 -1.383 4.715) 4.950 22.616 ( 4.491 -5.979 -7.697) 10.731 22.958 ( -3.135 -2.648 2.738) 4.933 23.008 ( -3.472 1.579 1.272) 4.021 23.282 ( -5.686 -6.183 -0.211) 8.403 23.406 ( -3.573 -1.578 -0.695) 3.967 ======================= Grid point 144 (53/102) ======================= q-point: ( 0.55 0.09 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.658 ( -3.739 -0.906 5.592) 6.788 1.751 ( 2.358 -7.921 -2.602) 8.665 1.963 ( 2.949 0.555 -3.356) 4.502 2.174 ( -1.442 2.386 0.539) 2.839 2.292 ( 6.213 1.268 -2.563) 6.839 2.404 ( 1.496 1.303 0.720) 2.110 2.453 ( -1.418 9.487 -0.337) 9.599 2.600 ( 5.581 -2.954 -3.592) 7.265 2.636 ( -6.099 -7.253 3.867) 10.236 2.740 ( -1.991 0.117 3.267) 3.828 2.896 ( 2.564 4.179 2.896) 5.694 2.918 ( -1.408 -2.913 -3.844) 5.025 3.022 ( 2.352 -1.394 -1.030) 2.922 3.140 ( -2.103 2.323 1.849) 3.639 3.218 ( -1.367 -0.199 0.326) 1.420 3.268 ( 2.338 -1.402 -0.492) 2.770 3.325 ( -0.496 2.119 0.480) 2.229 3.422 ( -1.663 -1.433 2.077) 3.022 3.560 ( 4.538 -3.757 -3.791) 7.006 3.653 ( 1.522 -3.244 -1.489) 3.880 3.712 ( -3.129 3.281 -0.259) 4.541 3.764 ( -2.899 0.010 1.078) 3.093 3.930 ( -1.397 -2.832 -2.038) 3.758 4.009 ( 4.154 -2.408 -0.180) 4.805 4.154 ( -5.705 -0.974 1.348) 5.943 4.277 ( -3.685 3.685 1.211) 5.350 4.378 ( 2.160 -3.977 -4.429) 6.333 4.422 ( -2.114 1.541 5.767) 6.333 4.677 ( -2.696 -0.445 1.053) 2.928 4.828 ( 2.206 1.990 -4.475) 5.371 4.944 ( -2.945 -1.315 -2.254) 3.935 5.005 ( -1.852 -1.171 4.140) 4.684 5.122 ( 3.375 -1.816 0.128) 3.835 5.129 ( 1.260 -1.897 3.996) 4.599 5.262 ( 0.630 -0.122 -1.415) 1.553 5.434 ( -1.488 1.731 -0.592) 2.358 5.537 ( -2.431 -4.105 -1.072) 4.890 5.657 ( 2.176 -0.343 -2.705) 3.488 5.862 ( -1.539 0.385 1.776) 2.381 5.933 ( 4.101 0.892 -0.102) 4.198 6.126 ( 0.201 -1.023 1.321) 1.682 6.462 ( 1.418 2.889 1.774) 3.675 6.565 ( -2.169 -2.825 -3.467) 4.971 6.704 ( 4.672 4.490 0.690) 6.516 7.007 ( -5.450 8.916 4.941) 11.559 7.070 ( 3.902 -3.527 -4.837) 7.146 7.217 ( 0.819 0.903 1.453) 1.896 7.376 ( 1.184 3.263 -2.625) 4.352 7.546 ( -7.326 2.273 0.649) 7.699 7.624 ( -4.422 -0.129 0.090) 4.425 8.055 ( -5.260 -1.690 2.148) 5.928 8.211 ( -1.455 1.179 -4.861) 5.209 8.406 ( 0.732 1.883 -3.159) 3.750 8.408 ( -6.306 0.801 2.921) 6.996 8.569 ( 0.299 0.305 5.437) 5.453 8.817 ( -1.165 4.066 -0.265) 4.238 9.032 ( 15.652 -4.563 -4.366) 16.878 9.293 ( -4.173 1.447 1.846) 4.787 9.361 ( 2.881 -3.020 -0.395) 4.192 9.738 ( -2.654 -1.358 -0.567) 3.035 9.819 ( 2.444 4.031 6.220) 7.805 10.028 ( 4.197 4.431 -4.150) 7.380 10.571 ( 1.079 -0.912 0.350) 1.455 10.711 ( -2.549 -2.261 0.612) 3.462 10.913 ( 0.237 -0.172 0.465) 0.550 11.178 ( 4.729 1.067 -2.879) 5.639 11.190 ( 0.337 -1.937 -0.339) 1.995 11.409 ( -0.270 6.674 4.721) 8.179 11.487 ( -6.004 1.490 -1.005) 6.267 11.567 ( 5.028 3.834 -4.547) 7.788 11.742 ( 6.858 3.410 2.156) 7.956 11.874 ( 4.704 2.101 0.098) 5.153 12.293 ( 0.621 2.587 -1.213) 2.924 12.473 ( -2.467 0.961 2.111) 3.386 12.845 ( 3.550 0.086 -1.226) 3.757 12.895 ( 0.153 1.577 0.629) 1.704 13.507 ( -0.590 -3.606 -0.424) 3.679 13.584 ( 1.071 1.187 1.416) 2.136 13.684 ( -1.844 0.356 -0.337) 1.908 13.877 ( -3.014 -0.207 -1.043) 3.196 15.780 ( -2.862 -1.623 2.041) 3.872 15.887 ( -1.277 0.737 -1.775) 2.307 17.234 ( 2.576 -1.287 -0.119) 2.882 17.679 ( -9.043 -6.312 1.930) 11.195 17.873 ( 4.186 0.954 -3.636) 5.626 18.072 ( 3.510 10.385 0.244) 10.965 18.303 ( 3.924 0.402 2.824) 4.851 18.825 ( -1.286 5.674 -4.149) 7.146 19.027 ( 2.595 1.562 3.790) 4.852 19.239 ( 0.817 4.222 -0.776) 4.370 19.664 ( -0.885 -0.548 -0.204) 1.061 20.072 ( -8.956 -5.893 0.152) 10.722 21.430 ( 8.715 4.966 0.376) 10.037 21.934 ( -0.963 0.313 -0.278) 1.050 22.095 ( 0.541 -0.927 -1.682) 1.995 22.186 ( -1.964 -3.983 1.559) 4.706 22.507 ( -0.749 1.320 3.443) 3.762 22.694 ( 2.091 -0.582 -7.901) 8.194 22.983 ( -0.477 -0.448 1.434) 1.576 22.995 ( -1.381 -2.682 4.465) 5.389 23.346 ( -1.787 -3.946 -0.742) 4.395 23.414 ( -1.387 -1.928 -0.730) 2.484 ======================= Grid point 145 (54/102) ======================= q-point: (-0.36 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.625 ( -6.430 3.070 6.520) 9.658 1.806 ( -3.731 13.136 -1.292) 13.717 1.833 ( 0.982 1.280 -2.523) 2.994 2.001 ( -2.326 9.586 -4.289) 10.756 2.261 ( -3.165 7.296 1.286) 8.056 2.342 ( -0.150 4.780 -3.263) 5.789 2.412 ( 2.722 -3.803 1.405) 4.883 2.644 ( -4.678 6.686 -0.081) 8.161 2.670 ( 1.680 -0.759 1.051) 2.122 2.728 ( -3.071 -1.356 2.642) 4.272 2.839 ( -0.654 -0.866 2.642) 2.857 2.941 ( 0.795 1.577 -1.154) 2.110 3.051 ( 3.134 -2.148 -1.604) 4.124 3.161 ( 1.435 -3.307 0.559) 3.648 3.204 ( 3.579 1.351 -2.066) 4.348 3.315 ( -1.686 -3.069 0.532) 3.542 3.334 ( 1.302 -1.378 -0.914) 2.105 3.436 ( -2.546 0.045 2.985) 3.923 3.590 ( 2.599 4.616 0.675) 5.340 3.638 ( 1.752 0.289 -2.896) 3.397 3.731 ( -1.641 -3.806 1.782) 4.511 3.766 ( 3.204 -1.400 -1.601) 3.846 3.954 ( -0.293 0.414 -0.982) 1.105 4.065 ( 3.841 -0.245 -2.577) 4.632 4.142 ( -4.985 -1.217 0.242) 5.137 4.191 ( -6.135 -0.402 0.400) 6.162 4.403 ( -2.159 -1.166 4.325) 4.972 4.470 ( 3.200 -2.745 -3.987) 5.803 4.659 ( -1.789 1.096 4.900) 5.330 4.792 ( 1.353 2.220 -3.154) 4.087 4.924 ( -3.636 0.080 -0.407) 3.660 5.008 ( -0.758 1.434 3.517) 3.873 5.147 ( 1.530 -1.794 -1.595) 2.847 5.206 ( 1.548 -2.718 -1.704) 3.562 5.281 ( 2.738 -0.114 3.740) 4.637 5.358 ( -0.183 3.444 -0.820) 3.545 5.598 ( -0.217 -2.178 -1.390) 2.593 5.688 ( 1.333 -1.851 -3.499) 4.177 5.814 ( 0.756 3.879 0.784) 4.029 5.949 ( -1.266 -0.563 -1.710) 2.201 6.157 ( 2.433 -0.190 6.462) 6.907 6.403 ( -3.088 3.022 0.960) 4.425 6.542 ( -1.654 2.525 -5.348) 6.141 6.635 ( -2.557 4.770 2.089) 5.801 6.837 ( -1.469 5.452 -1.835) 5.938 7.062 ( -9.170 0.436 1.225) 9.262 7.178 ( -4.477 2.619 3.450) 6.229 7.310 ( 1.282 4.550 -3.838) 6.089 7.509 ( -6.267 -3.812 0.765) 7.375 7.629 ( -3.566 -3.162 -0.249) 4.773 8.048 ( -4.979 -2.569 -0.354) 5.614 8.159 ( -2.883 1.418 -2.954) 4.365 8.337 ( -7.211 0.766 6.095) 9.473 8.383 ( 4.219 1.916 -7.826) 9.095 8.648 ( -0.800 -5.451 9.671) 11.130 8.800 ( 5.506 -1.520 -4.845) 7.490 9.206 ( 5.311 -2.478 2.982) 6.575 9.297 ( 6.118 -2.310 -5.088) 8.286 9.465 ( 7.412 -4.246 2.385) 8.869 9.748 ( -0.630 -1.472 -1.665) 2.310 9.793 ( -0.857 1.010 5.433) 5.592 9.984 ( 1.036 0.777 -3.854) 4.066 10.589 ( 2.628 0.968 0.931) 2.951 10.736 ( -0.739 -1.611 0.934) 2.004 10.890 ( -2.551 2.088 -1.399) 3.581 11.123 ( -2.020 6.288 -3.542) 7.494 11.164 ( 0.964 2.627 0.770) 2.902 11.307 ( -4.392 3.584 3.196) 6.507 11.451 ( -5.027 -2.929 1.269) 5.955 11.552 ( 1.859 0.973 -3.278) 3.892 11.730 ( 5.445 2.939 0.886) 6.251 11.902 ( 3.789 -0.852 0.120) 3.886 12.291 ( 1.937 -1.744 -0.874) 2.749 12.459 ( -2.870 -1.207 1.787) 3.590 12.860 ( 2.516 0.583 -2.021) 3.279 12.868 ( -0.483 1.428 1.424) 2.074 13.495 ( -0.348 3.456 0.298) 3.486 13.548 ( -1.483 1.707 -1.083) 2.507 13.737 ( 0.724 -5.448 3.123) 6.322 13.930 ( 0.644 -5.958 -2.666) 6.559 15.797 ( -3.611 -2.074 3.487) 5.431 15.873 ( 0.327 -0.189 -3.163) 3.186 17.279 ( 5.501 -0.356 -0.187) 5.516 17.732 ( -12.118 -7.676 0.795) 14.367 17.855 ( 3.513 3.764 -2.903) 5.911 17.929 ( 2.827 8.378 1.775) 9.018 18.361 ( 4.884 -3.100 1.588) 5.998 18.740 ( -5.704 -0.665 -1.492) 5.933 19.029 ( 1.874 0.822 -0.133) 2.051 19.196 ( -2.299 -0.511 0.450) 2.397 19.749 ( 5.107 -6.518 0.286) 8.285 20.130 ( -5.884 -6.635 -0.329) 8.874 21.393 ( 6.986 5.730 0.504) 9.050 21.822 ( -6.488 6.515 -0.670) 9.219 22.167 ( 3.055 -3.272 -1.245) 4.647 22.224 ( -1.128 -0.896 1.379) 1.994 22.469 ( -1.571 2.670 4.011) 5.068 22.645 ( 0.370 4.065 -7.599) 8.625 22.991 ( 0.535 0.312 5.013) 5.051 23.070 ( 1.138 -4.221 0.195) 4.376 23.391 ( 0.681 -1.617 0.265) 1.774 23.457 ( 1.739 -2.765 -1.815) 3.737 ======================= Grid point 146 (55/102) ======================= q-point: (-0.27 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.425 ( -5.429 14.879 3.974) 16.329 1.475 ( -6.360 17.552 3.176) 18.937 1.690 ( -2.331 12.588 -2.364) 13.019 1.876 ( -4.657 1.619 -4.139) 6.437 2.102 ( -2.974 8.641 1.317) 9.233 2.277 ( 0.660 1.949 -6.566) 6.881 2.394 ( -3.217 12.147 4.914) 13.493 2.438 ( -3.098 1.717 0.407) 3.565 2.650 ( -3.363 6.705 6.454) 9.895 2.724 ( 2.413 1.904 -5.685) 6.463 2.869 ( -1.523 -0.941 0.403) 1.835 2.917 ( -2.474 -1.149 0.726) 2.823 3.101 ( 5.375 0.965 -2.169) 5.875 3.182 ( -2.000 2.013 -0.004) 2.837 3.246 ( 3.370 -2.068 0.199) 3.959 3.328 ( 2.402 1.284 -1.188) 2.971 3.372 ( -0.282 -2.546 -1.468) 2.952 3.422 ( -3.937 -2.157 2.909) 5.349 3.532 ( 5.557 3.692 0.365) 6.682 3.640 ( 1.623 0.727 -2.825) 3.338 3.804 ( 1.209 -2.383 2.109) 3.404 3.835 ( 4.216 -4.094 -2.432) 6.360 3.935 ( 1.953 1.762 1.156) 2.874 4.039 ( -0.355 2.751 1.904) 3.364 4.141 ( -2.468 -3.368 -0.951) 4.282 4.213 ( -4.591 -3.913 0.360) 6.043 4.421 ( -0.544 -1.321 1.840) 2.330 4.521 ( -0.236 -1.977 -4.299) 4.738 4.641 ( -0.897 0.228 5.680) 5.755 4.759 ( 1.846 2.049 -2.031) 3.425 4.901 ( -3.312 -0.767 -1.095) 3.572 4.945 ( -3.322 3.933 0.471) 5.169 5.193 ( 2.869 -0.523 -0.305) 2.932 5.253 ( 1.984 -1.314 0.113) 2.382 5.296 ( 0.128 -1.729 0.990) 1.996 5.363 ( 6.979 -0.124 -0.706) 7.016 5.592 ( 2.470 3.219 -2.354) 4.690 5.681 ( -3.611 2.555 -0.266) 4.432 5.767 ( 0.921 0.745 -0.004) 1.184 5.920 ( -6.012 -0.103 -3.951) 7.194 6.176 ( 0.257 1.548 9.094) 9.228 6.314 ( -4.272 3.751 -1.136) 5.797 6.459 ( -1.650 3.595 -0.751) 4.026 6.538 ( -3.862 3.221 3.353) 6.044 6.753 ( 2.411 3.923 -3.938) 6.058 7.014 ( -11.471 -4.365 0.691) 12.293 7.111 ( -7.374 -0.690 2.679) 7.876 7.206 ( -0.720 5.149 -6.049) 7.977 7.569 ( -3.809 -5.380 2.594) 7.083 7.657 ( -1.687 -2.244 -1.560) 3.212 8.082 ( -5.459 -4.372 -0.035) 6.994 8.127 ( -0.735 -1.132 -2.449) 2.796 8.298 ( -2.505 0.779 3.430) 4.319 8.366 ( 1.411 1.505 -4.136) 4.622 8.761 ( -1.958 -5.936 8.494) 10.546 8.887 ( 6.503 -3.176 -5.783) 9.264 9.252 ( 0.618 -0.866 5.488) 5.591 9.371 ( 5.696 -0.536 -5.673) 8.057 9.621 ( 8.399 -4.793 4.325) 10.593 9.755 ( -2.301 -0.250 2.159) 3.166 9.812 ( -0.751 -3.081 -0.072) 3.172 10.013 ( 0.044 -4.010 -4.935) 6.359 10.569 ( 4.255 4.282 1.377) 6.191 10.748 ( -1.086 1.795 3.006) 3.666 10.809 ( -2.785 1.656 -5.190) 6.118 10.961 ( -5.162 6.156 -1.555) 8.183 11.146 ( 2.762 0.273 0.210) 2.783 11.253 ( -6.456 -1.834 2.826) 7.282 11.491 ( -4.846 -3.448 3.144) 6.728 11.532 ( 0.712 0.833 -3.018) 3.211 11.730 ( 5.950 2.084 -0.428) 6.319 11.920 ( -2.798 -0.026 0.030) 2.798 12.377 ( 2.964 -5.348 -0.400) 6.127 12.487 ( -1.677 -3.786 0.323) 4.153 12.832 ( -2.088 1.553 3.347) 4.239 12.864 ( 3.127 1.060 -3.186) 4.588 13.439 ( -0.078 2.501 1.202) 2.776 13.495 ( -0.228 2.390 -2.096) 3.187 13.878 ( 0.390 -7.931 4.780) 9.269 14.051 ( 2.000 -6.658 -4.185) 8.114 15.808 ( -5.508 -1.700 5.351) 7.865 15.879 ( 1.792 -0.379 -4.988) 5.314 17.327 ( 8.719 1.251 0.505) 8.822 17.732 ( -6.076 1.997 -2.155) 6.749 17.770 ( 3.665 6.874 -2.062) 8.058 17.853 ( -9.794 -3.551 3.905) 11.126 18.521 ( 8.064 -9.182 -0.394) 12.226 18.767 ( -7.936 -7.932 1.088) 11.273 19.033 ( 2.329 -0.243 -1.134) 2.601 19.222 ( -4.419 -4.769 -0.181) 6.504 19.958 ( 7.910 -10.426 1.161) 13.138 20.219 ( -2.921 -6.984 -1.246) 7.672 21.328 ( 5.749 6.938 0.525) 9.026 21.623 ( -9.159 8.895 -0.484) 12.777 22.190 ( 0.864 3.425 0.737) 3.608 22.213 ( 0.118 1.815 0.278) 1.840 22.422 ( -1.270 1.294 3.049) 3.547 22.546 ( 0.418 4.962 -6.322) 8.048 23.007 ( 1.269 -0.053 6.105) 6.236 23.145 ( 1.346 -2.981 -2.294) 3.995 23.417 ( 2.041 0.143 1.830) 2.745 23.518 ( 3.810 -1.876 -3.298) 5.377 ======================= Grid point 147 (56/102) ======================= q-point: (-0.18 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.098 ( -3.697 19.136 1.858) 19.578 1.124 ( -3.836 13.350 -0.040) 13.890 1.413 ( 1.905 17.143 0.073) 17.249 1.703 ( -10.209 9.484 -11.220) 17.891 1.945 ( -3.702 9.428 9.919) 14.176 2.117 ( -0.750 14.360 -1.374) 14.445 2.203 ( -1.201 9.640 7.946) 12.550 2.320 ( -7.477 11.979 5.226) 15.057 2.556 ( 1.507 -4.454 -4.170) 6.285 2.645 ( 2.281 5.673 -8.156) 10.194 2.863 ( 2.523 1.900 -3.554) 4.755 2.901 ( -3.864 1.712 -0.576) 4.266 3.066 ( -3.840 4.525 4.039) 7.179 3.097 ( 1.770 3.061 0.116) 3.538 3.313 ( 2.024 -1.198 2.552) 3.470 3.347 ( 3.318 1.034 -0.980) 3.611 3.387 ( 0.955 -0.110 -0.813) 1.258 3.419 ( -4.329 -0.353 0.291) 4.353 3.556 ( 2.702 -1.277 -0.125) 2.991 3.649 ( 1.457 -2.399 -5.725) 6.376 3.839 ( 2.667 -0.679 -0.357) 2.775 3.898 ( -1.567 1.240 0.169) 2.006 3.951 ( 6.810 -2.965 1.045) 7.501 4.047 ( -0.290 -2.718 1.762) 3.252 4.209 ( 3.758 -1.770 -0.387) 4.172 4.260 ( -6.740 -7.307 3.888) 10.674 4.426 ( 4.410 4.201 -0.107) 6.091 4.528 ( -7.171 -4.800 -1.107) 8.701 4.678 ( -0.291 -2.742 3.925) 4.797 4.735 ( -0.692 1.267 0.537) 1.541 4.863 ( 1.446 1.487 -2.805) 3.489 4.908 ( -3.947 -3.330 -3.845) 6.438 5.183 ( 4.350 3.898 1.178) 5.958 5.274 ( -3.047 0.938 -0.279) 3.200 5.360 ( 5.932 -1.575 0.975) 6.215 5.427 ( 6.416 -0.873 1.363) 6.617 5.529 ( 0.691 3.044 -3.658) 4.809 5.579 ( -5.568 2.026 -0.692) 5.965 5.795 ( -2.403 -3.173 1.691) 4.324 5.858 ( -2.706 2.003 -2.420) 4.146 6.142 ( -0.577 3.909 2.245) 4.544 6.196 ( -3.007 5.821 0.098) 6.553 6.398 ( -0.005 2.496 2.273) 3.376 6.463 ( -6.367 1.459 2.458) 6.979 6.744 ( 5.178 -0.119 0.970) 5.269 7.025 ( -3.896 -2.577 -1.572) 4.928 7.091 ( -8.303 -0.956 -1.800) 8.550 7.151 ( -1.060 -3.840 -3.440) 5.263 7.621 ( -4.658 -2.315 3.416) 6.223 7.683 ( 1.795 -1.157 -4.338) 4.835 8.094 ( -4.851 -1.531 2.703) 5.761 8.175 ( -0.151 -3.441 -4.705) 5.831 8.284 ( -1.807 -0.054 2.979) 3.485 8.336 ( 2.040 0.740 -2.471) 3.289 8.869 ( -3.613 -6.013 7.651) 10.380 8.978 ( 5.323 -3.708 -5.212) 8.322 9.276 ( -0.255 -0.177 4.334) 4.345 9.363 ( 1.631 3.343 -2.131) 4.287 9.756 ( -0.091 0.144 2.854) 2.859 9.773 ( 4.596 -5.361 5.587) 9.004 9.856 ( -4.421 -3.377 -0.383) 5.576 10.056 ( -1.164 -1.201 -5.814) 6.050 10.548 ( 6.452 0.627 -0.422) 6.496 10.656 ( -6.790 1.609 -0.331) 6.986 10.805 ( 0.402 -0.612 -0.312) 0.796 10.866 ( -1.305 0.915 -2.512) 2.975 11.205 ( 6.610 -2.269 -0.293) 6.995 11.269 ( -6.596 -3.869 3.235) 8.303 11.489 ( -3.595 -0.186 2.997) 4.684 11.538 ( -0.311 -0.845 -2.245) 2.419 11.730 ( 5.294 2.781 -0.120) 5.981 11.864 ( -7.706 1.202 -0.699) 7.830 12.496 ( 1.293 -5.471 1.216) 5.752 12.578 ( 0.433 -6.635 -2.536) 7.116 12.798 ( -2.180 1.101 3.825) 4.538 12.853 ( 2.299 1.808 -2.616) 3.924 13.411 ( -0.189 0.893 1.767) 1.989 13.459 ( 0.769 1.348 -2.106) 2.616 14.033 ( -0.575 -7.660 5.356) 9.364 14.175 ( 2.706 -6.104 -5.351) 8.557 15.799 ( -7.691 -1.251 6.581) 10.200 15.888 ( 3.456 0.201 -6.032) 6.955 17.342 ( 8.070 5.315 4.167) 10.523 17.599 ( -3.238 6.590 -2.616) 7.794 17.719 ( 10.320 2.696 -2.768) 11.020 17.860 ( -19.866 -6.977 0.399) 21.060 18.789 ( 8.952 -12.500 -1.004) 15.408 18.906 ( -8.715 -13.733 1.539) 16.337 19.088 ( 4.807 -3.342 2.404) 6.329 19.292 ( -5.623 -7.397 -2.887) 9.730 20.219 ( 4.733 -11.168 2.865) 12.464 20.335 ( 2.728 -6.800 -3.227) 8.007 21.227 ( 4.321 8.528 0.418) 9.570 21.361 ( -10.585 11.480 -0.048) 15.615 22.094 ( 3.242 8.496 -0.191) 9.095 22.126 ( -3.729 5.776 2.459) 7.302 22.421 ( 0.187 -0.229 -0.080) 0.306 22.456 ( 0.384 3.879 -3.045) 4.946 23.035 ( 1.404 -0.198 6.109) 6.272 23.185 ( 0.542 -1.397 -3.465) 3.775 23.418 ( 2.202 2.377 3.008) 4.422 23.555 ( 3.531 0.198 -5.640) 6.657 ======================= Grid point 148 (57/102) ======================= q-point: (-0.09 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.748 ( -0.036 17.283 5.728) 18.208 0.957 ( 2.969 4.113 -12.489) 13.480 1.109 ( 7.237 20.230 8.136) 22.974 1.401 ( -5.832 12.661 -16.177) 21.354 1.641 ( -6.582 29.158 9.814) 31.461 1.721 ( 1.689 16.906 4.535) 17.585 2.093 ( 4.564 7.184 8.098) 11.748 2.149 ( -6.593 1.984 1.967) 7.160 2.558 ( -0.466 3.071 -3.785) 4.896 2.639 ( 3.381 0.142 -7.628) 8.345 2.803 ( -4.503 3.009 0.716) 5.463 2.867 ( 5.886 -0.111 -2.119) 6.257 2.987 ( -2.737 0.308 2.558) 3.759 3.057 ( 1.446 3.492 -0.244) 3.787 3.302 ( 2.558 1.820 1.573) 3.512 3.314 ( -5.860 3.138 1.373) 6.788 3.381 ( 0.400 -0.568 1.082) 1.286 3.431 ( 1.780 -1.125 -2.629) 3.368 3.581 ( -0.339 0.009 2.701) 2.722 3.695 ( -1.022 -2.714 -6.064) 6.722 3.856 ( -1.304 1.272 2.576) 3.155 3.918 ( 2.098 -4.175 -0.068) 4.673 4.025 ( 1.369 1.266 0.817) 2.036 4.103 ( 1.979 -3.584 -4.471) 6.062 4.245 ( -9.666 2.980 -0.288) 10.119 4.274 ( 7.553 -2.171 -1.554) 8.011 4.488 ( 5.135 -6.811 6.540) 10.749 4.574 ( -7.682 -7.181 -1.072) 10.570 4.725 ( -0.713 -1.086 2.788) 3.076 4.739 ( 0.411 -3.125 1.876) 3.668 4.897 ( 0.815 -2.495 -1.772) 3.167 4.947 ( 0.890 -3.319 -4.302) 5.506 5.146 ( 7.340 4.704 -1.983) 8.941 5.154 ( -5.594 6.504 -1.495) 8.708 5.384 ( -5.388 -0.633 7.444) 9.211 5.491 ( 3.905 -0.084 2.262) 4.514 5.525 ( -9.463 -2.444 0.962) 9.821 5.561 ( 4.177 -3.379 -5.547) 7.722 5.807 ( -0.613 1.151 -0.236) 1.325 5.821 ( 3.582 2.199 -1.419) 4.436 6.046 ( 4.802 5.489 1.893) 7.535 6.094 ( -2.868 3.195 -1.918) 4.702 6.360 ( -3.089 2.990 3.599) 5.606 6.409 ( 1.122 1.250 -1.024) 1.967 6.815 ( 5.654 -1.468 5.180) 7.807 6.999 ( -4.527 -0.428 -9.577) 10.602 7.114 ( -2.299 -4.971 6.288) 8.338 7.234 ( 3.413 -3.891 -3.740) 6.386 7.598 ( -2.970 1.354 0.699) 3.338 7.672 ( 2.560 4.080 -6.265) 7.902 8.074 ( -1.638 1.557 3.409) 4.090 8.176 ( 0.442 1.584 -4.244) 4.551 8.338 ( 0.975 -6.624 1.216) 6.805 8.395 ( 2.173 -5.221 -1.139) 5.769 8.933 ( -7.727 -3.235 7.937) 11.540 9.085 ( 5.513 -4.285 -5.443) 8.853 9.256 ( -2.691 3.592 3.883) 5.935 9.313 ( 1.016 0.130 0.724) 1.254 9.722 ( -0.865 4.360 5.869) 7.363 9.848 ( -3.661 1.170 -3.661) 5.308 9.907 ( -3.740 -6.907 9.513) 12.337 10.070 ( 1.137 -4.929 -0.926) 5.143 10.614 ( -4.109 -3.753 0.165) 5.567 10.689 ( 5.700 -8.306 -5.527) 11.490 10.824 ( -1.704 -2.927 2.005) 3.936 10.890 ( 5.242 -1.954 -4.646) 7.271 11.260 ( -2.400 -0.283 4.471) 5.083 11.296 ( -3.003 -1.088 0.113) 3.196 11.471 ( -1.015 0.771 3.737) 3.948 11.548 ( 3.227 -0.219 -2.101) 3.857 11.705 ( 4.357 3.816 1.364) 5.950 11.773 ( -5.396 2.931 -4.359) 7.531 12.622 ( 4.867 -6.520 2.750) 8.589 12.683 ( -3.549 -5.724 -2.420) 7.157 12.791 ( -0.462 -0.976 1.434) 1.795 12.823 ( 0.655 1.671 -1.325) 2.231 13.407 ( -0.728 -0.309 1.681) 1.857 13.443 ( 0.486 0.755 -1.272) 1.557 14.159 ( -1.019 -5.475 4.296) 7.034 14.279 ( 2.243 -4.137 -5.839) 7.499 15.767 ( -10.175 -0.952 7.225) 12.515 15.913 ( 8.150 -0.384 -5.135) 9.640 17.283 ( 3.833 6.880 8.297) 11.440 17.458 ( -2.402 5.546 -4.415) 7.484 17.758 ( -18.206 -1.290 -0.862) 18.272 17.835 ( 15.429 -1.233 -6.069) 16.625 19.061 ( 3.188 -11.359 3.797) 12.394 19.124 ( -3.102 -15.203 -2.187) 15.669 19.261 ( 4.924 -10.688 5.686) 13.070 19.399 ( -3.460 -9.838 -5.683) 11.876 20.376 ( -0.825 -2.565 3.026) 4.051 20.470 ( 3.767 -2.881 -5.257) 7.080 21.070 ( -5.447 9.317 2.696) 11.124 21.114 ( 1.900 8.026 -1.197) 8.334 21.955 ( 2.209 8.314 2.567) 8.977 21.993 ( -1.322 6.557 -0.263) 6.694 22.383 ( -1.811 2.263 0.919) 3.041 22.428 ( 2.088 1.253 -2.619) 3.576 23.051 ( -0.040 0.970 6.419) 6.492 23.192 ( -0.334 -0.313 -4.419) 4.442 23.372 ( 0.713 4.653 3.024) 5.595 23.510 ( -1.203 5.087 -9.485) 10.830 ======================= Grid point 151 (58/102) ======================= q-point: ( 0.18 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.897 ( 15.396 -0.000 9.934) 18.323 0.899 ( 9.136 -0.000 16.685) 19.022 1.047 ( 19.688 -0.000 -9.179) 21.722 1.186 ( 19.909 -0.000 -10.010) 22.284 1.640 ( 35.145 -0.000 7.522) 35.941 1.852 ( 22.026 -0.000 -10.647) 24.465 2.107 ( 14.041 -0.000 -12.616) 18.876 2.323 ( 7.514 -0.000 5.871) 9.536 2.612 ( 9.254 -0.000 -0.308) 9.260 2.648 ( 0.431 -0.000 6.219) 6.234 2.726 ( -13.238 0.000 5.602) 14.375 2.883 ( -8.183 0.000 -2.990) 8.712 2.941 ( 3.277 -0.000 4.876) 5.874 2.966 ( 3.703 -0.000 -2.469) 4.451 3.218 ( -4.963 0.000 -4.410) 6.639 3.371 ( 4.384 -0.000 0.998) 4.496 3.373 ( -6.941 0.000 2.402) 7.345 3.504 ( 4.793 -0.000 -4.293) 6.434 3.609 ( 3.614 -0.000 -8.018) 8.795 3.625 ( 2.506 -0.000 6.918) 7.358 3.812 ( -3.305 0.000 4.755) 5.791 3.850 ( -4.957 0.000 -3.255) 5.930 3.887 ( 0.920 -0.000 3.244) 3.372 3.982 ( -2.537 0.000 -5.385) 5.953 4.365 ( 0.372 -0.000 3.911) 3.928 4.505 ( -10.423 0.000 -1.086) 10.480 4.548 ( -4.945 0.000 2.723) 5.645 4.637 ( 2.349 -0.000 -1.313) 2.691 4.734 ( -8.154 0.000 -0.069) 8.155 4.879 ( -1.755 0.000 -0.013) 1.755 4.915 ( 4.363 -0.000 -2.787) 5.177 4.972 ( 2.765 -0.000 3.611) 4.548 5.057 ( -1.743 0.000 -1.065) 2.042 5.074 ( -6.561 0.000 -3.762) 7.563 5.165 ( 5.568 -0.000 -3.949) 6.826 5.208 ( -8.642 0.000 7.602) 11.509 5.387 ( 1.820 -0.000 -1.117) 2.135 5.452 ( -7.862 0.000 1.285) 7.967 5.835 ( -8.469 0.000 4.740) 9.705 5.896 ( -3.493 0.000 -5.203) 6.267 6.099 ( 8.090 -0.000 -5.914) 10.021 6.207 ( 0.538 -0.000 11.902) 11.914 6.599 ( -0.227 0.000 -2.816) 2.825 6.645 ( 5.470 -0.000 -6.459) 8.463 6.859 ( 5.344 -0.000 4.381) 6.910 6.964 ( 2.073 -0.000 -1.143) 2.367 7.278 ( 8.424 -0.000 -7.038) 10.977 7.493 ( 0.992 -0.000 0.876) 1.324 7.530 ( 6.977 -0.000 7.861) 10.511 7.892 ( 8.554 -0.000 -10.346) 13.425 8.188 ( 9.810 -0.000 -0.092) 9.811 8.214 ( 2.406 -0.000 -1.752) 2.976 8.494 ( -8.387 0.000 4.767) 9.647 8.780 ( -1.177 0.000 -5.516) 5.640 8.852 ( 1.969 -0.000 -7.484) 7.739 9.087 ( -13.976 0.000 7.843) 16.027 9.159 ( 4.811 -0.000 -2.781) 5.557 9.532 ( -7.022 0.000 19.162) 20.408 9.636 ( 6.856 -0.000 -7.042) 9.829 9.976 ( 11.378 -0.000 -6.333) 13.022 10.024 ( 24.473 -0.000 -16.003) 29.241 10.472 ( 1.446 -0.000 11.337) 11.429 10.540 ( -7.724 0.000 -5.130) 9.272 10.652 ( -15.781 0.000 3.850) 16.244 11.005 ( 4.210 -0.000 -3.075) 5.214 11.018 ( -2.810 0.000 1.726) 3.298 11.141 ( 4.924 -0.000 3.030) 5.781 11.386 ( 6.618 -0.000 -1.714) 6.837 11.396 ( 5.748 -0.000 1.934) 6.064 11.622 ( 5.257 -0.000 4.433) 6.876 11.844 ( 11.719 -0.000 3.885) 12.346 12.083 ( -1.230 0.000 4.245) 4.419 12.599 ( -9.461 0.000 3.537) 10.101 12.681 ( -6.503 0.000 -3.947) 7.607 13.191 ( 4.958 -0.000 -3.802) 6.248 13.198 ( 17.367 -0.000 5.651) 18.263 13.397 ( 3.891 -0.000 1.118) 4.048 13.499 ( 5.643 -0.000 -2.259) 6.078 14.184 ( -3.404 0.000 0.039) 3.404 14.203 ( -3.700 0.000 -0.591) 3.747 15.752 ( 1.815 -0.000 -1.473) 2.338 16.357 ( -15.410 0.000 13.535) 20.510 17.141 ( 14.478 -0.000 4.914) 15.290 17.339 ( 4.598 -0.000 -5.218) 6.955 18.038 ( 11.615 -0.000 3.328) 12.082 18.053 ( 11.820 -0.000 -6.941) 13.708 19.037 ( -14.116 0.000 -5.189) 15.039 19.125 ( -17.183 0.000 2.362) 17.345 19.729 ( 3.439 -0.000 -0.117) 3.441 20.033 ( 3.713 -0.000 -1.729) 4.096 20.456 ( 12.623 -0.000 9.900) 16.042 20.575 ( 19.784 -0.000 -18.366) 26.995 20.921 ( -5.803 0.000 1.377) 5.964 21.050 ( 7.246 -0.000 -5.682) 9.208 21.908 ( 0.849 -0.000 3.535) 3.636 21.945 ( 4.822 -0.000 -2.511) 5.436 22.302 ( -7.785 0.000 6.959) 10.442 22.412 ( 0.805 -0.000 -0.546) 0.973 22.481 ( -7.419 0.000 12.131) 14.220 22.870 ( -7.945 0.000 -1.345) 8.058 23.177 ( -4.027 0.000 -0.017) 4.027 23.222 ( -3.101 0.000 -0.706) 3.181 ======================= Grid point 152 (59/102) ======================= q-point: ( 0.27 0.18 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.030 ( 16.448 -5.985 4.709) 18.125 1.200 ( 18.081 -2.631 -7.597) 19.788 1.251 ( 7.152 -17.146 12.622) 22.460 1.388 ( 18.879 -6.630 -9.305) 22.068 1.934 ( 24.341 -2.037 3.324) 24.651 1.982 ( 18.193 -3.120 -1.062) 18.489 2.214 ( 15.185 1.066 -6.103) 16.400 2.406 ( 4.463 -1.804 4.240) 6.415 2.540 ( -2.611 2.076 -1.530) 3.670 2.700 ( 5.456 -2.966 0.809) 6.262 2.778 ( -0.640 -6.366 3.383) 7.237 2.858 ( -7.117 -2.951 -0.988) 7.768 2.981 ( 1.113 -1.617 1.670) 2.578 3.026 ( 4.061 -3.178 -3.949) 6.496 3.178 ( -3.636 -1.163 -3.081) 4.906 3.298 ( -4.767 3.627 3.387) 6.882 3.391 ( 0.665 -0.331 1.203) 1.414 3.482 ( 1.130 3.391 -1.478) 3.868 3.603 ( 1.847 -0.315 -4.057) 4.469 3.701 ( -0.263 4.844 5.183) 7.099 3.748 ( -1.314 -0.548 -0.509) 1.512 3.791 ( -1.674 1.008 -1.747) 2.621 3.929 ( -3.847 -0.706 -3.167) 5.032 3.943 ( -1.602 -1.388 3.041) 3.707 4.248 ( -2.028 9.579 -0.675) 9.815 4.435 ( -2.893 1.901 1.465) 3.759 4.579 ( -6.003 1.559 0.958) 6.276 4.620 ( -2.536 -4.152 1.775) 5.179 4.669 ( -2.909 -0.602 -0.791) 3.074 4.751 ( 0.103 5.274 0.333) 5.286 4.947 ( -1.233 2.174 2.530) 3.556 4.958 ( -7.502 1.730 -2.010) 7.957 5.078 ( 3.413 -0.545 -3.181) 4.697 5.123 ( -4.200 -5.085 -2.613) 7.094 5.188 ( -2.265 -2.589 0.693) 3.509 5.237 ( -0.555 -6.001 -1.063) 6.119 5.354 ( 3.376 1.979 2.212) 4.495 5.445 ( -5.640 -2.538 2.398) 6.633 5.764 ( -8.776 0.364 2.078) 9.026 5.929 ( -0.417 -4.960 -2.593) 5.612 6.077 ( 4.435 4.826 0.104) 6.555 6.277 ( 1.522 -3.372 4.594) 5.898 6.568 ( 4.188 1.370 -1.700) 4.723 6.644 ( -3.712 0.085 -3.985) 5.447 6.896 ( 11.160 2.698 1.298) 11.555 7.017 ( 2.685 -2.859 0.767) 3.996 7.287 ( 4.777 2.460 -1.951) 5.717 7.549 ( -4.621 -4.844 6.305) 9.197 7.604 ( 6.379 -1.621 -2.293) 6.970 7.921 ( 7.643 1.041 -11.117) 13.531 8.212 ( 1.444 1.312 -1.040) 2.211 8.282 ( 8.042 -1.820 -0.816) 8.286 8.442 ( -7.064 0.277 3.857) 8.054 8.669 ( -4.000 7.828 1.396) 8.901 8.809 ( 2.271 3.733 -5.113) 6.726 8.919 ( -13.138 4.257 2.776) 14.087 9.252 ( 2.111 -2.647 -0.608) 3.440 9.519 ( -2.444 2.118 14.757) 15.107 9.620 ( 6.532 3.940 -9.223) 11.969 9.993 ( 11.378 6.151 -2.058) 13.097 10.106 ( 10.383 2.594 -4.754) 11.711 10.404 ( -4.801 6.467 1.609) 8.213 10.515 ( 1.196 -1.159 -1.810) 2.459 10.613 ( -11.048 -4.155 1.545) 11.904 10.914 ( 3.976 6.784 0.027) 7.863 11.024 ( 1.909 3.219 0.640) 3.797 11.204 ( 7.687 0.887 0.628) 7.763 11.311 ( 7.885 3.062 2.387) 8.789 11.589 ( 7.010 -6.676 -0.486) 9.693 11.735 ( 6.499 -4.924 1.342) 8.264 11.881 ( 9.643 4.481 3.015) 11.052 12.083 ( -4.616 -0.765 1.303) 4.857 12.545 ( -8.141 -0.213 2.549) 8.533 12.616 ( -2.781 1.269 -3.551) 4.685 13.165 ( 7.117 5.727 -1.607) 9.276 13.256 ( 11.770 4.864 2.857) 13.052 13.381 ( 3.927 5.394 1.240) 6.786 13.462 ( 4.725 7.116 -0.974) 8.598 14.139 ( -6.113 0.868 -1.372) 6.325 14.170 ( -4.164 1.949 0.152) 4.600 15.750 ( -2.019 -0.276 -0.489) 2.096 16.205 ( -16.081 4.188 4.944) 17.338 17.147 ( 11.241 7.075 1.265) 13.342 17.428 ( 5.437 -3.746 -0.738) 6.644 17.806 ( 13.405 10.067 -0.922) 16.789 18.445 ( 5.466 -8.866 3.136) 10.877 18.872 ( -10.580 3.744 -2.538) 11.507 19.167 ( -16.114 -12.239 0.710) 20.248 19.643 ( 2.927 11.280 0.525) 11.665 19.888 ( -2.947 11.415 -0.819) 11.818 20.138 ( 18.381 29.473 -5.704) 35.201 20.652 ( -3.717 16.840 0.199) 17.246 20.998 ( 7.543 -19.987 1.722) 21.433 21.261 ( 8.001 -10.295 -4.765) 13.882 21.933 ( 2.363 -2.867 2.579) 4.523 22.031 ( 4.787 -3.431 0.634) 5.923 22.332 ( -1.894 -1.937 -0.537) 2.762 22.407 ( -1.964 -2.436 1.237) 3.365 22.599 ( -7.634 -13.288 3.643) 15.752 22.873 ( -7.900 -5.810 1.355) 9.900 23.137 ( -5.002 0.771 0.290) 5.069 23.237 ( -3.996 -4.273 -1.132) 5.959 ======================= Grid point 154 (60/102) ======================= q-point: ( 0.36 0.18 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.308 ( 13.293 -6.369 -2.614) 14.970 1.334 ( 15.699 -5.195 -3.198) 16.842 1.608 ( 11.433 -6.976 -4.551) 14.145 1.661 ( 2.538 -18.370 10.621) 21.371 2.044 ( 6.271 -0.537 4.011) 7.463 2.184 ( 6.022 2.405 1.230) 6.600 2.287 ( 14.856 -7.191 -5.916) 17.533 2.462 ( 6.917 -4.162 2.655) 8.498 2.685 ( 10.366 -7.379 -4.802) 13.600 2.764 ( 0.507 -1.018 0.489) 1.238 2.827 ( -6.370 -1.397 1.224) 6.635 2.903 ( 3.425 -4.006 -4.360) 6.840 3.009 ( -0.191 -0.607 -2.657) 2.733 3.106 ( -0.685 -4.239 0.856) 4.379 3.184 ( -2.832 5.528 5.290) 8.159 3.209 ( -0.587 -2.873 1.000) 3.098 3.413 ( -0.619 0.921 -1.382) 1.773 3.429 ( -3.898 -1.387 4.231) 5.918 3.515 ( -2.459 9.264 1.670) 9.729 3.629 ( 5.257 -0.232 -4.005) 6.613 3.753 ( -4.021 -0.057 -0.984) 4.140 3.797 ( 1.648 -0.567 -2.284) 2.873 3.844 ( -5.456 3.469 1.100) 6.558 4.013 ( -1.530 -4.288 1.938) 4.948 4.100 ( 2.081 4.330 -2.962) 5.644 4.358 ( -3.418 4.348 1.515) 5.734 4.464 ( -4.136 4.402 0.275) 6.047 4.654 ( -4.396 0.914 1.326) 4.681 4.677 ( 1.203 -3.651 -0.923) 3.953 4.794 ( 1.349 -2.523 0.999) 3.031 4.854 ( -4.038 2.647 1.784) 5.147 4.899 ( -6.438 -0.820 -0.524) 6.511 5.018 ( -1.198 2.578 -2.391) 3.715 5.149 ( -5.471 -1.218 0.051) 5.605 5.172 ( -0.685 1.073 -2.306) 2.634 5.368 ( -0.724 -6.731 -0.683) 6.804 5.396 ( 2.534 -0.519 2.161) 3.370 5.508 ( -1.177 -7.894 1.538) 8.128 5.719 ( -5.944 -1.288 1.649) 6.301 5.998 ( 6.706 1.200 -0.364) 6.822 6.053 ( -1.783 -2.078 -1.261) 3.014 6.346 ( -0.372 -3.110 2.491) 4.002 6.581 ( 3.512 2.311 -1.176) 4.366 6.656 ( 4.354 -4.322 -1.088) 6.230 6.932 ( 10.414 2.398 -1.166) 10.750 7.086 ( 2.579 -1.826 2.660) 4.130 7.273 ( 1.990 1.569 0.051) 2.535 7.608 ( -4.459 -4.021 4.912) 7.757 7.654 ( 1.512 -1.039 -3.252) 3.734 7.884 ( 6.163 7.359 -10.346) 14.113 8.172 ( -2.178 2.793 1.278) 3.765 8.319 ( 3.216 3.996 -0.992) 5.224 8.390 ( -3.631 0.091 0.028) 3.632 8.545 ( -3.655 2.158 3.379) 5.425 8.767 ( -6.383 2.215 -1.789) 6.989 8.774 ( 0.711 2.082 0.545) 2.267 9.249 ( -1.083 2.746 -0.375) 2.976 9.471 ( 0.057 5.481 8.930) 10.477 9.544 ( -1.662 4.888 -5.796) 7.762 9.905 ( 0.817 8.209 4.715) 9.502 10.134 ( 9.349 1.409 -6.095) 11.249 10.233 ( -0.504 9.156 2.597) 9.530 10.559 ( 4.157 -1.618 -3.977) 5.976 10.596 ( -8.220 -1.155 1.660) 8.465 10.885 ( 6.518 -0.036 -0.461) 6.535 10.976 ( 5.211 4.224 1.078) 6.794 11.212 ( 8.500 3.142 -2.200) 9.326 11.388 ( 5.854 -1.901 5.371) 8.169 11.724 ( 8.509 -1.637 -0.805) 8.702 11.836 ( 9.451 1.913 -1.996) 9.847 11.892 ( 6.159 0.474 2.898) 6.823 12.025 ( -4.315 2.982 0.061) 5.246 12.490 ( -5.790 0.807 0.562) 5.873 12.589 ( 0.065 0.604 -1.360) 1.490 13.087 ( 10.603 10.612 0.290) 15.004 13.194 ( 15.169 13.306 0.207) 20.179 13.357 ( -2.267 -1.190 -0.164) 2.565 13.364 ( -2.141 0.862 0.259) 2.322 14.045 ( -6.960 5.338 -0.745) 8.803 14.069 ( -5.903 2.860 -0.418) 6.572 15.737 ( -4.081 -1.012 0.053) 4.205 16.034 ( -11.425 3.274 1.007) 11.927 17.137 ( 6.751 1.675 -0.091) 6.957 17.511 ( 2.044 -2.250 0.358) 3.061 17.817 ( 13.894 1.995 -0.558) 14.048 18.498 ( -0.267 3.768 4.191) 5.642 18.722 ( -5.400 5.954 -2.695) 8.478 19.190 ( -7.374 1.919 -0.017) 7.620 19.435 ( 4.537 13.525 4.000) 14.816 19.717 ( 0.094 8.607 -0.192) 8.610 19.768 ( 0.163 11.641 -5.941) 13.071 20.312 ( -1.972 18.047 -0.438) 18.159 21.381 ( 4.208 -16.703 3.310) 17.540 21.471 ( 10.051 -5.781 -2.520) 11.865 21.972 ( 3.668 0.708 -1.232) 3.934 22.190 ( 3.426 -7.931 3.142) 9.193 22.322 ( -1.141 -0.292 -1.253) 1.720 22.466 ( -1.559 -4.234 -0.307) 4.522 22.768 ( -5.220 -9.453 -3.142) 11.247 22.951 ( -8.852 -9.330 4.240) 13.542 23.077 ( -5.536 1.490 1.234) 5.864 23.288 ( -5.018 -4.851 -1.447) 7.128 ======================= Grid point 155 (61/102) ======================= q-point: ( 0.45 0.18 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.432 ( 6.575 -4.786 0.664) 8.160 1.621 ( 11.422 -7.791 -0.358) 13.831 1.727 ( 3.280 -3.979 -3.267) 6.105 2.004 ( -3.725 -16.599 8.077) 18.832 2.106 ( 9.130 -1.636 -1.588) 9.411 2.266 ( 5.461 -5.904 -1.700) 8.220 2.429 ( 2.189 -3.466 -1.228) 4.280 2.659 ( 9.309 -5.566 -1.206) 10.913 2.724 ( -0.238 2.225 -0.271) 2.254 2.759 ( -1.731 4.172 -3.489) 5.707 2.848 ( -1.841 -2.913 -0.139) 3.448 2.974 ( 0.623 1.622 0.804) 1.914 3.014 ( 8.464 0.089 -2.704) 8.885 3.093 ( 2.063 0.053 1.650) 2.642 3.174 ( -3.057 -3.763 1.246) 5.006 3.258 ( -0.664 -2.375 1.509) 2.891 3.345 ( -3.314 5.276 3.897) 7.349 3.394 ( -3.250 -0.796 0.988) 3.488 3.469 ( -2.660 -1.633 1.831) 3.619 3.660 ( 4.745 1.476 -2.523) 5.573 3.726 ( -3.349 -1.345 -1.970) 4.112 3.770 ( -4.636 -1.224 0.664) 4.841 3.820 ( 4.534 1.316 -3.467) 5.858 3.992 ( -1.065 2.019 -0.022) 2.282 4.163 ( -0.690 -6.793 0.899) 6.887 4.240 ( -5.251 4.997 1.720) 7.450 4.375 ( -1.886 3.513 0.042) 3.987 4.621 ( -3.986 1.906 2.382) 5.019 4.650 ( -5.047 5.428 -0.096) 7.412 4.759 ( 0.611 -4.178 -3.864) 5.723 4.884 ( -1.621 -2.656 -1.988) 3.692 4.945 ( 0.284 -3.856 0.832) 3.955 5.005 ( 0.776 -1.726 3.152) 3.677 5.120 ( -1.698 -0.285 0.423) 1.773 5.161 ( -3.332 -1.772 -2.176) 4.357 5.413 ( -1.046 -0.622 1.560) 1.979 5.460 ( -1.371 -4.013 -0.347) 4.255 5.630 ( 1.893 -3.615 -1.378) 4.308 5.746 ( -0.940 -4.176 2.175) 4.801 6.020 ( 6.742 1.354 1.128) 6.968 6.061 ( -3.602 -0.793 -2.145) 4.267 6.411 ( 0.000 -4.154 -1.629) 4.462 6.574 ( 3.947 1.804 5.578) 7.068 6.786 ( 7.562 -3.283 -2.939) 8.752 6.966 ( 8.736 0.605 -2.682) 9.158 7.125 ( 0.949 0.146 3.504) 3.633 7.261 ( 0.284 0.595 1.375) 1.525 7.624 ( -3.146 0.511 -4.532) 5.541 7.647 ( -2.335 3.215 0.420) 3.996 7.721 ( 1.485 8.344 -0.928) 8.526 8.081 ( -4.187 4.560 1.962) 6.495 8.251 ( 0.824 2.544 -4.295) 5.060 8.379 ( -4.498 -0.692 1.777) 4.885 8.480 ( -5.461 2.571 -0.003) 6.036 8.682 ( -5.867 -0.169 -0.318) 5.878 8.827 ( 8.719 -1.168 -0.947) 8.848 9.156 ( -0.575 6.116 -0.086) 6.144 9.370 ( -5.414 4.498 7.010) 9.933 9.412 ( -0.899 6.312 -2.722) 6.933 9.771 ( -2.367 5.627 0.038) 6.104 10.064 ( 3.477 8.143 4.777) 10.061 10.192 ( 9.575 2.568 -4.731) 10.985 10.555 ( -2.818 0.613 2.494) 3.812 10.604 ( -1.658 -2.749 -3.254) 4.571 10.956 ( 5.470 1.414 0.572) 5.679 10.995 ( 7.274 -3.833 -0.784) 8.259 11.222 ( 8.140 2.171 -2.290) 8.730 11.448 ( 0.357 -0.755 4.129) 4.213 11.734 ( 4.520 6.825 -0.598) 8.208 11.821 ( 5.757 5.568 0.980) 8.069 11.923 ( 5.828 1.104 -1.126) 6.038 11.965 ( 7.312 4.406 -0.118) 8.538 12.429 ( -3.054 2.314 -0.611) 3.880 12.561 ( -1.319 2.493 0.450) 2.857 12.964 ( 9.020 9.511 0.040) 13.108 13.059 ( 7.298 10.099 0.110) 12.461 13.350 ( -3.502 -3.493 0.047) 4.946 13.440 ( 1.318 -5.465 0.041) 5.622 13.874 ( -6.120 7.076 -0.141) 9.356 13.968 ( -6.609 3.044 -0.886) 7.331 15.729 ( -4.196 -1.467 0.383) 4.461 15.924 ( -7.940 1.192 0.137) 8.031 17.174 ( 4.642 -0.817 -0.185) 4.717 17.543 ( -3.094 -1.705 0.705) 3.602 17.891 ( 11.876 1.058 -1.294) 11.993 18.374 ( -4.599 7.787 3.276) 9.619 18.570 ( 3.554 8.915 -2.000) 9.803 19.063 ( -1.124 6.270 -3.438) 7.238 19.258 ( 6.210 11.594 7.113) 14.952 19.493 ( 5.749 11.548 -3.277) 13.309 19.750 ( -14.139 -7.107 -0.691) 15.839 19.984 ( -4.193 14.249 -0.527) 14.863 21.594 ( 12.386 1.164 -0.859) 12.470 21.677 ( 2.463 -12.350 3.316) 13.022 21.998 ( 1.338 -2.571 -2.336) 3.722 22.220 ( -1.399 3.514 -0.789) 3.863 22.427 ( -0.706 -7.884 4.517) 9.113 22.532 ( 1.439 -4.436 -4.392) 6.406 22.865 ( -1.461 -5.523 -2.251) 6.140 23.010 ( -6.109 1.213 2.386) 6.670 23.083 ( -6.305 -9.776 2.349) 11.867 23.322 ( -5.115 -3.587 -1.356) 6.393 ======================= Grid point 156 (62/102) ======================= q-point: ( 0.55 0.18 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.584 ( 0.057 -7.218 3.536) 8.038 1.679 ( 2.688 -0.118 -2.759) 3.854 1.921 ( 6.865 -7.710 -1.825) 10.484 2.160 ( -1.138 -2.917 -0.880) 3.253 2.260 ( 1.135 -7.975 3.984) 8.986 2.414 ( 0.907 -5.628 -0.788) 5.755 2.489 ( 1.298 -2.555 -0.479) 2.906 2.627 ( -0.559 5.476 -2.241) 5.943 2.640 ( 3.920 6.467 -3.312) 8.255 2.764 ( 1.006 1.355 5.532) 5.784 2.846 ( -1.570 -0.735 -4.701) 5.010 2.930 ( -0.997 -1.011 4.935) 5.135 3.072 ( 8.286 2.445 -1.890) 8.844 3.144 ( 2.492 -2.256 -1.283) 3.598 3.230 ( -5.317 2.822 2.953) 6.705 3.253 ( 1.591 -1.035 -0.470) 1.955 3.313 ( -0.687 -3.129 -0.096) 3.205 3.389 ( -5.588 -1.150 3.415) 6.649 3.498 ( 3.054 -3.824 -3.823) 6.210 3.632 ( -0.708 1.297 -0.331) 1.514 3.731 ( -1.050 -1.028 -1.828) 2.345 3.772 ( 1.590 4.789 -1.015) 5.147 3.827 ( -2.359 -6.208 0.933) 6.706 4.005 ( 1.490 -2.671 1.233) 3.297 4.125 ( -5.093 3.340 0.925) 6.160 4.274 ( -2.218 -3.590 -0.133) 4.222 4.318 ( -0.603 -0.962 -1.603) 1.964 4.456 ( -7.972 5.681 5.150) 11.060 4.642 ( -0.862 -0.983 -1.184) 1.764 4.804 ( -3.141 -2.890 -4.300) 6.059 4.917 ( 0.429 -1.069 -1.627) 1.994 4.995 ( 2.184 -0.693 2.537) 3.419 5.089 ( 2.829 -4.031 3.878) 6.268 5.133 ( 1.013 -0.302 -0.191) 1.074 5.203 ( -1.401 -5.576 -1.484) 5.938 5.412 ( -2.880 -1.461 0.106) 3.231 5.482 ( -2.345 0.032 -0.256) 2.359 5.675 ( 4.173 0.052 -3.250) 5.290 5.819 ( -2.167 -3.509 2.462) 4.803 6.002 ( 1.228 2.856 -0.690) 3.184 6.096 ( 3.638 -2.690 0.962) 4.626 6.477 ( 0.193 -3.880 -5.573) 6.794 6.573 ( 3.503 4.256 8.065) 9.769 6.820 ( 4.018 3.378 -1.289) 5.405 7.042 ( 5.702 -2.368 -5.394) 8.198 7.095 ( -3.954 3.136 3.367) 6.066 7.268 ( 2.204 1.132 4.888) 5.480 7.453 ( 1.747 8.726 -6.655) 11.112 7.578 ( -9.066 2.678 2.962) 9.907 7.616 ( -3.022 4.868 -0.627) 5.764 8.010 ( -3.366 0.213 1.913) 3.877 8.196 ( -3.507 1.466 -7.124) 8.075 8.357 ( -6.026 -0.535 3.644) 7.062 8.420 ( -0.612 0.201 0.027) 0.644 8.632 ( -0.914 3.524 0.714) 3.710 8.867 ( -3.108 1.849 0.198) 3.622 9.101 ( 13.107 1.131 -3.854) 13.709 9.280 ( -7.011 1.024 3.687) 7.987 9.350 ( 3.844 0.902 0.643) 4.001 9.686 ( -4.466 0.651 -0.639) 4.558 9.973 ( 4.056 6.855 6.497) 10.279 10.171 ( 8.459 6.191 -5.428) 11.805 10.552 ( -1.054 -1.451 1.355) 2.248 10.630 ( -3.524 -3.039 -0.854) 4.731 10.963 ( 5.910 2.440 0.343) 6.403 11.123 ( 3.386 -4.683 -0.889) 5.846 11.242 ( 6.378 1.259 -2.343) 6.910 11.434 ( -6.589 0.514 2.105) 6.936 11.593 ( 0.355 9.579 3.524) 10.212 11.722 ( 5.018 8.557 -4.331) 10.824 11.917 ( 11.332 7.135 0.221) 13.393 11.965 ( 6.963 2.055 0.523) 7.278 12.357 ( -0.307 3.772 -1.092) 3.939 12.487 ( -3.963 2.855 1.557) 5.127 12.904 ( 5.843 3.556 -0.528) 6.861 12.956 ( 1.899 5.009 0.377) 5.370 13.415 ( -1.437 -5.201 1.280) 5.546 13.563 ( 3.029 -5.852 -0.477) 6.607 13.714 ( -4.695 5.885 -0.115) 7.529 13.863 ( -6.018 2.601 -1.371) 6.698 15.731 ( -3.187 -1.710 1.301) 3.843 15.868 ( -4.796 -0.205 -0.799) 4.866 17.230 ( 4.420 -1.576 -0.102) 4.694 17.541 ( -7.241 -2.539 0.671) 7.703 17.937 ( 8.655 2.018 -2.570) 9.252 18.206 ( -5.273 6.459 2.905) 8.830 18.457 ( 8.843 8.321 0.464) 12.151 18.925 ( -2.034 7.023 -6.350) 9.684 19.147 ( 5.305 7.339 7.675) 11.870 19.371 ( 4.793 7.442 -2.671) 9.246 19.674 ( -5.319 4.640 0.170) 7.060 19.860 ( -11.998 -6.652 -0.185) 13.720 21.617 ( 11.914 5.805 0.489) 13.262 21.877 ( 1.076 -6.919 1.626) 7.188 22.068 ( -0.512 -3.963 -1.248) 4.186 22.130 ( -2.403 2.522 -2.066) 4.050 22.503 ( -3.178 -1.788 6.422) 7.385 22.643 ( 3.967 -5.184 -8.781) 10.942 22.941 ( -1.008 -3.256 2.930) 4.495 22.967 ( -2.552 -0.612 1.234) 2.900 23.213 ( -3.272 -8.089 0.527) 8.742 23.344 ( -4.038 -3.235 -1.094) 5.289 ======================= Grid point 157 (63/102) ======================= q-point: (-0.36 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.628 ( -2.673 0.337 4.645) 5.370 1.765 ( 2.098 -5.389 -5.903) 8.264 1.991 ( 1.661 4.488 0.024) 4.786 2.121 ( -3.500 5.019 -1.627) 6.332 2.362 ( -0.467 -0.521 4.507) 4.561 2.427 ( 2.709 8.556 0.716) 9.003 2.468 ( 3.954 3.054 -4.177) 6.512 2.549 ( -6.377 -4.026 2.923) 8.088 2.641 ( 1.524 -2.620 -1.308) 3.301 2.718 ( -2.560 1.690 1.614) 3.466 2.929 ( 5.251 -5.417 -2.893) 8.080 2.941 ( 1.500 4.493 1.666) 5.022 3.069 ( -0.537 4.658 0.512) 4.717 3.099 ( -1.228 -1.346 2.707) 3.263 3.203 ( 0.530 -2.899 -0.840) 3.065 3.283 ( 0.102 -0.545 -1.871) 1.952 3.333 ( -0.104 0.363 0.435) 0.576 3.392 ( -1.825 -2.766 -0.239) 3.323 3.599 ( 0.647 -2.450 -0.454) 2.574 3.640 ( -0.611 -2.930 -3.743) 4.792 3.699 ( 0.146 1.354 4.059) 4.282 3.762 ( 3.866 -0.786 -3.304) 5.146 3.921 ( 0.741 -3.955 -0.362) 4.041 4.061 ( -7.012 -1.520 0.672) 7.207 4.071 ( 4.755 -1.018 -1.341) 5.044 4.205 ( -6.076 4.211 1.808) 7.610 4.365 ( -5.745 -1.387 7.019) 9.176 4.418 ( 3.045 -4.079 -5.517) 7.507 4.648 ( -1.809 -0.708 2.676) 3.307 4.807 ( -2.661 -1.246 -4.219) 5.142 4.918 ( 1.599 1.350 -0.218) 2.104 5.028 ( 1.301 -0.438 2.680) 3.011 5.132 ( 0.029 -0.089 -1.146) 1.150 5.160 ( -1.535 -2.423 0.261) 2.881 5.296 ( 3.210 -2.407 5.168) 6.543 5.413 ( 0.406 2.685 -1.966) 3.352 5.489 ( -2.397 -6.233 -1.268) 6.797 5.675 ( 1.374 0.948 -6.084) 6.308 5.848 ( -2.022 -0.703 3.846) 4.402 5.964 ( 0.880 2.134 -2.510) 3.410 6.178 ( 4.516 -1.862 4.872) 6.899 6.485 ( -2.875 5.465 2.637) 6.714 6.538 ( 4.641 -0.878 -5.928) 7.580 6.733 ( -1.230 7.167 -0.496) 7.289 6.950 ( -3.944 8.185 4.272) 10.040 7.059 ( -1.984 2.404 -3.440) 4.642 7.232 ( -0.743 5.069 4.695) 6.949 7.402 ( 3.064 0.610 -0.848) 3.237 7.435 ( -5.046 3.748 -2.062) 6.615 7.546 ( -5.161 -0.877 -0.205) 5.239 7.998 ( -2.530 -0.652 0.287) 2.629 8.136 ( -4.050 0.236 -5.579) 6.898 8.314 ( -5.465 1.156 5.020) 7.510 8.433 ( 2.907 0.810 -6.602) 7.259 8.593 ( -1.001 -0.719 9.038) 9.122 8.806 ( 1.090 0.357 -4.230) 4.383 9.198 ( 1.302 -1.866 3.322) 4.026 9.282 ( 4.913 -2.827 -4.611) 7.306 9.432 ( 6.985 -4.834 1.956) 8.717 9.674 ( -5.741 -3.254 1.366) 6.738 9.893 ( 3.303 6.499 4.974) 8.826 10.081 ( 5.286 7.425 -5.991) 10.907 10.590 ( 0.781 -2.208 1.113) 2.593 10.664 ( -3.663 -3.829 0.625) 5.336 10.950 ( 4.815 3.841 0.042) 6.159 11.167 ( -1.770 1.469 -2.911) 3.710 11.244 ( 3.298 2.686 -0.715) 4.313 11.360 ( -7.920 1.323 1.876) 8.246 11.438 ( -0.130 7.034 4.379) 8.287 11.608 ( 3.168 5.517 -6.835) 9.338 11.865 ( 6.861 6.085 3.433) 9.792 11.965 ( 6.145 3.361 -0.584) 7.028 12.308 ( 2.562 1.557 -1.113) 3.198 12.426 ( -4.887 0.421 1.458) 5.117 12.897 ( 3.726 1.476 -1.567) 4.303 12.899 ( -0.316 2.373 1.362) 2.754 13.504 ( 0.510 -3.774 0.886) 3.910 13.586 ( -1.738 4.783 1.343) 5.263 13.672 ( -0.067 -3.118 0.793) 3.218 13.819 ( -2.811 -3.735 -3.574) 5.885 15.748 ( -2.410 -1.748 2.834) 4.110 15.852 ( -1.814 -1.037 -2.289) 3.099 17.298 ( 5.728 -1.834 -0.070) 6.015 17.540 ( -9.464 -4.358 0.235) 10.422 17.942 ( 6.649 2.835 -2.697) 7.715 18.076 ( -3.238 5.715 2.050) 6.881 18.410 ( 7.412 3.835 3.239) 8.952 18.756 ( -4.693 6.696 -5.505) 9.858 19.095 ( 3.666 3.813 3.893) 6.568 19.240 ( -0.384 7.090 -1.214) 7.203 19.675 ( 2.815 -5.060 0.341) 5.800 19.920 ( -10.333 -8.645 -0.249) 13.475 21.583 ( 10.471 7.036 0.896) 12.648 21.877 ( -5.890 4.606 -0.712) 7.511 22.118 ( 2.821 -4.211 -1.504) 5.287 22.163 ( -1.447 -4.080 0.318) 4.340 22.501 ( -2.707 0.923 5.844) 6.506 22.683 ( 1.866 0.909 -9.425) 9.651 22.992 ( -0.850 -2.650 4.161) 5.006 23.001 ( 0.525 -2.753 1.845) 3.355 23.325 ( -0.599 -5.582 -0.120) 5.616 23.387 ( -1.527 -4.359 -1.375) 4.819 ======================= Grid point 158 (64/102) ======================= q-point: (-0.27 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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 ( -3.122 4.712 7.560) 9.439 1.747 ( -2.749 12.303 -1.203) 12.664 1.846 ( 0.859 6.171 -0.192) 6.233 1.954 ( -0.319 9.817 -6.833) 11.965 2.228 ( -2.669 7.099 2.506) 7.988 2.313 ( 0.801 5.588 -4.451) 7.189 2.485 ( 4.568 2.343 0.205) 5.139 2.564 ( -4.270 4.347 -0.843) 6.152 2.676 ( -5.176 -2.755 5.866) 8.294 2.711 ( 2.944 -1.821 -1.059) 3.620 2.852 ( 0.390 2.786 3.311) 4.345 2.930 ( -1.353 3.097 -0.847) 3.485 3.106 ( 4.826 -3.265 -2.844) 6.483 3.151 ( -2.425 -2.179 -0.722) 3.339 3.267 ( 2.222 -3.288 1.371) 4.199 3.310 ( 1.572 -1.747 -1.092) 2.591 3.355 ( 3.322 -0.680 -1.755) 3.818 3.381 ( -4.066 0.593 1.256) 4.297 3.601 ( -3.841 0.403 3.613) 5.289 3.655 ( 3.003 0.183 -1.943) 3.581 3.748 ( 0.443 -3.184 1.019) 3.372 3.814 ( 4.844 -1.987 -4.194) 6.708 3.965 ( 2.086 -0.009 0.484) 2.141 4.055 ( -5.879 -3.200 0.360) 6.703 4.083 ( -3.630 2.997 1.147) 4.845 4.133 ( 2.159 -1.711 -3.594) 4.529 4.374 ( -4.786 -1.675 6.741) 8.435 4.486 ( 2.914 -2.028 -5.738) 6.747 4.654 ( -1.549 -0.166 6.142) 6.336 4.805 ( 1.429 -0.523 -5.417) 5.626 4.895 ( 1.540 2.703 1.614) 3.505 5.000 ( -2.327 3.487 -0.608) 4.236 5.165 ( -0.004 -3.396 0.321) 3.411 5.189 ( -1.125 -2.569 -0.842) 2.928 5.329 ( 1.622 1.706 5.592) 6.068 5.404 ( 4.667 -1.140 -1.048) 4.917 5.573 ( -0.840 -2.622 -1.342) 3.063 5.661 ( -2.699 -2.131 -6.395) 7.261 5.822 ( -1.565 3.123 3.295) 4.803 5.910 ( -0.176 3.672 -4.048) 5.468 6.231 ( 1.597 0.977 9.043) 9.235 6.368 ( -1.033 4.410 -0.688) 4.582 6.528 ( -0.477 4.723 -0.129) 4.749 6.600 ( -0.858 3.946 -1.873) 4.452 6.848 ( 4.523 2.888 -3.555) 6.437 6.906 ( -10.156 5.780 1.440) 11.774 7.137 ( -2.820 5.041 5.574) 8.027 7.301 ( 0.487 6.538 -6.134) 8.978 7.470 ( -0.283 -4.225 3.152) 5.278 7.571 ( -2.895 -4.425 -1.568) 5.516 8.007 ( -0.505 -1.644 -0.023) 1.720 8.101 ( -1.931 -0.326 -4.357) 4.777 8.274 ( -5.140 -0.127 6.428) 8.231 8.411 ( 4.250 1.995 -8.191) 9.441 8.665 ( -2.506 -4.871 10.573) 11.908 8.855 ( 4.699 -3.307 -6.766) 8.877 9.235 ( -1.794 -2.218 5.943) 6.592 9.363 ( 4.132 -2.849 -6.356) 8.099 9.593 ( 5.878 -5.357 3.686) 8.766 9.709 ( -4.652 -3.940 2.051) 6.432 9.822 ( 0.907 3.598 3.522) 5.116 9.990 ( 3.504 3.375 -7.515) 8.952 10.634 ( 1.535 -0.788 2.682) 3.189 10.719 ( -2.470 -4.421 0.053) 5.064 10.878 ( 2.992 7.613 0.171) 8.182 11.037 ( -6.439 6.932 -3.692) 10.156 11.194 ( 2.284 3.592 1.250) 4.437 11.263 ( -2.237 4.050 -0.559) 4.661 11.416 ( -1.299 -2.059 4.217) 4.869 11.545 ( 0.435 1.492 -5.194) 5.421 11.828 ( 4.005 3.335 3.487) 6.271 11.931 ( 0.599 3.047 -1.646) 3.515 12.340 ( 3.859 -1.928 0.236) 4.321 12.411 ( -3.195 -2.384 -0.293) 3.997 12.857 ( -1.702 1.994 2.707) 3.768 12.897 ( 2.657 0.871 -2.422) 3.699 13.496 ( -0.330 3.651 1.020) 3.805 13.529 ( 0.231 1.749 -1.928) 2.613 13.752 ( -1.414 -6.649 6.182) 9.189 13.919 ( 0.781 -7.534 -5.776) 9.526 15.764 ( -2.770 -1.141 4.535) 5.435 15.864 ( 0.814 -1.358 -3.975) 4.278 17.384 ( 8.268 -1.855 0.333) 8.480 17.555 ( -10.907 -5.602 -0.741) 12.284 17.911 ( 4.268 5.575 -0.994) 7.091 17.942 ( -1.179 7.352 0.715) 7.480 18.457 ( 4.583 -3.471 4.023) 7.017 18.633 ( -5.203 0.303 -3.737) 6.414 19.076 ( 4.128 1.949 0.015) 4.565 19.147 ( -4.344 0.785 0.102) 4.416 19.848 ( 7.135 -8.621 1.431) 11.282 20.012 ( -8.112 -9.415 -1.278) 12.493 21.527 ( 9.004 7.548 1.367) 11.828 21.704 ( -7.886 7.669 -1.879) 11.159 22.206 ( 2.203 -1.515 -0.560) 2.732 22.209 ( -1.292 -2.717 1.134) 3.215 22.459 ( -2.304 2.596 5.285) 6.323 22.626 ( 2.153 4.183 -9.178) 10.313 23.016 ( -0.571 -0.519 5.564) 5.618 23.083 ( 0.307 -4.245 -0.087) 4.257 23.401 ( 0.221 -3.026 1.316) 3.307 23.467 ( 0.954 -4.629 -2.954) 5.574 ======================= Grid point 159 (65/102) ======================= q-point: (-0.18 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.402 ( -1.283 17.231 5.031) 17.996 1.417 ( -2.199 16.198 4.565) 16.972 1.691 ( 2.238 11.217 -0.517) 11.450 1.787 ( -0.785 7.823 -8.359) 11.475 2.083 ( -1.732 7.818 3.913) 8.913 2.282 ( 5.039 1.920 -10.095) 11.445 2.385 ( -0.294 10.216 4.613) 11.213 2.422 ( 0.936 4.168 -0.242) 4.279 2.612 ( -6.009 8.531 7.819) 13.039 2.755 ( 2.932 1.198 -3.186) 4.493 2.865 ( 1.394 -2.127 0.623) 2.618 2.884 ( -0.105 1.336 -2.252) 2.620 3.124 ( -3.306 1.923 1.227) 4.016 3.159 ( 2.237 1.559 -2.308) 3.573 3.284 ( -1.278 -1.266 3.260) 3.724 3.363 ( -2.369 -3.086 -1.655) 4.228 3.369 ( -0.166 -0.478 -0.128) 0.522 3.386 ( 5.348 0.978 -2.451) 5.963 3.574 ( -1.661 0.753 2.204) 2.861 3.656 ( 3.225 1.916 -4.826) 6.113 3.798 ( -4.352 -4.518 3.623) 7.245 3.874 ( 0.555 -1.505 -3.020) 3.419 3.988 ( 4.890 -0.144 2.301) 5.407 4.021 ( -1.182 1.134 1.311) 2.098 4.102 ( -4.058 -5.852 1.503) 7.278 4.190 ( 2.462 -3.068 -2.890) 4.882 4.382 ( -4.997 -2.289 4.593) 7.163 4.511 ( 2.356 0.153 -5.276) 5.780 4.663 ( -0.591 -0.466 6.701) 6.743 4.807 ( 3.894 3.022 -3.614) 6.112 4.858 ( 0.628 1.120 -0.747) 1.486 4.904 ( -0.636 3.558 -2.647) 4.480 5.221 ( -3.112 -3.131 1.426) 4.639 5.227 ( 0.531 -1.394 0.632) 1.620 5.356 ( 1.906 -2.133 2.315) 3.680 5.460 ( 5.885 -0.485 -5.238) 7.894 5.552 ( -8.262 3.088 3.550) 9.508 5.650 ( 3.600 2.108 -3.664) 5.552 5.752 ( -2.592 1.867 2.876) 4.298 5.839 ( 0.261 1.101 -5.179) 5.301 6.220 ( 0.682 2.778 6.336) 6.952 6.303 ( 2.616 3.947 -2.590) 5.397 6.451 ( -3.559 2.263 5.198) 6.694 6.486 ( -2.186 6.962 2.882) 7.845 6.799 ( 2.110 0.476 -1.320) 2.534 6.904 ( 3.122 -4.436 -9.126) 10.616 7.040 ( -4.286 3.514 7.151) 9.047 7.191 ( 2.260 4.295 -5.794) 7.558 7.549 ( -1.907 -3.759 4.787) 6.378 7.639 ( 1.528 -4.068 -3.028) 5.296 8.039 ( -0.642 -2.006 1.529) 2.602 8.115 ( 1.698 -2.627 -4.927) 5.836 8.267 ( -3.933 -0.791 4.969) 6.387 8.386 ( 3.571 2.341 -4.954) 6.540 8.757 ( -3.511 -5.248 8.739) 10.782 8.931 ( 2.972 -3.237 -6.110) 7.526 9.270 ( -2.168 -1.322 5.770) 6.304 9.402 ( 1.452 0.077 -5.114) 5.317 9.693 ( -1.222 -3.265 3.351) 4.836 9.770 ( 4.201 -3.286 -1.927) 5.671 9.801 ( -4.192 -1.627 6.638) 8.018 9.991 ( 1.551 -1.897 -7.160) 7.568 10.633 ( 0.138 2.603 3.385) 4.273 10.703 ( -3.387 6.223 -2.258) 7.436 10.809 ( 4.743 -0.220 2.197) 5.232 10.874 ( -3.871 4.129 -3.183) 6.494 11.192 ( -0.062 0.178 0.344) 0.392 11.217 ( 3.763 -1.210 -1.864) 4.370 11.446 ( -3.114 -1.353 4.531) 5.662 11.535 ( 1.705 -0.417 -3.076) 3.541 11.803 ( -2.812 1.845 2.983) 4.495 11.871 ( 2.494 3.045 -2.706) 4.776 12.409 ( -1.722 -4.600 2.281) 5.415 12.476 ( 3.011 -4.779 -3.507) 6.648 12.813 ( -2.962 1.724 4.013) 5.278 12.890 ( 1.668 1.179 -2.618) 3.321 13.440 ( -0.630 2.316 1.617) 2.894 13.489 ( 0.918 2.086 -2.614) 3.468 13.895 ( -1.403 -8.068 6.801) 10.645 14.052 ( 1.369 -7.457 -6.293) 9.853 15.765 ( -3.043 -0.139 5.455) 6.247 15.891 ( 2.919 -1.162 -4.966) 5.877 17.465 ( 4.795 0.722 3.796) 6.158 17.570 ( -6.980 -4.278 -4.865) 9.523 17.778 ( -3.848 7.322 2.908) 8.768 17.845 ( 6.712 5.040 -2.370) 8.722 18.601 ( -6.458 -10.583 3.775) 12.960 18.684 ( 5.784 -7.279 -2.999) 9.769 19.094 ( 4.292 -0.609 1.668) 4.645 19.142 ( -4.573 -3.967 -2.224) 6.449 20.063 ( 0.498 -9.869 3.553) 10.501 20.149 ( -0.299 -10.625 -3.595) 11.220 21.438 ( 0.573 8.153 2.048) 8.426 21.491 ( -0.413 10.318 -2.284) 10.576 22.193 ( -1.867 3.211 2.262) 4.349 22.215 ( 0.243 2.431 0.307) 2.462 22.425 ( 0.242 0.784 2.258) 2.402 22.536 ( 2.214 5.114 -7.081) 9.011 23.036 ( -1.212 -1.005 6.596) 6.782 23.143 ( -0.316 -2.596 -2.427) 3.568 23.444 ( -0.044 -0.912 2.806) 2.951 23.534 ( 0.541 -2.571 -4.429) 5.150 ======================= Grid point 160 (66/102) ======================= q-point: (-0.09 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.110 ( 3.371 14.374 -0.194) 14.766 1.122 ( 4.460 17.012 1.065) 17.619 1.496 ( 5.061 13.861 0.734) 14.775 1.593 ( 5.427 12.573 -8.713) 16.231 1.947 ( -1.856 8.155 9.413) 12.592 2.111 ( 1.348 18.847 -2.413) 19.048 2.256 ( 1.360 8.230 6.052) 10.306 2.264 ( -0.721 11.166 6.966) 13.181 2.573 ( 3.746 -5.782 -5.859) 9.044 2.677 ( 6.062 7.225 -8.318) 12.575 2.834 ( -2.848 3.397 -2.014) 4.869 2.906 ( 4.100 0.415 -0.977) 4.235 3.046 ( -1.752 4.185 4.000) 6.049 3.123 ( 2.372 2.336 0.005) 3.329 3.296 ( -6.855 0.322 2.665) 7.362 3.359 ( -0.071 0.137 1.266) 1.276 3.370 ( -1.836 0.336 -1.675) 2.508 3.426 ( 3.918 -1.586 -0.640) 4.275 3.560 ( -2.180 -1.563 -0.755) 2.786 3.637 ( -0.046 0.282 -4.173) 4.182 3.851 ( -3.240 0.426 -1.559) 3.621 3.865 ( -0.177 -3.131 2.253) 3.861 4.005 ( -3.498 -1.458 -2.474) 4.526 4.066 ( 6.146 -1.856 0.862) 6.478 4.160 ( -7.040 -2.992 2.457) 8.034 4.291 ( 4.110 -4.456 3.207) 6.858 4.400 ( -6.543 -4.348 0.819) 7.899 4.510 ( 4.933 0.866 -0.528) 5.036 4.696 ( 0.518 -2.030 3.066) 3.713 4.759 ( 2.477 1.983 -0.212) 3.180 4.843 ( -0.988 0.217 -2.785) 2.963 4.919 ( 6.497 -2.067 -4.010) 7.910 5.210 ( -2.140 2.657 -0.910) 3.530 5.244 ( 0.820 1.052 1.472) 1.987 5.365 ( -11.857 3.599 2.845) 12.714 5.411 ( -4.674 -3.497 0.274) 5.844 5.516 ( 4.164 -0.760 -2.107) 4.728 5.584 ( 1.528 5.972 -1.623) 6.375 5.800 ( 4.380 -3.453 1.890) 5.889 5.846 ( 1.961 -0.580 -1.892) 2.786 6.158 ( -0.356 4.869 0.854) 4.956 6.227 ( 8.796 7.127 -1.687) 11.446 6.385 ( -3.591 1.944 2.177) 4.627 6.441 ( 3.475 0.482 4.576) 5.766 6.844 ( -2.116 -3.159 -3.350) 5.067 6.929 ( 0.418 2.101 1.926) 2.880 7.052 ( 7.546 -3.851 -0.828) 8.512 7.196 ( 5.909 -3.036 -3.883) 7.695 7.591 ( -1.132 -1.240 3.212) 3.624 7.706 ( 3.395 -1.308 -3.749) 5.224 8.085 ( 2.537 -1.677 2.558) 3.973 8.188 ( 4.493 -2.916 -4.837) 7.217 8.248 ( -4.126 -0.954 3.076) 5.234 8.377 ( 4.148 0.457 -2.844) 5.050 8.826 ( -6.635 -3.934 7.647) 10.861 9.003 ( 0.721 -4.855 -4.011) 6.339 9.273 ( -2.792 -0.210 4.494) 5.295 9.358 ( -1.020 3.296 -1.857) 3.919 9.754 ( -1.138 -1.842 2.760) 3.508 9.801 ( -3.098 -1.992 3.344) 4.974 9.878 ( 4.297 -3.232 2.359) 5.872 10.010 ( -0.351 -1.791 -6.504) 6.755 10.553 ( -5.823 1.877 -0.567) 6.144 10.643 ( 6.082 0.026 0.270) 6.088 10.796 ( -0.317 0.857 0.061) 0.916 10.887 ( 4.202 -2.222 -3.464) 5.882 11.185 ( -5.203 -1.927 1.021) 5.642 11.298 ( 3.347 -0.532 1.779) 3.827 11.456 ( 0.206 -1.774 2.416) 3.004 11.557 ( 1.936 -0.737 -1.171) 2.380 11.737 ( -3.607 1.300 -0.582) 3.878 11.864 ( 8.392 2.345 -0.670) 8.739 12.510 ( -1.044 -7.604 0.920) 7.730 12.577 ( 2.088 -4.354 -3.243) 5.817 12.776 ( -3.259 0.381 4.103) 5.254 12.864 ( 0.707 2.051 -2.058) 2.990 13.409 ( -0.885 0.954 1.782) 2.206 13.459 ( 0.263 1.310 -2.020) 2.422 14.040 ( -1.646 -7.454 5.262) 9.272 14.175 ( 0.381 -6.541 -5.621) 8.633 15.749 ( -2.192 0.972 5.382) 5.892 15.935 ( 5.801 -1.722 -4.698) 7.661 17.408 ( -7.536 4.249 3.195) 9.223 17.549 ( 3.244 4.719 -4.032) 7.003 17.638 ( -8.740 3.663 3.023) 9.947 17.915 ( 16.963 -3.752 -2.468) 17.548 18.769 ( -9.405 -15.016 0.253) 17.720 18.915 ( 7.541 -10.519 0.710) 12.962 19.170 ( -1.494 -6.496 0.082) 6.666 19.222 ( 3.982 -6.060 -1.072) 7.330 20.228 ( -5.411 -10.640 2.677) 12.233 20.333 ( -0.825 -7.907 -3.455) 8.669 21.234 ( -4.767 8.881 0.020) 10.080 21.346 ( 9.729 12.119 0.784) 15.561 22.077 ( -3.467 6.516 1.150) 7.470 22.149 ( 3.443 6.647 0.832) 7.532 22.409 ( -1.120 1.961 -0.240) 2.271 22.470 ( 2.745 2.313 -3.042) 4.705 23.054 ( -2.707 -0.555 6.567) 7.125 23.163 ( -1.330 -1.200 -3.655) 4.070 23.435 ( -2.385 2.044 3.309) 4.562 23.532 ( -2.521 1.224 -5.699) 6.351 ======================= Grid point 165 (67/102) ======================= q-point: ( 0.27 0.27 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.124 ( 12.154 -0.000 9.400) 15.364 1.158 ( 14.358 -0.000 5.439) 15.354 1.317 ( 19.982 -0.000 -6.022) 20.869 1.464 ( 21.469 -0.000 -7.037) 22.592 2.088 ( 22.838 -0.000 -4.408) 23.260 2.115 ( 12.824 -0.000 2.082) 12.992 2.343 ( 20.819 -0.000 -4.770) 21.359 2.423 ( 0.096 -0.000 4.400) 4.401 2.583 ( -3.477 0.000 2.847) 4.494 2.595 ( -10.157 0.000 5.788) 11.691 2.732 ( 5.811 -0.000 -4.076) 7.098 2.785 ( -4.270 0.000 0.458) 4.295 2.978 ( 0.994 -0.000 -0.244) 1.023 3.030 ( 5.926 -0.000 -2.017) 6.260 3.129 ( -3.143 0.000 -4.781) 5.722 3.281 ( -5.122 0.000 2.894) 5.883 3.420 ( 1.420 -0.000 0.622) 1.551 3.530 ( 0.821 -0.000 -4.628) 4.700 3.603 ( -1.518 0.000 -6.161) 6.345 3.676 ( -0.273 0.000 9.042) 9.046 3.772 ( -5.293 0.000 6.635) 8.488 3.817 ( 4.752 -0.000 -6.852) 8.339 3.913 ( -2.381 0.000 -4.939) 5.483 3.921 ( -0.781 0.000 6.984) 7.027 4.364 ( -5.482 0.000 -2.082) 5.864 4.401 ( 1.592 -0.000 3.838) 4.155 4.509 ( -1.366 0.000 1.462) 2.001 4.588 ( -7.673 0.000 -0.463) 7.687 4.646 ( -2.354 0.000 -0.368) 2.382 4.839 ( -4.771 0.000 -2.133) 5.226 4.921 ( -3.039 0.000 -1.412) 3.351 4.926 ( -7.434 0.000 0.926) 7.492 4.987 ( -3.921 0.000 5.712) 6.928 5.067 ( 3.371 -0.000 -7.966) 8.650 5.137 ( -5.106 0.000 0.686) 5.152 5.234 ( 6.783 -0.000 -3.227) 7.512 5.354 ( -6.630 0.000 3.878) 7.681 5.445 ( 4.955 -0.000 1.619) 5.213 5.727 ( -9.269 0.000 6.952) 11.587 5.832 ( 0.013 -0.000 -8.586) 8.586 6.197 ( 6.588 -0.000 -2.019) 6.890 6.239 ( -1.214 0.000 8.351) 8.439 6.560 ( -2.411 0.000 -0.553) 2.474 6.628 ( -1.412 0.000 -4.145) 4.379 6.991 ( 3.681 -0.000 -3.741) 5.248 7.026 ( 10.915 -0.000 4.056) 11.645 7.357 ( 4.430 -0.000 -2.168) 4.932 7.462 ( -5.123 0.000 5.049) 7.193 7.631 ( 3.403 -0.000 0.848) 3.507 7.939 ( 3.826 -0.000 -9.779) 10.500 8.220 ( -0.858 0.000 -2.892) 3.017 8.334 ( 9.504 -0.000 -1.307) 9.593 8.403 ( -5.126 0.000 5.389) 7.437 8.695 ( -8.028 0.000 0.951) 8.084 8.814 ( -1.637 0.000 -8.499) 8.656 8.876 ( -17.874 0.000 9.308) 20.153 9.259 ( 8.553 -0.000 -4.256) 9.554 9.520 ( -5.671 0.000 13.568) 14.705 9.703 ( 5.746 -0.000 -6.520) 8.691 10.133 ( 12.127 -0.000 -4.360) 12.887 10.286 ( 14.961 -0.000 -8.168) 17.045 10.331 ( -20.233 0.000 5.122) 20.871 10.399 ( -4.564 0.000 -5.421) 7.086 10.643 ( 7.186 -0.000 6.361) 9.597 10.999 ( -1.286 0.000 3.291) 3.534 11.077 ( 6.622 -0.000 -3.290) 7.394 11.283 ( 12.182 -0.000 0.376) 12.188 11.495 ( 8.415 -0.000 -0.452) 8.427 11.505 ( 8.006 -0.000 1.045) 8.074 11.721 ( 5.068 -0.000 4.703) 6.914 12.010 ( 7.155 -0.000 3.583) 8.002 12.019 ( -5.598 0.000 -3.550) 6.629 12.497 ( -5.200 0.000 2.860) 5.935 12.594 ( -3.056 0.000 -2.780) 4.132 13.210 ( -0.980 0.000 -0.641) 1.171 13.277 ( -1.878 0.000 0.271) 1.898 13.594 ( 8.257 -0.000 -2.833) 8.730 13.597 ( 13.877 -0.000 4.756) 14.670 14.131 ( -3.609 0.000 0.059) 3.610 14.131 ( -5.240 0.000 -0.806) 5.302 15.718 ( -5.529 0.000 0.221) 5.534 16.092 ( -20.960 0.000 2.918) 21.162 17.381 ( 12.059 -0.000 6.310) 13.610 17.408 ( 7.089 -0.000 -4.291) 8.287 18.180 ( 9.159 -0.000 -5.544) 10.706 18.208 ( 7.919 -0.000 6.441) 10.208 18.821 ( -11.820 0.000 -4.696) 12.718 18.905 ( -13.676 0.000 2.820) 13.964 19.776 ( 1.952 -0.000 1.926) 2.742 20.034 ( -1.880 0.000 -2.278) 2.953 20.653 ( 5.939 -0.000 11.737) 13.154 20.725 ( 11.408 -0.000 -15.254) 19.048 20.843 ( -4.450 0.000 2.602) 5.155 21.150 ( 9.772 -0.000 -10.401) 14.272 21.931 ( -1.043 0.000 6.647) 6.728 22.007 ( 4.929 -0.000 -3.526) 6.060 22.217 ( -6.992 0.000 9.813) 12.049 22.412 ( -0.720 0.000 -0.681) 0.991 22.496 ( 2.275 -0.000 5.609) 6.053 22.764 ( -3.493 0.000 -4.438) 5.647 23.105 ( -5.453 0.000 0.156) 5.455 23.167 ( -3.699 0.000 -0.959) 3.821 ======================= Grid point 166 (68/102) ======================= q-point: ( 0.36 0.27 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.278 ( 14.307 -5.688 1.087) 15.434 1.400 ( 6.204 -12.540 8.282) 16.258 1.440 ( 16.797 1.336 -4.411) 17.418 1.636 ( 17.666 -2.840 -5.901) 18.840 2.125 ( 4.821 3.770 4.213) 7.431 2.266 ( 9.409 -0.660 -1.950) 9.631 2.324 ( 4.198 2.967 -1.741) 5.427 2.477 ( 8.395 -1.162 0.814) 8.514 2.603 ( 1.082 -7.078 1.047) 7.237 2.689 ( -4.482 -5.579 2.674) 7.640 2.772 ( -2.458 -1.289 1.313) 3.071 2.803 ( 4.983 -4.809 -5.532) 8.864 3.001 ( 2.702 -1.122 -1.072) 3.116 3.075 ( 3.046 -1.084 -2.565) 4.127 3.135 ( -0.595 -3.152 -1.574) 3.573 3.248 ( -1.003 1.736 3.714) 4.221 3.411 ( -0.169 0.948 -0.251) 0.996 3.469 ( -2.459 4.650 1.510) 5.473 3.599 ( 1.129 -2.671 -7.482) 8.024 3.665 ( -6.683 6.524 7.141) 11.756 3.718 ( -4.498 -0.323 1.835) 4.868 3.812 ( 3.930 0.662 -2.672) 4.798 3.881 ( -2.839 3.700 1.337) 4.852 3.955 ( 5.347 -2.925 0.568) 6.121 4.244 ( 2.483 7.563 -2.091) 8.230 4.392 ( -4.757 2.789 2.231) 5.948 4.490 ( -3.832 2.409 -1.303) 4.710 4.592 ( -1.778 -4.456 1.935) 5.173 4.644 ( -1.160 -1.189 0.506) 1.736 4.774 ( 1.643 1.413 -1.891) 2.876 4.798 ( -9.376 -0.105 -1.377) 9.477 4.914 ( -4.597 3.116 2.300) 6.011 4.994 ( -7.137 -2.382 0.048) 7.524 5.091 ( -4.838 0.006 -0.841) 4.910 5.191 ( -2.610 -9.333 -1.291) 9.777 5.240 ( 4.449 1.869 -3.222) 5.802 5.365 ( -3.428 -1.726 2.328) 4.490 5.457 ( 6.766 0.271 2.302) 7.152 5.658 ( -6.730 -0.344 3.271) 7.491 5.921 ( 0.873 -7.550 -5.395) 9.320 6.144 ( 4.555 5.766 1.312) 7.464 6.301 ( -0.922 -2.318 4.212) 4.896 6.583 ( -1.244 -2.367 -0.263) 2.687 6.621 ( 2.983 -2.180 -2.443) 4.430 7.009 ( 5.237 0.704 -3.318) 6.240 7.115 ( 8.635 -0.332 3.553) 9.343 7.332 ( 1.246 3.093 0.386) 3.356 7.496 ( -4.429 -4.642 2.273) 6.807 7.652 ( 1.204 -0.117 -0.095) 1.213 7.941 ( 1.299 0.278 -9.357) 9.451 8.193 ( -2.897 1.003 -1.100) 3.257 8.371 ( 0.953 0.876 3.521) 3.751 8.403 ( 3.375 0.836 -2.235) 4.133 8.594 ( -6.659 4.222 2.992) 8.433 8.722 ( -13.181 2.924 2.986) 13.827 8.786 ( -3.528 -0.079 -2.430) 4.284 9.296 ( 4.526 1.641 -3.620) 6.023 9.488 ( -7.628 1.539 9.725) 12.455 9.687 ( 6.233 4.630 -6.945) 10.417 10.082 ( -7.368 9.368 4.067) 12.593 10.210 ( 10.714 0.327 -5.199) 11.913 10.303 ( -7.028 1.605 5.576) 9.114 10.473 ( 3.643 -3.930 -7.588) 9.289 10.660 ( 6.841 4.534 2.820) 8.678 10.975 ( 3.441 2.584 1.539) 4.570 11.084 ( 5.836 3.459 -0.852) 6.837 11.347 ( 9.802 3.569 -0.725) 10.457 11.457 ( 9.799 2.861 2.557) 10.523 11.696 ( 7.348 -6.396 -0.293) 9.746 11.846 ( 7.160 -6.124 1.970) 9.625 11.959 ( -2.732 0.708 -2.620) 3.851 12.035 ( 1.344 2.262 1.441) 3.000 12.470 ( -2.515 0.676 1.368) 2.942 12.579 ( -1.200 -0.661 -1.198) 1.820 13.198 ( -1.393 -0.336 0.404) 1.489 13.285 ( -2.228 -2.672 -0.306) 3.492 13.510 ( 8.431 12.258 0.233) 14.879 13.611 ( 12.422 11.724 0.942) 17.107 14.036 ( -6.747 2.506 -1.066) 7.276 14.100 ( -5.077 2.760 -0.129) 5.780 15.679 ( -6.665 -0.930 0.641) 6.760 15.949 ( -17.507 -0.170 0.571) 17.517 17.318 ( 10.265 9.241 0.133) 13.813 17.512 ( 4.944 -0.955 0.643) 5.076 18.017 ( 14.767 8.135 -0.562) 16.869 18.498 ( 0.300 -5.893 3.185) 6.706 18.721 ( -7.884 0.896 -2.665) 8.370 18.932 ( -15.070 -12.707 0.715) 19.725 19.678 ( 0.448 11.095 2.790) 11.449 19.840 ( -2.921 13.791 -1.538) 14.180 20.330 ( 9.628 27.766 -2.310) 29.478 20.620 ( 0.297 15.280 -2.248) 15.448 21.090 ( 2.928 -18.387 5.163) 19.322 21.347 ( 7.250 -11.802 -9.381) 16.729 21.984 ( 1.584 -4.861 6.060) 7.929 22.097 ( 3.611 -3.640 0.130) 5.129 22.276 ( -4.710 -7.269 1.028) 8.722 22.383 ( -1.252 1.036 -0.930) 1.872 22.575 ( 0.904 -6.208 3.154) 7.022 22.788 ( -3.083 -4.540 -1.143) 5.606 23.058 ( -5.636 0.619 0.889) 5.739 23.169 ( -4.119 -3.455 -1.692) 5.636 ======================= Grid point 167 (69/102) ======================= q-point: ( 0.45 0.27 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.456 ( 6.322 -0.210 2.110) 6.668 1.550 ( 12.678 -6.894 -0.629) 14.445 1.675 ( 0.616 -10.368 1.414) 10.482 1.764 ( 6.736 -4.193 -2.365) 8.279 2.140 ( 6.784 -0.832 -1.343) 6.965 2.228 ( 0.689 -0.828 3.114) 3.295 2.430 ( 7.311 -0.135 -3.655) 8.175 2.605 ( 8.465 -7.068 -2.117) 11.229 2.694 ( -6.525 -2.048 2.978) 7.459 2.730 ( -8.167 -4.508 1.706) 9.483 2.786 ( 2.343 -2.074 -2.274) 3.868 2.955 ( 8.353 -5.668 -4.810) 11.182 3.046 ( 2.801 -1.830 -0.748) 3.428 3.102 ( -0.354 -0.660 0.546) 0.927 3.172 ( 0.489 0.617 3.217) 3.312 3.239 ( 3.212 0.009 1.667) 3.619 3.355 ( -4.375 2.367 0.405) 4.991 3.425 ( -1.702 -0.377 1.866) 2.554 3.477 ( -2.842 8.233 3.440) 9.364 3.654 ( -1.616 -2.405 -3.286) 4.381 3.701 ( -0.313 -1.563 -1.822) 2.420 3.755 ( -5.628 4.433 0.673) 7.196 3.860 ( 5.450 -0.086 0.173) 5.453 4.050 ( 5.684 -1.812 1.723) 6.210 4.125 ( 2.395 6.772 -2.937) 7.760 4.286 ( -5.902 4.086 0.507) 7.197 4.413 ( -3.850 3.247 -0.467) 5.058 4.617 ( -0.025 -0.151 -0.133) 0.203 4.660 ( -2.821 -0.737 0.095) 2.917 4.750 ( -4.016 1.069 2.833) 5.030 4.784 ( -6.793 -1.259 -3.237) 7.629 4.877 ( 1.665 -4.270 -1.934) 4.974 4.975 ( -1.742 -1.906 1.185) 2.841 5.067 ( -5.332 -0.981 1.593) 5.651 5.190 ( 1.741 3.159 -1.564) 3.931 5.333 ( -6.846 -4.382 1.397) 8.248 5.363 ( -0.944 -5.296 1.960) 5.725 5.588 ( 9.135 -4.898 -3.790) 11.037 5.663 ( -3.616 -3.253 4.276) 6.476 6.004 ( -3.089 -2.766 -3.293) 5.295 6.115 ( 7.709 2.683 0.570) 8.182 6.340 ( -1.118 -2.998 0.443) 3.230 6.607 ( 0.337 -1.535 5.755) 5.965 6.746 ( 6.973 -5.798 -4.551) 10.146 7.021 ( 4.258 1.323 -2.666) 5.195 7.180 ( 6.745 0.982 3.580) 7.699 7.287 ( -0.197 1.974 0.156) 1.990 7.542 ( -4.672 -3.769 -1.027) 6.090 7.649 ( -1.890 0.449 2.589) 3.237 7.873 ( -1.446 5.746 -7.147) 9.284 8.132 ( -2.914 3.271 1.153) 4.529 8.335 ( -0.429 6.189 -3.561) 7.153 8.362 ( -1.450 0.969 4.387) 4.721 8.499 ( -3.462 3.201 -1.108) 4.844 8.626 ( -4.830 -0.646 0.018) 4.873 8.783 ( -4.621 -3.141 1.074) 5.690 9.258 ( 3.578 4.143 -3.367) 6.427 9.386 ( -9.279 4.065 5.901) 11.723 9.604 ( 6.503 8.494 -3.960) 11.407 9.878 ( -6.458 7.870 2.377) 10.454 10.212 ( -2.473 5.220 8.248) 10.070 10.285 ( 11.266 0.380 -5.329) 12.469 10.510 ( -1.591 -0.921 -0.681) 1.960 10.619 ( 2.829 3.536 -2.053) 4.972 10.997 ( 8.216 -0.288 -1.046) 8.287 11.068 ( 6.021 2.882 0.887) 6.734 11.331 ( 7.028 3.939 -1.398) 8.177 11.479 ( 2.802 2.375 2.645) 4.527 11.827 ( 5.152 -0.727 -1.278) 5.358 11.923 ( 2.694 -1.298 0.364) 3.013 11.979 ( 3.788 5.351 -0.385) 6.567 12.031 ( 6.265 -4.511 1.070) 7.794 12.439 ( -0.627 1.469 -0.265) 1.619 12.574 ( -2.127 0.408 0.403) 2.203 13.204 ( 2.825 1.947 1.461) 3.729 13.313 ( -0.685 4.650 -0.008) 4.701 13.354 ( 1.864 1.332 -0.266) 2.306 13.406 ( 10.675 17.756 -1.004) 20.742 13.933 ( -7.210 3.874 0.032) 8.185 13.980 ( -5.433 4.402 -0.949) 7.056 15.662 ( -5.133 -2.032 0.400) 5.535 15.848 ( -12.344 -1.022 0.125) 12.387 17.259 ( 8.724 4.887 -0.148) 10.001 17.524 ( -1.000 1.062 0.384) 1.509 18.042 ( 15.811 3.775 -0.315) 16.258 18.474 ( -4.101 5.230 2.292) 7.030 18.659 ( -1.675 1.697 -1.547) 2.842 19.028 ( -12.514 -6.750 -1.389) 14.287 19.487 ( -0.620 9.006 5.794) 10.727 19.609 ( -4.748 6.062 -2.486) 8.091 19.903 ( 10.213 25.340 -0.532) 27.326 20.294 ( -0.121 19.750 -2.754) 19.941 21.436 ( 0.641 -16.454 5.764) 17.446 21.581 ( 7.363 -9.477 -7.249) 14.021 22.040 ( 4.745 2.509 1.833) 5.672 22.241 ( 0.520 -6.921 5.442) 8.820 22.294 ( -1.363 -0.056 -2.644) 2.975 22.425 ( -1.913 -6.539 -3.143) 7.503 22.727 ( 0.380 -8.659 -1.621) 8.817 22.856 ( -5.717 -6.538 2.451) 9.024 23.012 ( -4.143 0.321 2.799) 5.010 23.206 ( -4.653 -4.330 -2.310) 6.763 ======================= Grid point 168 (70/102) ======================= q-point: ( 0.55 0.27 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.498 ( -0.216 -2.789 6.265) 6.861 1.701 ( 3.287 0.531 -6.516) 7.318 1.805 ( 6.483 -9.701 -0.789) 11.695 1.975 ( -1.173 -12.302 -0.886) 12.390 2.205 ( 2.984 -2.020 3.902) 5.312 2.323 ( 3.095 -4.864 -1.523) 5.963 2.468 ( 5.324 -1.353 -2.436) 6.010 2.651 ( -7.393 0.477 1.257) 7.514 2.713 ( -1.969 0.087 -0.388) 2.009 2.764 ( 0.854 -4.671 -1.364) 4.941 2.848 ( 5.664 -0.018 -3.418) 6.615 2.963 ( -4.389 4.114 7.471) 9.592 3.129 ( 1.719 -0.821 -0.049) 1.906 3.161 ( 4.758 -6.392 -5.780) 9.844 3.185 ( 9.065 1.732 0.934) 9.276 3.272 ( 0.836 -1.001 -0.648) 1.456 3.301 ( -3.453 1.319 2.307) 4.357 3.334 ( -3.876 3.133 3.462) 6.068 3.452 ( -0.352 -2.070 1.049) 2.347 3.636 ( -4.491 1.306 -3.345) 5.750 3.705 ( -1.954 -3.504 0.947) 4.122 3.736 ( 1.774 -0.325 -1.637) 2.436 3.877 ( 1.319 2.270 3.302) 4.219 3.994 ( 1.859 4.440 -1.821) 5.146 4.160 ( 0.205 -0.412 -3.872) 3.899 4.181 ( -2.615 -0.961 1.985) 3.421 4.316 ( -3.887 2.827 0.935) 4.896 4.529 ( -7.850 7.419 2.763) 11.149 4.630 ( 1.382 -0.357 -1.878) 2.359 4.721 ( -4.204 -1.749 -1.856) 4.918 4.850 ( -0.663 -5.771 0.921) 5.882 4.980 ( 1.310 -4.704 -2.058) 5.299 5.049 ( 0.208 -2.315 3.139) 3.906 5.072 ( 0.909 -4.830 0.332) 4.926 5.158 ( 2.251 0.577 -1.180) 2.607 5.338 ( -7.832 -2.686 0.911) 8.330 5.457 ( 1.044 -2.850 1.449) 3.363 5.694 ( 3.633 -2.239 -7.564) 8.685 5.732 ( 0.165 -3.926 6.350) 7.467 5.998 ( -3.344 -0.785 -3.398) 4.832 6.140 ( 6.914 0.999 3.851) 7.977 6.393 ( -0.697 -3.723 -4.547) 5.918 6.665 ( 3.368 -0.448 8.930) 9.554 6.858 ( 3.865 -1.669 -3.643) 5.567 7.030 ( 3.454 -0.782 -3.185) 4.763 7.147 ( -1.071 4.706 -1.292) 4.996 7.303 ( 4.560 -0.807 4.763) 6.643 7.540 ( -5.969 0.087 -1.549) 6.167 7.610 ( -2.766 3.324 1.564) 4.598 7.699 ( -2.142 9.094 -1.792) 9.514 8.040 ( -1.830 4.493 1.013) 4.956 8.206 ( -3.518 4.705 -5.847) 8.289 8.336 ( -2.041 1.090 3.090) 3.860 8.426 ( -1.058 1.461 -0.784) 1.967 8.647 ( 1.027 -1.380 -0.947) 1.964 8.809 ( -7.558 -3.402 1.515) 8.425 9.215 ( 6.453 3.483 -3.763) 8.242 9.263 ( -7.122 2.709 4.275) 8.737 9.481 ( 5.728 8.295 0.817) 10.113 9.714 ( -4.508 5.763 -2.096) 7.611 10.122 ( -0.268 5.504 10.617) 11.962 10.325 ( 10.912 3.833 -7.510) 13.790 10.506 ( -3.964 -1.250 3.591) 5.492 10.584 ( -0.070 0.249 -4.114) 4.122 11.064 ( 8.090 2.454 -0.410) 8.464 11.092 ( 5.279 -2.592 -0.232) 5.886 11.309 ( 3.744 2.549 -1.482) 4.766 11.421 ( -4.927 3.005 1.055) 5.867 11.770 ( 1.081 7.613 3.294) 8.365 11.890 ( 2.903 6.710 -2.780) 7.822 12.022 ( 8.870 -1.591 0.412) 9.021 12.107 ( 7.308 2.579 0.070) 7.750 12.405 ( 1.080 2.318 -1.191) 2.821 12.517 ( -5.138 3.232 1.325) 6.213 13.082 ( 6.147 11.188 0.204) 12.767 13.143 ( 3.428 13.757 -0.172) 14.179 13.313 ( -1.610 -4.766 2.414) 5.580 13.453 ( 0.829 -6.627 -2.598) 7.166 13.793 ( -4.495 5.887 1.153) 7.496 13.873 ( -4.774 3.372 -1.825) 6.123 15.675 ( -2.466 -2.370 0.824) 3.519 15.800 ( -7.532 -1.875 -0.322) 7.768 17.265 ( 7.010 1.223 -0.088) 7.116 17.477 ( -5.753 0.749 0.149) 5.804 18.073 ( 12.099 4.619 -0.530) 12.961 18.306 ( -5.617 8.508 1.542) 10.311 18.622 ( 3.972 3.619 0.763) 5.427 18.982 ( -6.316 2.455 -6.663) 9.503 19.358 ( 1.826 7.204 9.747) 12.257 19.545 ( -2.793 2.825 -2.328) 4.604 19.627 ( 4.008 6.812 -0.454) 7.917 19.917 ( -4.409 18.207 -2.257) 18.869 21.706 ( -0.630 -11.351 5.707) 12.720 21.751 ( 8.937 -3.636 -4.356) 10.586 22.026 ( 2.977 1.093 -0.696) 3.246 22.185 ( -1.892 5.198 -2.895) 6.244 22.412 ( -4.814 -6.673 8.046) 11.508 22.543 ( 3.958 -6.949 -7.761) 11.144 22.862 ( 0.089 -5.839 -0.114) 5.841 22.912 ( -5.481 -3.370 0.786) 6.482 23.050 ( -0.610 -6.561 3.588) 7.502 23.240 ( -4.697 -3.941 -1.985) 6.445 ======================= Grid point 169 (71/102) ======================= q-point: ( 0.64 0.27 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.583 ( -1.416 -4.883 3.926) 6.423 1.712 ( 4.982 -1.031 -8.302) 9.736 1.989 ( -0.450 -5.817 4.157) 7.164 2.108 ( -0.370 -3.462 -4.412) 5.621 2.298 ( -3.264 -5.783 8.054) 10.439 2.393 ( 2.419 -2.855 -2.542) 4.524 2.531 ( 1.783 -0.408 0.792) 1.993 2.602 ( -2.161 1.135 -1.756) 3.007 2.686 ( 3.062 4.687 -0.317) 5.608 2.735 ( -6.010 3.401 2.439) 7.324 2.880 ( 5.567 -2.835 -1.298) 6.381 2.942 ( 1.381 -0.815 -1.336) 2.087 3.146 ( -0.341 0.507 1.466) 1.588 3.170 ( -3.596 4.383 4.352) 7.147 3.186 ( 5.277 3.560 -2.483) 6.832 3.256 ( -0.700 -0.355 -2.360) 2.488 3.302 ( -6.254 -1.749 3.902) 7.575 3.351 ( 7.111 -2.531 -4.817) 8.954 3.530 ( -1.470 -4.703 -0.085) 4.928 3.590 ( 1.473 -1.047 -5.209) 5.514 3.733 ( 0.655 1.553 0.933) 1.926 3.758 ( -3.874 -2.410 1.539) 4.815 3.866 ( 4.333 -1.815 2.991) 5.569 3.983 ( -3.625 -1.260 -0.313) 3.851 4.113 ( 2.601 0.966 0.568) 2.832 4.189 ( -6.896 -0.443 -0.077) 6.910 4.340 ( 1.111 -0.866 0.586) 1.526 4.372 ( -1.651 1.440 -0.574) 2.265 4.641 ( 0.909 -0.131 0.523) 1.057 4.724 ( -4.926 -2.717 -1.707) 5.879 4.934 ( 1.907 -2.478 1.228) 3.360 5.031 ( -0.021 -0.964 -1.612) 1.878 5.082 ( -2.221 -3.058 2.732) 4.664 5.129 ( -1.349 -0.851 0.602) 1.705 5.271 ( 5.697 -3.939 0.970) 6.994 5.347 ( -1.981 -5.973 -2.710) 6.852 5.475 ( 0.878 1.843 2.466) 3.201 5.692 ( -1.051 1.139 -8.580) 8.719 5.812 ( 0.703 -2.489 6.396) 6.899 5.977 ( -1.719 -0.030 -3.649) 4.034 6.200 ( 4.863 -1.055 6.357) 8.073 6.434 ( -2.105 -2.940 -6.868) 7.761 6.672 ( 4.947 5.079 6.375) 9.534 6.839 ( 0.066 4.572 -2.238) 5.091 7.029 ( -5.802 4.021 2.642) 7.537 7.078 ( 3.255 -0.113 -5.739) 6.599 7.345 ( 3.474 3.186 7.191) 8.598 7.446 ( -7.857 2.331 4.377) 9.291 7.476 ( 3.210 7.878 -4.262) 9.515 7.568 ( -2.289 4.456 -3.595) 6.167 7.982 ( -1.015 0.847 1.106) 1.724 8.105 ( -3.288 1.589 -6.589) 7.533 8.317 ( -1.533 0.851 4.045) 4.409 8.424 ( 1.392 -0.903 -2.814) 3.267 8.644 ( 1.255 2.824 2.740) 4.130 8.791 ( -3.879 -0.738 -2.164) 4.502 9.178 ( -5.089 0.231 5.798) 7.718 9.260 ( 5.187 -1.420 -5.219) 7.494 9.447 ( 7.151 0.562 2.382) 7.558 9.604 ( -5.793 1.281 -1.255) 6.064 10.046 ( 0.948 6.048 8.126) 10.174 10.258 ( 5.974 8.180 -7.784) 12.774 10.529 ( -3.841 -3.200 4.634) 6.816 10.598 ( 1.472 -2.128 -3.949) 4.721 11.063 ( 5.447 3.106 1.233) 6.391 11.162 ( 2.144 -0.721 -2.701) 3.523 11.289 ( 0.656 1.236 -0.948) 1.690 11.329 ( -5.766 1.748 0.947) 6.099 11.613 ( -0.864 10.272 5.908) 11.881 11.759 ( 2.790 8.798 -6.047) 11.035 12.053 ( 4.423 7.665 2.010) 9.075 12.075 ( 6.381 2.776 -0.646) 6.988 12.368 ( 2.972 2.896 -1.460) 4.399 12.411 ( -6.550 2.606 1.518) 7.210 12.966 ( 1.006 5.282 0.734) 5.427 12.981 ( 2.106 6.055 -0.671) 6.446 13.417 ( 0.379 -6.080 3.852) 7.207 13.573 ( -1.291 -6.264 -4.015) 7.552 13.678 ( 0.074 4.623 2.330) 5.178 13.779 ( -3.250 2.550 -2.765) 4.971 15.709 ( -0.297 -1.964 2.054) 2.857 15.797 ( -3.407 -2.351 -1.495) 4.401 17.314 ( 6.545 -0.992 0.037) 6.620 17.428 ( -7.623 -1.156 -0.111) 7.710 18.061 ( 8.306 4.533 -1.298) 9.551 18.132 ( -5.624 5.761 1.318) 8.158 18.574 ( 4.257 6.102 4.780) 8.843 18.837 ( -3.756 6.483 -9.522) 12.116 19.255 ( 2.752 9.195 9.591) 13.569 19.434 ( 4.983 11.727 -4.753) 13.600 19.616 ( -1.468 -1.703 0.856) 2.406 19.703 ( -8.006 -4.997 -0.865) 9.477 21.778 ( 8.250 5.167 1.441) 9.840 21.864 ( -4.202 -3.345 2.387) 5.877 22.067 ( 1.113 -2.816 -2.595) 3.988 22.093 ( 0.242 -0.239 -3.968) 3.982 22.476 ( -4.374 -2.681 7.928) 9.443 22.658 ( 3.480 -3.441 -9.578) 10.756 22.911 ( -5.169 -3.964 6.700) 9.345 22.978 ( 3.397 -2.793 -1.949) 4.810 23.196 ( 0.686 -7.893 0.967) 7.982 23.281 ( -3.427 -4.730 -1.339) 5.993 ======================= Grid point 170 (72/102) ======================= q-point: (-0.27 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.631 ( 0.731 0.378 3.836) 3.923 1.775 ( 4.286 -2.890 -9.259) 10.604 1.984 ( -4.761 4.835 4.567) 8.179 2.097 ( 3.084 5.138 -4.743) 7.642 2.328 ( -7.762 3.514 10.877) 13.817 2.423 ( -3.268 -0.744 1.563) 3.698 2.489 ( 0.506 5.182 -1.535) 5.428 2.567 ( 7.755 0.579 -5.227) 9.370 2.661 ( 0.069 1.128 1.213) 1.658 2.681 ( -0.890 -2.723 -0.669) 2.942 2.944 ( -4.926 -0.686 1.148) 5.104 2.970 ( 0.475 6.730 0.683) 6.781 3.027 ( 0.525 -3.351 3.082) 4.583 3.158 ( 4.613 1.261 -4.339) 6.457 3.212 ( 1.001 -2.105 1.561) 2.805 3.266 ( -0.369 -2.545 -4.011) 4.765 3.332 ( 1.266 -4.298 1.669) 4.781 3.392 ( 1.412 1.831 -2.407) 3.338 3.557 ( -4.456 -2.239 2.551) 5.601 3.656 ( 3.400 -2.275 -5.082) 6.524 3.704 ( -2.969 -0.026 4.087) 5.052 3.796 ( 1.221 -2.646 -3.305) 4.406 3.954 ( -2.827 -2.992 1.593) 4.414 3.979 ( 3.178 -1.459 -0.458) 3.526 4.116 ( -4.878 3.557 0.956) 6.112 4.149 ( 5.009 -0.170 -1.304) 5.179 4.307 ( -5.261 -2.345 7.095) 9.139 4.462 ( 6.121 -3.114 -6.045) 9.149 4.654 ( 0.419 -0.258 4.265) 4.294 4.743 ( -2.523 -3.479 -3.488) 5.536 4.972 ( 4.129 1.271 1.308) 4.514 5.015 ( -3.289 0.771 -2.196) 4.030 5.117 ( -3.602 -1.295 1.870) 4.260 5.146 ( 2.513 -1.932 -0.255) 3.180 5.320 ( -4.616 -3.634 6.234) 8.566 5.435 ( 2.789 2.267 0.263) 3.603 5.515 ( 7.633 -5.829 -3.627) 10.266 5.616 ( -4.457 2.405 -7.887) 9.373 5.849 ( -0.371 0.147 5.319) 5.334 5.955 ( -0.259 1.112 -3.471) 3.654 6.257 ( -0.625 -0.899 8.809) 8.877 6.416 ( -2.463 1.235 -4.586) 5.350 6.629 ( 6.053 5.187 0.010) 7.971 6.678 ( -2.670 8.608 -3.876) 9.810 6.937 ( -0.940 3.827 5.104) 6.448 7.012 ( -1.302 7.835 -1.737) 8.131 7.255 ( 0.779 6.703 6.150) 9.130 7.383 ( 0.293 3.242 -4.487) 5.543 7.459 ( 3.352 -1.312 0.106) 3.601 7.477 ( -2.715 0.805 -1.575) 3.241 7.990 ( 1.294 -1.172 0.745) 1.898 8.068 ( -1.334 -0.399 -5.117) 5.303 8.279 ( -2.393 2.701 5.118) 6.262 8.444 ( 2.809 -0.200 -7.248) 7.776 8.622 ( -0.020 0.172 8.482) 8.483 8.810 ( 2.529 -2.970 -6.646) 7.706 9.178 ( -4.844 -2.594 6.460) 8.481 9.316 ( 1.912 -2.885 -4.741) 5.870 9.544 ( 1.662 -4.682 3.509) 6.082 9.583 ( -4.261 -3.483 1.056) 5.604 9.944 ( 0.238 7.021 4.581) 8.386 10.118 ( 3.380 8.123 -8.309) 12.101 10.572 ( -4.639 -3.916 4.550) 7.587 10.660 ( 4.187 -2.809 -2.622) 5.683 11.026 ( 0.647 4.780 1.655) 5.100 11.101 ( -1.284 5.095 -4.211) 6.734 11.283 ( -1.809 0.323 0.952) 2.069 11.285 ( 1.408 2.778 1.126) 3.312 11.456 ( -0.853 5.816 5.110) 7.789 11.608 ( 1.589 6.870 -7.881) 10.575 11.933 ( -1.613 6.860 5.236) 8.779 12.019 ( 1.443 5.154 -2.596) 5.948 12.341 ( -3.566 0.651 1.306) 3.853 12.373 ( 3.638 -0.486 -1.346) 3.910 12.892 ( -1.626 2.876 1.687) 3.709 12.930 ( 1.274 1.834 -1.434) 2.654 13.535 ( 2.535 -3.338 2.025) 4.655 13.559 ( -1.523 3.034 -0.258) 3.404 13.666 ( -2.515 -1.205 3.493) 4.469 13.784 ( 1.530 -5.726 -5.785) 8.282 15.743 ( -0.040 -1.014 3.642) 3.781 15.824 ( 0.044 -2.504 -3.063) 3.956 17.396 ( 2.467 -2.590 0.599) 3.627 17.412 ( -2.754 -3.003 -0.717) 4.137 18.012 ( -4.904 3.637 0.624) 6.137 18.039 ( 6.599 4.277 -1.791) 8.066 18.489 ( -3.542 4.632 7.777) 9.721 18.683 ( 2.448 6.356 -8.868) 11.181 19.143 ( -1.280 5.032 4.797) 7.068 19.226 ( 0.872 9.014 -2.535) 9.404 19.746 ( 1.837 -7.691 1.955) 8.145 19.792 ( -1.713 -8.865 -1.846) 9.216 21.702 ( -1.790 6.842 3.745) 8.002 21.793 ( 1.576 6.137 -3.565) 7.270 22.124 ( -1.882 -4.638 0.730) 5.059 22.175 ( 3.835 -3.975 -3.170) 6.369 22.482 ( -3.548 0.488 7.519) 8.328 22.673 ( 2.523 1.125 -9.339) 9.739 22.988 ( -1.796 -5.091 3.546) 6.459 23.020 ( 0.607 -0.674 2.012) 2.207 23.328 ( 0.937 -5.322 0.412) 5.419 23.362 ( -0.493 -6.230 -1.943) 6.545 ======================= Grid point 171 (73/102) ======================= q-point: (-0.18 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.599 ( 0.546 5.367 7.653) 9.363 1.718 ( -1.093 13.708 0.377) 13.757 1.858 ( 2.833 4.682 -3.331) 6.407 1.941 ( 1.714 10.826 -4.560) 11.871 2.208 ( -0.640 5.275 1.697) 5.578 2.334 ( 3.819 5.499 -3.468) 7.540 2.486 ( -3.811 -1.165 0.061) 3.985 2.571 ( 5.062 6.355 -1.652) 8.291 2.636 ( -2.480 0.240 4.538) 5.177 2.747 ( 1.042 -2.000 0.528) 2.316 2.859 ( -1.941 2.163 3.067) 4.225 2.927 ( 1.817 0.575 -0.489) 1.968 3.090 ( -2.316 -2.255 -1.627) 3.619 3.178 ( 4.496 0.083 -3.157) 5.494 3.264 ( -2.650 -4.458 0.995) 5.281 3.306 ( -3.307 3.435 1.164) 4.908 3.331 ( 1.279 -2.478 -2.006) 3.435 3.458 ( 8.060 -2.607 -3.392) 9.125 3.553 ( -4.024 -0.441 4.796) 6.276 3.677 ( -10.022 -0.836 3.178) 10.547 3.698 ( 3.290 -0.585 -1.790) 3.791 3.838 ( 0.324 -1.916 -4.414) 4.823 3.973 ( -4.617 -3.914 0.961) 6.129 4.021 ( -0.515 1.396 1.874) 2.393 4.060 ( 5.596 0.087 -0.254) 5.603 4.177 ( 4.543 0.058 -3.746) 5.888 4.337 ( -3.762 -1.948 6.416) 7.689 4.521 ( 4.719 -0.415 -5.040) 6.917 4.668 ( -0.634 0.081 6.155) 6.188 4.800 ( 1.972 -3.438 -5.824) 7.045 4.925 ( -2.715 3.814 0.215) 4.686 4.976 ( 3.106 2.971 0.166) 4.302 5.132 ( -2.435 -2.932 1.955) 4.284 5.199 ( 1.079 -2.281 -0.790) 2.644 5.341 ( -3.388 -0.281 4.034) 5.276 5.470 ( 3.444 -0.841 -4.544) 5.764 5.524 ( -4.912 -0.031 1.449) 5.122 5.640 ( 4.933 -3.465 -4.175) 7.333 5.816 ( -0.589 3.892 2.354) 4.586 5.906 ( 1.233 3.707 -2.767) 4.787 6.261 ( -3.302 -0.220 7.843) 8.512 6.373 ( 2.858 3.371 -1.455) 4.653 6.474 ( -5.519 4.871 1.439) 7.501 6.628 ( 4.197 4.409 -2.215) 6.478 6.808 ( -1.218 7.331 -1.212) 7.530 6.949 ( 8.059 0.619 -1.191) 8.170 7.149 ( 0.888 7.296 5.998) 9.487 7.289 ( 2.858 5.792 -6.784) 9.367 7.484 ( -0.951 -2.833 3.033) 4.258 7.559 ( 3.124 -5.514 -1.475) 6.507 8.028 ( 3.071 -0.643 0.060) 3.138 8.079 ( 2.069 -1.934 -4.708) 5.494 8.236 ( -3.921 0.309 6.598) 7.681 8.438 ( 3.935 1.639 -7.157) 8.330 8.669 ( -2.865 -3.514 9.397) 10.433 8.879 ( 2.791 -3.324 -7.709) 8.847 9.213 ( -5.300 -3.249 6.220) 8.794 9.367 ( 0.114 -2.775 -5.159) 5.859 9.616 ( -9.120 -6.864 2.689) 11.727 9.653 ( -0.034 -3.302 4.776) 5.806 9.836 ( -0.077 4.784 1.070) 4.903 10.019 ( 3.824 3.268 -7.480) 9.014 10.612 ( -4.927 -2.735 3.380) 6.571 10.724 ( 2.905 -0.739 0.086) 2.999 10.899 ( -4.297 5.800 -0.076) 7.219 10.996 ( 5.909 7.995 -1.740) 10.092 11.227 ( -0.902 1.429 -1.776) 2.451 11.255 ( 4.695 3.725 0.838) 6.052 11.429 ( -0.318 -0.332 4.262) 4.287 11.536 ( 1.951 0.769 -5.702) 6.075 11.812 ( -7.269 3.959 3.932) 9.164 11.944 ( 1.053 2.849 -1.847) 3.555 12.324 ( -3.988 -2.031 0.858) 4.557 12.435 ( 4.581 -2.646 -1.383) 5.469 12.835 ( -2.677 2.300 2.578) 4.371 12.911 ( 0.402 0.853 -1.804) 2.035 13.490 ( -0.627 3.203 0.853) 3.373 13.542 ( 2.148 3.022 -2.285) 4.355 13.754 ( -2.037 -7.640 6.739) 10.389 13.910 ( 1.479 -7.461 -5.782) 9.554 15.761 ( -0.324 -0.203 4.392) 4.408 15.868 ( 2.136 -2.239 -3.909) 4.985 17.396 ( -8.792 -2.720 -0.308) 9.208 17.531 ( 9.765 -3.935 0.555) 10.543 17.894 ( -3.432 6.314 0.126) 7.187 17.987 ( 4.872 5.935 -2.086) 7.957 18.421 ( -10.152 -2.487 5.138) 11.647 18.658 ( 8.928 -1.050 -4.131) 9.894 19.068 ( -5.356 1.000 0.478) 5.469 19.146 ( 4.300 2.068 0.121) 4.773 19.861 ( -7.471 -8.650 0.842) 11.460 20.000 ( 8.638 -9.379 -0.815) 12.777 21.528 ( -9.727 7.214 1.347) 12.185 21.705 ( 9.200 7.895 -1.962) 12.281 22.183 ( -2.265 -3.182 0.653) 3.960 22.232 ( 0.761 0.180 0.074) 0.785 22.455 ( -1.068 1.307 4.939) 5.220 22.630 ( 3.656 4.007 -8.897) 10.420 23.022 ( -1.850 -0.510 5.590) 5.911 23.075 ( -1.369 -3.931 -0.071) 4.163 23.409 ( -0.077 -3.054 1.476) 3.393 23.460 ( -0.013 -4.617 -3.154) 5.592 ======================= Grid point 172 (74/102) ======================= q-point: (-0.09 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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 ( 1.151 17.337 3.511) 17.726 1.463 ( 3.547 12.870 4.505) 14.090 1.723 ( 3.482 10.746 -0.524) 11.308 1.823 ( 7.516 6.082 -4.888) 10.834 2.092 ( 2.197 8.540 1.378) 8.925 2.328 ( 6.240 2.711 -8.019) 10.517 2.428 ( 2.311 7.275 1.451) 7.770 2.461 ( 4.627 5.584 -0.730) 7.288 2.561 ( -3.612 6.349 7.794) 10.682 2.751 ( -1.580 -0.186 -1.236) 2.015 2.875 ( 0.681 -0.663 -0.243) 0.981 2.942 ( 5.154 0.990 -1.613) 5.490 3.076 ( -1.692 0.904 -0.275) 1.938 3.176 ( -1.880 3.032 -0.186) 3.572 3.239 ( -2.456 -2.759 0.254) 3.703 3.330 ( -2.017 -1.121 -0.027) 2.308 3.368 ( 0.219 -0.572 -1.639) 1.750 3.449 ( 2.426 2.866 0.575) 3.799 3.534 ( -3.953 2.040 0.018) 4.449 3.638 ( -3.120 -1.194 -1.696) 3.747 3.759 ( -1.311 -5.261 3.591) 6.503 3.841 ( -2.101 0.069 -2.151) 3.007 3.987 ( -1.993 0.913 -3.122) 3.815 4.043 ( -3.981 -4.640 3.139) 6.872 4.111 ( 7.439 0.171 0.492) 7.458 4.224 ( 2.467 -3.923 -0.709) 4.688 4.341 ( -3.321 -0.014 5.235) 6.199 4.538 ( 2.877 -0.392 -3.409) 4.478 4.687 ( 1.662 -0.868 3.968) 4.389 4.781 ( -2.637 2.854 -4.841) 6.208 4.910 ( 5.065 0.891 0.060) 5.143 4.946 ( 4.209 1.838 -0.882) 4.677 5.176 ( -2.742 -3.061 0.778) 4.182 5.234 ( -1.391 -1.251 0.532) 1.944 5.320 ( -5.450 0.420 0.684) 5.508 5.378 ( -6.976 2.851 -1.678) 7.721 5.553 ( 1.860 1.531 -0.763) 2.527 5.705 ( 2.597 3.093 -1.599) 4.344 5.751 ( -0.172 -1.381 1.025) 1.729 5.881 ( 6.257 0.822 -0.337) 6.320 6.239 ( -1.913 3.072 4.288) 5.611 6.357 ( 7.708 0.476 -4.209) 8.795 6.403 ( -1.596 1.698 2.994) 3.794 6.538 ( 3.739 6.501 4.397) 8.693 6.738 ( -3.182 -0.278 -4.667) 5.656 7.047 ( 1.174 2.433 5.563) 6.184 7.069 ( 16.250 -1.255 -2.988) 16.570 7.222 ( 5.676 3.174 -5.178) 8.313 7.549 ( 0.009 -3.498 3.134) 4.696 7.675 ( 3.760 -4.010 -1.910) 5.820 8.080 ( 5.408 -2.333 0.269) 5.896 8.132 ( 2.607 -2.803 -3.374) 5.103 8.234 ( -2.365 -0.747 4.388) 5.040 8.422 ( 3.793 1.618 -4.325) 5.976 8.727 ( -5.705 -3.844 7.856) 10.442 8.925 ( -0.405 -2.620 -5.469) 6.077 9.230 ( -6.444 -2.250 5.763) 8.933 9.373 ( -2.095 0.412 -4.387) 4.878 9.680 ( -3.747 -5.817 -0.258) 6.924 9.724 ( -6.314 -5.184 7.617) 11.169 9.809 ( 2.010 -1.448 -2.869) 3.790 10.004 ( 2.753 0.429 -4.093) 4.952 10.574 ( -4.771 3.042 1.282) 5.802 10.713 ( 1.301 2.372 2.349) 3.583 10.830 ( 0.637 1.051 -3.982) 4.168 10.917 ( 6.737 4.570 1.146) 8.221 11.167 ( -1.674 2.557 -0.973) 3.207 11.315 ( 8.334 -2.319 -1.043) 8.713 11.441 ( 0.092 -0.862 3.870) 3.966 11.552 ( 1.864 -0.727 -1.836) 2.715 11.717 ( -5.379 0.580 0.258) 5.416 11.929 ( 2.406 0.255 -0.463) 2.463 12.371 ( -2.015 -5.781 -0.053) 6.122 12.518 ( 2.449 -3.659 -1.572) 4.675 12.781 ( -2.926 1.890 3.443) 4.897 12.892 ( 0.269 1.064 -1.819) 2.125 13.439 ( -0.112 2.325 1.215) 2.626 13.493 ( 0.661 2.787 -1.993) 3.489 13.895 ( -2.259 -7.960 4.612) 9.473 14.039 ( -0.010 -7.087 -4.288) 8.283 15.767 ( 0.105 0.456 4.235) 4.261 15.921 ( 3.406 -2.416 -3.898) 5.712 17.353 ( -10.184 -0.171 -0.974) 10.232 17.646 ( 6.508 1.133 2.211) 6.966 17.741 ( -1.462 7.989 0.832) 8.165 17.961 ( 10.418 -1.099 -2.983) 10.893 18.467 ( -9.904 -9.854 2.431) 14.181 18.813 ( 9.422 -7.772 -1.066) 12.260 19.041 ( -5.111 -2.727 -2.063) 6.149 19.193 ( 5.449 -2.764 1.700) 6.342 19.973 ( -8.387 -10.428 0.421) 13.389 20.208 ( 3.625 -7.142 -0.737) 8.043 21.334 ( -5.861 6.729 0.167) 8.926 21.619 ( 9.661 9.462 -0.342) 13.527 22.163 ( -3.155 5.091 2.160) 6.367 22.215 ( -0.515 -0.531 0.111) 0.748 22.449 ( 1.372 1.369 2.451) 3.125 22.550 ( 3.743 5.234 -7.209) 9.663 23.031 ( -3.359 -0.883 6.732) 7.575 23.113 ( -2.244 -2.112 -2.373) 3.889 23.435 ( -2.791 -0.146 1.743) 3.294 23.501 ( -2.074 -1.409 -3.308) 4.151 ======================= Grid point 178 (75/102) ======================= q-point: ( 0.36 0.36 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.325 ( 10.561 -0.000 3.101) 11.007 1.361 ( 9.848 -0.000 2.379) 10.131 1.582 ( 17.780 -0.000 -3.253) 18.075 1.739 ( 16.999 -0.000 -3.452) 17.346 2.215 ( -0.876 0.000 6.010) 6.073 2.323 ( 8.186 -0.000 -6.593) 10.511 2.346 ( -7.823 0.000 4.846) 9.203 2.463 ( 1.055 -0.000 -0.876) 1.371 2.535 ( 0.150 -0.000 -1.430) 1.437 2.617 ( -1.982 0.000 2.894) 3.507 2.746 ( -0.682 0.000 -0.948) 1.168 2.808 ( 10.165 -0.000 -3.810) 10.855 3.025 ( 3.191 -0.000 2.866) 4.289 3.074 ( -2.033 0.000 1.168) 2.344 3.096 ( 4.299 -0.000 -5.944) 7.335 3.280 ( 3.575 -0.000 0.620) 3.629 3.424 ( -1.999 0.000 2.876) 3.503 3.488 ( -2.799 0.000 -2.075) 3.484 3.551 ( 0.759 -0.000 -11.068) 11.094 3.663 ( -7.880 0.000 8.767) 11.788 3.721 ( -5.535 0.000 7.303) 9.164 3.804 ( -3.609 0.000 -3.640) 5.126 3.942 ( 2.503 -0.000 6.395) 6.867 3.989 ( 14.624 -0.000 -6.396) 15.962 4.333 ( 0.088 -0.000 1.035) 1.038 4.405 ( -2.924 0.000 1.743) 3.404 4.482 ( -4.923 0.000 -1.761) 5.228 4.538 ( 4.064 -0.000 0.851) 4.152 4.630 ( 0.385 -0.000 0.857) 0.939 4.702 ( -8.647 0.000 -3.742) 9.422 4.836 ( -7.798 0.000 -1.309) 7.908 4.901 ( -3.742 0.000 2.737) 4.636 4.923 ( -1.872 0.000 2.132) 2.838 5.043 ( -1.390 0.000 -4.320) 4.538 5.062 ( -4.665 0.000 -0.635) 4.708 5.209 ( -8.086 0.000 2.109) 8.356 5.413 ( 12.309 -0.000 -5.690) 13.561 5.520 ( 0.879 -0.000 6.932) 6.987 5.616 ( -9.059 0.000 7.235) 11.594 5.817 ( 3.144 -0.000 -11.197) 11.630 6.260 ( 0.997 -0.000 3.151) 3.305 6.261 ( 0.846 -0.000 3.766) 3.860 6.555 ( 3.404 -0.000 -3.486) 4.872 6.591 ( -2.652 0.000 0.770) 2.762 7.052 ( 6.354 -0.000 -2.846) 6.963 7.187 ( 8.440 -0.000 2.663) 8.850 7.390 ( 0.497 -0.000 0.303) 0.582 7.402 ( -4.976 0.000 1.940) 5.341 7.662 ( 1.426 -0.000 0.046) 1.427 7.922 ( -0.723 0.000 -8.123) 8.155 8.173 ( -3.012 0.000 -0.245) 3.022 8.396 ( 0.773 -0.000 2.744) 2.851 8.441 ( 4.415 -0.000 -2.086) 4.884 8.566 ( -9.299 0.000 0.279) 9.303 8.669 ( -13.328 0.000 9.802) 16.545 8.751 ( -1.668 0.000 -6.731) 6.935 9.349 ( 6.630 -0.000 -5.993) 8.937 9.469 ( -7.686 0.000 8.933) 11.784 9.752 ( 5.002 -0.000 -6.285) 8.033 10.056 ( -18.152 0.000 4.591) 18.724 10.278 ( -5.334 0.000 6.932) 8.746 10.283 ( 9.229 -0.000 -2.915) 9.678 10.503 ( 12.876 -0.000 -9.213) 15.833 10.773 ( 5.669 -0.000 1.753) 5.934 11.011 ( 0.896 -0.000 4.825) 4.907 11.166 ( 6.877 -0.000 -3.324) 7.639 11.454 ( 8.163 -0.000 1.363) 8.276 11.621 ( 7.310 -0.000 0.833) 7.357 11.654 ( 11.938 -0.000 -0.465) 11.947 11.804 ( 2.393 -0.000 3.623) 4.342 11.924 ( -2.504 0.000 -5.867) 6.379 12.067 ( -1.106 0.000 1.965) 2.255 12.481 ( 1.409 -0.000 1.316) 1.928 12.557 ( -1.028 0.000 -1.086) 1.495 13.170 ( -3.931 0.000 1.188) 4.106 13.236 ( -2.789 0.000 -0.937) 2.943 13.713 ( 8.523 -0.000 -1.076) 8.591 13.775 ( 7.786 -0.000 2.653) 8.226 14.045 ( -5.603 0.000 -0.602) 5.636 14.075 ( -3.595 0.000 -0.944) 3.716 15.617 ( -7.436 0.000 1.725) 7.633 15.813 ( -15.730 0.000 -0.876) 15.754 17.500 ( 6.651 -0.000 -2.074) 6.967 17.544 ( 7.011 -0.000 2.591) 7.474 18.282 ( 7.181 -0.000 -3.642) 8.051 18.337 ( 6.053 -0.000 5.728) 8.334 18.639 ( -10.142 0.000 -3.305) 10.667 18.739 ( -9.856 0.000 1.700) 10.002 19.801 ( -0.148 0.000 3.561) 3.564 19.977 ( -3.352 0.000 -2.959) 4.471 20.691 ( -4.375 0.000 6.169) 7.563 20.801 ( 7.494 -0.000 -13.479) 15.422 20.867 ( 2.542 -0.000 9.794) 10.119 21.231 ( 7.677 -0.000 -12.435) 14.613 21.936 ( -2.886 0.000 9.646) 10.068 22.057 ( 3.881 -0.000 -4.125) 5.664 22.184 ( -3.054 0.000 7.641) 8.229 22.383 ( -2.018 0.000 -2.364) 3.108 22.574 ( 4.724 -0.000 3.932) 6.146 22.733 ( 1.522 -0.000 -4.227) 4.493 23.022 ( -5.531 0.000 0.807) 5.590 23.104 ( -3.837 0.000 -1.579) 4.149 ======================= Grid point 179 (76/102) ======================= q-point: ( 0.45 0.36 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.436 ( 3.100 -3.967 5.653) 7.570 1.510 ( 8.431 -8.249 -3.580) 12.326 1.649 ( 10.589 4.649 1.767) 11.698 1.823 ( 9.257 1.726 -4.198) 10.310 2.181 ( 4.135 0.763 0.128) 4.207 2.244 ( -2.616 2.334 2.249) 4.166 2.453 ( -1.177 -6.088 -0.814) 6.254 2.525 ( -5.290 -2.667 0.540) 5.949 2.546 ( 5.593 -3.865 -2.272) 7.168 2.631 ( -3.783 -3.150 0.868) 4.999 2.765 ( 2.345 -2.089 -1.646) 3.546 2.922 ( 9.264 -4.126 -2.109) 10.359 3.032 ( -2.682 0.117 1.190) 2.937 3.057 ( -3.351 -1.913 1.268) 4.061 3.165 ( 6.180 -1.837 -2.358) 6.865 3.289 ( 1.672 1.459 -0.565) 2.291 3.388 ( -1.649 2.670 4.784) 5.721 3.450 ( -0.246 1.932 0.266) 1.965 3.571 ( -1.378 -0.445 -4.359) 4.593 3.584 ( -5.154 1.350 0.691) 5.372 3.676 ( -1.545 0.859 1.576) 2.369 3.760 ( -6.392 1.415 0.096) 6.547 3.954 ( 8.704 3.203 2.655) 9.647 4.095 ( 10.473 -0.031 -0.171) 10.474 4.281 ( 1.264 5.289 0.972) 5.525 4.320 ( -3.988 5.400 -1.468) 6.872 4.437 ( -3.318 1.928 -0.022) 3.838 4.601 ( 1.751 -2.131 0.168) 2.764 4.639 ( -0.088 -0.916 -2.829) 2.975 4.663 ( -4.506 -1.833 0.053) 4.865 4.764 ( -4.576 -0.173 -0.575) 4.615 4.832 ( -7.829 2.006 -1.127) 8.160 4.935 ( 2.336 -1.534 0.350) 2.816 5.021 ( -3.927 -0.608 0.888) 4.072 5.142 ( -1.892 -6.985 -1.158) 7.328 5.198 ( -6.963 -4.453 1.228) 8.356 5.393 ( 1.945 6.276 3.735) 7.558 5.549 ( 0.755 -2.556 -1.694) 3.157 5.616 ( 2.912 -3.023 4.071) 5.847 5.889 ( -1.652 -5.758 -6.934) 9.163 6.228 ( 5.851 3.489 -0.183) 6.814 6.290 ( -2.389 -1.431 3.628) 4.574 6.573 ( -1.640 -1.914 4.272) 4.960 6.665 ( 4.430 -6.414 -4.382) 8.943 7.083 ( 6.304 1.543 -1.593) 6.683 7.249 ( 6.577 0.238 2.387) 7.001 7.323 ( -2.361 2.693 -0.525) 3.620 7.438 ( -4.114 -3.512 0.363) 5.421 7.666 ( 1.120 1.017 1.398) 2.060 7.889 ( -2.734 0.773 -7.117) 7.663 8.154 ( -1.257 0.744 1.677) 2.224 8.388 ( -0.222 2.187 -0.069) 2.199 8.414 ( -3.973 2.878 1.801) 5.226 8.508 ( -4.450 0.197 -0.701) 4.509 8.602 ( -2.842 1.078 3.628) 4.734 8.719 ( -2.768 0.385 -3.478) 4.462 9.350 ( 5.252 3.264 -4.724) 7.782 9.403 ( -7.295 2.779 5.180) 9.369 9.746 ( 5.323 3.580 -4.804) 8.015 9.913 ( -13.242 3.115 3.785) 14.121 10.255 ( -4.135 1.070 9.636) 10.540 10.344 ( 7.694 -0.784 -3.462) 8.474 10.547 ( 7.424 2.540 -4.296) 8.946 10.737 ( 2.405 5.973 -2.524) 6.916 11.037 ( 2.964 -0.300 4.736) 5.595 11.172 ( 6.221 3.227 -2.983) 7.617 11.456 ( 4.206 4.548 1.618) 6.403 11.584 ( 4.485 5.530 -0.174) 7.123 11.804 ( 6.860 -4.895 -0.249) 8.431 11.900 ( -0.711 -3.726 -1.981) 4.280 11.949 ( 4.491 -5.714 1.342) 7.390 12.049 ( -0.576 0.550 0.093) 0.802 12.480 ( 2.796 1.714 -0.022) 3.280 12.557 ( -1.849 -0.406 0.136) 1.898 13.162 ( -3.045 -2.013 1.872) 4.102 13.243 ( -2.317 -3.091 -1.484) 4.138 13.636 ( 7.587 12.507 1.349) 14.690 13.773 ( 8.522 11.102 -0.081) 13.996 13.932 ( -6.223 3.215 -1.017) 7.077 14.019 ( -5.446 3.575 -0.647) 6.546 15.588 ( -5.140 -1.834 1.704) 5.718 15.726 ( -11.109 -1.747 -1.263) 11.317 17.451 ( 7.525 7.907 -0.358) 10.921 17.563 ( 1.053 2.791 0.433) 3.015 18.235 ( 14.265 4.291 -0.126) 14.897 18.493 ( -2.613 -0.820 2.171) 3.494 18.613 ( -5.398 -4.811 -1.208) 7.331 18.735 ( -10.710 -8.912 -0.489) 13.941 19.683 ( -1.168 11.631 3.559) 12.219 19.793 ( -1.911 13.180 -2.278) 13.512 20.418 ( 2.296 22.678 3.743) 23.099 20.630 ( 3.037 15.807 -6.879) 17.504 21.140 ( 0.364 -16.994 6.895) 18.343 21.393 ( 5.359 -12.172 -11.897) 17.844 22.023 ( -1.309 -7.978 9.717) 12.641 22.138 ( 1.505 -3.198 0.958) 3.662 22.229 ( -1.194 -6.915 -0.333) 7.025 22.356 ( -0.821 1.163 -4.201) 4.436 22.624 ( 2.779 -2.440 3.835) 5.327 22.764 ( 0.142 -2.273 -2.220) 3.180 22.987 ( -4.113 -0.117 2.050) 4.597 23.101 ( -3.442 -2.963 -2.575) 5.221 ======================= Grid point 180 (77/102) ======================= q-point: ( 0.55 0.36 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.483 ( -6.373 -0.346 11.944) 13.543 1.665 ( 0.435 -3.473 5.629) 6.629 1.725 ( 9.455 -6.936 -12.313) 17.004 1.829 ( 6.500 -1.126 -8.956) 11.123 2.216 ( 1.249 0.147 4.094) 4.282 2.274 ( 4.685 -3.844 -1.733) 6.303 2.504 ( 6.886 0.228 -3.318) 7.647 2.539 ( -12.645 -4.542 4.036) 14.029 2.635 ( -3.909 -4.851 2.612) 6.756 2.685 ( 0.378 -3.989 -3.457) 5.292 2.864 ( 9.912 -3.111 -2.198) 10.619 2.971 ( -8.245 -0.011 3.622) 9.005 3.084 ( 3.097 -4.824 -1.652) 5.966 3.091 ( 0.235 -3.619 0.440) 3.653 3.213 ( -0.118 -1.330 0.796) 1.555 3.264 ( -3.056 0.079 -0.633) 3.122 3.342 ( 4.839 4.198 3.618) 7.357 3.426 ( 1.960 2.942 3.188) 4.760 3.471 ( 0.961 3.844 -1.785) 4.345 3.601 ( -2.512 -1.337 -5.388) 6.093 3.656 ( -3.831 0.464 2.836) 4.789 3.714 ( -0.866 -1.710 -1.914) 2.709 3.949 ( 4.998 4.581 4.090) 7.918 4.129 ( 1.586 3.396 0.621) 3.799 4.169 ( 2.323 5.361 -5.211) 7.828 4.195 ( -3.684 3.850 0.047) 5.329 4.368 ( 0.741 3.520 2.962) 4.659 4.591 ( -6.919 4.768 -3.744) 9.199 4.634 ( 0.900 -0.168 0.891) 1.277 4.676 ( -3.588 -0.476 -0.575) 3.665 4.742 ( 0.054 -4.288 1.945) 4.709 4.850 ( -0.300 -7.178 -4.375) 8.411 5.015 ( -3.109 -1.535 3.360) 4.828 5.028 ( 6.653 -4.003 -0.791) 7.805 5.176 ( -4.530 0.478 2.232) 5.073 5.227 ( -2.962 -3.561 -2.180) 5.119 5.409 ( 2.663 -3.731 4.456) 6.393 5.584 ( -5.485 -4.522 -0.035) 7.109 5.740 ( 9.009 -3.103 -0.516) 9.542 5.925 ( -5.200 -2.951 -4.241) 7.330 6.216 ( 3.125 2.135 3.526) 5.172 6.323 ( 0.760 -2.653 -3.831) 4.721 6.643 ( -0.374 -4.555 8.248) 9.430 6.805 ( 3.700 -5.964 -5.285) 8.786 7.079 ( 4.597 2.895 -0.465) 5.453 7.212 ( -3.481 4.291 -3.006) 6.290 7.329 ( 4.939 -1.153 3.564) 6.198 7.465 ( -4.550 -3.181 -1.105) 5.661 7.643 ( -0.247 2.693 4.276) 5.059 7.809 ( -2.317 4.427 -5.747) 7.615 8.116 ( -0.326 3.754 2.990) 4.810 8.274 ( -4.488 5.901 -3.961) 8.406 8.371 ( 0.445 1.902 3.480) 3.991 8.462 ( 0.481 3.019 -2.546) 3.978 8.614 ( 0.167 -2.538 1.247) 2.833 8.698 ( -4.391 -1.953 -0.666) 4.852 9.289 ( -6.107 4.358 3.685) 8.358 9.316 ( 6.379 3.821 -5.337) 9.153 9.668 ( 1.065 7.513 2.233) 7.910 9.778 ( -3.735 4.774 -2.823) 6.686 10.210 ( -4.292 3.125 13.346) 14.364 10.409 ( 6.823 -0.955 -4.376) 8.162 10.516 ( 2.556 3.449 -1.750) 4.636 10.626 ( 0.228 5.424 -5.054) 7.417 11.083 ( 0.780 -1.491 3.965) 4.307 11.160 ( 6.600 2.071 -3.273) 7.652 11.393 ( 1.512 4.703 1.256) 5.097 11.480 ( -2.060 6.187 -1.045) 6.604 11.878 ( 2.669 1.918 0.978) 3.429 11.953 ( 0.193 -0.664 -0.843) 1.091 12.043 ( 4.123 -2.851 0.883) 5.090 12.108 ( 2.470 -4.110 -0.792) 4.860 12.470 ( 4.111 2.259 -0.521) 4.720 12.524 ( -4.566 1.580 0.717) 4.885 13.209 ( -0.745 -4.067 2.585) 4.876 13.292 ( -1.113 -2.484 -1.917) 3.330 13.415 ( 2.824 15.109 2.826) 15.628 13.516 ( 4.417 18.011 -3.471) 18.867 13.851 ( -3.169 3.536 1.399) 4.950 13.908 ( -2.815 3.815 -1.754) 5.055 15.613 ( -1.560 -3.111 1.861) 3.946 15.701 ( -5.753 -2.698 -1.539) 6.538 17.382 ( 7.520 5.362 -0.081) 9.236 17.481 ( -4.768 3.910 -0.053) 6.166 18.262 ( 11.206 5.607 1.638) 12.638 18.408 ( -4.511 5.809 -0.755) 7.393 18.659 ( 1.359 -2.026 1.816) 3.042 18.840 ( -9.353 -8.963 -3.890) 13.526 19.486 ( -1.810 7.998 4.475) 9.341 19.562 ( -0.557 8.720 -2.275) 9.029 20.032 ( 4.899 22.768 5.326) 23.890 20.271 ( -0.308 22.231 -6.671) 23.212 21.456 ( -1.479 -15.877 6.411) 17.186 21.635 ( 5.285 -11.900 -9.944) 16.384 22.105 ( 0.495 2.319 6.073) 6.520 22.239 ( -5.305 -8.720 9.778) 14.135 22.271 ( 1.764 4.087 -6.580) 7.944 22.412 ( 4.003 -8.962 -8.161) 12.765 22.723 ( -3.514 -6.483 4.837) 8.819 22.812 ( 0.601 -4.365 -2.621) 5.127 22.990 ( -0.481 -1.990 4.337) 4.795 23.134 ( -2.951 -3.669 -3.265) 5.730 ======================= Grid point 181 (78/102) ======================= q-point: (-0.36 -0.64 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.493 ( -3.670 -3.861 8.057) 9.659 1.730 ( 4.711 -0.007 -8.511) 9.728 1.818 ( -4.957 -8.386 2.983) 10.188 2.003 ( 7.449 -8.904 -8.356) 14.304 2.239 ( -1.770 -1.082 5.898) 6.252 2.359 ( 4.512 -3.334 -4.466) 7.170 2.509 ( -9.086 -2.718 3.323) 10.050 2.569 ( 4.939 0.351 -0.699) 5.001 2.695 ( -2.046 -3.656 1.917) 4.608 2.731 ( -2.035 -1.284 -0.550) 2.468 2.872 ( -5.659 1.425 4.033) 7.093 2.992 ( 8.406 -0.448 -4.737) 9.659 3.129 ( -3.732 -2.758 2.657) 5.348 3.163 ( -1.714 -0.413 0.600) 1.862 3.224 ( -3.729 -0.996 3.160) 4.988 3.254 ( -0.869 -0.308 -1.165) 1.486 3.324 ( 4.382 2.357 1.570) 5.217 3.382 ( 6.380 2.010 -5.513) 8.668 3.476 ( 4.257 0.562 -0.251) 4.302 3.581 ( 1.052 -0.910 -6.441) 6.590 3.665 ( -5.381 -2.636 4.839) 7.702 3.744 ( 0.717 -2.202 -1.609) 2.820 3.883 ( -3.676 4.007 8.085) 9.744 4.030 ( 3.954 4.473 -4.496) 7.474 4.081 ( -7.932 1.253 3.135) 8.621 4.188 ( 4.677 -0.055 -5.461) 7.191 4.368 ( 7.079 1.138 2.668) 7.651 4.422 ( -5.541 5.608 -1.829) 8.093 4.646 ( -0.157 -0.708 0.534) 0.900 4.662 ( -0.627 -0.068 -0.832) 1.044 4.857 ( -0.704 -6.687 4.090) 7.871 4.957 ( -0.879 -4.554 -3.899) 6.059 5.049 ( 0.726 -2.473 2.851) 3.843 5.096 ( -1.947 -0.861 1.364) 2.528 5.217 ( -5.101 -4.350 -1.207) 6.812 5.263 ( 9.996 -3.498 -3.104) 11.036 5.493 ( 1.244 -1.870 4.663) 5.176 5.621 ( -6.197 -3.857 -2.791) 7.815 5.832 ( 7.032 -0.397 1.034) 7.119 5.923 ( -4.555 -2.299 -3.880) 6.410 6.217 ( -1.712 -0.409 6.712) 6.939 6.368 ( 2.050 -2.201 -7.144) 7.751 6.732 ( -0.194 -2.566 8.683) 9.056 6.882 ( 1.760 -0.568 -3.614) 4.059 7.062 ( 0.704 2.197 -2.076) 3.104 7.092 ( -1.941 3.206 -3.496) 5.125 7.390 ( 0.440 -1.150 5.466) 5.603 7.471 ( 0.110 1.039 -0.259) 1.076 7.580 ( -2.722 3.726 2.886) 5.443 7.674 ( 1.511 8.368 -3.587) 9.230 8.038 ( 0.415 4.672 2.028) 5.110 8.132 ( -1.890 5.019 -5.390) 7.604 8.349 ( 1.730 2.117 2.613) 3.782 8.429 ( 2.472 0.678 -4.092) 4.828 8.663 ( -3.083 -2.381 3.314) 5.114 8.725 ( 0.706 -2.633 -1.166) 2.964 9.179 ( -5.201 3.519 4.382) 7.657 9.303 ( 6.926 2.115 -5.955) 9.376 9.540 ( -2.979 5.323 5.128) 7.969 9.654 ( 1.871 7.066 -4.772) 8.729 10.146 ( -3.690 3.666 12.133) 13.201 10.413 ( 4.626 6.248 -9.729) 12.454 10.475 ( -2.223 -0.438 3.746) 4.378 10.575 ( 1.923 -0.867 -4.160) 4.664 11.095 ( -3.869 -0.532 3.333) 5.134 11.184 ( 3.929 0.235 -4.004) 5.615 11.323 ( -0.640 3.305 1.665) 3.756 11.359 ( -0.800 4.518 -1.159) 4.733 11.797 ( -0.134 8.455 4.461) 9.560 11.898 ( 0.364 5.438 -3.948) 6.730 12.129 ( 1.011 -1.363 0.487) 1.765 12.141 ( -0.500 0.849 -0.499) 1.105 12.424 ( -5.048 3.331 1.888) 6.336 12.465 ( 4.674 3.845 -1.530) 6.243 13.129 ( -1.066 12.566 1.696) 12.725 13.167 ( 0.920 13.209 -1.567) 13.333 13.322 ( 0.488 -5.336 4.604) 7.064 13.434 ( -1.133 -5.754 -4.620) 7.466 13.767 ( 0.378 4.550 2.206) 5.071 13.825 ( 0.085 3.959 -2.630) 4.753 15.676 ( 1.412 -3.175 2.056) 4.038 15.722 ( -1.205 -2.635 -1.736) 3.378 17.367 ( 1.364 1.899 0.610) 2.416 17.384 ( -1.438 1.738 -0.741) 2.374 18.179 ( -5.180 6.552 3.590) 9.091 18.266 ( 6.611 8.288 -3.649) 11.212 18.677 ( -1.706 2.359 6.451) 7.078 18.865 ( -0.384 0.524 -10.162) 10.182 19.398 ( -2.312 2.392 8.411) 9.045 19.509 ( 2.740 -1.879 -2.042) 3.900 19.722 ( 2.162 14.203 3.214) 14.721 19.837 ( -1.767 21.657 -5.754) 22.478 21.700 ( -3.196 -11.208 4.859) 12.627 21.832 ( 4.852 -6.088 -5.600) 9.590 22.044 ( -2.734 2.608 2.868) 4.744 22.166 ( 3.111 6.123 -5.617) 8.873 22.372 ( -4.727 -6.783 8.172) 11.624 22.578 ( 5.487 -6.525 -9.084) 12.458 22.792 ( -7.953 -5.219 6.586) 11.570 22.929 ( 5.016 -5.779 -3.167) 8.281 23.084 ( 2.672 -5.976 3.901) 7.620 23.172 ( -2.694 -3.819 -2.652) 5.373 ======================= Grid point 182 (79/102) ======================= q-point: (-0.27 -0.64 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.594 ( 1.117 -5.794 2.094) 6.261 1.758 ( 6.701 -1.235 -10.614) 12.613 1.924 ( -8.702 -6.422 5.403) 12.090 2.148 ( 5.706 -2.278 -4.141) 7.409 2.243 ( -6.982 -2.040 8.786) 11.406 2.447 ( 1.604 -0.303 -0.155) 1.640 2.533 ( -1.705 -5.039 -1.481) 5.522 2.565 ( -0.587 -0.671 0.929) 1.288 2.642 ( -4.908 4.258 1.189) 6.605 2.727 ( 0.667 2.060 1.593) 2.688 2.884 ( -2.573 -2.651 -0.954) 3.816 3.019 ( 7.958 2.042 -4.490) 9.362 3.092 ( -5.170 3.472 1.976) 6.534 3.150 ( -2.745 0.652 1.902) 3.402 3.194 ( -4.611 -0.994 1.755) 5.033 3.267 ( 4.013 -2.906 1.807) 5.274 3.322 ( 7.275 3.936 -4.220) 9.286 3.425 ( 3.854 -1.163 -4.930) 6.365 3.472 ( -2.312 -1.456 -0.550) 2.787 3.629 ( 3.813 -1.791 -4.848) 6.423 3.694 ( -3.648 -2.441 2.792) 5.202 3.752 ( -0.966 1.365 2.726) 3.198 3.856 ( -5.549 -4.297 3.153) 7.694 4.025 ( 8.608 1.058 -1.967) 8.893 4.060 ( -6.669 -3.741 2.421) 8.021 4.210 ( 5.774 1.625 -0.866) 6.060 4.293 ( -3.222 2.706 2.055) 4.683 4.453 ( 8.530 -1.971 -3.444) 9.408 4.659 ( -2.037 -2.193 -1.512) 3.353 4.669 ( 1.423 -0.098 2.345) 2.745 4.965 ( -2.274 -3.468 0.295) 4.158 4.992 ( 1.271 -1.879 -0.225) 2.280 5.078 ( -1.859 -0.451 2.863) 3.444 5.133 ( 1.702 -2.663 1.082) 3.341 5.218 ( -5.788 -3.246 0.677) 6.671 5.433 ( 7.785 -4.522 -6.713) 11.230 5.521 ( 2.711 0.037 5.920) 6.512 5.600 ( -4.661 0.370 -5.716) 7.385 5.873 ( 3.396 0.599 3.648) 5.020 5.927 ( -2.909 -1.946 -3.138) 4.701 6.220 ( -6.939 -1.405 5.595) 9.024 6.396 ( 1.385 -1.044 -4.502) 4.824 6.758 ( 2.424 2.212 4.802) 5.816 6.820 ( 0.212 7.606 -6.349) 9.910 6.957 ( -5.157 2.126 4.359) 7.079 7.118 ( 5.142 0.503 -4.600) 6.918 7.343 ( -6.348 4.318 6.164) 9.846 7.427 ( 0.233 3.353 4.148) 5.339 7.524 ( 0.528 1.521 -4.726) 4.993 7.541 ( 6.382 8.238 -1.885) 10.590 7.996 ( 1.936 0.857 2.065) 2.957 8.062 ( 1.402 1.362 -5.342) 5.688 8.335 ( 1.556 1.996 2.785) 3.763 8.437 ( 2.436 -0.025 -4.145) 4.808 8.672 ( 0.404 0.264 2.186) 2.239 8.772 ( 3.052 -1.057 -1.784) 3.690 9.115 ( -6.168 -0.068 5.108) 8.009 9.301 ( 2.848 1.004 -2.994) 4.252 9.462 ( -8.462 0.130 1.488) 8.593 9.586 ( 6.039 1.575 -0.548) 6.265 10.062 ( -3.882 5.348 7.572) 10.050 10.264 ( -0.211 8.398 -8.529) 11.971 10.494 ( -2.437 -2.359 3.801) 5.094 10.636 ( 4.948 -3.134 -3.277) 6.712 11.058 ( -6.213 1.953 1.411) 6.663 11.157 ( -1.488 0.987 -2.298) 2.911 11.278 ( -2.415 1.197 0.016) 2.695 11.336 ( 6.512 0.983 0.163) 6.587 11.614 ( -2.467 10.743 6.139) 12.616 11.752 ( -0.140 9.063 -5.915) 10.823 12.046 ( -5.484 6.025 1.572) 8.297 12.089 ( -5.553 3.918 -0.679) 6.830 12.351 ( -0.464 2.498 -0.093) 2.543 12.427 ( 4.367 3.047 0.166) 5.327 12.954 ( -2.453 5.602 0.834) 6.172 12.991 ( -0.918 5.726 -0.636) 5.834 13.458 ( 1.933 -6.765 5.320) 8.820 13.517 ( -2.590 -4.907 -4.398) 7.080 13.699 ( 0.621 4.244 1.380) 4.506 13.770 ( 4.104 2.231 -2.758) 5.425 15.745 ( 3.333 -1.025 2.838) 4.497 15.765 ( 0.554 -3.227 -2.487) 4.112 17.316 ( -6.777 -0.990 -0.081) 6.850 17.423 ( 7.622 -1.082 0.147) 7.700 18.029 ( -7.301 4.010 0.639) 8.354 18.184 ( 7.539 6.360 -1.909) 10.047 18.564 ( -9.416 6.394 5.919) 12.829 18.806 ( 5.555 5.237 -7.569) 10.750 19.283 ( -4.068 9.696 8.041) 13.237 19.434 ( -2.775 13.317 -5.445) 14.652 19.634 ( 1.389 -0.188 0.087) 1.404 19.681 ( 8.004 -7.793 0.149) 11.172 21.762 ( -9.540 3.603 2.061) 10.404 21.868 ( 1.499 -1.442 2.277) 3.085 22.075 ( 3.068 -1.011 -3.724) 4.930 22.115 ( 3.944 -2.414 -4.728) 6.614 22.449 ( -3.889 -3.133 8.578) 9.926 22.663 ( 2.583 -1.884 -8.712) 9.280 22.866 ( -4.208 -6.710 6.096) 9.995 23.027 ( 3.833 -1.037 -1.516) 4.251 23.230 ( 1.273 -7.183 0.314) 7.302 23.244 ( 1.247 -5.543 -0.574) 5.710 ======================= Grid point 183 (80/102) ======================= q-point: (-0.18 -0.64 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.676 ( 2.643 -0.084 2.985) 3.988 1.816 ( 6.915 -0.881 -11.641) 13.568 1.920 ( -4.908 1.647 3.029) 5.999 2.138 ( 2.884 6.869 -0.645) 7.478 2.249 ( -8.371 -1.625 10.555) 13.569 2.390 ( -1.507 1.217 -0.081) 1.939 2.481 ( -0.426 7.423 -1.567) 7.599 2.610 ( -2.302 -3.358 -0.172) 4.075 2.669 ( 4.030 -3.829 -2.880) 6.261 2.711 ( 2.505 0.759 2.260) 3.459 2.862 ( -4.654 0.364 1.711) 4.972 2.983 ( 0.600 5.121 -0.187) 5.159 3.037 ( -0.783 -1.490 -0.678) 1.815 3.173 ( -0.027 -3.632 0.907) 3.743 3.233 ( -2.659 -3.950 0.833) 4.834 3.265 ( 4.655 4.733 -5.179) 8.419 3.380 ( 1.236 -1.298 -1.598) 2.402 3.409 ( 5.383 0.086 -1.542) 5.600 3.508 ( -3.488 -3.474 2.011) 5.318 3.648 ( -6.056 2.320 4.516) 7.903 3.685 ( 2.582 -2.784 -2.833) 4.737 3.786 ( 1.262 -3.012 -3.741) 4.966 3.895 ( -3.539 -2.281 1.973) 4.650 4.048 ( -2.049 1.236 0.535) 2.452 4.098 ( 8.051 -1.054 -2.110) 8.390 4.230 ( 5.476 1.048 -0.049) 5.576 4.273 ( -3.156 -1.793 5.504) 6.593 4.535 ( 5.793 -1.329 -4.882) 7.691 4.681 ( -0.246 -0.262 4.035) 4.051 4.716 ( 0.716 -4.535 -2.106) 5.051 4.936 ( -3.830 0.916 -1.718) 4.297 5.042 ( 2.934 1.514 2.442) 4.107 5.083 ( -1.650 -2.022 1.403) 2.963 5.175 ( 0.592 -1.254 -0.365) 1.434 5.281 ( -1.953 -4.802 3.392) 6.195 5.476 ( 1.544 -0.085 -2.264) 2.742 5.507 ( -3.952 1.776 -2.901) 5.215 5.618 ( 5.578 -2.328 -2.373) 6.493 5.875 ( 0.942 2.182 2.085) 3.162 5.929 ( -1.200 -0.443 -1.044) 1.651 6.195 ( -8.342 -2.201 3.906) 9.471 6.415 ( 0.511 -0.537 1.723) 1.876 6.612 ( 0.230 11.590 -5.504) 12.833 6.727 ( 3.565 4.204 -0.583) 5.543 6.951 ( -1.065 -1.124 6.071) 6.266 7.026 ( 4.349 10.179 -2.560) 11.361 7.276 ( -1.729 3.387 2.560) 4.584 7.390 ( -1.104 1.029 -0.924) 1.770 7.453 ( 5.909 2.721 -3.499) 7.386 7.533 ( 5.021 -0.118 0.956) 5.113 8.040 ( 4.213 -2.043 1.486) 4.913 8.061 ( 3.358 -0.166 -4.283) 5.445 8.285 ( 0.386 4.980 4.167) 6.505 8.452 ( 1.632 -0.969 -4.119) 4.536 8.670 ( 2.077 2.076 4.512) 5.383 8.818 ( 2.440 -3.029 -6.857) 7.884 9.105 ( -9.188 -3.506 5.375) 11.207 9.311 ( -0.050 -1.675 -2.238) 2.796 9.431 ( -9.802 -4.387 2.106) 10.943 9.637 ( 3.417 -1.202 2.392) 4.341 9.933 ( -3.987 6.207 3.342) 8.099 10.102 ( -0.616 6.075 -7.371) 9.572 10.538 ( -1.581 -2.993 2.761) 4.368 10.724 ( 4.545 -2.407 -1.189) 5.278 10.949 ( -5.719 4.027 -0.071) 6.995 11.139 ( 3.124 2.571 -1.179) 4.214 11.234 ( -3.754 1.288 -0.006) 3.969 11.369 ( 7.267 2.183 0.950) 7.647 11.451 ( -2.528 4.902 4.433) 7.076 11.590 ( 0.027 5.551 -6.327) 8.417 11.870 ( -7.966 7.345 2.791) 11.189 11.971 ( -6.211 2.943 -0.811) 6.921 12.303 ( -0.693 1.839 -0.683) 2.081 12.437 ( 3.358 -0.320 0.718) 3.448 12.867 ( -2.195 2.854 0.762) 3.680 12.923 ( -1.255 1.367 -0.654) 1.968 13.532 ( -0.905 0.763 -1.276) 1.740 13.600 ( 3.759 -2.849 2.141) 5.179 13.637 ( -2.544 -0.472 1.724) 3.109 13.809 ( 3.912 -3.399 -2.956) 5.965 15.774 ( 1.853 0.192 2.998) 3.529 15.830 ( 2.277 -2.859 -2.690) 4.538 17.299 ( -5.838 -1.991 -0.162) 6.170 17.531 ( 9.052 -3.723 0.736) 9.816 17.932 ( -4.796 2.079 -1.554) 5.453 18.125 ( 4.780 5.997 -1.707) 7.857 18.379 ( -11.650 4.583 5.395) 13.632 18.744 ( 6.603 4.231 -4.586) 9.085 19.103 ( -4.776 6.544 3.212) 8.715 19.241 ( 0.954 6.238 -1.278) 6.439 19.687 ( -3.163 -5.192 -0.290) 6.086 19.912 ( 10.753 -8.564 0.202) 13.748 21.577 ( -11.104 6.631 1.199) 12.989 21.877 ( 5.713 3.960 -0.587) 6.976 22.099 ( -0.925 -2.972 -0.837) 3.224 22.215 ( 2.851 -3.392 -2.654) 5.165 22.466 ( -2.744 -0.078 7.053) 7.568 22.676 ( 2.776 0.310 -7.519) 8.021 22.971 ( -2.238 -5.675 2.887) 6.749 23.033 ( 0.011 1.093 1.900) 2.192 23.346 ( 1.009 -4.753 -0.558) 4.891 23.365 ( 1.943 -5.387 -0.885) 5.795 ======================= Grid point 185 (81/102) ======================= q-point: (-0.09 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.647 ( 0.939 5.402 7.064) 8.942 1.712 ( -0.074 12.889 1.102) 12.936 1.908 ( 5.695 0.579 -9.632) 11.205 1.968 ( 4.554 12.104 1.801) 13.057 2.235 ( 3.159 1.744 0.635) 3.664 2.384 ( 4.276 3.868 -2.455) 6.267 2.424 ( -3.745 -4.323 -0.092) 5.721 2.616 ( -0.353 0.389 1.396) 1.492 2.663 ( 4.447 7.082 0.182) 8.364 2.742 ( -2.234 0.597 2.243) 3.221 2.837 ( -2.184 -2.176 2.957) 4.272 2.933 ( -0.592 0.345 -0.835) 1.080 3.092 ( 3.041 -3.109 -3.230) 5.417 3.192 ( -1.021 2.809 -2.230) 3.729 3.208 ( -2.450 0.679 -2.921) 3.872 3.296 ( -2.177 -2.232 3.498) 4.686 3.330 ( 0.550 -1.570 -1.109) 1.999 3.500 ( -4.157 0.373 -0.393) 4.193 3.537 ( -3.466 -2.363 3.641) 5.554 3.576 ( 2.472 1.661 0.613) 3.040 3.734 ( 2.181 -0.614 0.408) 2.302 3.821 ( 0.900 -0.626 -5.358) 5.469 3.919 ( -3.226 -3.598 2.634) 5.504 4.010 ( -0.876 1.189 0.259) 1.499 4.172 ( 7.950 -0.563 -1.631) 8.135 4.221 ( 2.305 1.794 -1.278) 3.189 4.321 ( -1.497 -2.391 5.325) 6.026 4.540 ( -1.348 1.191 -4.222) 4.589 4.697 ( 1.838 -0.825 5.234) 5.609 4.780 ( -1.277 -1.246 -5.186) 5.484 4.931 ( 4.215 -1.340 -0.359) 4.437 5.009 ( -0.056 3.037 3.739) 4.817 5.113 ( -1.900 -1.978 0.662) 2.822 5.196 ( -2.065 -1.085 -1.377) 2.709 5.311 ( -2.332 0.100 1.120) 2.589 5.393 ( -2.252 3.646 -2.334) 4.880 5.559 ( 2.110 -2.325 0.740) 3.225 5.676 ( 0.859 -2.492 -2.425) 3.581 5.817 ( 0.263 4.163 0.055) 4.171 5.928 ( 1.365 0.189 0.305) 1.412 6.202 ( -6.555 -2.928 3.774) 8.111 6.422 ( -0.723 0.652 2.413) 2.602 6.457 ( 7.784 5.537 -2.432) 9.857 6.661 ( 0.300 4.509 -0.845) 4.597 6.853 ( 7.716 10.032 -2.730) 12.947 7.034 ( 2.115 -4.209 3.374) 5.795 7.190 ( 1.043 4.784 2.096) 5.326 7.353 ( 7.814 3.948 -6.825) 11.101 7.496 ( 2.827 -2.740 2.569) 4.701 7.623 ( 4.410 -4.313 0.079) 6.169 8.085 ( 5.388 -0.391 -3.713) 6.556 8.129 ( 5.355 -2.387 -0.712) 5.906 8.220 ( -0.940 1.577 6.185) 6.452 8.465 ( 3.283 0.669 -4.816) 5.866 8.656 ( -4.180 -0.333 6.947) 8.115 8.866 ( -0.169 -2.359 -7.521) 7.884 9.114 ( -11.607 -4.603 5.541) 13.660 9.337 ( -0.742 -1.509 -3.633) 4.003 9.476 ( -9.466 -7.380 1.708) 12.124 9.672 ( 0.860 -1.182 3.695) 3.974 9.831 ( -1.220 2.719 0.755) 3.074 10.023 ( 0.449 1.405 -4.729) 4.954 10.568 ( -2.267 -0.657 1.970) 3.075 10.752 ( -0.159 1.268 0.396) 1.338 10.867 ( 1.450 2.444 -0.340) 2.862 11.073 ( 3.747 6.315 0.020) 7.343 11.204 ( -0.495 1.003 -1.887) 2.194 11.369 ( 9.708 1.824 -1.445) 9.984 11.424 ( -2.901 -0.927 3.865) 4.921 11.550 ( 1.945 -0.720 -3.677) 4.221 11.711 ( -6.388 4.015 2.216) 7.864 11.909 ( -4.519 -0.832 -0.229) 4.601 12.292 ( -0.298 -1.737 -0.856) 1.959 12.479 ( 1.309 -1.960 0.660) 2.448 12.810 ( -1.394 2.297 1.187) 2.937 12.901 ( -0.553 0.427 -0.909) 1.147 13.493 ( 0.754 2.869 0.345) 2.987 13.558 ( 1.054 3.799 -1.631) 4.266 13.747 ( -2.025 -7.170 3.098) 8.069 13.912 ( 0.920 -5.955 -2.102) 6.381 15.785 ( 0.873 0.373 3.197) 3.335 15.888 ( 2.205 -2.515 -3.006) 4.497 17.283 ( -5.710 -0.725 -0.463) 5.775 17.681 ( 8.390 -3.543 2.592) 9.469 17.850 ( -1.605 4.499 -0.944) 4.869 18.024 ( 1.423 3.775 -5.007) 6.430 18.301 ( -7.304 -2.009 5.505) 9.365 18.771 ( 7.225 -3.041 -3.233) 8.479 19.002 ( -3.530 1.949 1.601) 4.338 19.201 ( 2.678 0.000 0.140) 2.681 19.761 ( -5.523 -6.677 -0.352) 8.672 20.121 ( 6.208 -6.453 0.155) 8.955 21.394 ( -7.145 5.312 0.411) 8.913 21.827 ( 7.329 6.508 -0.985) 9.851 22.149 ( -2.315 -3.533 -0.159) 4.226 22.229 ( -1.379 2.415 1.193) 3.026 22.471 ( 0.575 -0.373 3.248) 3.320 22.654 ( 4.294 3.566 -7.549) 9.389 23.013 ( -2.449 0.109 5.392) 5.923 23.043 ( -2.740 -3.138 0.084) 4.167 23.406 ( -0.986 -1.560 -0.057) 1.847 23.444 ( -0.449 -2.901 -1.592) 3.340 ======================= Grid point 192 (82/102) ======================= q-point: ( 0.45 0.45 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.459 ( 6.877 -0.000 -1.764) 7.099 1.463 ( 3.449 -0.000 -0.561) 3.494 1.800 ( 10.021 -0.000 1.858) 10.192 1.883 ( -0.059 0.000 2.659) 2.659 2.191 ( -3.053 0.000 3.936) 4.981 2.282 ( -1.643 0.000 -4.368) 4.667 2.300 ( -1.079 0.000 4.318) 4.451 2.508 ( 1.713 -0.000 -5.433) 5.697 2.549 ( -6.442 0.000 3.073) 7.138 2.558 ( 3.923 -0.000 -7.899) 8.819 2.783 ( 10.038 -0.000 0.039) 10.038 2.924 ( -1.404 0.000 1.329) 1.933 3.006 ( -0.193 0.000 -1.930) 1.940 3.016 ( -4.493 0.000 2.881) 5.337 3.208 ( 8.160 -0.000 -1.914) 8.381 3.315 ( -1.898 0.000 -0.781) 2.052 3.370 ( -9.201 0.000 9.750) 13.406 3.475 ( 2.262 -0.000 -1.921) 2.968 3.556 ( 8.239 -0.000 -11.497) 14.144 3.560 ( -6.883 0.000 2.386) 7.285 3.684 ( -2.281 0.000 3.991) 4.597 3.741 ( -2.587 0.000 -0.818) 2.714 4.062 ( 7.703 -0.000 5.432) 9.426 4.178 ( 10.230 -0.000 -2.270) 10.479 4.330 ( -3.757 0.000 5.129) 6.358 4.349 ( -4.644 0.000 -1.085) 4.769 4.428 ( -1.321 0.000 -0.412) 1.384 4.595 ( -0.654 0.000 3.320) 3.383 4.600 ( 2.210 -0.000 -9.581) 9.832 4.668 ( 3.868 -0.000 0.252) 3.876 4.691 ( -8.613 0.000 0.318) 8.619 4.807 ( -4.651 0.000 -3.189) 5.639 4.971 ( 1.238 -0.000 1.969) 2.326 5.014 ( 1.303 -0.000 0.522) 1.404 5.023 ( 1.090 -0.000 -2.831) 3.033 5.099 ( -7.067 0.000 1.045) 7.144 5.457 ( -11.826 0.000 12.066) 16.895 5.570 ( 12.521 -0.000 -9.123) 15.492 5.586 ( -2.087 0.000 7.248) 7.542 5.803 ( 0.214 -0.000 -9.140) 9.143 6.269 ( -0.940 0.000 3.745) 3.861 6.302 ( 3.673 -0.000 -0.669) 3.734 6.546 ( -5.293 0.000 4.854) 7.182 6.613 ( 5.639 -0.000 -5.042) 7.565 7.150 ( 7.197 -0.000 -0.223) 7.200 7.293 ( 1.315 -0.000 0.322) 1.353 7.325 ( -2.742 0.000 -0.394) 2.770 7.377 ( -2.321 0.000 0.683) 2.419 7.696 ( 2.965 -0.000 1.391) 3.275 7.857 ( -2.891 0.000 -6.398) 7.020 8.166 ( 1.960 -0.000 3.054) 3.629 8.376 ( -8.364 0.000 -3.254) 8.974 8.427 ( 1.342 -0.000 2.414) 2.762 8.466 ( -5.920 0.000 5.167) 7.858 8.616 ( 0.956 -0.000 1.023) 1.400 8.718 ( 1.556 -0.000 -6.324) 6.512 9.382 ( -7.616 0.000 5.867) 9.614 9.422 ( 7.415 -0.000 -6.489) 9.853 9.810 ( 6.436 -0.000 -4.942) 8.115 9.843 ( -12.893 0.000 4.695) 13.721 10.258 ( -2.788 0.000 8.892) 9.319 10.368 ( 3.500 -0.000 -2.159) 4.113 10.634 ( 8.526 -0.000 -3.081) 9.066 10.788 ( -2.307 0.000 -4.596) 5.143 11.069 ( 1.924 -0.000 7.279) 7.529 11.236 ( 3.837 -0.000 -4.832) 6.170 11.532 ( 1.573 -0.000 4.493) 4.760 11.681 ( 0.048 -0.000 -1.957) 1.958 11.814 ( 0.259 -0.000 0.273) 0.377 11.821 ( 9.142 -0.000 -2.381) 9.447 11.931 ( 3.011 -0.000 0.583) 3.067 12.020 ( -4.924 0.000 0.136) 4.926 12.518 ( 2.075 -0.000 0.247) 2.090 12.544 ( -0.557 0.000 -0.420) 0.697 13.126 ( -2.176 0.000 2.492) 3.308 13.196 ( -1.361 0.000 -2.014) 2.431 13.835 ( 7.646 -0.000 1.017) 7.713 13.861 ( 2.342 -0.000 2.103) 3.148 13.963 ( -5.075 0.000 -0.190) 5.079 14.015 ( -2.906 0.000 -3.156) 4.290 15.542 ( -2.914 0.000 2.465) 3.817 15.637 ( -6.361 0.000 -2.084) 6.694 17.576 ( 3.709 -0.000 -0.049) 3.710 17.613 ( 1.325 -0.000 0.022) 1.325 18.366 ( 5.488 -0.000 -1.140) 5.605 18.452 ( 6.288 -0.000 3.235) 7.071 18.487 ( -8.357 0.000 -0.880) 8.403 18.622 ( -6.045 0.000 -0.699) 6.086 19.809 ( -0.720 0.000 4.214) 4.275 19.925 ( -1.405 0.000 -3.328) 3.612 20.650 ( -3.931 0.000 5.526) 6.782 20.835 ( 4.842 -0.000 -12.563) 13.464 20.940 ( 0.451 -0.000 11.490) 11.499 21.269 ( 5.231 -0.000 -14.015) 14.960 21.936 ( -3.105 0.000 10.720) 11.160 22.087 ( 2.612 -0.000 -4.357) 5.080 22.182 ( -1.639 0.000 6.950) 7.141 22.343 ( -1.089 0.000 -3.845) 3.996 22.651 ( 2.482 -0.000 3.389) 4.200 22.747 ( 1.625 -0.000 -3.253) 3.636 22.963 ( -2.389 0.000 1.880) 3.040 23.044 ( -2.399 0.000 -2.679) 3.596 ======================= Grid point 193 (83/102) ======================= q-point: (-0.45 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.441 ( -4.094 0.234 5.922) 7.203 1.615 ( 8.462 -8.470 -9.025) 14.994 1.710 ( -6.173 6.666 7.925) 12.056 1.898 ( 3.402 1.636 -6.395) 7.426 2.203 ( -3.483 -1.319 2.370) 4.415 2.263 ( 4.165 -0.232 0.093) 4.173 2.371 ( -4.168 -5.727 3.472) 7.888 2.522 ( -0.092 -1.731 -0.983) 1.993 2.560 ( 2.304 -3.403 -3.995) 5.731 2.599 ( 1.291 -3.286 -2.668) 4.425 2.884 ( -9.577 -0.877 -0.052) 9.617 2.898 ( 13.405 -2.095 -1.391) 13.639 2.996 ( -7.778 -2.272 3.102) 8.677 3.054 ( 4.538 -2.851 -1.551) 5.579 3.219 ( -3.110 2.353 2.890) 4.854 3.256 ( -0.366 0.899 -0.403) 1.051 3.383 ( -7.543 -3.418 7.083) 10.897 3.466 ( 2.210 2.011 1.038) 3.163 3.523 ( -0.543 0.717 -2.319) 2.487 3.594 ( 8.671 1.294 -8.867) 12.470 3.669 ( -0.863 1.683 2.161) 2.871 3.706 ( 0.236 1.531 -0.309) 1.580 4.095 ( 6.069 3.005 3.514) 7.630 4.184 ( -1.979 3.405 1.805) 4.332 4.224 ( -5.642 5.317 -0.681) 7.783 4.282 ( -2.878 4.335 -1.065) 5.312 4.439 ( 3.363 0.044 3.771) 5.053 4.588 ( -2.292 1.457 -6.384) 6.937 4.606 ( -0.845 -1.352 2.814) 3.235 4.681 ( 3.070 -0.014 -2.959) 4.264 4.698 ( 0.130 -1.528 0.158) 1.541 4.769 ( 2.651 -0.587 -4.568) 5.314 4.961 ( -4.223 -1.161 2.655) 5.122 5.023 ( 6.546 -1.566 -1.852) 6.981 5.103 ( -5.169 -3.429 1.709) 6.434 5.149 ( 4.007 -6.106 -2.045) 7.584 5.389 ( -6.612 -0.321 9.971) 11.969 5.521 ( -1.970 2.323 1.777) 3.527 5.726 ( 8.641 -5.457 -2.670) 10.563 5.811 ( -5.074 -3.288 -5.385) 8.097 6.262 ( -2.378 1.620 2.152) 3.593 6.314 ( 5.486 0.284 -2.663) 6.105 6.557 ( -3.994 -4.432 7.134) 9.300 6.701 ( 2.697 -5.835 -5.265) 8.309 7.176 ( 5.638 2.746 1.355) 6.416 7.228 ( -6.913 2.334 -3.046) 7.906 7.351 ( 3.547 -0.746 2.239) 4.260 7.379 ( -3.748 -2.230 -0.189) 4.365 7.708 ( 3.114 1.815 2.897) 4.625 7.820 ( -1.337 0.724 -6.714) 6.884 8.183 ( 2.825 2.020 4.769) 5.899 8.300 ( -4.674 1.779 -4.231) 6.551 8.410 ( -0.713 1.379 4.649) 4.901 8.469 ( -1.867 -1.716 1.706) 3.056 8.616 ( 2.153 1.386 -0.938) 2.726 8.692 ( 1.763 2.442 -4.324) 5.270 9.319 ( -5.374 2.352 3.616) 6.891 9.431 ( 8.109 3.773 -6.332) 10.958 9.739 ( -9.102 3.128 5.270) 10.972 9.840 ( 7.292 1.760 -4.465) 8.730 10.241 ( -4.588 1.549 10.762) 11.801 10.401 ( 1.852 -2.119 -2.102) 3.513 10.633 ( 5.506 5.362 -1.296) 7.794 10.709 ( -2.552 4.352 -7.089) 8.701 11.081 ( -1.652 0.642 6.888) 7.112 11.214 ( 0.672 1.962 -4.691) 5.129 11.499 ( 0.379 4.949 4.308) 6.572 11.589 ( -1.249 6.731 -3.110) 7.519 11.873 ( 1.348 -4.721 0.311) 4.920 11.905 ( 0.098 -3.201 -1.855) 3.701 11.984 ( 0.523 -2.716 2.855) 3.975 12.036 ( -1.265 -4.796 -1.682) 5.237 12.520 ( -2.693 1.663 0.217) 3.173 12.528 ( 2.871 0.489 -0.340) 2.932 13.149 ( 0.343 -2.670 2.847) 3.918 13.213 ( -0.141 -2.960 -2.525) 3.893 13.725 ( 0.376 13.507 3.918) 14.069 13.821 ( -1.344 12.237 -3.983) 12.939 13.897 ( 1.334 1.925 1.983) 3.069 13.946 ( -0.645 2.842 -2.128) 3.608 15.559 ( 0.032 -2.115 2.992) 3.664 15.628 ( -0.105 -2.323 -2.685) 3.551 17.536 ( 1.580 5.699 0.273) 5.920 17.544 ( -1.592 5.948 -0.371) 6.168 18.397 ( -7.383 3.281 2.141) 8.358 18.447 ( 9.301 -1.006 -2.151) 9.600 18.564 ( -1.033 -6.369 3.146) 7.178 18.635 ( -1.099 -6.333 -2.862) 7.036 19.687 ( -0.290 11.944 3.855) 12.554 19.767 ( 0.117 12.712 -2.800) 13.017 20.447 ( -1.465 18.396 6.505) 19.567 20.634 ( 2.006 17.536 -8.940) 19.786 21.165 ( -1.170 -15.573 7.440) 17.299 21.406 ( 3.942 -12.666 -13.345) 18.816 22.028 ( -3.978 -8.636 10.825) 14.408 22.147 ( -1.518 -1.488 2.752) 3.478 22.242 ( 3.467 -8.117 -1.789) 9.007 22.330 ( 0.757 0.301 -5.948) 6.004 22.658 ( -2.017 -0.062 5.046) 5.435 22.756 ( 0.294 -1.513 -2.966) 3.342 22.971 ( 0.797 -1.115 3.156) 3.441 23.054 ( -0.480 -2.691 -3.581) 4.505 ======================= Grid point 194 (84/102) ======================= q-point: (-0.36 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.420 ( -7.919 -1.685 10.422) 13.197 1.627 ( -8.363 -3.129 5.430) 10.451 1.805 ( 8.213 -1.399 -13.536) 15.895 1.881 ( 4.148 -5.739 -7.938) 10.637 2.198 ( -5.787 -1.777 2.079) 6.401 2.320 ( 3.142 -2.773 -0.854) 4.277 2.417 ( -4.277 -1.725 2.177) 5.100 2.584 ( -4.461 -5.223 4.355) 8.133 2.639 ( 9.895 -0.911 -3.654) 10.587 2.667 ( 0.340 -3.161 0.077) 3.181 2.827 ( -9.115 -0.552 0.406) 9.141 2.997 ( -5.546 -4.062 2.840) 7.438 3.024 ( 4.068 -3.052 -0.378) 5.100 3.138 ( 1.090 -2.787 -0.973) 3.147 3.197 ( -4.857 1.274 2.544) 5.629 3.218 ( 0.769 -2.318 0.104) 2.445 3.376 ( -2.002 1.473 2.219) 3.332 3.480 ( 4.791 1.537 -0.404) 5.048 3.512 ( 0.178 -1.962 -2.655) 3.306 3.576 ( 4.888 3.985 -4.185) 7.569 3.640 ( 0.285 0.713 2.895) 2.995 3.706 ( 1.221 -0.164 -1.172) 1.700 4.012 ( -2.017 8.969 6.291) 11.139 4.053 ( -6.331 4.212 -4.286) 8.729 4.173 ( -4.453 -1.186 -1.058) 4.728 4.180 ( 5.685 4.822 0.104) 7.456 4.460 ( -0.065 4.478 0.023) 4.478 4.487 ( 3.458 2.861 -0.035) 4.488 4.654 ( 0.864 -2.251 0.464) 2.456 4.674 ( 4.417 2.678 -1.502) 5.380 4.745 ( 1.059 -4.178 1.173) 4.467 4.859 ( 2.298 -5.368 -4.118) 7.145 4.985 ( -3.187 -4.046 2.228) 5.611 5.086 ( -0.616 -0.033 0.485) 0.784 5.132 ( 1.039 -2.742 0.828) 3.047 5.270 ( 8.714 -3.323 -3.220) 9.866 5.438 ( -3.286 -5.789 5.797) 8.827 5.500 ( -3.923 -2.275 1.499) 4.776 5.815 ( -6.981 -3.555 -3.098) 8.424 5.866 ( 8.209 -2.875 -1.547) 8.834 6.203 ( -5.310 1.477 2.940) 6.247 6.352 ( 3.898 -0.911 -4.410) 5.956 6.653 ( -3.129 -5.979 8.070) 10.520 6.808 ( -0.087 -5.808 -5.802) 8.210 7.115 ( -6.354 3.584 -3.409) 8.052 7.148 ( 3.673 4.014 1.966) 5.785 7.375 ( -3.192 -1.004 2.067) 3.933 7.422 ( 0.944 -3.541 -0.010) 3.665 7.688 ( 3.359 4.211 4.516) 7.029 7.776 ( 2.001 3.112 -6.792) 7.734 8.139 ( 0.584 4.967 3.911) 6.348 8.211 ( -1.166 4.885 -1.922) 5.377 8.416 ( 4.553 1.055 0.357) 4.687 8.470 ( 1.232 1.901 -3.004) 3.763 8.589 ( -2.169 -0.158 1.963) 2.930 8.702 ( 3.388 -2.305 -0.226) 4.104 9.236 ( -2.488 4.296 1.709) 5.250 9.401 ( 8.100 3.926 -6.230) 10.947 9.608 ( -7.562 5.750 5.423) 10.939 9.822 ( 8.849 6.499 -4.509) 11.869 10.181 ( -7.833 2.323 12.502) 14.935 10.454 ( 1.242 -1.947 -0.706) 2.415 10.538 ( 0.349 6.366 -5.497) 8.418 10.598 ( 0.554 4.018 -4.500) 6.058 11.051 ( -6.694 0.055 4.564) 8.102 11.181 ( -2.903 0.416 -3.151) 4.304 11.399 ( -2.535 5.457 1.460) 6.192 11.462 ( 1.704 5.733 -0.511) 6.002 11.913 ( -0.628 0.156 -0.032) 0.648 11.928 ( -0.421 2.233 -0.516) 2.331 12.048 ( -4.495 -4.547 0.861) 6.451 12.105 ( -2.604 -3.741 -0.786) 4.625 12.452 ( -3.123 3.005 0.567) 4.371 12.541 ( 3.518 1.018 -0.298) 3.675 13.233 ( 2.038 -4.509 2.762) 5.667 13.279 ( 1.096 -3.670 -2.681) 4.675 13.409 ( -6.016 17.619 3.425) 18.930 13.505 ( -3.396 17.303 -3.080) 17.900 13.862 ( 3.353 3.484 1.448) 5.048 13.899 ( 2.994 3.864 -1.939) 5.259 15.620 ( 1.361 -3.423 1.688) 4.052 15.697 ( 6.207 -2.517 -1.538) 6.872 17.384 ( -7.735 5.310 -0.154) 9.383 17.479 ( 5.075 4.001 0.040) 6.463 18.239 ( -12.054 5.747 2.340) 13.558 18.455 ( 8.249 6.342 -3.138) 10.868 18.641 ( -5.715 -3.355 3.314) 7.409 18.824 ( 9.967 -7.589 -3.058) 12.895 19.488 ( -0.192 9.023 4.086) 9.908 19.566 ( 2.378 7.095 -2.344) 7.841 20.065 ( -5.191 21.973 5.349) 23.203 20.243 ( 1.985 22.841 -6.955) 23.959 21.449 ( -3.040 -14.799 5.927) 16.229 21.658 ( 4.092 -13.435 -10.931) 17.797 22.088 ( -6.374 3.427 6.738) 9.888 22.195 ( -5.652 -7.970 9.142) 13.381 22.290 ( 4.542 2.813 -7.067) 8.859 22.466 ( 7.674 -9.329 -8.885) 14.995 22.665 ( -6.575 -3.296 7.000) 10.154 22.833 ( 2.484 -6.729 -1.435) 7.315 23.035 ( 3.482 -3.366 4.619) 6.693 23.098 ( 0.624 -2.669 -4.300) 5.099 ======================= Grid point 195 (85/102) ======================= q-point: (-0.27 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.470 ( -3.674 -7.084 4.963) 9.397 1.690 ( -10.033 -8.844 5.780) 14.570 1.793 ( 4.943 0.390 -11.278) 12.320 2.080 ( 5.237 -8.526 -5.089) 11.225 2.191 ( -6.493 -1.897 3.311) 7.532 2.402 ( -1.345 -2.288 -4.774) 5.462 2.415 ( 0.248 -4.310 1.091) 4.453 2.591 ( -3.363 1.893 6.131) 7.245 2.684 ( 1.470 1.788 -0.383) 2.347 2.746 ( 2.645 -1.850 0.589) 3.281 2.781 ( -6.409 -3.355 0.897) 7.289 3.038 ( -8.602 -4.938 3.422) 10.492 3.072 ( -4.688 1.181 2.798) 5.586 3.115 ( 3.934 -1.777 -2.870) 5.184 3.228 ( 0.384 0.568 -2.491) 2.584 3.265 ( 2.584 0.559 -0.059) 2.644 3.331 ( -1.155 -0.661 1.289) 1.853 3.459 ( 5.727 2.492 -5.849) 8.557 3.517 ( 2.209 1.503 -3.035) 4.043 3.614 ( -3.192 0.272 3.737) 4.922 3.638 ( 7.504 -3.529 -1.846) 8.495 3.739 ( -1.778 -3.635 0.899) 4.145 3.832 ( -6.253 7.370 4.574) 10.693 3.976 ( -2.797 -0.042 -0.106) 2.799 4.125 ( 6.461 2.665 -0.422) 7.002 4.229 ( 0.826 -2.356 -1.900) 3.137 4.349 ( 0.787 4.532 -1.205) 4.755 4.505 ( 5.232 1.220 3.752) 6.553 4.657 ( 4.993 2.104 -3.772) 6.602 4.685 ( 1.915 0.177 0.991) 2.163 4.861 ( 0.474 -6.271 0.476) 6.307 4.940 ( -1.197 -3.917 0.103) 4.097 5.058 ( -1.856 -4.372 1.995) 5.152 5.080 ( 0.418 -0.629 2.178) 2.305 5.153 ( -1.093 -0.689 -2.851) 3.130 5.407 ( 8.516 -3.902 -4.405) 10.351 5.518 ( -4.136 -1.840 1.333) 4.719 5.532 ( 0.341 -4.437 3.061) 5.402 5.831 ( -5.629 -4.109 -2.058) 7.267 5.932 ( 5.740 0.932 0.646) 5.851 6.153 ( -7.492 -0.375 2.286) 7.842 6.379 ( 0.928 -0.974 -2.889) 3.187 6.734 ( -3.926 -3.958 7.151) 9.067 6.866 ( -1.374 -1.659 -7.460) 7.765 6.994 ( -5.010 4.122 -0.125) 6.489 7.125 ( 3.996 0.846 -0.405) 4.105 7.358 ( -4.930 0.304 3.381) 5.986 7.488 ( -1.061 -2.444 -1.283) 2.957 7.594 ( 3.834 9.720 2.620) 10.772 7.717 ( 5.129 4.981 -2.263) 7.499 8.064 ( 2.066 4.078 1.819) 4.920 8.119 ( 1.981 4.196 -2.149) 5.113 8.406 ( 5.444 3.500 -0.116) 6.473 8.452 ( 2.370 0.117 -4.586) 5.164 8.625 ( -0.256 -3.470 0.960) 3.609 8.783 ( 2.619 -2.372 3.188) 4.759 9.139 ( -1.576 4.714 1.367) 5.155 9.385 ( 6.951 3.589 -4.984) 9.276 9.448 ( -8.478 5.824 3.998) 11.036 9.723 ( 6.945 8.298 -2.621) 11.134 10.105 ( -8.318 2.495 9.565) 12.919 10.377 ( -2.941 7.489 -8.954) 12.038 10.474 ( -0.624 0.267 4.512) 4.563 10.603 ( 3.825 -2.978 -3.811) 6.166 11.024 ( -5.656 -1.227 1.357) 5.945 11.116 ( -8.257 0.654 -0.993) 8.343 11.293 ( -4.511 3.203 -0.360) 5.544 11.420 ( 5.474 2.364 0.843) 6.022 11.799 ( -2.165 9.650 3.332) 10.436 11.871 ( -1.075 4.726 -3.448) 5.948 12.045 ( -7.634 -0.358 -1.488) 7.786 12.082 ( -10.163 2.114 2.105) 10.592 12.399 ( 1.911 1.891 -0.722) 2.784 12.526 ( 2.415 3.426 0.707) 4.251 13.076 ( -6.069 11.651 0.528) 13.148 13.148 ( -3.370 13.492 -0.381) 13.912 13.362 ( 1.615 -6.346 3.381) 7.370 13.393 ( -0.932 -5.249 -2.980) 6.108 13.812 ( 3.874 5.862 0.813) 7.073 13.857 ( 5.451 3.217 -1.660) 6.544 15.706 ( 3.229 -3.745 -0.980) 5.041 15.778 ( 6.972 -0.498 1.047) 7.068 17.265 ( -7.200 1.181 -0.090) 7.297 17.477 ( 6.231 0.887 0.180) 6.297 18.049 ( -11.244 5.047 0.819) 12.352 18.367 ( 6.550 8.012 -2.052) 10.550 18.595 ( -8.310 3.540 2.646) 9.412 18.925 ( 8.215 3.474 -2.621) 9.296 19.388 ( -2.277 4.047 5.927) 7.530 19.596 ( 6.518 -0.057 -3.374) 7.340 19.633 ( -7.896 11.787 -1.093) 14.230 19.881 ( 5.669 18.307 -0.584) 19.173 21.653 ( -5.768 -8.892 3.404) 11.132 21.835 ( -2.479 -2.983 -3.027) 4.920 22.001 ( -1.334 -2.623 -1.484) 3.296 22.202 ( 2.410 4.302 -1.506) 5.156 22.354 ( -1.646 -6.039 5.721) 8.480 22.613 ( 3.349 -3.919 -8.912) 10.296 22.725 ( -3.875 -6.485 7.439) 10.602 23.003 ( 6.277 -6.767 -1.765) 9.397 23.127 ( -0.041 -3.206 0.027) 3.207 23.172 ( 5.037 -5.290 0.523) 7.323 ======================= Grid point 196 (86/102) ======================= q-point: (-0.18 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.616 ( 0.611 -8.291 -0.861) 8.358 1.789 ( -4.279 -7.096 -0.180) 8.288 1.836 ( 2.000 -3.243 -5.500) 6.691 2.130 ( -9.428 -1.345 5.900) 11.203 2.240 ( 2.824 -1.519 1.047) 3.374 2.396 ( -6.255 -0.344 0.769) 6.311 2.502 ( -1.518 -3.120 2.517) 4.287 2.586 ( 2.033 -4.938 -4.466) 6.961 2.618 ( 0.785 6.778 0.379) 6.834 2.747 ( 1.900 0.002 3.703) 4.162 2.831 ( -3.873 -2.342 -1.533) 4.779 3.022 ( -4.050 0.649 0.868) 4.193 3.036 ( -4.330 0.917 -0.560) 4.462 3.129 ( -3.153 0.929 0.456) 3.319 3.193 ( 6.786 -1.157 -0.415) 6.896 3.321 ( 1.792 -1.794 -1.583) 2.989 3.369 ( -2.163 -2.767 2.183) 4.136 3.438 ( 5.688 2.740 -9.268) 11.214 3.497 ( 1.999 2.636 3.309) 4.679 3.631 ( 1.070 -3.196 -3.737) 5.033 3.654 ( -6.921 2.891 3.992) 8.496 3.766 ( 5.613 -1.761 -0.884) 5.949 3.823 ( -0.380 -4.468 1.745) 4.811 3.997 ( -2.996 -3.478 1.584) 4.856 4.150 ( 7.506 1.401 -0.474) 7.650 4.238 ( -0.254 -0.601 0.887) 1.101 4.328 ( 5.290 2.172 -0.587) 5.749 4.536 ( 0.914 -1.120 2.120) 2.566 4.655 ( 4.015 0.533 -5.966) 7.211 4.699 ( 0.440 -0.607 4.013) 4.082 4.913 ( -1.992 -0.732 -1.356) 2.519 5.018 ( 0.368 -4.277 0.977) 4.402 5.085 ( 1.221 -0.270 3.589) 3.801 5.149 ( -0.654 -1.387 0.172) 1.543 5.176 ( 0.512 -5.707 -1.226) 5.860 5.466 ( 0.054 -0.687 -2.766) 2.850 5.505 ( -2.214 0.483 -1.440) 2.685 5.619 ( 4.261 -1.941 0.385) 4.698 5.862 ( -3.848 -3.273 -0.472) 5.074 5.948 ( 4.376 1.900 2.371) 5.328 6.106 ( -7.661 -1.139 0.392) 7.755 6.396 ( -0.935 -1.354 1.198) 2.035 6.769 ( -3.895 -1.268 1.719) 4.442 6.779 ( -1.010 7.037 -6.958) 9.948 6.924 ( -3.026 0.665 4.260) 5.268 7.176 ( 4.476 -1.396 -3.870) 6.080 7.294 ( -4.169 4.926 7.137) 9.622 7.383 ( -3.886 4.575 -3.893) 7.154 7.569 ( 5.065 0.240 -0.244) 5.076 7.639 ( 6.184 7.749 0.322) 9.919 8.052 ( 3.631 0.268 3.084) 4.771 8.096 ( 5.278 0.826 -3.888) 6.608 8.392 ( 4.906 3.495 0.860) 6.085 8.454 ( 2.066 0.614 -2.573) 3.356 8.688 ( 2.267 -2.051 -3.372) 4.551 8.809 ( -3.616 -0.311 5.003) 6.181 9.050 ( -1.326 4.186 -0.887) 4.480 9.313 ( -3.354 2.685 2.300) 4.873 9.352 ( -2.101 1.644 -0.359) 2.691 9.679 ( 6.169 1.908 -0.290) 6.464 9.995 ( -8.321 4.470 5.425) 10.893 10.191 ( -4.507 7.372 -6.639) 10.897 10.495 ( 0.259 -1.866 2.641) 3.244 10.698 ( 4.772 -3.829 -2.680) 6.679 10.962 ( -6.018 2.455 0.420) 6.513 11.116 ( -2.262 -4.550 -0.895) 5.159 11.213 ( -5.740 1.219 -0.198) 5.872 11.433 ( 3.389 0.996 1.822) 3.974 11.606 ( -0.907 9.901 3.948) 10.697 11.701 ( -3.611 9.712 -4.253) 11.201 11.919 ( -11.207 4.742 0.140) 12.170 11.971 ( -7.251 2.640 0.085) 7.717 12.366 ( 1.627 4.147 -1.767) 4.792 12.479 ( 1.664 2.463 2.215) 3.707 12.908 ( -3.376 3.879 -0.732) 5.194 12.955 ( -3.447 4.846 0.468) 5.966 13.468 ( -1.534 -4.790 -3.105) 5.911 13.504 ( 0.919 -6.547 4.088) 7.773 13.727 ( 3.180 6.100 -0.661) 6.911 13.849 ( 6.658 2.533 -0.633) 7.152 15.788 ( 3.843 -2.528 -3.227) 5.619 15.819 ( 4.002 0.774 3.305) 5.247 17.229 ( -4.403 -1.608 -0.081) 4.688 17.542 ( 7.776 -2.236 0.594) 8.113 17.916 ( -7.266 1.663 -1.143) 7.541 18.275 ( 5.584 6.783 -1.712) 8.951 18.411 ( -12.292 7.794 3.603) 14.994 18.868 ( 3.898 5.912 -1.717) 7.287 19.226 ( -6.469 10.148 3.238) 12.462 19.347 ( -4.498 6.235 -2.817) 8.188 19.688 ( 4.785 6.214 -0.613) 7.867 19.848 ( 12.996 -8.390 0.458) 15.476 21.602 ( -12.193 5.083 1.225) 13.266 21.864 ( -2.614 -5.171 1.976) 6.122 22.121 ( 4.674 -1.712 -4.353) 6.613 22.150 ( 2.902 -0.889 -3.310) 4.491 22.436 ( -2.800 -2.905 8.002) 8.962 22.654 ( 0.445 -2.196 -6.369) 6.752 22.850 ( -0.861 -6.677 4.901) 8.327 23.072 ( 2.901 1.504 -1.667) 3.669 23.243 ( 2.751 -7.231 -1.099) 7.814 23.306 ( 4.671 -4.534 0.911) 6.573 ======================= Grid point 197 (87/102) ======================= q-point: (-0.09 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.713 ( -0.093 -0.657 2.558) 2.643 1.845 ( 0.267 2.826 -3.010) 4.137 1.888 ( 1.885 -5.193 -6.610) 8.615 2.140 ( -6.007 -4.572 6.524) 9.977 2.213 ( 2.108 5.207 1.643) 5.852 2.369 ( -1.720 -1.304 -0.756) 2.287 2.470 ( -1.857 5.470 2.306) 6.220 2.565 ( -0.839 -2.529 -1.911) 3.279 2.699 ( 1.488 -4.644 -0.721) 4.929 2.759 ( 1.727 1.659 1.950) 3.088 2.831 ( -1.504 0.175 2.426) 2.860 2.976 ( -0.808 2.394 -2.857) 3.814 3.026 ( 0.812 -3.081 -1.445) 3.499 3.136 ( -4.304 -3.458 1.775) 5.800 3.249 ( 3.460 0.538 0.973) 3.634 3.266 ( -2.424 4.333 -2.100) 5.391 3.358 ( -1.428 2.460 -1.362) 3.153 3.458 ( -2.378 -2.720 0.324) 3.627 3.518 ( 5.933 -0.365 -1.303) 6.085 3.598 ( -1.706 -0.614 2.152) 2.814 3.701 ( 0.917 -3.453 -0.995) 3.708 3.813 ( 0.654 -0.003 -1.935) 2.043 3.888 ( 4.391 -1.181 0.888) 4.633 4.020 ( -1.573 -0.515 -0.723) 1.807 4.203 ( 5.368 -1.994 -1.519) 5.924 4.253 ( -1.844 0.133 3.363) 3.838 4.314 ( 5.845 2.448 -0.285) 6.343 4.534 ( -5.333 0.866 -1.084) 5.511 4.679 ( -1.081 -2.746 0.890) 3.083 4.736 ( 2.834 -1.519 0.293) 3.229 4.926 ( 2.663 -1.661 -0.366) 3.160 5.071 ( -1.047 -1.772 0.082) 2.059 5.086 ( 2.030 2.876 2.800) 4.498 5.156 ( -2.338 -0.998 0.193) 2.549 5.273 ( -1.143 -3.017 -1.187) 3.438 5.433 ( -1.696 1.545 -0.785) 2.425 5.526 ( 2.916 -2.803 -0.344) 4.060 5.651 ( 1.183 -0.166 -2.145) 2.456 5.879 ( -0.874 0.219 0.676) 1.127 5.915 ( -1.539 1.735 0.810) 2.457 6.119 ( -2.439 -2.981 1.690) 4.206 6.419 ( -0.341 -1.116 2.249) 2.534 6.620 ( 2.858 7.524 -4.349) 9.148 6.724 ( -3.406 3.132 -1.316) 4.810 6.948 ( -3.147 -4.385 5.567) 7.753 7.101 ( 6.079 9.967 -3.081) 12.074 7.240 ( -2.850 0.678 -0.049) 2.930 7.347 ( -2.733 -2.353 -0.749) 3.683 7.569 ( 7.610 3.729 -1.517) 8.610 7.612 ( 4.025 -0.438 1.332) 4.262 8.107 ( 2.695 -2.411 3.501) 5.034 8.133 ( 7.855 0.192 -4.208) 8.914 8.320 ( 1.705 6.352 2.285) 6.963 8.469 ( 2.886 -0.426 -0.996) 3.083 8.670 ( -6.130 1.574 -0.123) 6.330 8.821 ( -1.335 -2.337 -0.564) 2.750 8.972 ( -4.571 1.080 -1.598) 4.961 9.301 ( -1.370 -2.073 0.771) 2.602 9.341 ( -2.030 -1.854 1.447) 3.107 9.694 ( 2.967 1.230 2.060) 3.816 9.871 ( -5.504 3.522 3.094) 7.229 10.046 ( -2.608 3.510 -5.278) 6.854 10.542 ( 0.374 -1.874 1.524) 2.445 10.761 ( 0.772 -0.358 -1.638) 1.845 10.908 ( 0.084 0.782 0.807) 1.126 11.164 ( 0.902 0.416 -0.579) 1.150 11.177 ( -3.037 -1.661 -1.159) 3.650 11.406 ( -4.046 2.050 4.472) 6.370 11.490 ( 5.053 4.798 -0.632) 6.996 11.551 ( -1.190 2.162 -3.514) 4.294 11.756 ( -7.342 4.887 1.042) 8.881 11.876 ( -4.784 2.077 0.004) 5.216 12.296 ( -0.144 2.497 -1.402) 2.868 12.473 ( 0.669 0.181 2.142) 2.251 12.842 ( -0.926 1.966 -0.960) 2.376 12.898 ( -1.794 0.405 0.412) 1.885 13.517 ( -0.556 -1.789 -1.029) 2.137 13.606 ( -2.072 -1.810 0.415) 2.782 13.660 ( 3.131 1.197 0.833) 3.454 13.865 ( 4.122 -0.077 -0.391) 4.142 15.814 ( 1.668 1.198 1.696) 2.663 15.857 ( 2.200 -1.933 -1.650) 3.362 17.235 ( -2.525 -1.338 -0.136) 2.861 17.675 ( 9.170 -4.708 2.064) 10.513 17.864 ( -2.654 -0.027 -2.819) 3.871 18.109 ( -7.396 9.492 -2.992) 12.400 18.280 ( -2.248 1.178 4.989) 5.597 18.800 ( 2.620 2.732 -2.258) 4.408 19.053 ( -3.244 5.390 1.906) 6.574 19.235 ( -0.900 3.030 -0.614) 3.220 19.668 ( 0.566 -0.675 -0.462) 0.995 20.070 ( 9.266 -5.666 0.252) 10.864 21.424 ( -8.922 4.535 0.666) 10.031 21.924 ( 0.380 -1.267 0.342) 1.366 22.099 ( 1.810 1.094 -1.937) 2.868 22.233 ( 0.759 -1.986 -1.220) 2.451 22.464 ( -1.283 -1.068 5.070) 5.338 22.684 ( 1.884 -1.302 -5.884) 6.314 22.955 ( -1.359 -4.518 2.971) 5.575 23.041 ( 0.122 2.579 1.415) 2.944 23.360 ( 1.577 -3.608 -1.531) 4.224 23.398 ( 2.379 -2.524 0.155) 3.472 ======================= Grid point 204 (88/102) ======================= q-point: (-0.45 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.480 ( 0.465 -0.000 -3.517) 3.548 1.515 ( 1.762 -0.000 -4.037) 4.405 1.762 ( -15.069 0.000 3.388) 15.445 1.818 ( -11.144 0.000 7.790) 13.596 2.236 ( 7.572 -0.000 -0.230) 7.575 2.287 ( 3.345 -0.000 -3.646) 4.948 2.307 ( -3.746 0.000 7.883) 8.728 2.478 ( 0.085 -0.000 -9.613) 9.613 2.495 ( -0.807 0.000 1.267) 1.502 2.625 ( 9.292 -0.000 -4.102) 10.157 2.821 ( -4.715 0.000 -2.752) 5.460 2.903 ( -11.335 0.000 3.328) 11.814 2.987 ( 11.881 -0.000 -0.734) 11.904 3.045 ( 0.778 -0.000 0.285) 0.829 3.216 ( -8.423 0.000 -2.946) 8.923 3.248 ( -7.102 0.000 8.115) 10.784 3.310 ( 1.409 -0.000 5.160) 5.349 3.499 ( -1.651 0.000 -2.452) 2.956 3.503 ( 1.480 -0.000 -3.054) 3.394 3.674 ( 10.089 -0.000 -5.213) 11.356 3.685 ( -0.140 0.000 3.853) 3.856 3.759 ( 7.715 -0.000 -2.816) 8.213 4.076 ( -13.665 0.000 4.926) 14.526 4.213 ( -4.219 0.000 -4.932) 6.491 4.275 ( -3.835 0.000 2.977) 4.855 4.297 ( 2.111 -0.000 5.170) 5.584 4.458 ( 3.923 -0.000 1.580) 4.229 4.602 ( 2.657 -0.000 -6.366) 6.898 4.608 ( 0.256 -0.000 -1.192) 1.219 4.640 ( 0.918 -0.000 -0.709) 1.159 4.760 ( 8.754 -0.000 1.292) 8.848 4.780 ( 4.056 -0.000 -4.938) 6.390 4.956 ( -2.265 0.000 2.489) 3.365 5.012 ( -3.891 0.000 -1.353) 4.119 5.050 ( 3.576 -0.000 -2.571) 4.405 5.109 ( 7.440 -0.000 0.627) 7.466 5.348 ( -8.139 0.000 10.164) 13.021 5.572 ( -4.043 0.000 9.340) 10.178 5.705 ( 11.078 -0.000 -9.792) 14.786 5.727 ( -6.463 0.000 -4.224) 7.721 6.281 ( 0.965 -0.000 1.627) 1.891 6.345 ( 0.987 -0.000 -2.457) 2.647 6.488 ( -3.638 0.000 5.378) 6.493 6.647 ( 0.982 -0.000 -3.694) 3.822 7.182 ( -8.531 0.000 -2.964) 9.031 7.247 ( 4.010 -0.000 3.178) 5.117 7.334 ( -2.889 0.000 -0.543) 2.939 7.365 ( 1.282 -0.000 1.587) 2.040 7.756 ( 3.378 -0.000 2.543) 4.229 7.807 ( 1.436 -0.000 -8.051) 8.178 8.256 ( 6.280 -0.000 6.052) 8.722 8.270 ( -2.713 0.000 -5.294) 5.948 8.416 ( -3.080 0.000 4.495) 5.449 8.447 ( -0.257 0.000 3.467) 3.476 8.633 ( 0.319 -0.000 -0.208) 0.381 8.750 ( 6.583 -0.000 -6.594) 9.318 9.307 ( -5.047 0.000 3.607) 6.203 9.523 ( 9.843 -0.000 -6.837) 11.985 9.713 ( -7.153 0.000 4.520) 8.462 9.913 ( 9.655 -0.000 -2.263) 9.916 10.248 ( -4.351 0.000 8.411) 9.469 10.371 ( -1.945 0.000 -1.052) 2.211 10.691 ( -6.195 0.000 -8.110) 10.206 10.740 ( 6.454 -0.000 0.176) 6.456 11.091 ( -3.872 0.000 7.560) 8.494 11.212 ( -4.059 0.000 -5.184) 6.585 11.578 ( 2.184 -0.000 5.768) 6.168 11.636 ( -3.392 0.000 -3.731) 5.042 11.784 ( -6.189 0.000 0.254) 6.194 11.860 ( -3.663 0.000 -2.357) 4.356 11.946 ( -3.324 0.000 -0.990) 3.468 11.998 ( 5.245 -0.000 2.008) 5.617 12.532 ( -0.622 0.000 -0.856) 1.058 12.533 ( -0.269 0.000 0.486) 0.555 13.140 ( 2.419 -0.000 2.682) 3.612 13.186 ( 1.428 -0.000 -2.449) 2.835 13.839 ( -6.530 0.000 0.716) 6.569 13.886 ( -5.199 0.000 1.772) 5.493 13.952 ( 6.836 -0.000 0.310) 6.843 13.994 ( 2.547 -0.000 -2.841) 3.816 15.571 ( 5.550 -0.000 3.336) 6.475 15.606 ( 3.322 -0.000 -2.886) 4.401 17.584 ( -4.923 0.000 -0.710) 4.974 17.604 ( -0.300 0.000 0.780) 0.836 18.352 ( -8.415 0.000 -0.075) 8.415 18.437 ( 3.245 -0.000 1.808) 3.715 18.554 ( -1.144 0.000 -3.667) 3.842 18.587 ( 9.116 -0.000 2.299) 9.402 19.826 ( 0.559 -0.000 4.752) 4.785 19.907 ( 0.899 -0.000 -3.825) 3.929 20.622 ( -3.431 0.000 5.551) 6.526 20.842 ( 3.437 -0.000 -11.074) 11.595 20.979 ( -1.986 0.000 11.334) 11.507 21.265 ( 3.274 -0.000 -16.404) 16.728 21.937 ( -2.895 0.000 9.936) 10.349 22.097 ( 1.343 -0.000 -4.244) 4.452 22.196 ( -0.998 0.000 8.587) 8.645 22.320 ( 0.575 -0.000 -4.639) 4.674 22.656 ( -3.792 0.000 3.862) 5.413 22.732 ( -1.858 0.000 -3.257) 3.749 22.983 ( 3.485 -0.000 2.386) 4.224 23.024 ( 1.773 -0.000 -3.207) 3.664 ======================= Grid point 205 (89/102) ======================= q-point: (-0.36 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.383 ( -6.756 2.775 3.582) 8.135 1.566 ( -14.100 2.988 4.352) 15.056 1.679 ( 3.783 -10.645 -9.534) 14.783 1.792 ( -14.930 -3.557 1.328) 15.406 2.202 ( 0.536 4.084 -1.273) 4.311 2.303 ( 0.721 -1.284 1.731) 2.273 2.346 ( -1.528 -2.562 0.666) 3.057 2.513 ( 0.900 -1.511 1.598) 2.376 2.565 ( 2.955 -6.767 -1.989) 7.647 2.696 ( 6.270 -1.476 -4.237) 7.710 2.782 ( -2.033 1.443 -1.833) 3.095 2.848 ( -11.346 -3.551 3.033) 12.270 3.030 ( 0.218 -0.629 0.588) 0.888 3.087 ( 1.172 -3.117 0.465) 3.363 3.153 ( -9.202 -0.184 -1.145) 9.274 3.227 ( 2.831 0.326 2.045) 3.508 3.346 ( -0.264 -1.953 5.203) 5.564 3.475 ( 0.147 0.754 -2.178) 2.309 3.526 ( -0.172 -1.576 -0.134) 1.591 3.674 ( 2.723 2.768 -0.422) 3.905 3.692 ( 3.590 3.818 -0.552) 5.270 3.781 ( 10.173 3.309 -2.732) 11.040 4.011 ( -13.036 -2.645 0.525) 13.312 4.106 ( -6.619 3.483 -3.115) 8.102 4.175 ( -3.262 7.320 5.116) 9.507 4.313 ( 5.305 3.619 1.857) 6.685 4.515 ( 3.947 -2.279 0.902) 4.646 4.544 ( 2.093 4.372 -4.857) 6.862 4.625 ( 1.003 -1.263 1.739) 2.372 4.698 ( 3.666 -2.056 -3.988) 5.794 4.799 ( 1.407 -0.294 -1.020) 1.763 4.819 ( 10.341 2.216 -0.956) 10.619 4.908 ( -1.294 -0.926 2.158) 2.681 5.059 ( 0.487 -3.254 -1.294) 3.535 5.122 ( 5.037 -2.253 0.527) 5.543 5.214 ( 1.228 -6.830 0.133) 6.940 5.336 ( -1.139 -1.913 4.871) 5.356 5.507 ( -1.779 3.568 4.168) 5.768 5.693 ( -8.140 -2.837 -0.901) 8.667 5.837 ( 8.122 -5.817 -4.635) 11.013 6.224 ( -3.898 4.283 0.615) 5.824 6.355 ( 0.163 -0.826 -1.168) 1.440 6.540 ( -0.422 -5.028 4.726) 6.913 6.689 ( -1.335 -4.814 -4.019) 6.412 7.098 ( -7.822 1.459 -2.880) 8.463 7.242 ( 0.252 2.655 3.408) 4.328 7.324 ( -2.224 -0.675 -1.332) 2.679 7.388 ( -0.254 -1.767 3.293) 3.746 7.768 ( 2.910 1.521 1.761) 3.726 7.814 ( 5.185 0.373 -8.615) 10.062 8.223 ( 0.188 2.688 -2.717) 3.826 8.281 ( 2.177 3.061 5.267) 6.470 8.440 ( -1.951 -2.106 1.642) 3.307 8.455 ( 4.326 -0.343 2.280) 4.902 8.641 ( 0.988 -0.237 0.324) 1.066 8.733 ( 5.857 4.884 -3.213) 8.275 9.275 ( -2.005 1.062 1.295) 2.612 9.531 ( 6.706 4.731 -4.762) 9.488 9.659 ( -1.692 2.832 2.233) 3.984 9.971 ( 11.381 2.216 -1.542) 11.697 10.189 ( -8.526 3.168 8.508) 12.455 10.390 ( -2.464 -3.814 0.144) 4.543 10.599 ( -5.564 2.848 -9.020) 10.974 10.713 ( 4.024 6.743 -0.277) 7.857 11.039 ( -7.298 2.819 5.890) 9.793 11.151 ( -5.721 0.548 -2.902) 6.438 11.484 ( -5.274 7.094 0.616) 8.861 11.562 ( -1.216 4.721 0.464) 4.897 11.816 ( -6.420 -5.491 -0.613) 8.471 11.878 ( -3.842 -6.229 -0.461) 7.333 11.981 ( -4.241 -5.368 -1.620) 7.030 12.027 ( 3.021 1.827 1.987) 4.051 12.487 ( -1.121 2.546 -0.447) 2.818 12.554 ( 0.455 -1.029 0.291) 1.162 13.191 ( 3.160 -2.381 1.783) 4.340 13.222 ( 2.497 -2.781 -1.819) 4.157 13.649 ( -9.261 12.875 0.888) 15.885 13.757 ( -7.504 12.705 0.435) 14.762 13.934 ( 5.853 2.079 -0.980) 6.288 14.009 ( 5.839 3.206 -0.161) 6.663 15.613 ( 6.026 -0.235 0.769) 6.080 15.701 ( 10.035 -3.623 -0.362) 10.675 17.447 ( -8.256 7.656 -0.090) 11.260 17.567 ( -0.076 2.915 0.140) 2.919 18.218 ( -13.867 4.100 0.773) 14.481 18.558 ( 4.703 -3.006 0.429) 5.599 18.581 ( 1.262 -0.645 -1.300) 1.924 18.717 ( 12.325 -9.918 0.534) 15.828 19.713 ( 1.338 12.178 4.100) 12.919 19.769 ( 1.582 12.205 -3.128) 12.699 20.419 ( -5.807 18.950 3.744) 20.170 20.620 ( 1.217 18.286 -6.311) 19.383 21.170 ( -2.587 -14.210 6.900) 16.007 21.396 ( 2.910 -13.955 -14.301) 20.192 22.005 ( -5.086 -6.943 9.750) 13.005 22.116 ( -4.200 0.483 2.825) 5.085 22.309 ( 5.466 -7.414 -1.997) 9.425 22.332 ( 3.500 -3.827 -4.964) 7.179 22.615 ( -5.512 0.628 5.054) 7.505 22.739 ( -1.221 -3.687 -1.417) 4.134 23.029 ( 4.557 -1.445 2.488) 5.390 23.062 ( 3.283 -2.024 -3.204) 5.014 ======================= Grid point 206 (90/102) ======================= q-point: (-0.27 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.332 ( -9.350 -3.435 6.336) 11.805 1.486 ( -11.949 -4.576 2.446) 13.027 1.751 ( -11.330 -3.858 -1.915) 12.121 1.909 ( 4.022 -12.389 -8.228) 15.406 2.144 ( -1.138 1.637 -1.340) 2.402 2.346 ( -6.204 -3.094 2.909) 7.518 2.349 ( -0.119 -1.078 -6.729) 6.816 2.561 ( -1.049 -3.416 2.042) 4.116 2.678 ( 1.675 -2.399 3.898) 4.874 2.724 ( -3.515 -0.521 1.709) 3.943 2.751 ( -0.261 -1.298 0.045) 1.325 2.880 ( -4.048 -4.581 -0.255) 6.119 3.034 ( -9.574 0.959 0.162) 9.623 3.094 ( 2.322 -3.341 0.497) 4.099 3.177 ( 0.562 -4.847 1.228) 5.032 3.274 ( 2.797 -0.889 -1.117) 3.140 3.373 ( 0.376 2.124 0.157) 2.162 3.477 ( 0.292 -2.848 -0.113) 2.865 3.512 ( -2.602 2.380 3.243) 4.791 3.632 ( 2.695 0.325 -1.966) 3.352 3.675 ( 4.296 3.006 -2.257) 5.708 3.760 ( 4.620 4.223 0.291) 6.265 3.909 ( -5.613 4.901 -3.230) 8.121 4.025 ( -2.068 5.573 3.046) 6.679 4.080 ( -5.476 -4.641 0.171) 7.180 4.283 ( 6.316 4.220 0.894) 7.649 4.451 ( 2.610 5.464 -3.061) 6.785 4.580 ( 5.845 1.623 2.202) 6.453 4.671 ( 1.103 -1.772 -0.041) 2.087 4.757 ( 6.160 -2.865 -1.283) 6.913 4.827 ( 8.486 3.906 -2.628) 9.705 4.839 ( -3.655 -4.860 0.500) 6.102 4.971 ( 1.696 -4.048 1.446) 4.621 5.090 ( -0.262 0.697 2.390) 2.503 5.147 ( 0.750 0.122 -1.223) 1.440 5.358 ( 1.086 -7.295 -1.082) 7.454 5.439 ( 7.404 -4.919 -2.370) 9.200 5.478 ( -3.299 -1.320 4.800) 5.971 5.703 ( -6.312 -4.277 1.129) 7.708 5.968 ( 6.101 -2.600 -1.546) 6.810 6.118 ( -6.689 2.475 0.456) 7.147 6.359 ( -1.687 -0.645 -0.683) 1.930 6.638 ( -2.047 -4.689 4.959) 7.125 6.755 ( -3.136 -5.080 -6.072) 8.515 7.006 ( -6.429 2.257 -1.377) 6.952 7.195 ( 0.197 2.672 1.922) 3.298 7.311 ( -3.982 -0.773 -0.850) 4.144 7.437 ( -0.785 -2.738 4.237) 5.106 7.761 ( 3.347 3.278 2.770) 5.443 7.804 ( 5.560 3.158 -8.992) 11.034 8.164 ( 2.332 4.109 -0.452) 4.747 8.219 ( 0.730 5.642 3.953) 6.927 8.437 ( -2.562 -1.086 -1.274) 3.061 8.525 ( 8.571 1.681 -2.106) 8.985 8.620 ( 5.838 2.259 -0.803) 6.311 8.743 ( -0.123 -2.753 4.220) 5.040 9.227 ( 0.700 4.139 -0.525) 4.230 9.451 ( -2.879 4.462 1.788) 5.603 9.593 ( 7.749 7.200 -3.649) 11.189 9.947 ( 8.461 9.598 -3.506) 13.266 10.085 ( -10.317 1.205 9.373) 13.990 10.437 ( -3.457 1.463 -5.062) 6.302 10.473 ( -4.183 1.244 0.421) 4.384 10.619 ( 2.988 3.864 -2.317) 5.407 10.955 ( -7.101 -0.261 1.771) 7.323 11.080 ( -8.093 2.012 0.017) 8.340 11.320 ( -7.476 4.929 -0.519) 8.970 11.490 ( -0.282 2.594 1.732) 3.131 11.844 ( -5.625 -2.288 -2.289) 6.489 11.940 ( -4.887 -2.996 -1.019) 5.822 11.958 ( -2.688 5.230 1.161) 5.994 12.027 ( -6.059 -1.625 1.467) 6.442 12.446 ( 2.173 1.840 -0.680) 2.927 12.568 ( 0.054 0.198 0.810) 0.836 13.258 ( -3.905 3.923 -2.992) 6.291 13.291 ( -3.457 2.672 4.525) 6.290 13.315 ( 0.919 2.436 -0.231) 2.614 13.401 ( -8.460 16.933 -0.480) 18.935 13.947 ( 7.032 2.027 -0.558) 7.339 13.964 ( 5.651 6.123 -0.248) 8.335 15.684 ( 6.622 -2.139 -0.937) 7.022 15.833 ( 10.865 -1.185 1.036) 10.978 17.256 ( -8.845 4.703 0.033) 10.018 17.532 ( 1.965 1.297 -0.094) 2.356 18.029 ( -15.678 3.968 0.423) 16.178 18.539 ( 3.829 6.016 -0.742) 7.170 18.603 ( 0.451 1.039 0.994) 1.507 19.005 ( 13.064 -4.937 0.022) 13.965 19.521 ( 2.032 9.737 4.835) 11.059 19.608 ( 4.864 3.140 -3.418) 6.724 19.924 ( -13.537 25.087 -1.588) 28.550 20.267 ( 2.744 20.063 -1.402) 20.298 21.416 ( -4.695 -13.363 4.603) 14.893 21.655 ( 1.480 -13.492 -10.559) 17.196 21.996 ( -8.530 3.830 5.217) 10.708 22.156 ( -4.665 -7.435 7.783) 11.731 22.331 ( 4.248 0.849 -5.418) 6.937 22.531 ( 3.036 -5.781 -6.785) 9.417 22.627 ( 0.468 -4.476 5.155) 6.843 22.877 ( 4.062 -10.227 1.506) 11.107 23.108 ( 3.006 -1.046 -1.336) 3.452 23.127 ( 5.763 -4.294 0.766) 7.228 ======================= Grid point 207 (91/102) ======================= q-point: (-0.18 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.414 ( -5.604 -10.570 0.525) 11.975 1.543 ( -11.958 -10.142 4.065) 16.198 1.777 ( -4.135 -6.441 -4.128) 8.696 2.054 ( -5.437 0.150 2.569) 6.016 2.163 ( 1.784 -7.409 -2.823) 8.126 2.301 ( -8.107 -2.136 -4.183) 9.369 2.424 ( -2.713 -6.738 -0.983) 7.330 2.594 ( 1.039 2.340 2.697) 3.719 2.704 ( 0.638 1.002 0.570) 1.318 2.719 ( -3.254 -3.094 -0.114) 4.491 2.788 ( 2.110 -0.354 3.238) 3.881 2.922 ( -7.236 -4.513 1.224) 8.615 2.978 ( -3.758 -1.479 -0.113) 4.040 3.192 ( 2.918 -1.532 -0.397) 3.320 3.206 ( -0.225 3.227 -2.684) 4.203 3.282 ( 0.449 -3.165 0.484) 3.233 3.331 ( -0.549 0.249 1.008) 1.175 3.488 ( -0.043 -1.103 0.943) 1.451 3.566 ( 2.775 3.586 -0.755) 4.597 3.602 ( 2.304 -1.715 -4.814) 5.606 3.639 ( -3.949 1.279 2.473) 4.832 3.770 ( 1.442 -1.614 1.100) 2.428 3.803 ( 4.368 2.542 -1.937) 5.412 3.964 ( 0.034 0.965 1.544) 1.821 4.174 ( -0.335 -6.845 0.358) 6.862 4.252 ( 3.906 3.978 1.124) 5.687 4.383 ( 1.965 2.972 -0.512) 3.600 4.576 ( 3.834 3.500 2.325) 5.688 4.696 ( -0.127 -0.493 1.524) 1.607 4.756 ( 6.952 5.744 -5.552) 10.590 4.875 ( 0.683 -2.341 -1.347) 2.786 4.929 ( 1.010 -6.640 2.233) 7.078 5.063 ( -1.708 -4.165 -1.145) 4.645 5.085 ( 2.846 -1.755 3.633) 4.938 5.156 ( 2.802 0.373 -2.460) 3.747 5.449 ( -1.814 -0.289 -0.659) 1.951 5.471 ( -0.340 -3.020 -0.841) 3.153 5.599 ( 5.601 -4.527 0.490) 7.218 5.752 ( -4.327 -4.803 1.891) 6.736 6.009 ( 2.947 0.355 1.540) 3.344 6.052 ( -4.514 0.608 -1.625) 4.836 6.361 ( -2.436 -1.463 1.478) 3.203 6.684 ( -5.521 -2.756 2.198) 6.550 6.788 ( -3.403 -2.561 -7.148) 8.320 6.909 ( -8.346 2.420 2.196) 8.963 7.181 ( 3.250 0.019 -1.283) 3.494 7.288 ( -5.674 -0.550 1.924) 6.017 7.460 ( -2.649 2.008 3.192) 4.609 7.662 ( 3.796 7.475 -1.931) 8.604 7.779 ( 3.363 3.360 -1.960) 5.142 8.118 ( 3.076 3.276 2.674) 5.229 8.149 ( 3.083 2.694 -1.352) 4.312 8.441 ( -1.687 -1.153 -1.826) 2.740 8.524 ( 11.044 3.744 -2.936) 12.025 8.680 ( 6.693 -1.363 -0.892) 6.888 8.755 ( -10.144 0.242 4.308) 11.023 9.159 ( 3.922 4.108 -0.142) 5.682 9.339 ( -5.829 4.338 3.154) 7.921 9.495 ( 8.118 9.719 -1.906) 12.806 9.807 ( 4.983 7.564 -2.696) 9.450 10.004 ( -8.341 2.812 6.157) 10.742 10.263 ( -7.049 6.834 -6.821) 11.955 10.481 ( -1.573 -0.573 4.461) 4.764 10.655 ( 5.315 -3.633 -3.341) 7.254 10.956 ( -4.770 0.875 0.526) 4.878 10.985 ( -7.354 -3.958 -0.137) 8.353 11.201 ( -6.365 2.427 -0.727) 6.851 11.463 ( -1.257 0.757 2.864) 3.218 11.746 ( -5.244 6.818 -1.037) 8.663 11.853 ( -0.977 7.464 -1.529) 7.681 11.884 ( -13.931 2.608 1.629) 14.267 11.952 ( -4.968 1.127 0.548) 5.123 12.441 ( 3.803 2.203 -1.533) 4.655 12.541 ( -0.768 2.669 1.772) 3.294 12.972 ( -7.063 8.361 -0.415) 10.953 13.059 ( -8.118 10.917 0.103) 13.605 13.369 ( 0.800 -4.483 -1.575) 4.818 13.414 ( 1.731 -5.063 2.010) 5.716 13.880 ( 4.987 7.262 -0.436) 8.820 13.957 ( 7.588 3.006 -0.236) 8.165 15.771 ( 5.926 -2.324 -2.535) 6.852 15.891 ( 5.927 2.129 2.519) 6.783 17.173 ( -4.452 -0.886 -0.128) 4.541 17.557 ( 4.219 -1.577 -0.036) 4.504 17.872 ( -11.601 1.345 -0.259) 11.682 18.432 ( 0.788 7.257 1.580) 7.469 18.511 ( -1.865 9.051 -0.330) 9.248 19.012 ( 2.857 7.326 0.360) 7.872 19.384 ( -4.285 10.717 5.810) 12.922 19.431 ( -8.896 12.115 -6.430) 16.348 19.775 ( 14.124 -9.106 -2.269) 16.958 19.959 ( 4.814 15.580 1.063) 16.342 21.547 ( -9.939 -3.445 1.702) 10.656 21.750 ( -6.737 -3.150 0.113) 7.438 22.001 ( 2.354 -8.112 -4.600) 9.618 22.213 ( -1.100 0.512 2.827) 3.077 22.369 ( 1.078 -3.463 1.805) 4.052 22.581 ( -2.982 -3.304 -2.693) 5.202 22.761 ( 4.478 -5.412 2.874) 7.590 23.104 ( 7.767 -4.628 -1.948) 9.249 23.137 ( 2.482 -3.875 -1.385) 4.805 23.265 ( 6.080 -4.932 1.858) 8.046 ======================= Grid point 208 (92/102) ======================= q-point: (-0.09 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.592 ( -2.753 -11.152 -2.582) 11.773 1.677 ( -9.267 -12.311 3.595) 15.823 1.880 ( 5.068 -2.799 -7.915) 9.807 1.975 ( -13.552 -2.855 5.915) 15.059 2.263 ( -1.608 -2.480 0.935) 3.100 2.302 ( -4.891 -2.733 0.725) 5.649 2.518 ( 0.403 2.770 0.820) 2.917 2.552 ( -4.224 -7.707 -1.037) 8.849 2.656 ( 3.247 5.032 0.189) 5.991 2.755 ( -4.058 -2.587 -1.975) 5.202 2.826 ( 5.594 -0.569 3.457) 6.601 2.949 ( -5.266 -2.811 0.623) 6.002 2.985 ( -1.184 -1.030 -1.852) 2.428 3.123 ( 2.513 1.954 -0.613) 3.242 3.277 ( 3.244 -1.121 0.506) 3.469 3.317 ( -1.929 1.690 -0.655) 2.647 3.347 ( -0.144 -2.909 1.366) 3.217 3.440 ( -1.365 4.171 -4.164) 6.050 3.525 ( -0.663 -2.487 2.259) 3.425 3.582 ( -1.315 1.351 0.380) 1.923 3.679 ( 6.135 -0.813 -2.983) 6.870 3.816 ( -0.251 -0.741 1.174) 1.411 3.872 ( 4.817 -5.136 -0.852) 7.092 3.981 ( 0.476 -1.412 1.519) 2.128 4.198 ( -0.325 1.401 1.738) 2.256 4.291 ( 5.644 -0.152 -0.889) 5.715 4.376 ( 0.809 -1.693 -1.488) 2.395 4.510 ( -3.642 4.137 3.877) 6.739 4.663 ( -0.748 1.966 -1.648) 2.672 4.747 ( 3.952 -0.161 -0.413) 3.977 4.911 ( 1.325 -1.762 0.017) 2.205 5.024 ( -0.645 -2.797 -0.410) 2.900 5.113 ( 1.901 -1.685 1.488) 2.944 5.161 ( 1.857 0.650 0.293) 1.990 5.191 ( 2.730 -4.872 -1.078) 5.687 5.416 ( -4.430 0.144 -1.697) 4.746 5.507 ( 1.677 -1.353 -0.158) 2.161 5.673 ( 3.806 0.074 -0.619) 3.857 5.804 ( -4.594 -3.891 1.697) 6.255 5.990 ( -0.393 3.525 -2.237) 4.193 6.061 ( 2.278 -2.893 3.402) 5.013 6.388 ( -0.804 -2.350 2.277) 3.369 6.676 ( -6.327 -1.713 -3.430) 7.398 6.727 ( -5.055 4.702 -1.110) 6.992 6.853 ( -7.673 -3.494 0.720) 8.461 7.213 ( 1.873 -0.399 -2.506) 3.154 7.261 ( -5.294 1.490 8.096) 9.788 7.315 ( -2.509 5.855 -5.502) 8.417 7.640 ( 4.121 0.066 -0.740) 4.187 7.698 ( 0.452 6.248 0.580) 6.291 8.113 ( 1.805 0.181 4.603) 4.948 8.164 ( 5.569 -0.661 -4.850) 7.415 8.421 ( -1.306 2.724 -0.566) 3.073 8.532 ( 2.408 3.552 1.232) 4.465 8.610 ( -9.619 1.789 -1.323) 9.873 8.749 ( 2.227 -1.543 -0.366) 2.734 9.117 ( 8.001 6.857 -1.333) 10.621 9.270 ( -1.255 0.586 1.557) 2.084 9.380 ( 3.180 5.366 2.581) 6.750 9.762 ( 4.548 2.488 -0.706) 5.232 9.891 ( -7.439 3.764 4.608) 9.525 10.089 ( -4.522 5.331 -5.778) 9.069 10.510 ( 0.152 -2.315 1.856) 2.971 10.744 ( 2.481 -2.183 -2.543) 4.170 10.898 ( -2.555 -0.596 -0.186) 2.630 11.072 ( -4.521 -6.565 0.716) 8.003 11.140 ( -1.764 -0.403 -1.561) 2.390 11.436 ( -3.976 1.858 5.430) 6.981 11.603 ( -3.710 6.001 -2.381) 7.446 11.617 ( -4.491 8.243 0.931) 9.433 11.767 ( -7.248 2.983 -1.401) 7.962 11.902 ( -1.333 2.631 -0.031) 2.949 12.370 ( -0.138 5.851 -1.358) 6.008 12.501 ( 0.033 1.790 2.400) 2.994 12.859 ( -1.926 1.560 -2.006) 3.188 12.901 ( -3.903 2.395 1.147) 4.721 13.443 ( -0.667 -4.049 -0.963) 4.215 13.518 ( -0.340 -5.100 0.977) 5.204 13.782 ( 4.083 6.976 -0.036) 8.083 13.947 ( 6.142 3.728 -0.071) 7.185 15.837 ( 4.154 -1.347 -3.543) 5.623 15.873 ( 0.622 2.735 3.540) 4.517 17.192 ( -0.239 -2.271 -0.286) 2.301 17.654 ( 6.466 -4.671 0.553) 7.996 17.815 ( -4.981 -1.751 -1.318) 5.442 18.234 ( -12.768 11.938 2.246) 17.623 18.346 ( 4.402 6.150 -0.526) 7.581 18.886 ( -1.018 6.030 0.110) 6.116 19.133 ( -5.788 6.933 -1.551) 9.164 19.295 ( -2.205 5.171 0.832) 5.683 19.760 ( 5.205 8.246 -0.443) 9.761 20.049 ( 12.768 -6.081 -0.046) 14.143 21.427 ( -11.016 3.678 0.810) 11.642 21.819 ( -4.246 -6.725 1.026) 8.019 22.160 ( 2.694 -6.669 -4.306) 8.383 22.176 ( 2.166 3.444 -0.852) 4.156 22.433 ( -2.005 -2.391 6.397) 7.118 22.621 ( -1.324 -3.958 -4.911) 6.445 22.884 ( 2.351 -4.214 4.537) 6.623 23.102 ( 2.323 2.755 -1.873) 4.062 23.300 ( 4.965 -5.312 -1.095) 7.353 23.382 ( 4.926 -2.701 0.576) 5.648 ======================= Grid point 216 (93/102) ======================= q-point: (-0.36 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.423 ( -15.272 0.000 2.234) 15.434 1.448 ( -1.794 0.000 -6.398) 6.644 1.551 ( -10.289 0.000 -5.194) 11.526 1.596 ( -21.194 0.000 7.543) 22.496 2.159 ( -15.700 0.000 6.675) 17.061 2.311 ( 0.156 -0.000 -3.493) 3.497 2.407 ( 8.746 -0.000 5.070) 10.109 2.496 ( 7.254 -0.000 -5.641) 9.189 2.522 ( 1.435 -0.000 -1.980) 2.445 2.645 ( -14.573 0.000 2.371) 14.764 2.777 ( 3.126 -0.000 -3.940) 5.029 2.812 ( 5.059 -0.000 -4.383) 6.693 2.998 ( -6.872 0.000 1.378) 7.009 3.023 ( -9.124 0.000 6.600) 11.261 3.101 ( -3.072 0.000 -3.616) 4.744 3.263 ( 5.700 -0.000 -0.665) 5.738 3.357 ( 1.394 -0.000 6.305) 6.457 3.487 ( 1.547 -0.000 -1.103) 1.900 3.493 ( -0.175 0.000 -3.320) 3.325 3.712 ( 1.226 -0.000 4.307) 4.478 3.784 ( 6.966 -0.000 -2.733) 7.483 3.855 ( -13.751 0.000 4.612) 14.504 3.912 ( 11.540 -0.000 -5.897) 12.959 4.095 ( -5.121 0.000 -6.531) 8.299 4.227 ( -5.674 0.000 5.882) 8.172 4.373 ( 2.699 -0.000 4.591) 5.326 4.526 ( 3.757 -0.000 -0.591) 3.803 4.601 ( 0.007 -0.000 -0.936) 0.936 4.627 ( 5.174 -0.000 -6.265) 8.125 4.673 ( 4.554 -0.000 0.926) 4.647 4.842 ( 4.663 -0.000 -1.823) 5.007 4.926 ( 6.140 -0.000 1.584) 6.341 4.929 ( -3.272 0.000 5.081) 6.043 4.987 ( 7.244 -0.000 -4.436) 8.494 5.100 ( 4.154 -0.000 -3.290) 5.300 5.181 ( -0.335 0.000 4.393) 4.405 5.337 ( 3.122 -0.000 1.463) 3.448 5.576 ( 0.238 -0.000 8.155) 8.159 5.582 ( -10.965 0.000 0.170) 10.966 5.815 ( 8.831 -0.000 -8.885) 12.527 6.266 ( -9.865 0.000 2.386) 10.150 6.301 ( 0.383 -0.000 1.671) 1.714 6.529 ( 6.245 -0.000 -1.092) 6.340 6.622 ( -1.451 0.000 -1.937) 2.420 7.046 ( -7.494 0.000 -2.350) 7.854 7.232 ( -6.167 0.000 -0.065) 6.167 7.345 ( 2.654 -0.000 3.476) 4.374 7.356 ( -3.827 0.000 2.658) 4.659 7.807 ( 1.412 -0.000 2.812) 3.147 7.837 ( 8.253 -0.000 -13.408) 15.745 8.234 ( 0.135 -0.000 -4.526) 4.529 8.337 ( -1.321 0.000 5.338) 5.499 8.435 ( 4.848 -0.000 -0.095) 4.849 8.488 ( 4.108 -0.000 6.095) 7.350 8.620 ( -2.913 0.000 3.805) 4.792 8.854 ( 10.483 -0.000 -4.915) 11.578 9.259 ( -3.132 0.000 1.452) 3.452 9.597 ( -2.324 0.000 2.228) 3.219 9.711 ( 10.098 -0.000 -6.637) 12.084 10.067 ( 7.120 -0.000 3.887) 8.112 10.203 ( -1.937 0.000 3.182) 3.725 10.306 ( -7.060 0.000 1.976) 7.331 10.550 ( -6.452 0.000 -10.056) 11.948 10.818 ( 3.493 -0.000 -1.066) 3.652 11.033 ( -7.403 0.000 7.113) 10.266 11.099 ( -7.006 0.000 -3.073) 7.650 11.541 ( -7.282 0.000 -4.659) 8.644 11.614 ( -3.761 0.000 2.119) 4.317 11.652 ( -9.302 0.000 -0.755) 9.333 11.769 ( -3.705 0.000 6.706) 7.662 11.897 ( -2.344 0.000 -4.329) 4.923 12.078 ( 3.260 -0.000 0.925) 3.389 12.520 ( -1.875 0.000 2.059) 2.785 12.525 ( 1.161 -0.000 -2.221) 2.506 13.205 ( 4.286 -0.000 1.766) 4.635 13.210 ( 2.500 -0.000 -2.015) 3.211 13.703 ( -10.856 0.000 -0.120) 10.857 13.805 ( -6.553 0.000 0.689) 6.589 14.044 ( 4.548 -0.000 -0.734) 4.607 14.049 ( 5.703 -0.000 0.600) 5.734 15.689 ( 8.714 -0.000 -4.233) 9.688 15.739 ( 14.168 -0.000 5.180) 15.085 17.470 ( -9.545 0.000 0.432) 9.555 17.576 ( -3.481 0.000 -0.012) 3.481 18.228 ( -8.467 0.000 1.044) 8.531 18.440 ( -2.555 0.000 -0.969) 2.733 18.595 ( 7.417 -0.000 -1.149) 7.505 18.748 ( 11.432 -0.000 0.803) 11.460 19.868 ( 1.610 -0.000 5.847) 6.065 19.904 ( 0.696 -0.000 -4.941) 4.990 20.586 ( -4.765 0.000 4.876) 6.818 20.850 ( 3.619 -0.000 -8.426) 9.170 20.983 ( -3.666 0.000 10.027) 10.676 21.219 ( 1.124 -0.000 -19.890) 19.922 21.933 ( -3.054 0.000 7.720) 8.303 22.087 ( -0.502 0.000 -3.788) 3.821 22.235 ( 0.434 -0.000 12.006) 12.014 22.319 ( 2.066 -0.000 -4.674) 5.110 22.596 ( -6.384 0.000 5.759) 8.597 22.679 ( -2.037 0.000 -4.695) 5.118 23.062 ( 5.041 -0.000 1.874) 5.378 23.062 ( 4.538 -0.000 -2.539) 5.200 ======================= Grid point 217 (94/102) ======================= q-point: (-0.27 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.246 ( -14.976 2.023 5.185) 15.976 1.363 ( -11.990 1.162 -2.409) 12.285 1.517 ( -21.478 -6.538 5.020) 23.006 1.649 ( -2.586 -13.917 -10.254) 17.479 2.080 ( -15.090 -3.066 5.618) 16.391 2.278 ( -8.139 -0.812 -4.082) 9.141 2.397 ( 3.966 4.977 -1.807) 6.615 2.501 ( -3.162 -0.514 -1.810) 3.679 2.566 ( -14.187 -4.180 2.724) 15.039 2.643 ( 5.987 -5.122 3.807) 8.751 2.796 ( 2.764 2.579 0.377) 3.799 2.826 ( 1.570 -2.101 -5.005) 5.651 2.974 ( -3.051 -2.332 -0.827) 3.928 3.035 ( -3.766 -2.971 0.838) 4.870 3.084 ( -1.954 -3.150 2.271) 4.347 3.294 ( 2.175 0.596 0.337) 2.280 3.390 ( 4.000 -1.002 0.666) 4.177 3.487 ( 1.000 1.620 0.466) 1.960 3.503 ( -0.897 -1.147 0.565) 1.562 3.711 ( 2.063 4.886 2.055) 5.688 3.726 ( -0.207 1.170 0.836) 1.453 3.862 ( 0.191 -1.232 -3.749) 3.951 3.921 ( 2.855 3.406 -4.139) 6.073 4.016 ( -2.342 2.844 -1.781) 4.092 4.133 ( -3.473 6.321 4.591) 8.550 4.390 ( 2.977 2.280 2.033) 4.266 4.552 ( 4.926 1.162 -3.037) 5.903 4.625 ( 5.837 -1.233 -0.770) 6.015 4.649 ( 1.383 -1.909 -0.591) 2.430 4.761 ( 1.213 3.165 -1.129) 3.572 4.762 ( 4.028 -1.818 0.958) 4.522 4.897 ( 0.891 0.426 2.918) 3.081 5.043 ( 13.311 3.613 -2.091) 13.950 5.077 ( 2.346 -5.440 -0.801) 5.978 5.148 ( -5.469 0.669 2.884) 6.219 5.203 ( 4.051 -7.485 -1.990) 8.740 5.400 ( 3.748 -3.346 1.138) 5.151 5.477 ( -4.731 1.652 -0.320) 5.022 5.620 ( 0.144 -1.854 5.260) 5.579 5.920 ( 5.387 -5.532 -4.668) 9.023 6.141 ( -7.743 4.447 1.405) 9.039 6.321 ( -3.601 -1.105 2.902) 4.755 6.590 ( 4.885 -1.824 -0.982) 5.306 6.647 ( -1.367 -3.179 -3.403) 4.853 6.982 ( -6.373 0.942 -0.981) 6.516 7.183 ( -6.769 -0.495 -1.246) 6.900 7.303 ( -3.794 1.616 1.944) 4.559 7.398 ( 0.279 -2.188 5.359) 5.795 7.807 ( 1.262 0.837 0.416) 1.570 7.867 ( 6.580 0.924 -12.082) 13.788 8.219 ( 1.367 1.111 -2.117) 2.754 8.323 ( -1.398 1.227 2.956) 3.493 8.418 ( 0.808 3.722 0.889) 3.912 8.572 ( 8.202 -2.385 2.117) 8.800 8.641 ( -2.858 -2.878 5.345) 6.709 8.835 ( 8.923 7.956 -1.881) 12.102 9.261 ( -0.437 -0.888 -0.557) 1.135 9.517 ( -7.047 5.049 5.361) 10.193 9.756 ( 13.636 3.255 -10.372) 17.439 10.051 ( -11.404 2.094 8.033) 14.105 10.149 ( 7.440 5.896 -2.160) 9.736 10.357 ( 0.243 -5.607 2.976) 6.352 10.469 ( -6.074 2.001 -7.351) 9.743 10.745 ( 0.522 7.574 -3.494) 8.357 10.943 ( -6.913 3.764 3.259) 8.519 11.056 ( -5.554 0.446 1.206) 5.701 11.366 ( -9.004 7.382 -1.374) 11.724 11.508 ( -6.367 1.911 -0.943) 6.714 11.705 ( -8.121 -6.580 -0.651) 10.473 11.822 ( -4.788 -3.158 3.421) 6.678 11.933 ( 0.489 -4.951 -0.542) 5.005 12.054 ( -0.872 3.862 -0.128) 3.961 12.493 ( 1.574 1.449 0.652) 2.237 12.554 ( 0.547 -1.214 -0.379) 1.384 13.228 ( 0.559 -0.996 -1.799) 2.131 13.266 ( 2.918 -2.363 1.279) 3.967 13.497 ( -10.352 12.277 1.043) 16.092 13.621 ( -10.765 13.714 0.418) 17.439 14.030 ( 6.909 1.958 -0.757) 7.221 14.094 ( 5.381 2.538 0.190) 5.953 15.729 ( 8.946 0.766 -2.859) 9.423 15.903 ( 15.255 -2.066 3.816) 15.860 17.305 ( -10.366 7.980 0.782) 13.106 17.541 ( -2.977 0.250 -0.863) 3.110 18.005 ( -14.671 8.037 0.129) 16.729 18.583 ( -0.014 -4.945 0.056) 4.946 18.653 ( 7.758 0.459 -0.469) 7.786 18.936 ( 15.736 -11.635 0.493) 19.577 19.753 ( 1.098 12.053 2.321) 12.323 19.776 ( 0.923 10.930 -1.751) 11.107 20.296 ( -11.553 24.932 -0.623) 27.486 20.624 ( 1.858 17.637 -2.074) 17.856 21.144 ( -4.303 -12.824 4.358) 14.211 21.365 ( 1.319 -15.752 -14.099) 21.181 21.960 ( -6.558 -3.487 8.591) 11.356 22.054 ( -5.207 0.743 2.391) 5.778 22.342 ( 2.813 -1.103 -4.160) 5.141 22.417 ( 6.062 -9.748 -2.350) 11.718 22.578 ( -0.522 -2.754 5.512) 6.184 22.726 ( 0.452 -7.795 1.084) 7.883 23.108 ( 5.217 -1.674 -2.877) 6.189 23.117 ( 4.434 -1.445 2.168) 5.143 ======================= Grid point 218 (95/102) ======================= q-point: (-0.18 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.190 ( -12.225 -6.738 3.129) 14.305 1.309 ( -11.698 -5.367 -0.503) 12.880 1.525 ( -17.437 -10.105 2.517) 20.310 1.888 ( -3.169 -15.026 -4.607) 16.033 2.070 ( -9.102 -4.697 2.709) 10.594 2.237 ( -10.621 -3.882 -2.455) 11.572 2.280 ( -6.647 4.222 -5.101) 9.382 2.518 ( -5.457 -5.621 -0.087) 7.835 2.581 ( -8.454 -5.963 0.181) 10.347 2.737 ( 2.201 0.607 4.058) 4.656 2.788 ( 1.415 -0.736 2.124) 2.656 2.873 ( 0.251 -2.800 -2.697) 3.896 2.969 ( 2.847 1.758 -0.126) 3.348 3.107 ( -0.858 -6.440 -0.036) 6.497 3.183 ( -1.057 -6.207 2.827) 6.901 3.266 ( -1.663 2.814 -0.258) 3.279 3.367 ( -1.266 3.790 2.460) 4.693 3.497 ( -0.209 1.500 2.901) 3.273 3.541 ( 7.138 -4.895 -3.372) 9.289 3.625 ( -0.800 4.575 -2.391) 5.224 3.739 ( 2.470 -0.440 0.271) 2.523 3.783 ( 0.929 7.793 -2.486) 8.232 3.889 ( 3.377 2.624 -2.862) 5.146 4.008 ( -0.931 0.981 2.561) 2.896 4.039 ( -0.586 -2.832 1.295) 3.169 4.349 ( 1.466 3.974 1.606) 4.530 4.501 ( 4.825 7.079 -1.707) 8.736 4.671 ( 2.405 -0.004 0.101) 2.407 4.694 ( 4.444 1.701 -1.338) 4.943 4.785 ( -1.444 -7.723 1.397) 7.980 4.864 ( 3.844 -1.551 0.672) 4.199 4.885 ( 3.393 2.604 0.649) 4.326 5.009 ( -1.568 1.462 -1.464) 2.596 5.123 ( 8.473 0.816 0.164) 8.514 5.176 ( 3.450 -1.122 -1.321) 3.861 5.377 ( 1.084 -7.556 -1.270) 7.739 5.414 ( -5.282 -0.778 1.075) 5.446 5.542 ( 5.438 -5.743 -1.206) 8.001 5.679 ( 1.844 -2.275 4.690) 5.530 6.013 ( -6.558 1.613 -0.909) 6.814 6.034 ( 3.277 -2.129 -0.604) 3.954 6.316 ( -3.889 -1.146 3.442) 5.318 6.626 ( -2.065 -0.391 -2.186) 3.033 6.680 ( -2.764 -3.530 -3.321) 5.580 6.896 ( -9.242 2.729 1.292) 9.722 7.164 ( -2.396 -2.066 -2.568) 4.075 7.251 ( -5.723 0.624 2.050) 6.111 7.454 ( 0.188 -1.755 6.148) 6.397 7.789 ( -1.353 3.423 0.368) 3.699 7.830 ( 3.111 2.787 -10.397) 11.205 8.208 ( 3.477 2.099 -1.277) 4.257 8.248 ( 0.499 6.876 2.988) 7.514 8.384 ( -3.450 -1.515 0.137) 3.771 8.652 ( 5.230 0.192 -3.861) 6.504 8.684 ( -1.039 -0.807 4.169) 4.372 8.764 ( 7.043 4.712 1.159) 8.553 9.241 ( 0.908 2.767 0.387) 2.938 9.386 ( -6.107 4.069 4.334) 8.523 9.732 ( 10.437 7.544 -7.869) 15.092 9.931 ( -6.240 4.657 5.477) 9.519 10.070 ( 2.629 6.899 -2.662) 7.848 10.307 ( -8.919 6.503 -4.653) 11.979 10.454 ( -0.809 -1.379 4.492) 4.768 10.659 ( 4.705 0.300 -2.993) 5.584 10.870 ( -4.790 -0.934 0.232) 4.885 10.971 ( -6.179 3.851 1.504) 7.434 11.203 ( -6.386 3.450 -1.092) 7.340 11.450 ( -5.783 -0.064 1.492) 5.973 11.734 ( -7.798 -2.437 -1.474) 8.302 11.797 ( -10.155 -0.056 0.592) 10.172 11.948 ( -4.810 3.921 -1.403) 6.363 11.979 ( 0.866 2.988 3.479) 4.667 12.498 ( 4.132 0.569 0.413) 4.191 12.565 ( 0.520 0.744 -0.377) 0.983 13.095 ( -12.077 11.547 -0.187) 16.709 13.193 ( -13.466 11.944 0.308) 18.003 13.344 ( 1.985 1.122 0.574) 2.352 13.366 ( 2.853 -1.358 0.094) 3.161 14.039 ( 5.386 4.737 -0.522) 7.192 14.066 ( 7.538 3.457 -0.149) 8.294 15.785 ( 7.126 -0.822 -3.287) 7.891 15.996 ( 8.117 3.176 3.797) 9.507 17.136 ( -6.306 1.682 -0.084) 6.527 17.538 ( -0.607 -1.894 -1.113) 2.279 17.801 ( -14.101 2.141 0.358) 14.267 18.558 ( -1.722 5.956 3.007) 6.891 18.665 ( 6.981 4.865 -1.651) 8.668 19.172 ( 7.740 4.390 0.896) 8.943 19.572 ( 0.901 10.998 1.779) 11.177 19.648 ( -11.972 15.426 -4.515) 20.042 19.723 ( 4.897 3.270 -0.638) 5.923 20.306 ( 3.062 18.432 -0.013) 18.684 21.346 ( -6.821 -11.448 2.649) 13.586 21.591 ( -5.159 -9.837 -7.731) 13.534 21.908 ( -4.785 -0.453 3.249) 5.801 22.120 ( -4.310 -7.345 6.254) 10.566 22.365 ( 3.249 -0.141 -4.550) 5.593 22.497 ( -3.529 -2.711 0.484) 4.476 22.720 ( 8.420 -5.245 -0.807) 9.952 22.988 ( 9.986 -12.448 1.626) 16.041 23.150 ( 3.967 -0.095 -2.917) 4.925 23.224 ( 5.832 -5.034 2.400) 8.069 ======================= Grid point 219 (96/102) ======================= q-point: (-0.09 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.313 ( -7.171 -13.628 -1.838) 15.509 1.377 ( -11.884 -11.629 2.493) 16.813 1.634 ( -12.192 -13.472 0.156) 18.170 2.004 ( -4.158 1.803 5.618) 7.218 2.142 ( -9.761 -2.374 -6.055) 11.729 2.175 ( 0.681 -9.701 -0.583) 9.742 2.308 ( -10.847 -10.331 0.412) 14.985 2.599 ( -0.441 0.588 -5.183) 5.234 2.615 ( -11.813 -7.561 4.615) 14.765 2.700 ( -0.822 0.061 -1.702) 1.891 2.838 ( 2.574 -3.073 0.095) 4.009 2.891 ( 2.022 1.309 3.465) 4.220 2.987 ( 3.859 0.202 -2.252) 4.473 3.188 ( 0.781 0.482 -0.867) 1.263 3.223 ( 0.615 -3.650 -0.809) 3.789 3.280 ( -2.051 -4.041 1.646) 4.821 3.334 ( 0.973 0.867 4.229) 4.426 3.477 ( -1.940 -0.086 -0.282) 1.962 3.519 ( -1.561 4.996 -1.888) 5.564 3.640 ( 1.962 5.147 -2.850) 6.202 3.699 ( 8.495 -3.682 -2.053) 9.484 3.777 ( 0.645 -1.752 1.498) 2.394 3.870 ( 4.089 1.661 -1.493) 4.659 3.981 ( 0.866 0.337 1.573) 1.827 4.182 ( 1.016 -7.583 2.188) 7.958 4.291 ( -0.027 2.662 2.283) 3.507 4.395 ( -0.185 5.210 0.092) 5.214 4.632 ( 2.481 6.463 -0.607) 6.950 4.691 ( -0.323 1.278 -0.939) 1.618 4.792 ( 0.239 3.177 -1.892) 3.705 4.877 ( -0.745 -2.508 2.100) 3.355 4.962 ( 0.880 -3.874 0.468) 4.001 5.060 ( 4.841 -5.066 -1.772) 7.228 5.184 ( 3.801 1.410 -2.235) 4.629 5.196 ( 6.619 -0.843 1.939) 6.949 5.378 ( -4.560 -0.270 -1.418) 4.783 5.486 ( 1.298 -2.732 -0.792) 3.127 5.664 ( 1.356 -4.630 -0.887) 4.905 5.733 ( 0.970 -0.904 3.486) 3.729 5.960 ( -3.586 -1.643 -1.393) 4.183 6.094 ( 4.121 -0.289 2.345) 4.751 6.334 ( -2.268 -2.863 3.242) 4.884 6.588 ( -6.697 -0.882 -4.256) 7.984 6.714 ( -7.360 -3.947 -0.161) 8.353 6.751 ( -9.666 4.223 -0.046) 10.548 7.197 ( -0.008 -1.973 -4.709) 5.106 7.205 ( -7.054 -1.052 4.691) 8.536 7.425 ( -5.370 6.533 4.195) 9.440 7.684 ( 1.223 3.151 -3.483) 4.853 7.778 ( -2.196 3.582 -3.303) 5.345 8.152 ( 0.211 2.856 2.674) 3.918 8.209 ( 5.052 1.622 -2.450) 5.844 8.392 ( -4.134 -1.781 0.182) 4.505 8.530 ( -18.036 5.438 1.320) 18.884 8.701 ( 13.253 2.806 -3.901) 14.097 8.794 ( 7.188 1.267 1.089) 7.380 9.229 ( 3.118 1.551 2.980) 4.583 9.302 ( -0.124 2.363 0.271) 2.381 9.596 ( 4.310 12.254 2.250) 13.183 9.820 ( -2.502 3.196 2.062) 4.553 9.956 ( -0.372 6.150 -0.433) 6.177 10.135 ( -4.539 4.848 -7.037) 9.676 10.467 ( -1.915 -2.056 2.926) 4.057 10.728 ( 5.478 -1.521 -2.215) 6.102 10.860 ( -6.022 -0.366 -0.726) 6.077 10.923 ( -3.096 -4.834 1.264) 5.878 11.131 ( -1.886 1.129 -1.203) 2.505 11.423 ( -5.166 -0.688 3.899) 6.509 11.655 ( -6.236 3.302 -1.548) 7.224 11.683 ( -12.542 4.878 2.451) 13.678 11.788 ( -5.655 5.987 -1.138) 8.313 11.946 ( 1.740 1.898 0.268) 2.589 12.488 ( 2.600 6.316 -1.354) 6.963 12.535 ( -0.237 1.142 1.396) 1.819 12.878 ( -4.695 4.100 -0.631) 6.265 12.927 ( -8.529 5.284 0.119) 10.034 13.383 ( 1.116 -2.401 0.335) 2.669 13.441 ( 1.321 -3.743 -0.157) 3.972 13.951 ( 4.252 7.730 0.475) 8.835 14.064 ( 6.589 3.657 -0.639) 7.563 15.840 ( 4.453 -0.992 -3.626) 5.827 15.948 ( -0.772 4.726 3.807) 6.117 17.145 ( 1.350 -3.277 -0.539) 3.585 17.600 ( 1.955 -4.654 -1.114) 5.169 17.725 ( -7.462 -2.532 0.660) 7.907 18.364 ( -10.474 11.583 4.541) 16.263 18.558 ( 6.740 11.236 -2.971) 13.435 19.009 ( -2.878 9.769 1.415) 10.282 19.220 ( -9.760 10.344 -4.543) 14.929 19.407 ( -1.137 8.248 2.248) 8.624 19.979 ( 12.137 0.851 -1.756) 12.293 20.059 ( 9.592 4.614 0.926) 10.684 21.384 ( -11.592 0.196 0.673) 11.614 21.646 ( -7.563 -7.517 0.450) 10.673 22.020 ( 2.737 -9.171 -3.877) 10.326 22.199 ( -2.774 -2.444 4.248) 5.631 22.392 ( 1.470 -1.638 -0.425) 2.242 22.525 ( -3.109 -3.500 -1.171) 4.826 22.858 ( 6.155 -3.445 3.290) 7.784 23.155 ( 2.761 1.279 -2.926) 4.221 23.240 ( 8.889 -6.646 -1.133) 11.157 23.368 ( 6.873 -4.169 1.241) 8.134 ======================= Grid point 228 (97/102) ======================= q-point: (-0.27 -0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.146 ( -22.094 0.000 6.966) 23.166 1.277 ( -25.245 0.000 7.965) 26.472 1.370 ( -10.260 0.000 -9.875) 14.241 1.375 ( -2.979 0.000 -9.614) 10.065 1.936 ( -16.172 0.000 5.178) 16.980 2.112 ( -28.920 0.000 1.265) 28.947 2.344 ( -18.424 0.000 -1.957) 18.528 2.462 ( -5.162 0.000 0.069) 5.163 2.609 ( 9.428 -0.000 4.856) 10.605 2.631 ( 9.852 -0.000 -1.435) 9.956 2.792 ( 0.662 -0.000 -7.138) 7.168 2.839 ( -1.671 0.000 -6.150) 6.373 2.897 ( -9.594 0.000 8.844) 13.048 3.008 ( 9.274 -0.000 1.164) 9.347 3.060 ( -1.553 0.000 -1.892) 2.448 3.313 ( 2.516 -0.000 0.835) 2.651 3.409 ( 2.093 -0.000 2.065) 2.940 3.477 ( 0.034 -0.000 -3.918) 3.918 3.529 ( 1.097 -0.000 2.724) 2.936 3.723 ( -0.522 0.000 1.382) 1.477 3.794 ( 2.289 -0.000 5.221) 5.701 3.845 ( 2.606 -0.000 -4.053) 4.818 3.935 ( -0.864 0.000 -7.885) 7.932 4.027 ( -6.651 0.000 -1.429) 6.803 4.242 ( 6.152 -0.000 6.338) 8.833 4.400 ( -0.651 0.000 2.457) 2.542 4.569 ( 4.232 -0.000 -3.180) 5.293 4.600 ( -0.555 0.000 3.683) 3.725 4.717 ( 10.762 -0.000 -9.263) 14.199 4.794 ( 8.944 -0.000 2.706) 9.345 4.879 ( 0.223 -0.000 1.664) 1.679 4.931 ( 2.012 -0.000 3.599) 4.123 4.936 ( 0.067 -0.000 -0.208) 0.219 5.121 ( 3.206 -0.000 -5.658) 6.503 5.166 ( -2.918 0.000 2.126) 3.611 5.182 ( 12.494 -0.000 -3.064) 12.864 5.404 ( 4.571 -0.000 0.200) 4.575 5.424 ( -10.189 0.000 3.449) 10.757 5.654 ( 5.266 -0.000 5.877) 7.891 5.886 ( 5.387 -0.000 -6.629) 8.542 6.114 ( -11.340 0.000 3.559) 11.886 6.308 ( -0.666 0.000 3.811) 3.869 6.619 ( 2.833 -0.000 -3.087) 4.190 6.620 ( 6.270 -0.000 -4.422) 7.672 6.950 ( -4.243 0.000 0.051) 4.244 7.109 ( -9.050 0.000 -2.518) 9.394 7.275 ( -8.509 0.000 3.572) 9.228 7.397 ( 1.445 -0.000 4.484) 4.711 7.815 ( -2.302 0.000 3.027) 3.803 7.894 ( 6.726 -0.000 -17.477) 18.727 8.233 ( 2.347 -0.000 -3.092) 3.882 8.289 ( -5.772 0.000 1.571) 5.982 8.528 ( 4.243 -0.000 -4.919) 6.496 8.571 ( 0.784 -0.000 9.369) 9.402 8.610 ( 2.259 -0.000 8.456) 8.753 9.015 ( 12.593 -0.000 -1.997) 12.750 9.210 ( -4.286 0.000 -0.335) 4.299 9.514 ( -11.571 0.000 8.076) 14.111 9.859 ( 13.155 -0.000 -14.861) 19.847 10.002 ( -12.808 0.000 7.101) 14.645 10.184 ( -8.111 0.000 0.090) 8.111 10.378 ( 18.229 -0.000 0.360) 18.233 10.436 ( -3.965 0.000 -4.333) 5.873 10.808 ( -2.219 0.000 -7.521) 7.841 10.961 ( -4.458 0.000 4.614) 6.416 11.021 ( -2.550 0.000 1.933) 3.200 11.391 ( -8.030 0.000 -6.675) 10.442 11.485 ( -10.203 0.000 0.430) 10.212 11.529 ( -6.681 0.000 -1.209) 6.789 11.775 ( -5.130 0.000 2.310) 5.626 11.911 ( 8.170 -0.000 5.003) 9.580 12.070 ( -4.696 0.000 -1.561) 4.949 12.507 ( -1.235 0.000 4.153) 4.332 12.566 ( 6.110 -0.000 -3.071) 6.838 13.218 ( -1.629 0.000 -1.288) 2.077 13.271 ( 3.410 -0.000 0.843) 3.513 13.540 ( -10.130 0.000 1.935) 10.313 13.683 ( -9.777 0.000 -1.841) 9.948 14.116 ( 4.962 -0.000 0.313) 4.971 14.127 ( 4.442 -0.000 0.024) 4.442 15.795 ( 7.349 -0.000 -5.994) 9.484 16.033 ( 20.756 -0.000 8.101) 22.281 17.325 ( -9.863 0.000 2.871) 10.272 17.504 ( -5.223 0.000 -2.887) 5.968 18.105 ( -8.729 0.000 1.311) 8.826 18.379 ( -3.656 0.000 -5.798) 6.854 18.728 ( 9.709 -0.000 1.638) 9.846 18.936 ( 13.271 -0.000 -0.006) 13.271 19.868 ( -2.628 0.000 -6.074) 6.618 19.911 ( -0.507 0.000 7.225) 7.243 20.512 ( -7.952 0.000 4.049) 8.924 20.881 ( 4.521 -0.000 -5.718) 7.290 20.966 ( -3.405 0.000 7.079) 7.855 21.114 ( -2.578 0.000 -24.052) 24.189 21.913 ( -3.235 0.000 5.080) 6.023 22.044 ( -3.087 0.000 -3.052) 4.341 22.320 ( 3.207 -0.000 12.992) 13.382 22.340 ( 2.965 -0.000 -3.414) 4.522 22.537 ( -5.370 0.000 11.433) 12.631 22.654 ( 2.741 -0.000 -6.788) 7.320 23.127 ( 4.981 -0.000 -1.674) 5.255 23.140 ( 4.229 -0.000 1.163) 4.386 ======================= Grid point 229 (98/102) ======================= q-point: (-0.18 -0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.001 ( -20.272 -2.108 8.046) 21.912 1.181 ( -14.230 -3.099 -2.831) 14.837 1.217 ( -16.326 -4.126 -0.228) 16.841 1.539 ( -6.075 -16.086 -8.079) 18.998 1.881 ( -13.627 -5.421 3.774) 15.143 1.951 ( -31.078 -8.691 2.549) 32.371 2.186 ( -21.365 -0.950 -3.216) 21.626 2.451 ( -3.957 -1.371 -1.758) 4.542 2.604 ( 10.944 7.150 -2.627) 13.334 2.726 ( -4.464 -1.992 4.706) 6.785 2.761 ( -3.313 -3.028 3.773) 5.863 2.806 ( 0.770 -1.211 -4.059) 4.305 2.953 ( -0.486 -4.912 0.920) 5.021 3.045 ( -1.001 -1.041 -0.989) 1.751 3.117 ( 9.479 -2.578 0.835) 9.859 3.318 ( 0.528 3.091 1.536) 3.492 3.421 ( -2.109 2.471 1.114) 3.434 3.471 ( 2.893 -3.382 -4.551) 6.366 3.535 ( -0.611 -0.835 2.466) 2.674 3.725 ( 0.829 1.695 1.611) 2.481 3.760 ( 3.700 5.844 0.597) 6.943 3.870 ( 1.383 -0.865 -6.285) 6.494 3.913 ( 1.448 0.375 -3.480) 3.788 3.973 ( -2.529 -0.794 1.082) 2.863 4.167 ( 2.977 9.961 4.976) 11.526 4.414 ( -1.055 1.848 2.413) 3.217 4.631 ( 5.040 -1.901 0.616) 5.422 4.650 ( 1.627 -4.393 -1.441) 4.901 4.705 ( 6.609 5.611 -3.251) 9.260 4.783 ( 3.844 3.586 -2.232) 5.711 4.892 ( -0.692 2.593 3.353) 4.295 4.921 ( 9.794 -2.054 2.422) 10.296 5.054 ( -4.860 3.185 -2.292) 6.246 5.115 ( 3.087 -6.672 -0.758) 7.391 5.219 ( 3.413 -3.429 -1.068) 4.954 5.253 ( 7.194 -1.252 -2.324) 7.663 5.364 ( -3.435 -0.866 1.523) 3.856 5.488 ( 4.292 -4.050 -0.519) 5.924 5.702 ( 4.888 -0.002 5.437) 7.311 5.957 ( 1.695 -3.773 -3.358) 5.327 6.026 ( -6.742 1.243 2.198) 7.200 6.300 ( -1.407 1.018 3.869) 4.241 6.617 ( -0.412 1.771 -5.427) 5.724 6.643 ( 1.580 -0.048 -2.634) 3.072 6.885 ( -7.543 3.337 1.393) 8.365 7.080 ( -4.152 -3.691 -2.745) 6.197 7.212 ( -8.582 0.262 2.832) 9.041 7.434 ( 0.403 -2.047 4.738) 5.177 7.793 ( -4.422 0.282 1.872) 4.810 7.871 ( 1.667 2.162 -15.056) 15.302 8.238 ( -0.114 0.368 -3.071) 3.095 8.274 ( -2.416 -1.949 -1.269) 3.354 8.450 ( 0.027 7.031 4.035) 8.106 8.592 ( -7.564 -0.975 8.150) 11.162 8.722 ( 11.603 -2.936 -0.895) 12.002 8.963 ( 7.887 9.320 -0.801) 12.235 9.252 ( -0.301 -2.521 0.109) 2.541 9.392 ( -13.093 2.873 7.616) 15.417 9.834 ( -3.363 3.912 -6.211) 8.074 9.967 ( 1.208 -1.287 -1.451) 2.285 10.138 ( -0.070 1.230 -6.856) 6.965 10.356 ( -6.499 5.394 3.411) 9.109 10.522 ( 14.579 1.722 0.940) 14.710 10.701 ( -1.390 4.329 -6.604) 8.018 10.892 ( -1.057 4.533 1.172) 4.800 11.006 ( -2.467 2.307 2.807) 4.392 11.239 ( -6.023 6.330 -1.662) 8.895 11.387 ( -7.646 -0.281 -3.354) 8.354 11.584 ( -7.510 -6.525 0.594) 9.967 11.735 ( -7.189 -0.155 0.318) 7.198 11.954 ( -5.027 2.658 -1.776) 5.957 12.045 ( 4.676 0.160 5.620) 7.313 12.512 ( -0.017 -0.190 3.687) 3.692 12.608 ( 7.383 0.651 -2.572) 7.845 13.150 ( -10.262 4.717 -0.287) 11.297 13.282 ( -4.971 4.046 0.829) 6.463 13.402 ( -2.787 6.824 0.938) 7.431 13.452 ( -8.581 9.699 -1.078) 12.995 14.124 ( 5.751 1.264 -0.532) 5.913 14.171 ( 4.863 1.386 0.021) 5.057 15.822 ( 5.249 0.238 -5.883) 7.888 16.170 ( 15.548 5.425 8.190) 18.392 17.159 ( -9.271 7.562 0.629) 11.981 17.479 ( -3.667 -2.277 -3.311) 5.440 17.789 ( -13.729 10.234 0.061) 17.124 18.563 ( -2.830 -6.696 -3.167) 7.929 18.788 ( 9.636 2.245 1.859) 10.067 19.184 ( 16.954 -12.915 -0.207) 21.314 19.718 ( -4.372 9.124 -6.063) 11.795 19.796 ( -1.211 10.623 6.044) 12.282 20.080 ( -15.088 30.695 -1.815) 34.251 20.656 ( 2.790 17.427 -0.029) 17.649 21.075 ( -5.820 -12.285 -1.043) 13.634 21.305 ( -2.123 -15.731 -11.162) 19.405 21.888 ( -7.213 1.173 7.545) 10.504 21.993 ( -4.276 -2.423 2.329) 5.439 22.364 ( 2.085 -0.945 -3.016) 3.786 22.431 ( -1.901 -2.614 -0.043) 3.232 22.686 ( 10.951 -6.213 -2.859) 12.911 22.803 ( 9.261 -17.180 7.820) 21.025 23.168 ( 4.362 -0.642 -2.067) 4.869 23.192 ( 4.131 -2.704 1.783) 5.249 ======================= Grid point 230 (99/102) ======================= q-point: (-0.09 -0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 1.005 ( -13.585 -11.310 2.539) 17.858 1.142 ( -8.889 -4.516 -4.623) 10.990 1.275 ( -16.892 -14.137 3.574) 22.315 1.780 ( -8.321 -15.749 -1.571) 17.881 1.952 ( -11.030 -11.154 0.906) 15.713 1.996 ( -16.246 -15.269 -0.822) 22.310 2.077 ( -14.560 -2.593 1.013) 14.824 2.403 ( -9.262 -0.609 3.756) 10.013 2.571 ( 4.814 0.426 -7.035) 8.535 2.729 ( -3.450 0.087 0.475) 3.484 2.801 ( -0.565 -0.691 -4.999) 5.078 2.865 ( -0.093 -5.340 4.451) 6.953 3.017 ( 0.030 -2.535 2.820) 3.792 3.089 ( -1.111 -2.632 -0.555) 2.911 3.200 ( 1.130 -2.175 2.207) 3.298 3.269 ( 4.269 0.881 -1.453) 4.595 3.372 ( -0.073 1.703 1.873) 2.533 3.502 ( -1.405 2.156 1.803) 3.142 3.572 ( -0.586 0.619 -2.333) 2.484 3.660 ( 6.378 0.051 -3.662) 7.355 3.766 ( 3.076 -0.634 -0.850) 3.254 3.800 ( 2.021 5.722 -1.286) 6.203 3.938 ( 4.320 1.314 -2.192) 5.019 4.030 ( 2.626 2.629 1.307) 3.939 4.070 ( 2.897 -3.870 3.403) 5.912 4.348 ( -1.983 3.423 1.983) 4.425 4.545 ( -0.059 10.206 0.683) 10.229 4.693 ( 2.556 -0.543 -3.048) 4.015 4.723 ( 0.223 1.480 0.883) 1.738 4.810 ( -1.085 -0.701 -0.390) 1.349 4.846 ( -0.782 -0.415 3.308) 3.424 4.936 ( 0.469 1.859 -2.550) 3.191 5.049 ( 7.818 -1.628 0.599) 8.008 5.199 ( 1.433 -1.145 -1.552) 2.403 5.275 ( 8.965 1.138 -0.370) 9.045 5.319 ( -3.215 -3.836 -0.649) 5.047 5.427 ( 4.123 -3.730 -1.131) 5.673 5.592 ( 2.663 -3.737 -2.562) 5.255 5.750 ( 2.101 -0.924 6.118) 6.534 5.920 ( -4.234 1.307 -0.886) 4.518 6.083 ( 3.488 -4.125 0.127) 5.403 6.280 ( -3.733 -0.758 3.288) 5.032 6.526 ( -9.175 2.065 -4.272) 10.330 6.621 ( -8.378 -0.249 1.591) 8.531 6.763 ( -4.483 3.529 -1.317) 5.855 7.126 ( -1.777 -3.251 -2.678) 4.572 7.158 ( -6.950 0.046 3.042) 7.586 7.466 ( -3.747 0.709 5.038) 6.319 7.723 ( -5.612 2.660 -2.445) 6.675 7.801 ( -1.102 2.370 -10.026) 10.361 8.209 ( -3.032 1.183 -1.712) 3.678 8.267 ( 1.131 2.881 -0.895) 3.222 8.351 ( -1.962 1.168 2.917) 3.704 8.492 ( -14.958 4.549 3.378) 15.995 8.833 ( 13.232 0.732 -5.920) 14.515 8.895 ( 7.178 4.327 3.289) 9.004 9.254 ( -0.988 -0.367 4.902) 5.014 9.323 ( -3.081 0.383 0.009) 3.105 9.742 ( -3.506 2.235 -0.411) 4.178 9.952 ( 0.315 7.686 4.594) 8.960 10.052 ( -0.587 7.650 -5.462) 9.418 10.165 ( -6.365 5.013 -3.825) 8.960 10.466 ( 1.601 3.519 -0.693) 3.928 10.761 ( 8.802 -2.091 -0.026) 9.047 10.806 ( -4.267 2.578 0.794) 5.048 10.906 ( -3.613 3.940 0.845) 5.412 11.146 ( -0.359 1.761 -1.036) 2.074 11.355 ( -6.276 -2.350 0.970) 6.771 11.606 ( -8.638 -1.684 0.942) 8.851 11.668 ( -6.596 1.461 -0.745) 6.797 11.837 ( -8.979 3.912 -1.296) 9.879 12.009 ( -0.891 5.294 5.325) 7.562 12.539 ( 1.627 -1.044 0.199) 1.944 12.622 ( 7.008 4.299 -1.514) 8.360 12.929 ( -9.929 6.822 1.062) 12.094 12.968 ( -14.703 9.303 -1.047) 17.431 13.377 ( 1.608 0.232 1.187) 2.012 13.406 ( 2.499 -1.550 -0.658) 3.013 14.106 ( 3.282 5.373 1.292) 6.428 14.170 ( 6.651 2.820 -1.813) 7.448 15.846 ( 3.449 -0.678 -5.601) 6.613 16.065 ( -3.483 9.747 6.762) 12.364 17.090 ( 1.065 -3.553 -0.531) 3.747 17.521 ( 0.562 -4.310 -2.386) 4.959 17.633 ( -8.519 -0.690 1.189) 8.629 18.483 ( -11.460 8.154 0.880) 14.092 18.784 ( 9.256 6.940 -0.190) 11.570 19.229 ( -0.633 14.920 1.106) 14.974 19.364 ( -14.501 17.191 -4.927) 23.024 19.573 ( -3.534 10.986 1.639) 11.656 19.932 ( 17.982 -12.227 -0.144) 21.746 20.364 ( 4.673 17.045 0.273) 17.676 21.238 ( -8.033 -8.670 0.391) 11.826 21.438 ( -11.223 -7.211 -3.579) 13.812 21.885 ( -0.173 -5.784 1.648) 6.017 22.080 ( -4.239 -7.288 4.201) 9.419 22.388 ( 2.353 -0.814 -3.974) 4.690 22.450 ( -3.165 -2.163 1.507) 4.119 22.852 ( 8.694 -4.421 1.347) 9.846 23.152 ( 8.385 -5.934 -2.830) 10.655 23.211 ( 7.256 -2.483 -1.686) 7.852 23.330 ( 7.789 -6.741 2.026) 10.499 ======================= Grid point 241 (100/102) ======================= q-point: (-0.18 -0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.846 ( -22.651 0.000 9.339) 24.501 0.927 ( -26.056 0.000 9.683) 27.797 1.167 ( -9.784 0.000 -11.904) 15.409 1.296 ( -0.157 0.000 -11.817) 11.818 1.580 ( -41.578 0.000 9.912) 42.743 1.725 ( -15.195 0.000 -0.671) 15.210 2.004 ( -20.361 0.000 -4.586) 20.871 2.413 ( -1.979 0.000 -2.653) 3.310 2.643 ( -5.893 0.000 -1.812) 6.165 2.678 ( -9.175 0.000 3.550) 9.838 2.797 ( -2.922 0.000 6.344) 6.984 2.826 ( 8.114 -0.000 0.230) 8.117 2.898 ( 10.385 -0.000 -2.672) 10.723 3.007 ( -4.134 0.000 1.767) 4.496 3.184 ( 11.090 -0.000 -3.019) 11.494 3.365 ( 2.888 -0.000 2.810) 4.030 3.429 ( -0.750 0.000 0.806) 1.101 3.456 ( 0.079 -0.000 -5.479) 5.480 3.494 ( -5.891 0.000 2.945) 6.586 3.781 ( 5.446 -0.000 1.988) 5.798 3.806 ( -4.217 0.000 -7.288) 8.420 3.874 ( 4.555 -0.000 4.316) 6.275 3.917 ( 1.059 -0.000 -2.917) 3.103 3.934 ( -0.709 0.000 -3.434) 3.506 4.338 ( -1.284 0.000 9.973) 10.055 4.401 ( 0.933 -0.000 -0.392) 1.012 4.636 ( 6.847 -0.000 -4.105) 7.984 4.638 ( 4.806 -0.000 2.019) 5.213 4.823 ( 6.122 -0.000 -5.582) 8.285 4.900 ( 2.425 -0.000 -1.514) 2.859 4.905 ( 4.062 -0.000 -2.393) 4.715 4.961 ( 3.343 -0.000 3.749) 5.023 5.009 ( 3.929 -0.000 3.731) 5.418 5.099 ( -2.559 0.000 -3.894) 4.660 5.131 ( 1.114 -0.000 -1.814) 2.129 5.330 ( -0.823 0.000 1.352) 1.583 5.351 ( 9.270 -0.000 -2.104) 9.506 5.475 ( 5.054 -0.000 -0.441) 5.073 5.744 ( 0.615 -0.000 7.256) 7.282 5.930 ( 3.832 -0.000 -3.731) 5.349 5.991 ( -4.915 0.000 2.258) 5.409 6.322 ( -0.261 0.000 4.448) 4.456 6.624 ( -5.142 0.000 -3.949) 6.484 6.663 ( 4.732 -0.000 -7.758) 9.088 6.936 ( 1.926 -0.000 2.489) 3.147 6.948 ( -9.787 0.000 -3.817) 10.504 7.153 ( -8.126 0.000 1.684) 8.298 7.413 ( -2.201 0.000 2.806) 3.566 7.750 ( -9.462 0.000 4.902) 10.656 7.857 ( -1.285 0.000 -17.374) 17.421 8.203 ( -4.799 0.000 -2.139) 5.254 8.245 ( -0.746 0.000 -5.336) 5.388 8.503 ( -3.664 0.000 6.698) 7.635 8.584 ( -4.317 0.000 9.665) 10.585 8.782 ( 15.689 -0.000 -3.212) 16.015 9.127 ( -5.896 0.000 -0.620) 5.929 9.190 ( 9.900 -0.000 -1.460) 10.008 9.324 ( -17.640 0.000 13.125) 21.987 9.837 ( -12.292 0.000 6.377) 13.848 9.885 ( -1.753 0.000 -11.926) 12.054 10.162 ( 9.567 -0.000 -15.763) 18.439 10.397 ( -1.035 0.000 7.596) 7.666 10.661 ( 17.667 -0.000 1.244) 17.711 10.727 ( -2.261 0.000 -10.190) 10.438 10.965 ( 3.430 -0.000 0.231) 3.438 11.013 ( -0.725 0.000 3.280) 3.360 11.269 ( -3.676 0.000 -7.149) 8.038 11.355 ( -7.373 0.000 0.840) 7.420 11.437 ( -4.812 0.000 -1.586) 5.067 11.678 ( -6.852 0.000 -1.175) 6.952 11.931 ( -11.506 0.000 -3.794) 12.116 12.123 ( 15.040 -0.000 6.263) 16.292 12.535 ( 2.262 -0.000 7.063) 7.417 12.669 ( 8.450 -0.000 -2.728) 8.879 13.126 ( -9.899 0.000 1.914) 10.082 13.295 ( -2.692 0.000 -1.577) 3.120 13.451 ( -3.227 0.000 2.190) 3.900 13.489 ( -12.428 0.000 -6.332) 13.948 14.184 ( 3.205 -0.000 -0.172) 3.210 14.188 ( 4.143 -0.000 0.560) 4.181 15.834 ( 1.856 -0.000 -7.266) 7.499 16.427 ( 26.250 -0.000 10.073) 28.116 17.225 ( -5.292 0.000 4.832) 7.166 17.385 ( -7.720 0.000 -10.716) 13.207 17.977 ( -8.909 0.000 0.667) 8.934 18.240 ( -11.347 0.000 -15.869) 19.509 18.897 ( 10.989 -0.000 5.521) 12.298 19.145 ( 14.559 -0.000 0.177) 14.560 19.773 ( -6.139 0.000 -4.883) 7.844 19.897 ( -6.248 0.000 7.711) 9.925 20.379 ( -11.808 0.000 3.090) 12.206 20.857 ( -7.963 0.000 -25.060) 26.294 20.957 ( -0.530 0.000 3.256) 3.298 20.976 ( 1.200 -0.000 -6.790) 6.895 21.886 ( -2.605 0.000 2.751) 3.789 21.976 ( -4.194 0.000 -1.980) 4.638 22.368 ( 1.986 -0.000 -2.043) 2.849 22.386 ( -0.632 0.000 2.139) 2.230 22.625 ( 8.433 -0.000 26.065) 27.396 22.712 ( 9.250 -0.000 -7.416) 11.855 23.189 ( 4.004 -0.000 -1.094) 4.151 23.198 ( 2.986 -0.000 0.869) 3.110 ======================= Grid point 242 (101/102) ======================= q-point: (-0.09 -0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.733 ( -20.131 -5.710 9.427) 22.951 0.891 ( -21.499 -12.312 8.842) 26.306 1.061 ( -3.900 0.780 -14.704) 15.233 1.426 ( -4.254 -14.630 -5.558) 16.218 1.487 ( -30.601 -18.724 11.014) 37.527 1.651 ( -19.553 -7.176 -8.262) 22.407 1.915 ( -8.680 -4.054 1.200) 9.655 2.377 ( -4.851 1.785 -3.675) 6.342 2.621 ( -9.575 -2.020 4.233) 10.662 2.643 ( -4.224 -3.543 -4.775) 7.293 2.781 ( 5.871 3.672 4.242) 8.120 2.810 ( -1.631 -0.617 4.189) 4.537 2.997 ( 0.947 -0.901 -0.066) 1.309 3.034 ( 4.045 -2.675 -1.201) 4.996 3.238 ( 3.929 1.920 -2.272) 4.928 3.323 ( 1.835 3.672 -1.323) 4.313 3.392 ( -1.951 0.720 1.926) 2.834 3.495 ( 0.102 -1.823 -2.397) 3.013 3.506 ( -1.948 -4.684 2.909) 5.848 3.737 ( -0.029 2.354 -2.467) 3.410 3.821 ( 3.810 4.515 -0.062) 5.907 3.864 ( 3.659 -0.846 -3.698) 5.270 3.940 ( 2.525 -2.123 -1.891) 3.802 4.000 ( 4.578 -3.852 -0.076) 5.984 4.216 ( 0.336 9.421 5.306) 10.818 4.394 ( -1.652 2.693 1.417) 3.462 4.672 ( 2.231 2.390 -2.578) 4.164 4.704 ( 2.745 -0.690 0.659) 2.906 4.793 ( 4.761 6.252 0.961) 7.917 4.840 ( 4.680 0.759 -1.429) 4.952 4.855 ( -3.963 5.565 1.972) 7.110 4.968 ( -1.577 1.301 -5.154) 5.545 5.065 ( -1.128 -1.454 2.187) 2.858 5.163 ( -0.029 -5.899 -0.587) 5.928 5.210 ( 9.791 -4.063 -1.406) 10.693 5.329 ( 3.479 -0.687 0.511) 3.583 5.453 ( 12.183 -1.032 -3.283) 12.660 5.550 ( 4.864 -3.279 -2.132) 6.241 5.740 ( -5.206 -0.450 7.542) 9.175 5.943 ( 0.808 1.898 0.216) 2.074 6.020 ( 2.784 -4.405 -1.047) 5.315 6.282 ( -4.751 3.821 0.590) 6.126 6.532 ( -14.272 7.854 -1.590) 16.367 6.554 ( -8.262 0.794 -3.682) 9.080 6.811 ( -0.517 3.703 -1.293) 3.956 7.049 ( 0.373 -4.109 -2.003) 4.586 7.113 ( -4.405 -0.774 2.013) 4.904 7.424 ( -4.586 -2.527 2.053) 5.625 7.680 ( -11.189 -0.270 2.310) 11.428 7.788 ( -3.972 0.725 -15.056) 15.588 8.169 ( -4.822 -0.208 -1.817) 5.157 8.228 ( -5.196 -2.081 -4.267) 7.038 8.456 ( -0.891 5.950 4.420) 7.466 8.508 ( -6.359 4.793 6.931) 10.557 8.910 ( 13.931 -0.918 -4.223) 14.585 9.037 ( 1.954 4.201 0.919) 4.724 9.223 ( -11.717 -2.174 8.102) 14.410 9.280 ( 3.097 -0.503 0.498) 3.177 9.731 ( -6.415 1.668 1.178) 6.732 9.903 ( -5.642 -4.520 -4.494) 8.512 10.169 ( 3.923 2.771 -11.534) 12.494 10.346 ( 3.709 12.062 6.692) 14.284 10.597 ( 1.306 8.475 -9.571) 12.850 10.796 ( 10.644 -1.063 3.014) 11.114 10.897 ( 0.125 7.101 0.908) 7.160 10.993 ( -1.404 6.555 1.784) 6.937 11.187 ( 0.123 3.398 -0.929) 3.525 11.271 ( -4.710 -1.108 -2.984) 5.685 11.485 ( -6.425 -5.366 1.076) 8.440 11.630 ( -6.280 -0.166 -0.133) 6.283 11.797 ( -11.500 2.010 -4.075) 12.365 12.162 ( 1.484 9.374 5.536) 10.987 12.551 ( 3.389 1.204 4.072) 5.433 12.721 ( 7.845 0.590 -1.900) 8.094 12.977 ( -11.933 7.236 1.642) 14.052 13.031 ( -22.063 12.539 -3.448) 25.610 13.398 ( 1.490 0.272 -0.515) 1.600 13.419 ( 0.183 1.298 1.098) 1.710 14.190 ( 2.928 1.410 0.706) 3.326 14.241 ( 4.919 -0.198 -1.691) 5.205 15.835 ( 1.448 -0.912 -7.251) 7.451 16.353 ( -2.591 25.241 8.665) 26.812 17.045 ( -3.505 0.429 -1.247) 3.744 17.427 ( 0.091 -6.694 -5.161) 8.453 17.621 ( -7.164 7.394 0.510) 10.308 18.406 ( -17.073 -7.287 -10.124) 21.145 18.957 ( 10.848 3.881 5.531) 12.780 19.406 ( 10.677 -4.493 -2.438) 11.838 19.575 ( -10.133 15.471 -1.332) 18.542 19.737 ( -10.323 11.393 3.724) 15.819 19.951 ( 2.906 10.813 0.119) 11.197 20.674 ( -2.785 12.553 -0.643) 12.874 20.980 ( -3.038 -11.810 -5.866) 13.532 21.201 ( -6.730 -10.428 -5.032) 13.392 21.832 ( -4.055 1.310 6.794) 8.020 21.944 ( -3.296 -4.055 1.414) 5.413 22.373 ( 0.124 -0.692 -1.040) 1.255 22.402 ( -1.162 -1.707 -0.307) 2.088 22.831 ( 10.497 -5.237 -2.169) 11.930 23.059 ( 18.111 -16.176 -0.041) 24.284 23.221 ( 3.994 -0.976 -0.966) 4.224 23.260 ( 4.447 -5.431 2.339) 7.399 ======================= Grid point 253 (102/102) ======================= q-point: (-0.09 -0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 8.27e-07 8.27e-07 8.27e-07 8.27e-07 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| 0.550 ( -21.919 0.000 11.481) 24.744 0.611 ( -21.939 0.000 15.272) 26.732 0.980 ( -11.103 0.000 -7.082) 13.170 1.059 ( -30.284 0.000 17.530) 34.992 1.279 ( 0.630 -0.000 -12.839) 12.854 1.409 ( -13.724 0.000 -20.181) 24.406 1.841 ( -1.459 0.000 5.831) 6.011 2.370 ( -1.166 0.000 -6.488) 6.592 2.500 ( -12.294 0.000 2.888) 12.629 2.550 ( -4.021 0.000 -2.686) 4.836 2.787 ( -2.609 0.000 9.581) 9.930 2.954 ( -1.004 0.000 -1.563) 1.858 2.975 ( 5.548 -0.000 6.733) 8.724 3.066 ( 12.440 -0.000 -4.533) 13.240 3.277 ( 2.644 -0.000 -3.215) 4.163 3.359 ( -8.080 0.000 1.055) 8.149 3.419 ( 1.928 -0.000 3.789) 4.251 3.447 ( 2.946 -0.000 -5.874) 6.571 3.448 ( -1.856 0.000 3.167) 3.671 3.715 ( -2.282 0.000 -7.706) 8.037 3.859 ( 3.003 -0.000 2.407) 3.849 3.939 ( 4.196 -0.000 -4.364) 6.054 3.943 ( 0.755 -0.000 4.651) 4.712 3.953 ( 4.503 -0.000 -5.845) 7.379 4.302 ( -6.738 0.000 8.375) 10.749 4.430 ( 3.736 -0.000 -5.155) 6.366 4.728 ( 6.962 -0.000 -4.009) 8.034 4.732 ( 4.021 -0.000 3.041) 5.042 4.866 ( 1.653 -0.000 -1.223) 2.056 4.882 ( -3.140 0.000 -0.193) 3.146 4.931 ( -1.195 0.000 -3.094) 3.317 4.969 ( -4.149 0.000 -2.448) 4.818 5.000 ( -1.301 0.000 3.697) 3.919 5.089 ( 2.483 -0.000 1.146) 2.734 5.285 ( 17.546 -0.000 -6.595) 18.745 5.341 ( 4.446 -0.000 3.110) 5.426 5.529 ( 14.150 -0.000 -4.391) 14.816 5.558 ( 5.870 -0.000 0.463) 5.888 5.698 ( -8.315 0.000 5.783) 10.128 5.955 ( 0.336 -0.000 -1.125) 1.174 6.012 ( 3.853 -0.000 1.502) 4.136 6.301 ( -7.048 0.000 -2.476) 7.470 6.433 ( -15.845 0.000 -0.479) 15.852 6.560 ( -17.347 0.000 -18.518) 25.374 6.844 ( -1.823 0.000 1.105) 2.132 7.001 ( 4.453 -0.000 -2.161) 4.949 7.086 ( -0.541 0.000 1.656) 1.742 7.342 ( -6.699 0.000 -1.293) 6.822 7.573 ( -16.483 0.000 7.925) 18.290 7.704 ( -8.893 0.000 -14.364) 16.894 8.141 ( -9.666 0.000 0.967) 9.714 8.147 ( -0.111 0.000 -5.098) 5.100 8.518 ( 2.538 -0.000 2.519) 3.575 8.549 ( -4.092 0.000 6.143) 7.381 9.018 ( 15.710 -0.000 -8.522) 17.872 9.056 ( -0.875 0.000 4.297) 4.385 9.084 ( -14.436 0.000 7.636) 16.331 9.337 ( 2.752 -0.000 2.633) 3.809 9.707 ( -8.676 0.000 7.063) 11.188 9.802 ( -0.961 0.000 -8.813) 8.865 10.220 ( 3.851 -0.000 -3.392) 5.132 10.546 ( 19.916 -0.000 -2.588) 20.083 10.655 ( -1.394 0.000 -11.681) 11.764 10.873 ( 7.933 -0.000 1.616) 8.096 11.032 ( 4.758 -0.000 -1.486) 4.984 11.040 ( 3.553 -0.000 3.234) 4.804 11.231 ( 2.792 -0.000 -5.867) 6.497 11.268 ( -5.020 0.000 1.034) 5.125 11.366 ( -3.963 0.000 -2.046) 4.460 11.580 ( -4.948 0.000 -0.939) 5.036 11.723 ( -12.540 0.000 -3.113) 12.921 12.280 ( -4.676 0.000 -19.508) 20.061 12.680 ( 13.190 -0.000 12.086) 17.890 12.761 ( 3.843 -0.000 -2.033) 4.348 12.969 ( -32.221 0.000 -12.041) 34.397 12.994 ( -7.862 0.000 4.235) 8.930 13.407 ( 0.846 -0.000 -0.835) 1.188 13.432 ( -0.986 0.000 0.857) 1.306 14.222 ( 1.919 -0.000 0.232) 1.933 14.238 ( 2.144 -0.000 0.184) 2.152 15.821 ( 2.792 -0.000 -6.824) 7.373 16.870 ( 18.678 -0.000 -14.081) 23.390 17.047 ( -28.264 0.000 -21.529) 35.530 17.201 ( -1.855 0.000 5.202) 5.523 17.830 ( -29.546 0.000 -7.366) 30.451 17.850 ( -7.199 0.000 -1.418) 7.337 19.142 ( 18.823 -0.000 11.350) 21.981 19.368 ( 14.366 -0.000 1.359) 14.430 19.681 ( -3.325 0.000 -0.636) 3.386 19.783 ( -13.008 0.000 5.887) 14.278 20.208 ( -10.809 0.000 0.904) 10.846 20.480 ( -23.635 0.000 -23.087) 33.040 20.977 ( 1.586 -0.000 0.874) 1.810 21.004 ( 1.777 -0.000 -0.691) 1.907 21.865 ( -1.088 0.000 1.090) 1.540 21.912 ( -3.084 0.000 -1.004) 3.243 22.366 ( -2.014 0.000 1.580) 2.559 22.381 ( 1.109 -0.000 -1.755) 2.076 22.848 ( 11.279 -0.000 -4.199) 12.035 22.945 ( 17.036 -0.000 11.559) 20.588 23.233 ( 2.353 -0.000 -0.747) 2.469 23.239 ( 1.861 -0.000 1.315) 2.279 =================== 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 10.0 331.026 195.568 121.379 0.000 -39.680 -0.000 3/37026 20.0 88.404 65.438 30.161 0.000 -11.998 -0.000 3/37026 30.0 40.123 30.817 13.787 0.000 -5.522 -0.000 3/37026 40.0 23.911 18.544 8.388 0.000 -3.355 -0.000 3/37026 50.0 16.560 12.849 5.921 0.000 -2.367 -0.000 3/37026 60.0 12.560 9.712 4.559 0.000 -1.820 -0.000 3/37026 70.0 10.100 7.769 3.708 0.000 -1.478 -0.000 3/37026 80.0 8.448 6.462 3.130 0.000 -1.246 -0.000 3/37026 90.0 7.268 5.529 2.713 0.000 -1.077 -0.000 3/37026 100.0 6.383 4.832 2.397 0.000 -0.950 -0.000 3/37026 110.0 5.696 4.293 2.149 0.000 -0.851 -0.000 3/37026 120.0 5.147 3.865 1.950 0.000 -0.771 -0.000 3/37026 130.0 4.699 3.516 1.786 0.000 -0.705 -0.000 3/37026 140.0 4.325 3.228 1.648 0.000 -0.650 -0.000 3/37026 150.0 4.009 2.986 1.532 0.000 -0.603 -0.000 3/37026 160.0 3.739 2.780 1.431 0.000 -0.562 -0.000 3/37026 170.0 3.504 2.602 1.344 0.000 -0.527 -0.000 3/37026 180.0 3.299 2.447 1.267 0.000 -0.496 -0.000 3/37026 190.0 3.118 2.311 1.199 0.000 -0.469 -0.000 3/37026 200.0 2.956 2.191 1.138 0.000 -0.445 -0.000 3/37026 210.0 2.812 2.083 1.084 0.000 -0.423 -0.000 3/37026 220.0 2.681 1.986 1.035 0.000 -0.403 -0.000 3/37026 230.0 2.563 1.899 0.990 0.000 -0.385 -0.000 3/37026 240.0 2.455 1.820 0.949 0.000 -0.369 -0.000 3/37026 250.0 2.357 1.747 0.912 0.000 -0.354 -0.000 3/37026 260.0 2.266 1.680 0.878 0.000 -0.340 -0.000 3/37026 270.0 2.182 1.619 0.846 0.000 -0.327 -0.000 3/37026 280.0 2.105 1.562 0.817 0.000 -0.316 -0.000 3/37026 290.0 2.033 1.510 0.789 0.000 -0.305 -0.000 3/37026 300.0 1.966 1.461 0.764 0.000 -0.295 -0.000 3/37026 310.0 1.903 1.415 0.740 0.000 -0.285 -0.000 3/37026 320.0 1.845 1.372 0.718 0.000 -0.276 -0.000 3/37026 330.0 1.790 1.332 0.697 0.000 -0.268 -0.000 3/37026 340.0 1.738 1.294 0.677 0.000 -0.260 -0.000 3/37026 350.0 1.689 1.258 0.659 0.000 -0.253 -0.000 3/37026 360.0 1.643 1.225 0.641 0.000 -0.246 -0.000 3/37026 370.0 1.600 1.193 0.624 0.000 -0.239 -0.000 3/37026 380.0 1.558 1.163 0.608 0.000 -0.233 -0.000 3/37026 390.0 1.519 1.134 0.593 0.000 -0.227 -0.000 3/37026 400.0 1.482 1.107 0.579 0.000 -0.221 -0.000 3/37026 410.0 1.446 1.081 0.566 0.000 -0.216 -0.000 3/37026 420.0 1.413 1.056 0.553 0.000 -0.211 -0.000 3/37026 430.0 1.380 1.032 0.540 0.000 -0.206 -0.000 3/37026 440.0 1.350 1.010 0.528 0.000 -0.202 -0.000 3/37026 450.0 1.320 0.988 0.517 0.000 -0.197 -0.000 3/37026 460.0 1.292 0.967 0.506 0.000 -0.193 -0.000 3/37026 470.0 1.265 0.948 0.496 0.000 -0.189 -0.000 3/37026 480.0 1.239 0.929 0.486 0.000 -0.185 -0.000 3/37026 490.0 1.215 0.910 0.476 0.000 -0.181 -0.000 3/37026 500.0 1.191 0.893 0.467 0.000 -0.178 -0.000 3/37026 510.0 1.168 0.876 0.458 0.000 -0.174 -0.000 3/37026 520.0 1.146 0.860 0.450 0.000 -0.171 -0.000 3/37026 530.0 1.125 0.844 0.442 0.000 -0.168 -0.000 3/37026 540.0 1.104 0.829 0.434 0.000 -0.165 -0.000 3/37026 550.0 1.084 0.814 0.426 0.000 -0.162 -0.000 3/37026 560.0 1.065 0.800 0.419 0.000 -0.159 -0.000 3/37026 570.0 1.047 0.787 0.412 0.000 -0.156 -0.000 3/37026 580.0 1.029 0.773 0.405 0.000 -0.154 -0.000 3/37026 590.0 1.012 0.761 0.398 0.000 -0.151 -0.000 3/37026 600.0 0.995 0.748 0.392 0.000 -0.148 -0.000 3/37026 610.0 0.979 0.736 0.385 0.000 -0.146 -0.000 3/37026 620.0 0.964 0.725 0.379 0.000 -0.144 -0.000 3/37026 630.0 0.949 0.714 0.373 0.000 -0.141 -0.000 3/37026 640.0 0.934 0.703 0.368 0.000 -0.139 -0.000 3/37026 650.0 0.920 0.692 0.362 0.000 -0.137 -0.000 3/37026 660.0 0.906 0.682 0.357 0.000 -0.135 -0.000 3/37026 670.0 0.893 0.672 0.352 0.000 -0.133 -0.000 3/37026 680.0 0.880 0.663 0.347 0.000 -0.131 -0.000 3/37026 690.0 0.867 0.653 0.342 0.000 -0.129 -0.000 3/37026 700.0 0.855 0.644 0.337 0.000 -0.127 -0.000 3/37026 710.0 0.843 0.635 0.332 0.000 -0.126 -0.000 3/37026 720.0 0.832 0.627 0.328 0.000 -0.124 -0.000 3/37026 730.0 0.820 0.618 0.323 0.000 -0.122 -0.000 3/37026 740.0 0.810 0.610 0.319 0.000 -0.121 -0.000 3/37026 750.0 0.799 0.602 0.315 0.000 -0.119 -0.000 3/37026 760.0 0.788 0.594 0.311 0.000 -0.118 -0.000 3/37026 770.0 0.778 0.587 0.307 0.000 -0.116 -0.000 3/37026 780.0 0.768 0.579 0.303 0.000 -0.115 -0.000 3/37026 790.0 0.759 0.572 0.299 0.000 -0.113 -0.000 3/37026 800.0 0.749 0.565 0.296 0.000 -0.112 -0.000 3/37026 810.0 0.740 0.558 0.292 0.000 -0.110 -0.000 3/37026 820.0 0.731 0.552 0.289 0.000 -0.109 -0.000 3/37026 830.0 0.723 0.545 0.285 0.000 -0.108 -0.000 3/37026 840.0 0.714 0.539 0.282 0.000 -0.106 -0.000 3/37026 850.0 0.706 0.533 0.279 0.000 -0.105 -0.000 3/37026 860.0 0.698 0.527 0.275 0.000 -0.104 -0.000 3/37026 870.0 0.690 0.521 0.272 0.000 -0.103 -0.000 3/37026 880.0 0.682 0.515 0.269 0.000 -0.102 -0.000 3/37026 890.0 0.674 0.509 0.266 0.000 -0.100 -0.000 3/37026 900.0 0.667 0.504 0.263 0.000 -0.099 -0.000 3/37026 910.0 0.660 0.498 0.261 0.000 -0.098 -0.000 3/37026 920.0 0.653 0.493 0.258 0.000 -0.097 -0.000 3/37026 930.0 0.646 0.488 0.255 0.000 -0.096 -0.000 3/37026 940.0 0.639 0.482 0.252 0.000 -0.095 -0.000 3/37026 950.0 0.632 0.477 0.250 0.000 -0.094 -0.000 3/37026 960.0 0.626 0.473 0.247 0.000 -0.093 -0.000 3/37026 970.0 0.619 0.468 0.245 0.000 -0.092 -0.000 3/37026 980.0 0.613 0.463 0.242 0.000 -0.091 -0.000 3/37026 990.0 0.607 0.458 0.240 0.000 -0.090 -0.000 3/37026 1000.0 0.601 0.454 0.237 0.000 -0.090 -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 10:54:33]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|