----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 20:40:04]------------------------- 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: [2 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 8 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.703197722847107 0.000000000000000 0.000000000000000 b 0.000000000000000 7.761487279999999 0.000000000000000 c -5.912566530379348 0.000000000000000 9.240515440353290 Atomic positions (fractional): *1 Ba 0.64127086462501 0.14776563913283 0.89472263264245 137.327 2 Ba 0.64127086462501 0.35223436086717 0.39472263264245 137.327 3 Ba 0.35872913537499 0.85223436086717 0.10527736735755 137.327 4 Ba 0.35872913537499 0.64776563913283 0.60527736735755 137.327 *5 Ba 0.03573807465394 0.05011965490712 0.31669541314530 137.327 6 Ba 0.03573807465394 0.44988034509288 0.81669541314530 137.327 7 Ba 0.96426192534606 0.94988034509288 0.68330458685470 137.327 8 Ba 0.96426192534606 0.55011965490712 0.18330458685470 137.327 *9 H 0.43278263340206 0.04847061138358 0.61918489732738 1.008 10 H 0.43278263340206 0.45152938861642 0.11918489732738 1.008 11 H 0.56721736659794 0.95152938861642 0.38081510267262 1.008 12 H 0.56721736659794 0.54847061138358 0.88081510267262 1.008 *13 H 0.80476282349656 0.85081573468732 0.01718783101653 1.008 14 H 0.80476282349656 0.64918426531268 0.51718783101652 1.008 15 H 0.19523717650344 0.14918426531268 0.98281216898348 1.008 16 H 0.19523717650344 0.35081573468732 0.48281216898348 1.008 *17 H 0.81657899952810 0.71806648902826 0.88242599154737 1.008 18 H 0.81657899952810 0.78193351097174 0.38242599154737 1.008 19 H 0.18342100047190 0.28193351097174 0.11757400845263 1.008 20 H 0.18342100047190 0.21806648902826 0.61757400845263 1.008 *21 H 0.47114910552511 0.73669589939461 0.41354239292734 1.008 22 H 0.47114910552511 0.76330410060539 0.91354239292734 1.008 23 H 0.52885089447489 0.26330410060539 0.58645760707266 1.008 24 H 0.52885089447489 0.23669589939461 0.08645760707266 1.008 *25 O 0.29533093332691 0.99942499894735 0.61906708166506 15.999 26 O 0.29533093332691 0.50057500105265 0.11906708166506 15.999 27 O 0.70466906667309 0.00057500105265 0.38093291833494 15.999 28 O 0.70466906667309 0.49942499894735 0.88093291833494 15.999 *29 O 0.73357171366387 0.86120928882686 0.07811050895395 15.999 30 O 0.73357171366387 0.63879071117314 0.57811050895395 15.999 31 O 0.26642828633613 0.13879071117314 0.92188949104605 15.999 32 O 0.26642828633613 0.36120928882686 0.42188949104605 15.999 *33 O 0.88561838651366 0.83555099385364 0.89570230603343 15.999 34 O 0.88561838651366 0.66444900614636 0.39570230603343 15.999 35 O 0.11438161348634 0.16444900614636 0.10429769396657 15.999 36 O 0.11438161348634 0.33555099385364 0.60429769396657 15.999 *37 O 0.32322464262266 0.79985015387654 0.34391223014539 15.999 38 O 0.32322464262266 0.70014984612346 0.84391223014539 15.999 39 O 0.67677535737734 0.20014984612346 0.65608776985461 15.999 40 O 0.67677535737734 0.29985015387654 0.15608776985461 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.703197722847107 0.000000000000000 0.000000000000000 b 0.000000000000000 7.761487279999999 0.000000000000000 c -5.912566530379348 0.000000000000000 9.240515440353290 Atomic positions (fractional): *1 Ba 0.64127086462501 0.14776563913283 0.89472263264245 137.327 > 1 2 Ba 0.64127086462501 0.35223436086717 0.39472263264245 137.327 > 2 3 Ba 0.35872913537499 0.85223436086717 0.10527736735755 137.327 > 3 4 Ba 0.35872913537499 0.64776563913283 0.60527736735755 137.327 > 4 *5 Ba 0.03573807465394 0.05011965490712 0.31669541314530 137.327 > 5 6 Ba 0.03573807465394 0.44988034509288 0.81669541314530 137.327 > 6 7 Ba 0.96426192534606 0.94988034509288 0.68330458685470 137.327 > 7 8 Ba 0.96426192534606 0.55011965490712 0.18330458685470 137.327 > 8 *9 H 0.43278263340206 0.04847061138358 0.61918489732738 1.008 > 9 10 H 0.43278263340206 0.45152938861642 0.11918489732738 1.008 > 10 11 H 0.56721736659794 0.95152938861642 0.38081510267262 1.008 > 11 12 H 0.56721736659794 0.54847061138358 0.88081510267262 1.008 > 12 *13 H 0.80476282349656 0.85081573468732 0.01718783101653 1.008 > 13 14 H 0.80476282349656 0.64918426531268 0.51718783101652 1.008 > 14 15 H 0.19523717650344 0.14918426531268 0.98281216898348 1.008 > 15 16 H 0.19523717650344 0.35081573468732 0.48281216898348 1.008 > 16 *17 H 0.81657899952810 0.71806648902826 0.88242599154737 1.008 > 17 18 H 0.81657899952810 0.78193351097174 0.38242599154737 1.008 > 18 19 H 0.18342100047190 0.28193351097174 0.11757400845263 1.008 > 19 20 H 0.18342100047190 0.21806648902826 0.61757400845263 1.008 > 20 *21 H 0.47114910552511 0.73669589939461 0.41354239292734 1.008 > 21 22 H 0.47114910552511 0.76330410060539 0.91354239292734 1.008 > 22 23 H 0.52885089447489 0.26330410060539 0.58645760707266 1.008 > 23 24 H 0.52885089447489 0.23669589939461 0.08645760707266 1.008 > 24 *25 O 0.29533093332691 0.99942499894735 0.61906708166506 15.999 > 25 26 O 0.29533093332691 0.50057500105265 0.11906708166506 15.999 > 26 27 O 0.70466906667309 0.00057500105265 0.38093291833494 15.999 > 27 28 O 0.70466906667309 0.49942499894735 0.88093291833494 15.999 > 28 *29 O 0.73357171366387 0.86120928882686 0.07811050895395 15.999 > 29 30 O 0.73357171366387 0.63879071117314 0.57811050895395 15.999 > 30 31 O 0.26642828633613 0.13879071117314 0.92188949104605 15.999 > 31 32 O 0.26642828633613 0.36120928882686 0.42188949104605 15.999 > 32 *33 O 0.88561838651366 0.83555099385364 0.89570230603343 15.999 > 33 34 O 0.88561838651366 0.66444900614636 0.39570230603343 15.999 > 34 35 O 0.11438161348634 0.16444900614636 0.10429769396657 15.999 > 35 36 O 0.11438161348634 0.33555099385364 0.60429769396657 15.999 > 36 *37 O 0.32322464262266 0.79985015387654 0.34391223014539 15.999 > 37 38 O 0.32322464262266 0.70014984612346 0.84391223014539 15.999 > 38 39 O 0.67677535737734 0.20014984612346 0.65608776985461 15.999 > 39 40 O 0.67677535737734 0.29985015387654 0.15608776985461 15.999 > 40 -------------------------------- super cell -------------------------------- Lattice vectors: a 13.406395445694214 0.000000000000000 0.000000000000000 b 0.000000000000000 7.761487279999999 0.000000000000000 c -5.912566530379348 0.000000000000000 9.240515440353290 Atomic positions (fractional): *1 Ba 0.32063543231251 0.14776563913283 0.89472263264245 137.327 > 1 2 Ba 0.82063543231251 0.14776563913283 0.89472263264245 137.327 > 1 3 Ba 0.32063543231251 0.35223436086717 0.39472263264245 137.327 > 2 4 Ba 0.82063543231251 0.35223436086717 0.39472263264245 137.327 > 2 5 Ba 0.17936456768749 0.85223436086717 0.10527736735755 137.327 > 3 6 Ba 0.67936456768749 0.85223436086717 0.10527736735755 137.327 > 3 7 Ba 0.17936456768749 0.64776563913283 0.60527736735755 137.327 > 4 8 Ba 0.67936456768749 0.64776563913283 0.60527736735755 137.327 > 4 *9 Ba 0.01786903732697 0.05011965490712 0.31669541314530 137.327 > 5 10 Ba 0.51786903732697 0.05011965490712 0.31669541314530 137.327 > 5 11 Ba 0.01786903732697 0.44988034509288 0.81669541314530 137.327 > 6 12 Ba 0.51786903732697 0.44988034509288 0.81669541314530 137.327 > 6 13 Ba 0.48213096267303 0.94988034509288 0.68330458685470 137.327 > 7 14 Ba 0.98213096267303 0.94988034509288 0.68330458685470 137.327 > 7 15 Ba 0.48213096267303 0.55011965490712 0.18330458685470 137.327 > 8 16 Ba 0.98213096267303 0.55011965490712 0.18330458685470 137.327 > 8 *17 H 0.21639131670103 0.04847061138358 0.61918489732738 1.008 > 9 18 H 0.71639131670103 0.04847061138358 0.61918489732738 1.008 > 9 19 H 0.21639131670103 0.45152938861642 0.11918489732738 1.008 > 10 20 H 0.71639131670103 0.45152938861642 0.11918489732738 1.008 > 10 21 H 0.28360868329897 0.95152938861642 0.38081510267262 1.008 > 11 22 H 0.78360868329897 0.95152938861642 0.38081510267262 1.008 > 11 23 H 0.28360868329897 0.54847061138358 0.88081510267262 1.008 > 12 24 H 0.78360868329897 0.54847061138358 0.88081510267262 1.008 > 12 *25 H 0.40238141174828 0.85081573468732 0.01718783101653 1.008 > 13 26 H 0.90238141174828 0.85081573468732 0.01718783101653 1.008 > 13 27 H 0.40238141174828 0.64918426531268 0.51718783101652 1.008 > 14 28 H 0.90238141174828 0.64918426531268 0.51718783101652 1.008 > 14 29 H 0.09761858825172 0.14918426531268 0.98281216898348 1.008 > 15 30 H 0.59761858825172 0.14918426531268 0.98281216898348 1.008 > 15 31 H 0.09761858825172 0.35081573468732 0.48281216898348 1.008 > 16 32 H 0.59761858825172 0.35081573468732 0.48281216898348 1.008 > 16 *33 H 0.40828949976405 0.71806648902826 0.88242599154737 1.008 > 17 34 H 0.90828949976405 0.71806648902826 0.88242599154737 1.008 > 17 35 H 0.40828949976405 0.78193351097174 0.38242599154737 1.008 > 18 36 H 0.90828949976405 0.78193351097174 0.38242599154737 1.008 > 18 37 H 0.09171050023595 0.28193351097174 0.11757400845263 1.008 > 19 38 H 0.59171050023595 0.28193351097174 0.11757400845263 1.008 > 19 39 H 0.09171050023595 0.21806648902826 0.61757400845263 1.008 > 20 40 H 0.59171050023595 0.21806648902826 0.61757400845263 1.008 > 20 *41 H 0.23557455276256 0.73669589939461 0.41354239292734 1.008 > 21 42 H 0.73557455276256 0.73669589939461 0.41354239292734 1.008 > 21 43 H 0.23557455276256 0.76330410060539 0.91354239292734 1.008 > 22 44 H 0.73557455276256 0.76330410060539 0.91354239292734 1.008 > 22 45 H 0.26442544723744 0.26330410060539 0.58645760707266 1.008 > 23 46 H 0.76442544723744 0.26330410060539 0.58645760707266 1.008 > 23 47 H 0.26442544723744 0.23669589939461 0.08645760707266 1.008 > 24 48 H 0.76442544723744 0.23669589939461 0.08645760707266 1.008 > 24 *49 O 0.14766546666345 0.99942499894735 0.61906708166506 15.999 > 25 50 O 0.64766546666345 0.99942499894735 0.61906708166506 15.999 > 25 51 O 0.14766546666345 0.50057500105265 0.11906708166506 15.999 > 26 52 O 0.64766546666345 0.50057500105265 0.11906708166506 15.999 > 26 53 O 0.35233453333655 0.00057500105265 0.38093291833494 15.999 > 27 54 O 0.85233453333655 0.00057500105265 0.38093291833494 15.999 > 27 55 O 0.35233453333655 0.49942499894735 0.88093291833494 15.999 > 28 56 O 0.85233453333655 0.49942499894735 0.88093291833494 15.999 > 28 *57 O 0.36678585683193 0.86120928882686 0.07811050895395 15.999 > 29 58 O 0.86678585683193 0.86120928882686 0.07811050895395 15.999 > 29 59 O 0.36678585683193 0.63879071117314 0.57811050895395 15.999 > 30 60 O 0.86678585683193 0.63879071117314 0.57811050895395 15.999 > 30 61 O 0.13321414316807 0.13879071117314 0.92188949104605 15.999 > 31 62 O 0.63321414316807 0.13879071117314 0.92188949104605 15.999 > 31 63 O 0.13321414316807 0.36120928882686 0.42188949104605 15.999 > 32 64 O 0.63321414316807 0.36120928882686 0.42188949104605 15.999 > 32 *65 O 0.44280919325683 0.83555099385364 0.89570230603343 15.999 > 33 66 O 0.94280919325683 0.83555099385364 0.89570230603343 15.999 > 33 67 O 0.44280919325683 0.66444900614636 0.39570230603343 15.999 > 34 68 O 0.94280919325683 0.66444900614636 0.39570230603343 15.999 > 34 69 O 0.05719080674317 0.16444900614636 0.10429769396657 15.999 > 35 70 O 0.55719080674317 0.16444900614636 0.10429769396657 15.999 > 35 71 O 0.05719080674317 0.33555099385364 0.60429769396657 15.999 > 36 72 O 0.55719080674317 0.33555099385364 0.60429769396657 15.999 > 36 *73 O 0.16161232131133 0.79985015387654 0.34391223014539 15.999 > 37 74 O 0.66161232131133 0.79985015387654 0.34391223014539 15.999 > 37 75 O 0.16161232131133 0.70014984612346 0.84391223014539 15.999 > 38 76 O 0.66161232131133 0.70014984612346 0.84391223014539 15.999 > 38 77 O 0.33838767868867 0.20014984612346 0.65608776985461 15.999 > 39 78 O 0.83838767868867 0.20014984612346 0.65608776985461 15.999 > 39 79 O 0.33838767868867 0.29985015387654 0.15608776985461 15.999 > 40 80 O 0.83838767868867 0.29985015387654 0.15608776985461 15.999 > 40 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.2917088 0.0000000 -0.0272375 0.0000000 3.3018829 0.0000000 -0.0272377 0.0000000 3.3509819 -------------------------- Born effective charges -------------------------- 1 Ba 2.6342635 0.0767464 -0.0263335 0.0652182 2.5470019 -0.0107285 -0.0554864 -0.0744915 2.6471647 2 Ba 2.6342635 -0.0767464 -0.0263335 -0.0652182 2.5470019 0.0107285 -0.0554864 0.0744915 2.6471647 3 Ba 2.6342635 0.0767464 -0.0263335 0.0652182 2.5470019 -0.0107285 -0.0554864 -0.0744915 2.6471647 4 Ba 2.6342635 -0.0767464 -0.0263335 -0.0652182 2.5470019 0.0107285 -0.0554864 0.0744915 2.6471647 5 Ba 2.6208498 -0.0288140 -0.0521838 0.0085708 2.6312186 0.0077709 -0.0377930 -0.0226183 2.6687045 6 Ba 2.6208498 0.0288140 -0.0521838 -0.0085708 2.6312186 -0.0077709 -0.0377930 0.0226183 2.6687045 7 Ba 2.6208498 -0.0288140 -0.0521838 0.0085708 2.6312186 0.0077709 -0.0377930 -0.0226183 2.6687045 8 Ba 2.6208498 0.0288140 -0.0521838 -0.0085708 2.6312186 -0.0077709 -0.0377930 0.0226183 2.6687045 9 H 0.7209467 0.3335817 0.1333302 0.3433716 0.5051037 0.0538019 0.1133177 0.0407631 0.3320095 10 H 0.7209467 -0.3335817 0.1333302 -0.3433716 0.5051037 -0.0538019 0.1133177 -0.0407631 0.3320095 11 H 0.7209467 0.3335817 0.1333302 0.3433716 0.5051037 0.0538019 0.1133177 0.0407631 0.3320095 12 H 0.7209467 -0.3335817 0.1333302 -0.3433716 0.5051037 -0.0538019 0.1133177 -0.0407631 0.3320095 13 H 0.9020387 -0.0582235 -0.5773466 -0.0840575 0.3120240 0.0546534 -0.5339177 0.0381297 0.6605260 14 H 0.9020387 0.0582235 -0.5773466 0.0840575 0.3120240 -0.0546534 -0.5339177 -0.0381297 0.6605260 15 H 0.9020387 -0.0582235 -0.5773466 -0.0840575 0.3120240 0.0546534 -0.5339177 0.0381297 0.6605260 16 H 0.9020387 0.0582235 -0.5773466 0.0840575 0.3120240 -0.0546534 -0.5339177 -0.0381297 0.6605260 17 H 0.3845240 0.2550953 -0.0140704 0.2619482 0.8527906 0.0601460 -0.0187290 0.0496780 0.2640915 18 H 0.3845240 -0.2550953 -0.0140704 -0.2619482 0.8527906 -0.0601460 -0.0187290 -0.0496780 0.2640915 19 H 0.3845240 0.2550953 -0.0140704 0.2619482 0.8527906 0.0601460 -0.0187290 0.0496780 0.2640915 20 H 0.3845240 -0.2550953 -0.0140704 -0.2619482 0.8527906 -0.0601460 -0.0187290 -0.0496780 0.2640915 21 H 0.4694901 -0.0839087 0.2594223 -0.0920130 0.3996030 -0.2958579 0.2440720 -0.2690560 0.7145920 22 H 0.4694901 0.0839087 0.2594223 0.0920130 0.3996030 0.2958579 0.2440720 0.2690560 0.7145920 23 H 0.4694901 -0.0839087 0.2594223 -0.0920130 0.3996030 -0.2958579 0.2440720 -0.2690560 0.7145920 24 H 0.4694901 0.0839087 0.2594223 0.0920130 0.3996030 0.2958579 0.2440720 0.2690560 0.7145920 25 O -1.7735044 -0.0588899 -0.0435905 -0.1132728 -1.9733777 -0.0701014 -0.0160340 -0.0448969 -1.7237070 26 O -1.7735044 0.0588899 -0.0435905 0.1132728 -1.9733777 0.0701014 -0.0160340 0.0448969 -1.7237070 27 O -1.7735044 -0.0588899 -0.0435905 -0.1132728 -1.9733777 -0.0701014 -0.0160340 -0.0448969 -1.7237070 28 O -1.7735044 0.0588899 -0.0435905 0.1132728 -1.9733777 0.0701014 -0.0160340 0.0448969 -1.7237070 29 O -2.0460462 0.0105221 0.1488497 0.0363145 -1.7967431 -0.1151310 0.1595756 -0.0458743 -2.0057542 30 O -2.0460462 -0.0105221 0.1488497 -0.0363145 -1.7967431 0.1151310 0.1595756 0.0458743 -2.0057542 31 O -2.0460462 0.0105221 0.1488497 0.0363145 -1.7967431 -0.1151310 0.1595756 -0.0458743 -2.0057542 32 O -2.0460462 -0.0105221 0.1488497 -0.0363145 -1.7967431 0.1151310 0.1595756 0.0458743 -2.0057542 33 O -1.9397128 -0.0638182 0.2370900 -0.0733497 -1.7304504 -0.0248532 0.2017386 0.0247664 -1.7282310 34 O -1.9397128 0.0638182 0.2370900 0.0733497 -1.7304504 0.0248532 0.2017386 -0.0247664 -1.7282310 35 O -1.9397128 -0.0638182 0.2370900 -0.0733497 -1.7304504 -0.0248532 0.2017386 0.0247664 -1.7282310 36 O -1.9397128 0.0638182 0.2370900 0.0733497 -1.7304504 0.0248532 0.2017386 -0.0247664 -1.7282310 37 O -1.9728495 -0.0944059 -0.0651675 -0.0460860 -1.7471706 0.1399319 -0.0567439 0.2037978 -1.8293961 38 O -1.9728495 0.0944059 -0.0651675 0.0460860 -1.7471706 -0.1399319 -0.0567439 -0.2037978 -1.8293961 39 O -1.9728495 -0.0944059 -0.0651675 -0.0460860 -1.7471706 0.1399319 -0.0567439 0.2037978 -1.8293961 40 O -1.9728495 0.0944059 -0.0651675 0.0460860 -1.7471706 -0.1399319 -0.0567439 -0.2037978 -1.8293961 ---------------------------------------------------------------------------- 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: 240/240 Permutation basis: 14520/14520 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3720 Number of blocks in projector: 3720 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: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 280 eigenvectors found. (1) Complementary block size: 40 (1) Compute compressed projector. (1) Use standard solver. (1) 20 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 280 eigenvectors found. (1) Complementary block size: 40 (1) Compute compressed projector. (1) Use standard solver. (1) 20 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 800 / 800 (1) 287 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 13 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 440 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 440 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 440 Use standard eigh solver. Tree of FC basis block matrices: - (3720, 3631), data: False |-- (440, 430), data: True |-- (440, 430), data: True |-- (440, 430), data: True |-- (800, 781), data: False |-- (800, 13), data: (800, 32) @ (32, 13) |-- (300, 287), data: True |-- (500, 481), data: False |-- (500, 17), data: (500, 36) @ (36, 17) |-- (250, 233), data: True |-- (250, 231), data: True |-- (800, 780), data: False |-- (800, 20), data: (800, 40) @ (40, 20) |-- (300, 280), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True |-- (800, 780), data: False |-- (800, 20), data: (800, 40) @ (40, 20) |-- (300, 280), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 1200 - Time: 0.735 Solver_block: 200 / 1200 - Time: 0.636 Solver_block: 300 / 1200 - Time: 0.630 Solver_block: 400 / 1200 - Time: 0.635 Solver_block: 500 / 1200 - Time: 0.631 Solver_block: 600 / 1200 - Time: 0.633 Solver_block: 700 / 1200 - Time: 0.635 Solver_block: 800 / 1200 - Time: 0.634 Solver_block: 900 / 1200 - Time: 0.633 Solver_block: 1000 / 1200 - Time: 0.628 Solver_block: 1100 / 1200 - Time: 0.628 Solver_block: 1200 / 1200 - Time: 0.626 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 7.861 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) Permutation basis: 240/240 Permutation basis: 14520/14520 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3720 Number of blocks in projector: 3720 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: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 280 eigenvectors found. (1) Complementary block size: 40 (1) Compute compressed projector. (1) Use standard solver. (1) 20 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 280 eigenvectors found. (1) Complementary block size: 40 (1) Compute compressed projector. (1) Use standard solver. (1) 20 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 800 / 800 (1) 287 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 13 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 440 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 440 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 440 Use standard eigh solver. Tree of FC basis block matrices: - (3720, 3631), data: False |-- (440, 430), data: True |-- (440, 430), data: True |-- (440, 430), data: True |-- (800, 781), data: False |-- (800, 13), data: (800, 32) @ (32, 13) |-- (300, 287), data: True |-- (500, 481), data: False |-- (500, 17), data: (500, 36) @ (36, 17) |-- (250, 233), data: True |-- (250, 231), data: True |-- (800, 780), data: False |-- (800, 20), data: (800, 40) @ (40, 20) |-- (300, 280), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True |-- (800, 780), data: False |-- (800, 20), data: (800, 40) @ (40, 20) |-- (300, 280), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), 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 20:40:48]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 20:40:49]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.703197722847107 0.000000000000000 0.000000000000000 b 0.000000000000000 7.761487279999999 0.000000000000000 c -5.912566530379348 0.000000000000000 9.240515440353290 Atomic positions (fractional): 1 Ba 0.64127086462501 0.14776563913283 0.89472263264245 137.327 2 Ba 0.64127086462501 0.35223436086717 0.39472263264245 137.327 3 Ba 0.35872913537499 0.85223436086717 0.10527736735755 137.327 4 Ba 0.35872913537499 0.64776563913283 0.60527736735755 137.327 5 Ba 0.03573807465394 0.05011965490712 0.31669541314530 137.327 6 Ba 0.03573807465394 0.44988034509288 0.81669541314530 137.327 7 Ba 0.96426192534606 0.94988034509288 0.68330458685470 137.327 8 Ba 0.96426192534606 0.55011965490712 0.18330458685470 137.327 9 H 0.43278263340206 0.04847061138358 0.61918489732738 1.008 10 H 0.43278263340206 0.45152938861642 0.11918489732738 1.008 11 H 0.56721736659794 0.95152938861642 0.38081510267262 1.008 12 H 0.56721736659794 0.54847061138358 0.88081510267262 1.008 13 H 0.80476282349656 0.85081573468732 0.01718783101653 1.008 14 H 0.80476282349656 0.64918426531268 0.51718783101652 1.008 15 H 0.19523717650344 0.14918426531268 0.98281216898348 1.008 16 H 0.19523717650344 0.35081573468732 0.48281216898348 1.008 17 H 0.81657899952810 0.71806648902826 0.88242599154737 1.008 18 H 0.81657899952810 0.78193351097174 0.38242599154737 1.008 19 H 0.18342100047190 0.28193351097174 0.11757400845263 1.008 20 H 0.18342100047190 0.21806648902826 0.61757400845263 1.008 21 H 0.47114910552511 0.73669589939461 0.41354239292734 1.008 22 H 0.47114910552511 0.76330410060539 0.91354239292734 1.008 23 H 0.52885089447489 0.26330410060539 0.58645760707266 1.008 24 H 0.52885089447489 0.23669589939461 0.08645760707266 1.008 25 O 0.29533093332691 0.99942499894735 0.61906708166506 15.999 26 O 0.29533093332691 0.50057500105265 0.11906708166506 15.999 27 O 0.70466906667309 0.00057500105265 0.38093291833494 15.999 28 O 0.70466906667309 0.49942499894735 0.88093291833494 15.999 29 O 0.73357171366387 0.86120928882686 0.07811050895395 15.999 30 O 0.73357171366387 0.63879071117314 0.57811050895395 15.999 31 O 0.26642828633613 0.13879071117314 0.92188949104605 15.999 32 O 0.26642828633613 0.36120928882686 0.42188949104605 15.999 33 O 0.88561838651366 0.83555099385364 0.89570230603343 15.999 34 O 0.88561838651366 0.66444900614636 0.39570230603343 15.999 35 O 0.11438161348634 0.16444900614636 0.10429769396657 15.999 36 O 0.11438161348634 0.33555099385364 0.60429769396657 15.999 37 O 0.32322464262266 0.79985015387654 0.34391223014539 15.999 38 O 0.32322464262266 0.70014984612346 0.84391223014539 15.999 39 O 0.67677535737734 0.20014984612346 0.65608776985461 15.999 40 O 0.67677535737734 0.29985015387654 0.15608776985461 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.406395445694214 0.000000000000000 0.000000000000000 b 0.000000000000000 7.761487279999999 0.000000000000000 c -5.912566530379348 0.000000000000000 9.240515440353290 Atomic positions (fractional): 1 Ba 0.32063543231251 0.14776563913283 0.89472263264245 137.327 > 1 2 Ba 0.82063543231251 0.14776563913283 0.89472263264245 137.327 > 1 3 Ba 0.32063543231251 0.35223436086717 0.39472263264245 137.327 > 3 4 Ba 0.82063543231251 0.35223436086717 0.39472263264245 137.327 > 3 5 Ba 0.17936456768749 0.85223436086717 0.10527736735755 137.327 > 5 6 Ba 0.67936456768749 0.85223436086717 0.10527736735755 137.327 > 5 7 Ba 0.17936456768749 0.64776563913283 0.60527736735755 137.327 > 7 8 Ba 0.67936456768749 0.64776563913283 0.60527736735755 137.327 > 7 9 Ba 0.01786903732697 0.05011965490712 0.31669541314530 137.327 > 9 10 Ba 0.51786903732697 0.05011965490712 0.31669541314530 137.327 > 9 11 Ba 0.01786903732697 0.44988034509288 0.81669541314530 137.327 > 11 12 Ba 0.51786903732697 0.44988034509288 0.81669541314530 137.327 > 11 13 Ba 0.48213096267303 0.94988034509288 0.68330458685470 137.327 > 13 14 Ba 0.98213096267303 0.94988034509288 0.68330458685470 137.327 > 13 15 Ba 0.48213096267303 0.55011965490712 0.18330458685470 137.327 > 15 16 Ba 0.98213096267303 0.55011965490712 0.18330458685470 137.327 > 15 17 H 0.21639131670103 0.04847061138358 0.61918489732738 1.008 > 17 18 H 0.71639131670103 0.04847061138358 0.61918489732738 1.008 > 17 19 H 0.21639131670103 0.45152938861642 0.11918489732738 1.008 > 19 20 H 0.71639131670103 0.45152938861642 0.11918489732738 1.008 > 19 21 H 0.28360868329897 0.95152938861642 0.38081510267262 1.008 > 21 22 H 0.78360868329897 0.95152938861642 0.38081510267262 1.008 > 21 23 H 0.28360868329897 0.54847061138358 0.88081510267262 1.008 > 23 24 H 0.78360868329897 0.54847061138358 0.88081510267262 1.008 > 23 25 H 0.40238141174828 0.85081573468732 0.01718783101653 1.008 > 25 26 H 0.90238141174828 0.85081573468732 0.01718783101653 1.008 > 25 27 H 0.40238141174828 0.64918426531268 0.51718783101652 1.008 > 27 28 H 0.90238141174828 0.64918426531268 0.51718783101652 1.008 > 27 29 H 0.09761858825172 0.14918426531268 0.98281216898348 1.008 > 29 30 H 0.59761858825172 0.14918426531268 0.98281216898348 1.008 > 29 31 H 0.09761858825172 0.35081573468732 0.48281216898348 1.008 > 31 32 H 0.59761858825172 0.35081573468732 0.48281216898348 1.008 > 31 33 H 0.40828949976405 0.71806648902826 0.88242599154737 1.008 > 33 34 H 0.90828949976405 0.71806648902826 0.88242599154737 1.008 > 33 35 H 0.40828949976405 0.78193351097174 0.38242599154737 1.008 > 35 36 H 0.90828949976405 0.78193351097174 0.38242599154737 1.008 > 35 37 H 0.09171050023595 0.28193351097174 0.11757400845263 1.008 > 37 38 H 0.59171050023595 0.28193351097174 0.11757400845263 1.008 > 37 39 H 0.09171050023595 0.21806648902826 0.61757400845263 1.008 > 39 40 H 0.59171050023595 0.21806648902826 0.61757400845263 1.008 > 39 41 H 0.23557455276256 0.73669589939461 0.41354239292734 1.008 > 41 42 H 0.73557455276256 0.73669589939461 0.41354239292734 1.008 > 41 43 H 0.23557455276256 0.76330410060539 0.91354239292734 1.008 > 43 44 H 0.73557455276256 0.76330410060539 0.91354239292734 1.008 > 43 45 H 0.26442544723744 0.26330410060539 0.58645760707266 1.008 > 45 46 H 0.76442544723744 0.26330410060539 0.58645760707266 1.008 > 45 47 H 0.26442544723744 0.23669589939461 0.08645760707266 1.008 > 47 48 H 0.76442544723744 0.23669589939461 0.08645760707266 1.008 > 47 49 O 0.14766546666345 0.99942499894735 0.61906708166506 15.999 > 49 50 O 0.64766546666345 0.99942499894735 0.61906708166506 15.999 > 49 51 O 0.14766546666345 0.50057500105265 0.11906708166506 15.999 > 51 52 O 0.64766546666345 0.50057500105265 0.11906708166506 15.999 > 51 53 O 0.35233453333655 0.00057500105265 0.38093291833494 15.999 > 53 54 O 0.85233453333655 0.00057500105265 0.38093291833494 15.999 > 53 55 O 0.35233453333655 0.49942499894735 0.88093291833494 15.999 > 55 56 O 0.85233453333655 0.49942499894735 0.88093291833494 15.999 > 55 57 O 0.36678585683193 0.86120928882686 0.07811050895395 15.999 > 57 58 O 0.86678585683193 0.86120928882686 0.07811050895395 15.999 > 57 59 O 0.36678585683193 0.63879071117314 0.57811050895395 15.999 > 59 60 O 0.86678585683193 0.63879071117314 0.57811050895395 15.999 > 59 61 O 0.13321414316807 0.13879071117314 0.92188949104605 15.999 > 61 62 O 0.63321414316807 0.13879071117314 0.92188949104605 15.999 > 61 63 O 0.13321414316807 0.36120928882686 0.42188949104605 15.999 > 63 64 O 0.63321414316807 0.36120928882686 0.42188949104605 15.999 > 63 65 O 0.44280919325683 0.83555099385364 0.89570230603343 15.999 > 65 66 O 0.94280919325683 0.83555099385364 0.89570230603343 15.999 > 65 67 O 0.44280919325683 0.66444900614636 0.39570230603343 15.999 > 67 68 O 0.94280919325683 0.66444900614636 0.39570230603343 15.999 > 67 69 O 0.05719080674317 0.16444900614636 0.10429769396657 15.999 > 69 70 O 0.55719080674317 0.16444900614636 0.10429769396657 15.999 > 69 71 O 0.05719080674317 0.33555099385364 0.60429769396657 15.999 > 71 72 O 0.55719080674317 0.33555099385364 0.60429769396657 15.999 > 71 73 O 0.16161232131133 0.79985015387654 0.34391223014539 15.999 > 73 74 O 0.66161232131133 0.79985015387654 0.34391223014539 15.999 > 73 75 O 0.16161232131133 0.70014984612346 0.84391223014539 15.999 > 75 76 O 0.66161232131133 0.70014984612346 0.84391223014539 15.999 > 75 77 O 0.33838767868867 0.20014984612346 0.65608776985461 15.999 > 77 78 O 0.83838767868867 0.20014984612346 0.65608776985461 15.999 > 77 79 O 0.33838767868867 0.29985015387654 0.15608776985461 15.999 > 79 80 O 0.83838767868867 0.29985015387654 0.15608776985461 15.999 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.2917088 0.0000000 -0.0272375 0.0000000 3.3018829 0.0000000 -0.0272377 0.0000000 3.3509819 -------------------------- Born effective charges -------------------------- 1 Ba 2.6342635 0.0767464 -0.0263335 0.0652182 2.5470019 -0.0107285 -0.0554864 -0.0744915 2.6471647 2 Ba 2.6342635 -0.0767464 -0.0263335 -0.0652182 2.5470019 0.0107285 -0.0554864 0.0744915 2.6471647 3 Ba 2.6342635 0.0767464 -0.0263335 0.0652182 2.5470019 -0.0107285 -0.0554864 -0.0744915 2.6471647 4 Ba 2.6342635 -0.0767464 -0.0263335 -0.0652182 2.5470019 0.0107285 -0.0554864 0.0744915 2.6471647 5 Ba 2.6208498 -0.0288140 -0.0521838 0.0085708 2.6312186 0.0077709 -0.0377930 -0.0226183 2.6687045 6 Ba 2.6208498 0.0288140 -0.0521838 -0.0085708 2.6312186 -0.0077709 -0.0377930 0.0226183 2.6687045 7 Ba 2.6208498 -0.0288140 -0.0521838 0.0085708 2.6312186 0.0077709 -0.0377930 -0.0226183 2.6687045 8 Ba 2.6208498 0.0288140 -0.0521838 -0.0085708 2.6312186 -0.0077709 -0.0377930 0.0226183 2.6687045 9 H 0.7209467 0.3335817 0.1333302 0.3433716 0.5051037 0.0538019 0.1133177 0.0407631 0.3320095 10 H 0.7209467 -0.3335817 0.1333302 -0.3433716 0.5051037 -0.0538019 0.1133177 -0.0407631 0.3320095 11 H 0.7209467 0.3335817 0.1333302 0.3433716 0.5051037 0.0538019 0.1133177 0.0407631 0.3320095 12 H 0.7209467 -0.3335817 0.1333302 -0.3433716 0.5051037 -0.0538019 0.1133177 -0.0407631 0.3320095 13 H 0.9020387 -0.0582235 -0.5773466 -0.0840575 0.3120240 0.0546534 -0.5339177 0.0381297 0.6605260 14 H 0.9020387 0.0582235 -0.5773466 0.0840575 0.3120240 -0.0546534 -0.5339177 -0.0381297 0.6605260 15 H 0.9020387 -0.0582235 -0.5773466 -0.0840575 0.3120240 0.0546534 -0.5339177 0.0381297 0.6605260 16 H 0.9020387 0.0582235 -0.5773466 0.0840575 0.3120240 -0.0546534 -0.5339177 -0.0381297 0.6605260 17 H 0.3845240 0.2550953 -0.0140704 0.2619482 0.8527906 0.0601460 -0.0187290 0.0496780 0.2640915 18 H 0.3845240 -0.2550953 -0.0140704 -0.2619482 0.8527906 -0.0601460 -0.0187290 -0.0496780 0.2640915 19 H 0.3845240 0.2550953 -0.0140704 0.2619482 0.8527906 0.0601460 -0.0187290 0.0496780 0.2640915 20 H 0.3845240 -0.2550953 -0.0140704 -0.2619482 0.8527906 -0.0601460 -0.0187290 -0.0496780 0.2640915 21 H 0.4694901 -0.0839087 0.2594223 -0.0920130 0.3996030 -0.2958579 0.2440720 -0.2690560 0.7145920 22 H 0.4694901 0.0839087 0.2594223 0.0920130 0.3996030 0.2958579 0.2440720 0.2690560 0.7145920 23 H 0.4694901 -0.0839087 0.2594223 -0.0920130 0.3996030 -0.2958579 0.2440720 -0.2690560 0.7145920 24 H 0.4694901 0.0839087 0.2594223 0.0920130 0.3996030 0.2958579 0.2440720 0.2690560 0.7145920 25 O -1.7735044 -0.0588899 -0.0435905 -0.1132728 -1.9733777 -0.0701014 -0.0160340 -0.0448969 -1.7237070 26 O -1.7735044 0.0588899 -0.0435905 0.1132728 -1.9733777 0.0701014 -0.0160340 0.0448969 -1.7237070 27 O -1.7735044 -0.0588899 -0.0435905 -0.1132728 -1.9733777 -0.0701014 -0.0160340 -0.0448969 -1.7237070 28 O -1.7735044 0.0588899 -0.0435905 0.1132728 -1.9733777 0.0701014 -0.0160340 0.0448969 -1.7237070 29 O -2.0460462 0.0105221 0.1488497 0.0363145 -1.7967431 -0.1151310 0.1595756 -0.0458743 -2.0057542 30 O -2.0460462 -0.0105221 0.1488497 -0.0363145 -1.7967431 0.1151310 0.1595756 0.0458743 -2.0057542 31 O -2.0460462 0.0105221 0.1488497 0.0363145 -1.7967431 -0.1151310 0.1595756 -0.0458743 -2.0057542 32 O -2.0460462 -0.0105221 0.1488497 -0.0363145 -1.7967431 0.1151310 0.1595756 0.0458743 -2.0057542 33 O -1.9397128 -0.0638182 0.2370900 -0.0733497 -1.7304504 -0.0248532 0.2017386 0.0247664 -1.7282310 34 O -1.9397128 0.0638182 0.2370900 0.0733497 -1.7304504 0.0248532 0.2017386 -0.0247664 -1.7282310 35 O -1.9397128 -0.0638182 0.2370900 -0.0733497 -1.7304504 -0.0248532 0.2017386 0.0247664 -1.7282310 36 O -1.9397128 0.0638182 0.2370900 0.0733497 -1.7304504 0.0248532 0.2017386 -0.0247664 -1.7282310 37 O -1.9728495 -0.0944059 -0.0651675 -0.0460860 -1.7471706 0.1399319 -0.0567439 0.2037978 -1.8293961 38 O -1.9728495 0.0944059 -0.0651675 0.0460860 -1.7471706 -0.1399319 -0.0567439 -0.2037978 -1.8293961 39 O -1.9728495 -0.0944059 -0.0651675 -0.0460860 -1.7471706 0.1399319 -0.0567439 0.2037978 -1.8293961 40 O -1.9728495 0.0944059 -0.0651675 0.0460860 -1.7471706 -0.1399319 -0.0567439 -0.2037978 -1.8293961 ---------------------------------------------------------------------------- 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] [-0.0054 0.0000 0.0084] [ 0.0054 0.0000 -0.0084] Computing fc3[ 9, 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] [-0.0054 0.0000 0.0084] [ 0.0054 0.0000 -0.0084] 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] [-0.0054 0.0000 0.0084] [ 0.0054 0.0000 -0.0084] 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] [-0.0054 0.0000 0.0084] [ 0.0054 0.0000 -0.0084] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0054 0.0000 0.0084] [ 0.0054 0.0000 -0.0084] Computing fc3[ 41, 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] [-0.0054 0.0000 0.0084] [ 0.0054 0.0000 -0.0084] 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] [-0.0054 0.0000 0.0084] [ 0.0054 0.0000 -0.0084] 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] [-0.0054 0.0000 0.0084] [ 0.0054 0.0000 -0.0084] 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] [-0.0054 0.0000 0.0084] [ 0.0054 0.0000 -0.0084] 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] [-0.0054 0.0000 0.0084] [ 0.0054 0.0000 -0.0084] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000001 (xxx) 0.00000001 (xxx) 0.00000001 (xxx) 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 20:41:15]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 20:41:16]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.703197722847107 0.000000000000000 0.000000000000000 b 0.000000000000000 7.761487279999999 0.000000000000000 c -5.912566530379348 0.000000000000000 9.240515440353290 Atomic positions (fractional): 1 Ba 0.64127086462501 0.14776563913283 0.89472263264245 137.327 2 Ba 0.64127086462501 0.35223436086717 0.39472263264245 137.327 3 Ba 0.35872913537499 0.85223436086717 0.10527736735755 137.327 4 Ba 0.35872913537499 0.64776563913283 0.60527736735755 137.327 5 Ba 0.03573807465394 0.05011965490712 0.31669541314530 137.327 6 Ba 0.03573807465394 0.44988034509288 0.81669541314530 137.327 7 Ba 0.96426192534606 0.94988034509288 0.68330458685470 137.327 8 Ba 0.96426192534606 0.55011965490712 0.18330458685470 137.327 9 H 0.43278263340206 0.04847061138358 0.61918489732738 1.008 10 H 0.43278263340206 0.45152938861642 0.11918489732738 1.008 11 H 0.56721736659794 0.95152938861642 0.38081510267262 1.008 12 H 0.56721736659794 0.54847061138358 0.88081510267262 1.008 13 H 0.80476282349656 0.85081573468732 0.01718783101653 1.008 14 H 0.80476282349656 0.64918426531268 0.51718783101652 1.008 15 H 0.19523717650344 0.14918426531268 0.98281216898348 1.008 16 H 0.19523717650344 0.35081573468732 0.48281216898348 1.008 17 H 0.81657899952810 0.71806648902826 0.88242599154737 1.008 18 H 0.81657899952810 0.78193351097174 0.38242599154737 1.008 19 H 0.18342100047190 0.28193351097174 0.11757400845263 1.008 20 H 0.18342100047190 0.21806648902826 0.61757400845263 1.008 21 H 0.47114910552511 0.73669589939461 0.41354239292734 1.008 22 H 0.47114910552511 0.76330410060539 0.91354239292734 1.008 23 H 0.52885089447489 0.26330410060539 0.58645760707266 1.008 24 H 0.52885089447489 0.23669589939461 0.08645760707266 1.008 25 O 0.29533093332691 0.99942499894735 0.61906708166506 15.999 26 O 0.29533093332691 0.50057500105265 0.11906708166506 15.999 27 O 0.70466906667309 0.00057500105265 0.38093291833494 15.999 28 O 0.70466906667309 0.49942499894735 0.88093291833494 15.999 29 O 0.73357171366387 0.86120928882686 0.07811050895395 15.999 30 O 0.73357171366387 0.63879071117314 0.57811050895395 15.999 31 O 0.26642828633613 0.13879071117314 0.92188949104605 15.999 32 O 0.26642828633613 0.36120928882686 0.42188949104605 15.999 33 O 0.88561838651366 0.83555099385364 0.89570230603343 15.999 34 O 0.88561838651366 0.66444900614636 0.39570230603343 15.999 35 O 0.11438161348634 0.16444900614636 0.10429769396657 15.999 36 O 0.11438161348634 0.33555099385364 0.60429769396657 15.999 37 O 0.32322464262266 0.79985015387654 0.34391223014539 15.999 38 O 0.32322464262266 0.70014984612346 0.84391223014539 15.999 39 O 0.67677535737734 0.20014984612346 0.65608776985461 15.999 40 O 0.67677535737734 0.29985015387654 0.15608776985461 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.406395445694214 0.000000000000000 0.000000000000000 b 0.000000000000000 7.761487279999999 0.000000000000000 c -5.912566530379348 0.000000000000000 9.240515440353290 Atomic positions (fractional): 1 Ba 0.32063543231251 0.14776563913283 0.89472263264245 137.327 > 1 2 Ba 0.82063543231251 0.14776563913283 0.89472263264245 137.327 > 1 3 Ba 0.32063543231251 0.35223436086717 0.39472263264245 137.327 > 3 4 Ba 0.82063543231251 0.35223436086717 0.39472263264245 137.327 > 3 5 Ba 0.17936456768749 0.85223436086717 0.10527736735755 137.327 > 5 6 Ba 0.67936456768749 0.85223436086717 0.10527736735755 137.327 > 5 7 Ba 0.17936456768749 0.64776563913283 0.60527736735755 137.327 > 7 8 Ba 0.67936456768749 0.64776563913283 0.60527736735755 137.327 > 7 9 Ba 0.01786903732697 0.05011965490712 0.31669541314530 137.327 > 9 10 Ba 0.51786903732697 0.05011965490712 0.31669541314530 137.327 > 9 11 Ba 0.01786903732697 0.44988034509288 0.81669541314530 137.327 > 11 12 Ba 0.51786903732697 0.44988034509288 0.81669541314530 137.327 > 11 13 Ba 0.48213096267303 0.94988034509288 0.68330458685470 137.327 > 13 14 Ba 0.98213096267303 0.94988034509288 0.68330458685470 137.327 > 13 15 Ba 0.48213096267303 0.55011965490712 0.18330458685470 137.327 > 15 16 Ba 0.98213096267303 0.55011965490712 0.18330458685470 137.327 > 15 17 H 0.21639131670103 0.04847061138358 0.61918489732738 1.008 > 17 18 H 0.71639131670103 0.04847061138358 0.61918489732738 1.008 > 17 19 H 0.21639131670103 0.45152938861642 0.11918489732738 1.008 > 19 20 H 0.71639131670103 0.45152938861642 0.11918489732738 1.008 > 19 21 H 0.28360868329897 0.95152938861642 0.38081510267262 1.008 > 21 22 H 0.78360868329897 0.95152938861642 0.38081510267262 1.008 > 21 23 H 0.28360868329897 0.54847061138358 0.88081510267262 1.008 > 23 24 H 0.78360868329897 0.54847061138358 0.88081510267262 1.008 > 23 25 H 0.40238141174828 0.85081573468732 0.01718783101653 1.008 > 25 26 H 0.90238141174828 0.85081573468732 0.01718783101653 1.008 > 25 27 H 0.40238141174828 0.64918426531268 0.51718783101652 1.008 > 27 28 H 0.90238141174828 0.64918426531268 0.51718783101652 1.008 > 27 29 H 0.09761858825172 0.14918426531268 0.98281216898348 1.008 > 29 30 H 0.59761858825172 0.14918426531268 0.98281216898348 1.008 > 29 31 H 0.09761858825172 0.35081573468732 0.48281216898348 1.008 > 31 32 H 0.59761858825172 0.35081573468732 0.48281216898348 1.008 > 31 33 H 0.40828949976405 0.71806648902826 0.88242599154737 1.008 > 33 34 H 0.90828949976405 0.71806648902826 0.88242599154737 1.008 > 33 35 H 0.40828949976405 0.78193351097174 0.38242599154737 1.008 > 35 36 H 0.90828949976405 0.78193351097174 0.38242599154737 1.008 > 35 37 H 0.09171050023595 0.28193351097174 0.11757400845263 1.008 > 37 38 H 0.59171050023595 0.28193351097174 0.11757400845263 1.008 > 37 39 H 0.09171050023595 0.21806648902826 0.61757400845263 1.008 > 39 40 H 0.59171050023595 0.21806648902826 0.61757400845263 1.008 > 39 41 H 0.23557455276256 0.73669589939461 0.41354239292734 1.008 > 41 42 H 0.73557455276256 0.73669589939461 0.41354239292734 1.008 > 41 43 H 0.23557455276256 0.76330410060539 0.91354239292734 1.008 > 43 44 H 0.73557455276256 0.76330410060539 0.91354239292734 1.008 > 43 45 H 0.26442544723744 0.26330410060539 0.58645760707266 1.008 > 45 46 H 0.76442544723744 0.26330410060539 0.58645760707266 1.008 > 45 47 H 0.26442544723744 0.23669589939461 0.08645760707266 1.008 > 47 48 H 0.76442544723744 0.23669589939461 0.08645760707266 1.008 > 47 49 O 0.14766546666345 0.99942499894735 0.61906708166506 15.999 > 49 50 O 0.64766546666345 0.99942499894735 0.61906708166506 15.999 > 49 51 O 0.14766546666345 0.50057500105265 0.11906708166506 15.999 > 51 52 O 0.64766546666345 0.50057500105265 0.11906708166506 15.999 > 51 53 O 0.35233453333655 0.00057500105265 0.38093291833494 15.999 > 53 54 O 0.85233453333655 0.00057500105265 0.38093291833494 15.999 > 53 55 O 0.35233453333655 0.49942499894735 0.88093291833494 15.999 > 55 56 O 0.85233453333655 0.49942499894735 0.88093291833494 15.999 > 55 57 O 0.36678585683193 0.86120928882686 0.07811050895395 15.999 > 57 58 O 0.86678585683193 0.86120928882686 0.07811050895395 15.999 > 57 59 O 0.36678585683193 0.63879071117314 0.57811050895395 15.999 > 59 60 O 0.86678585683193 0.63879071117314 0.57811050895395 15.999 > 59 61 O 0.13321414316807 0.13879071117314 0.92188949104605 15.999 > 61 62 O 0.63321414316807 0.13879071117314 0.92188949104605 15.999 > 61 63 O 0.13321414316807 0.36120928882686 0.42188949104605 15.999 > 63 64 O 0.63321414316807 0.36120928882686 0.42188949104605 15.999 > 63 65 O 0.44280919325683 0.83555099385364 0.89570230603343 15.999 > 65 66 O 0.94280919325683 0.83555099385364 0.89570230603343 15.999 > 65 67 O 0.44280919325683 0.66444900614636 0.39570230603343 15.999 > 67 68 O 0.94280919325683 0.66444900614636 0.39570230603343 15.999 > 67 69 O 0.05719080674317 0.16444900614636 0.10429769396657 15.999 > 69 70 O 0.55719080674317 0.16444900614636 0.10429769396657 15.999 > 69 71 O 0.05719080674317 0.33555099385364 0.60429769396657 15.999 > 71 72 O 0.55719080674317 0.33555099385364 0.60429769396657 15.999 > 71 73 O 0.16161232131133 0.79985015387654 0.34391223014539 15.999 > 73 74 O 0.66161232131133 0.79985015387654 0.34391223014539 15.999 > 73 75 O 0.16161232131133 0.70014984612346 0.84391223014539 15.999 > 75 76 O 0.66161232131133 0.70014984612346 0.84391223014539 15.999 > 75 77 O 0.33838767868867 0.20014984612346 0.65608776985461 15.999 > 77 78 O 0.83838767868867 0.20014984612346 0.65608776985461 15.999 > 77 79 O 0.33838767868867 0.29985015387654 0.15608776985461 15.999 > 79 80 O 0.83838767868867 0.29985015387654 0.15608776985461 15.999 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.2917088 0.0000000 -0.0272375 0.0000000 3.3018829 0.0000000 -0.0272377 0.0000000 3.3509819 -------------------------- Born effective charges -------------------------- 1 Ba 2.6342635 0.0767464 -0.0263335 0.0652182 2.5470019 -0.0107285 -0.0554864 -0.0744915 2.6471647 2 Ba 2.6342635 -0.0767464 -0.0263335 -0.0652182 2.5470019 0.0107285 -0.0554864 0.0744915 2.6471647 3 Ba 2.6342635 0.0767464 -0.0263335 0.0652182 2.5470019 -0.0107285 -0.0554864 -0.0744915 2.6471647 4 Ba 2.6342635 -0.0767464 -0.0263335 -0.0652182 2.5470019 0.0107285 -0.0554864 0.0744915 2.6471647 5 Ba 2.6208498 -0.0288140 -0.0521838 0.0085708 2.6312186 0.0077709 -0.0377930 -0.0226183 2.6687045 6 Ba 2.6208498 0.0288140 -0.0521838 -0.0085708 2.6312186 -0.0077709 -0.0377930 0.0226183 2.6687045 7 Ba 2.6208498 -0.0288140 -0.0521838 0.0085708 2.6312186 0.0077709 -0.0377930 -0.0226183 2.6687045 8 Ba 2.6208498 0.0288140 -0.0521838 -0.0085708 2.6312186 -0.0077709 -0.0377930 0.0226183 2.6687045 9 H 0.7209467 0.3335817 0.1333302 0.3433716 0.5051037 0.0538019 0.1133177 0.0407631 0.3320095 10 H 0.7209467 -0.3335817 0.1333302 -0.3433716 0.5051037 -0.0538019 0.1133177 -0.0407631 0.3320095 11 H 0.7209467 0.3335817 0.1333302 0.3433716 0.5051037 0.0538019 0.1133177 0.0407631 0.3320095 12 H 0.7209467 -0.3335817 0.1333302 -0.3433716 0.5051037 -0.0538019 0.1133177 -0.0407631 0.3320095 13 H 0.9020387 -0.0582235 -0.5773466 -0.0840575 0.3120240 0.0546534 -0.5339177 0.0381297 0.6605260 14 H 0.9020387 0.0582235 -0.5773466 0.0840575 0.3120240 -0.0546534 -0.5339177 -0.0381297 0.6605260 15 H 0.9020387 -0.0582235 -0.5773466 -0.0840575 0.3120240 0.0546534 -0.5339177 0.0381297 0.6605260 16 H 0.9020387 0.0582235 -0.5773466 0.0840575 0.3120240 -0.0546534 -0.5339177 -0.0381297 0.6605260 17 H 0.3845240 0.2550953 -0.0140704 0.2619482 0.8527906 0.0601460 -0.0187290 0.0496780 0.2640915 18 H 0.3845240 -0.2550953 -0.0140704 -0.2619482 0.8527906 -0.0601460 -0.0187290 -0.0496780 0.2640915 19 H 0.3845240 0.2550953 -0.0140704 0.2619482 0.8527906 0.0601460 -0.0187290 0.0496780 0.2640915 20 H 0.3845240 -0.2550953 -0.0140704 -0.2619482 0.8527906 -0.0601460 -0.0187290 -0.0496780 0.2640915 21 H 0.4694901 -0.0839087 0.2594223 -0.0920130 0.3996030 -0.2958579 0.2440720 -0.2690560 0.7145920 22 H 0.4694901 0.0839087 0.2594223 0.0920130 0.3996030 0.2958579 0.2440720 0.2690560 0.7145920 23 H 0.4694901 -0.0839087 0.2594223 -0.0920130 0.3996030 -0.2958579 0.2440720 -0.2690560 0.7145920 24 H 0.4694901 0.0839087 0.2594223 0.0920130 0.3996030 0.2958579 0.2440720 0.2690560 0.7145920 25 O -1.7735044 -0.0588899 -0.0435905 -0.1132728 -1.9733777 -0.0701014 -0.0160340 -0.0448969 -1.7237070 26 O -1.7735044 0.0588899 -0.0435905 0.1132728 -1.9733777 0.0701014 -0.0160340 0.0448969 -1.7237070 27 O -1.7735044 -0.0588899 -0.0435905 -0.1132728 -1.9733777 -0.0701014 -0.0160340 -0.0448969 -1.7237070 28 O -1.7735044 0.0588899 -0.0435905 0.1132728 -1.9733777 0.0701014 -0.0160340 0.0448969 -1.7237070 29 O -2.0460462 0.0105221 0.1488497 0.0363145 -1.7967431 -0.1151310 0.1595756 -0.0458743 -2.0057542 30 O -2.0460462 -0.0105221 0.1488497 -0.0363145 -1.7967431 0.1151310 0.1595756 0.0458743 -2.0057542 31 O -2.0460462 0.0105221 0.1488497 0.0363145 -1.7967431 -0.1151310 0.1595756 -0.0458743 -2.0057542 32 O -2.0460462 -0.0105221 0.1488497 -0.0363145 -1.7967431 0.1151310 0.1595756 0.0458743 -2.0057542 33 O -1.9397128 -0.0638182 0.2370900 -0.0733497 -1.7304504 -0.0248532 0.2017386 0.0247664 -1.7282310 34 O -1.9397128 0.0638182 0.2370900 0.0733497 -1.7304504 0.0248532 0.2017386 -0.0247664 -1.7282310 35 O -1.9397128 -0.0638182 0.2370900 -0.0733497 -1.7304504 -0.0248532 0.2017386 0.0247664 -1.7282310 36 O -1.9397128 0.0638182 0.2370900 0.0733497 -1.7304504 0.0248532 0.2017386 -0.0247664 -1.7282310 37 O -1.9728495 -0.0944059 -0.0651675 -0.0460860 -1.7471706 0.1399319 -0.0567439 0.2037978 -1.8293961 38 O -1.9728495 0.0944059 -0.0651675 0.0460860 -1.7471706 -0.1399319 -0.0567439 -0.2037978 -1.8293961 39 O -1.9728495 -0.0944059 -0.0651675 -0.0460860 -1.7471706 0.1399319 -0.0567439 0.2037978 -1.8293961 40 O -1.9728495 0.0944059 -0.0651675 0.0460860 -1.7471706 -0.1399319 -0.0567439 -0.2037978 -1.8293961 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000001 (xxx) 0.00000001 (xxx) 0.00000001 (xxx) Max drift of fc2: 0.00000000 (yy) 0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 9 6 5 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.53, Number of G-points: 301, Lambda: 0.10 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/92) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 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 1.823 ( 0.000 0.000 0.000) 0.000 1.824 ( 0.000 0.000 0.000) 0.000 2.001 ( 0.000 0.000 0.000) 0.000 2.013 ( 0.000 0.000 0.000) 0.000 2.171 ( 0.000 0.000 0.000) 0.000 2.206 ( 0.000 0.000 0.000) 0.000 2.334 ( 0.000 0.000 0.000) 0.000 2.451 ( 0.000 0.000 0.000) 0.000 2.488 ( 0.000 0.000 0.000) 0.000 2.579 ( 0.000 0.000 0.000) 0.000 2.625 ( 0.000 0.000 0.000) 0.000 2.767 ( 0.000 0.000 0.000) 0.000 2.866 ( 0.000 0.000 0.000) 0.000 2.873 ( 0.000 0.000 0.000) 0.000 3.182 ( 0.000 0.000 0.000) 0.000 3.251 ( 0.000 0.000 0.000) 0.000 3.283 ( 0.000 0.000 0.000) 0.000 3.368 ( 0.000 0.000 0.000) 0.000 3.394 ( 0.000 0.000 0.000) 0.000 3.471 ( 0.000 0.000 0.000) 0.000 3.620 ( 0.000 0.000 0.000) 0.000 4.327 ( 0.000 0.000 0.000) 0.000 4.516 ( 0.000 0.000 0.000) 0.000 4.572 ( 0.000 0.000 0.000) 0.000 4.815 ( 0.000 0.000 0.000) 0.000 4.880 ( 0.000 0.000 0.000) 0.000 5.006 ( 0.000 0.000 0.000) 0.000 5.115 ( 0.000 0.000 0.000) 0.000 5.151 ( 0.000 0.000 0.000) 0.000 5.187 ( 0.000 0.000 0.000) 0.000 5.323 ( 0.000 0.000 0.000) 0.000 5.489 ( 0.000 0.000 0.000) 0.000 5.513 ( 0.000 0.000 0.000) 0.000 5.577 ( 0.000 0.000 0.000) 0.000 5.745 ( 0.000 0.000 0.000) 0.000 5.755 ( 0.000 0.000 0.000) 0.000 5.880 ( 0.000 0.000 0.000) 0.000 5.889 ( 0.000 0.000 0.000) 0.000 5.907 ( 0.000 0.000 0.000) 0.000 5.984 ( 0.000 0.000 0.000) 0.000 6.254 ( 0.000 0.000 0.000) 0.000 6.269 ( 0.000 0.000 0.000) 0.000 6.352 ( 0.000 0.000 0.000) 0.000 6.467 ( 0.000 0.000 0.000) 0.000 6.526 ( 0.000 0.000 0.000) 0.000 7.028 ( 0.000 0.000 0.000) 0.000 7.182 ( 0.000 0.000 0.000) 0.000 7.227 ( 0.000 0.000 0.000) 0.000 7.248 ( 0.000 0.000 0.000) 0.000 7.294 ( 0.000 0.000 0.000) 0.000 7.381 ( 0.000 0.000 0.000) 0.000 8.032 ( 0.000 0.000 0.000) 0.000 8.081 ( 0.000 0.000 0.000) 0.000 8.174 ( 0.000 0.000 0.000) 0.000 8.404 ( 0.000 0.000 0.000) 0.000 8.681 ( 0.000 0.000 0.000) 0.000 8.694 ( 0.000 0.000 0.000) 0.000 8.752 ( 0.000 0.000 0.000) 0.000 8.782 ( 0.000 0.000 0.000) 0.000 9.012 ( 0.000 0.000 0.000) 0.000 9.014 ( 0.000 0.000 0.000) 0.000 9.177 ( 0.000 0.000 0.000) 0.000 9.328 ( 0.000 0.000 0.000) 0.000 9.696 ( 0.000 0.000 0.000) 0.000 9.791 ( 0.000 0.000 0.000) 0.000 10.207 ( 0.000 0.000 0.000) 0.000 10.331 ( 0.000 0.000 0.000) 0.000 10.581 ( 0.000 0.000 0.000) 0.000 10.961 ( 0.000 0.000 0.000) 0.000 20.480 ( 0.000 0.000 0.000) 0.000 20.481 ( 0.000 0.000 0.000) 0.000 20.838 ( 0.000 0.000 0.000) 0.000 20.926 ( 0.000 0.000 0.000) 0.000 22.742 ( 0.000 0.000 0.000) 0.000 22.880 ( 0.000 0.000 0.000) 0.000 23.041 ( 0.000 0.000 0.000) 0.000 23.126 ( 0.000 0.000 0.000) 0.000 24.658 ( 0.000 0.000 0.000) 0.000 24.700 ( 0.000 0.000 0.000) 0.000 24.837 ( 0.000 0.000 0.000) 0.000 24.893 ( 0.000 0.000 0.000) 0.000 25.846 ( 0.000 0.000 0.000) 0.000 25.903 ( 0.000 0.000 0.000) 0.000 25.985 ( 0.000 0.000 0.000) 0.000 26.116 ( 0.000 0.000 0.000) 0.000 28.275 ( 0.000 0.000 0.000) 0.000 28.299 ( 0.000 0.000 0.000) 0.000 28.539 ( 0.000 0.000 0.000) 0.000 28.572 ( 0.000 0.000 0.000) 0.000 28.610 ( 0.000 0.000 0.000) 0.000 28.614 ( 0.000 0.000 0.000) 0.000 28.678 ( 0.000 0.000 0.000) 0.000 28.873 ( 0.000 0.000 0.000) 0.000 32.281 ( 0.000 0.000 0.000) 0.000 32.368 ( 0.000 0.000 0.000) 0.000 32.428 ( 0.000 0.000 0.000) 0.000 32.566 ( 0.000 0.000 0.000) 0.000 35.320 ( 0.000 0.000 0.000) 0.000 35.385 ( 0.000 0.000 0.000) 0.000 35.492 ( 0.000 0.000 0.000) 0.000 35.568 ( 0.000 0.000 0.000) 0.000 88.665 ( 0.000 0.000 0.000) 0.000 88.762 ( 0.000 0.000 0.000) 0.000 88.911 ( 0.000 0.000 0.000) 0.000 89.103 ( 0.000 0.000 0.000) 0.000 97.623 ( 0.000 0.000 0.000) 0.000 97.633 ( 0.000 0.000 0.000) 0.000 97.636 ( 0.000 0.000 0.000) 0.000 97.682 ( 0.000 0.000 0.000) 0.000 98.665 ( 0.000 0.000 0.000) 0.000 98.685 ( 0.000 0.000 0.000) 0.000 98.711 ( 0.000 0.000 0.000) 0.000 98.873 ( 0.000 0.000 0.000) 0.000 99.602 ( 0.000 0.000 0.000) 0.000 99.740 ( 0.000 0.000 0.000) 0.000 99.778 ( 0.000 0.000 0.000) 0.000 100.008 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/92) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.447 ( 21.296 0.000 7.973) 22.739 0.479 ( 21.597 0.000 11.023) 24.248 0.740 ( 32.467 0.000 16.713) 36.516 1.812 ( 0.821 0.000 -1.337) 1.569 1.843 ( -0.468 0.000 4.526) 4.550 1.962 ( 1.287 0.000 -10.328) 10.408 2.093 ( 2.241 0.000 9.797) 10.050 2.123 ( -1.164 0.000 -2.709) 2.949 2.236 ( -3.169 0.000 -6.475) 7.209 2.261 ( -1.896 0.000 7.770) 7.998 2.415 ( -4.431 0.000 2.613) 5.144 2.567 ( 2.440 0.000 3.000) 3.867 2.581 ( -2.291 0.000 2.193) 3.171 2.633 ( 0.261 0.000 1.708) 1.728 2.745 ( -1.323 0.000 -1.194) 1.782 2.865 ( 0.016 0.000 0.034) 0.038 2.876 ( -2.016 0.000 2.471) 3.189 3.160 ( -1.502 0.000 -0.953) 1.779 3.207 ( -5.131 0.000 0.098) 5.132 3.256 ( -0.948 0.000 -3.447) 3.575 3.369 ( 1.112 0.000 -2.057) 2.339 3.401 ( 2.410 0.000 -4.753) 5.329 3.456 ( -0.749 0.000 -2.704) 2.806 3.605 ( 2.868 0.000 -6.269) 6.894 4.352 ( 2.870 0.000 0.137) 2.873 4.481 ( -4.067 0.000 0.764) 4.138 4.686 ( 6.154 0.000 -10.132) 11.854 4.841 ( 2.363 0.000 0.688) 2.461 4.849 ( -2.727 0.000 -1.555) 3.139 4.960 ( -5.077 0.000 0.413) 5.093 5.042 ( -5.419 0.000 -2.612) 6.016 5.158 ( -1.268 0.000 1.082) 1.667 5.272 ( 4.671 0.000 4.689) 6.619 5.441 ( -2.997 0.000 -3.897) 4.917 5.509 ( 0.434 0.000 2.245) 2.287 5.558 ( -1.927 0.000 -2.623) 3.255 5.677 ( -4.319 0.000 -1.098) 4.456 5.782 ( -2.044 0.000 1.256) 2.399 5.857 ( -4.890 0.000 10.651) 11.720 5.902 ( 3.718 0.000 -2.849) 4.684 5.941 ( 4.783 0.000 3.041) 5.668 5.976 ( -0.765 0.000 -0.810) 1.115 6.082 ( -7.663 0.000 8.811) 11.677 6.144 ( -11.356 0.000 -1.477) 11.452 6.271 ( 1.821 0.000 -2.525) 3.113 6.410 ( -0.236 0.000 -3.132) 3.141 6.628 ( 4.660 0.000 1.999) 5.071 7.023 ( -2.866 0.000 -0.042) 2.866 7.061 ( -3.239 0.000 -13.349) 13.736 7.184 ( 0.695 0.000 -0.532) 0.875 7.198 ( -0.599 0.000 -7.574) 7.598 7.269 ( 1.739 0.000 4.437) 4.766 7.515 ( 1.191 0.000 16.236) 16.280 7.922 ( -15.320 0.000 -8.962) 17.748 7.987 ( -7.176 0.000 0.627) 7.203 8.081 ( -1.229 0.000 1.981) 2.331 8.394 ( -12.091 0.000 7.090) 14.017 8.620 ( -1.647 0.000 -1.203) 2.040 8.682 ( 2.175 0.000 -3.251) 3.912 8.756 ( -1.091 0.000 2.205) 2.460 8.811 ( 2.313 0.000 2.279) 3.247 9.022 ( -0.497 0.000 7.271) 7.288 9.067 ( 4.495 0.000 -3.774) 5.869 9.199 ( 6.133 0.000 0.459) 6.150 9.395 ( 7.619 0.000 -1.937) 7.862 9.560 ( -8.030 0.000 3.363) 8.706 9.787 ( -3.003 0.000 3.837) 4.873 9.807 ( 9.577 0.000 -2.564) 9.914 10.223 ( 1.364 0.000 0.730) 1.547 10.401 ( 5.368 0.000 2.767) 6.039 10.710 ( 8.629 0.000 -15.524) 17.762 11.014 ( 4.747 0.000 2.119) 5.199 20.477 ( -0.087 0.000 -0.416) 0.425 20.501 ( 0.184 0.000 0.920) 0.939 20.829 ( -0.999 0.000 -0.088) 1.003 20.921 ( -0.625 0.000 0.088) 0.632 22.766 ( 1.576 0.000 2.008) 2.553 22.856 ( -1.368 0.000 -2.151) 2.549 23.069 ( 1.717 0.000 1.192) 2.090 23.112 ( -0.709 0.000 -1.593) 1.743 24.705 ( -6.446 0.000 6.695) 9.294 24.715 ( 0.863 0.000 1.370) 1.620 24.836 ( -0.342 0.000 0.186) 0.389 24.900 ( 0.287 0.000 0.720) 0.775 25.813 ( -4.255 0.000 1.078) 4.390 25.867 ( -3.701 0.000 -0.882) 3.805 25.993 ( -0.096 0.000 0.992) 0.997 26.107 ( -2.237 0.000 1.578) 2.738 28.287 ( 0.911 0.000 0.659) 1.124 28.312 ( -1.833 0.000 2.424) 3.039 28.534 ( -0.442 0.000 -0.264) 0.514 28.604 ( -1.534 0.000 0.869) 1.763 28.612 ( 0.173 0.000 0.173) 0.245 28.686 ( 1.435 0.000 -1.180) 1.858 28.868 ( -0.621 0.000 0.050) 0.623 29.003 ( 0.047 0.000 -1.083) 1.085 32.289 ( 0.773 0.000 0.314) 0.834 32.428 ( 0.198 0.000 -0.220) 0.296 32.434 ( -3.369 0.000 5.829) 6.733 32.561 ( -0.455 0.000 -0.173) 0.487 35.329 ( 0.532 0.000 0.790) 0.952 35.392 ( 0.419 0.000 0.629) 0.756 35.482 ( -1.131 0.000 -0.096) 1.135 35.566 ( -0.068 0.000 -0.336) 0.343 88.767 ( 0.766 0.000 -0.339) 0.838 88.815 ( 19.612 0.000 -30.169) 35.984 88.923 ( 1.954 0.000 -0.367) 1.988 89.159 ( 3.605 0.000 4.123) 5.477 97.632 ( 0.951 0.000 0.121) 0.958 97.641 ( 0.645 0.000 -0.104) 0.653 97.708 ( 2.466 0.000 0.803) 2.593 97.768 ( 8.297 0.000 -13.575) 15.910 98.669 ( 0.275 0.000 0.358) 0.452 98.710 ( -0.267 0.000 0.308) 0.407 98.766 ( -2.276 0.000 3.005) 3.770 98.859 ( -1.031 0.000 -0.930) 1.388 99.604 ( -0.064 0.000 0.540) 0.544 99.726 ( -1.655 0.000 0.133) 1.660 99.974 ( -1.423 0.000 -3.946) 4.195 100.440 ( -2.327 0.000 5.256) 5.748 ======================= Grid point 2 (3/92) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.865 ( 18.688 0.000 7.859) 20.273 0.944 ( 19.955 0.000 11.326) 22.945 1.397 ( 26.901 0.000 11.811) 29.379 1.826 ( 0.621 0.000 0.445) 0.763 1.871 ( 3.401 0.000 -12.925) 13.365 1.912 ( 2.370 0.000 5.422) 5.918 2.084 ( -5.416 0.000 0.510) 5.440 2.093 ( -0.936 0.000 1.543) 1.805 2.290 ( -3.088 0.000 5.647) 6.436 2.314 ( 5.520 0.000 10.907) 12.224 2.367 ( -2.656 0.000 0.605) 2.724 2.527 ( -5.117 0.000 -0.123) 5.118 2.586 ( -3.198 0.000 1.851) 3.695 2.645 ( -3.424 0.000 2.588) 4.292 2.730 ( -0.294 0.000 2.357) 2.375 2.862 ( -0.842 0.000 -0.097) 0.848 2.882 ( -1.669 0.000 5.516) 5.763 3.096 ( -7.136 0.000 -1.175) 7.232 3.130 ( -0.020 0.000 -1.717) 1.718 3.187 ( -1.309 0.000 -5.448) 5.603 3.346 ( -1.665 0.000 -3.089) 3.509 3.375 ( 2.177 0.000 -7.449) 7.761 3.380 ( -1.361 0.000 -6.574) 6.713 3.604 ( 6.119 0.000 -7.777) 9.895 4.419 ( -2.375 0.000 1.480) 2.798 4.419 ( 2.315 0.000 0.608) 2.393 4.679 ( 2.400 0.000 -4.996) 5.543 4.759 ( -4.903 0.000 -2.399) 5.458 4.871 ( -1.957 0.000 -0.871) 2.142 4.892 ( -3.063 0.000 1.244) 3.306 4.942 ( -1.033 0.000 0.153) 1.045 5.142 ( -3.244 0.000 3.510) 4.779 5.342 ( -4.609 0.000 -4.318) 6.316 5.406 ( 4.938 0.000 2.113) 5.371 5.479 ( -0.246 0.000 -7.457) 7.461 5.541 ( -0.969 0.000 4.901) 4.996 5.607 ( -3.494 0.000 0.860) 3.598 5.738 ( -4.539 0.000 2.704) 5.283 5.872 ( -16.723 0.000 0.765) 16.741 5.875 ( -4.213 0.000 2.606) 4.953 5.923 ( -6.591 0.000 6.402) 9.189 5.931 ( 2.158 0.000 -4.081) 4.616 6.072 ( 6.211 0.000 0.328) 6.220 6.087 ( 2.630 0.000 1.084) 2.844 6.271 ( 2.517 0.000 -4.682) 5.315 6.384 ( 0.128 0.000 -2.651) 2.654 6.666 ( -0.414 0.000 -1.911) 1.955 6.813 ( -5.704 0.000 -12.343) 13.597 6.984 ( -4.843 0.000 -1.633) 5.111 7.151 ( 2.357 0.000 -2.028) 3.109 7.198 ( 1.551 0.000 -0.244) 1.570 7.353 ( 0.952 0.000 5.730) 5.809 7.549 ( -12.982 0.000 -14.811) 19.695 7.677 ( -2.990 0.000 16.162) 16.436 7.831 ( -17.531 0.000 9.549) 19.963 8.089 ( -1.273 0.000 3.842) 4.047 8.235 ( -11.052 0.000 4.500) 11.933 8.562 ( -1.385 0.000 -4.511) 4.719 8.671 ( 0.851 0.000 -3.537) 3.638 8.753 ( -3.001 0.000 3.206) 4.392 8.902 ( 4.006 0.000 4.026) 5.680 9.051 ( 1.233 0.000 -5.095) 5.242 9.118 ( 1.915 0.000 6.780) 7.045 9.409 ( 13.864 0.000 2.349) 14.061 9.467 ( -3.773 0.000 -2.336) 4.437 9.512 ( 8.383 0.000 -1.142) 8.461 9.776 ( 2.623 0.000 -4.476) 5.188 9.937 ( 7.641 0.000 -1.010) 7.707 10.264 ( 2.015 0.000 1.853) 2.737 10.520 ( 4.384 0.000 3.178) 5.415 10.676 ( 1.680 0.000 -6.896) 7.098 11.146 ( 6.736 0.000 3.593) 7.634 20.469 ( -0.139 0.000 -0.696) 0.710 20.519 ( 1.041 0.000 0.397) 1.114 20.805 ( -1.599 0.000 -0.108) 1.602 20.908 ( -1.014 0.000 0.103) 1.019 22.796 ( -2.100 0.000 -3.187) 3.817 22.830 ( 2.473 0.000 3.141) 3.998 23.073 ( -1.114 0.000 -2.518) 2.753 23.125 ( 2.597 0.000 2.383) 3.524 24.661 ( -3.890 0.000 1.550) 4.187 24.753 ( 1.220 0.000 2.242) 2.553 24.827 ( -0.704 0.000 -0.275) 0.756 24.917 ( 0.598 0.000 0.992) 1.159 25.744 ( -5.515 0.000 1.767) 5.791 25.772 ( -5.833 0.000 -1.460) 6.013 25.993 ( -1.463 0.000 1.340) 1.984 26.079 ( -2.434 0.000 0.491) 2.483 28.307 ( -0.495 0.000 0.242) 0.551 28.317 ( 1.636 0.000 0.790) 1.817 28.520 ( -0.656 0.000 -0.523) 0.839 28.589 ( -1.389 0.000 1.242) 1.863 28.619 ( 0.230 0.000 0.414) 0.474 28.692 ( 1.022 0.000 -1.773) 2.047 28.855 ( -0.956 0.000 0.238) 0.985 28.989 ( -0.845 0.000 -0.214) 0.872 32.312 ( 1.440 0.000 0.507) 1.526 32.431 ( 0.476 0.000 -0.204) 0.518 32.440 ( -1.324 0.000 2.488) 2.818 32.547 ( -0.930 0.000 -0.455) 1.035 35.352 ( 0.898 0.000 1.270) 1.556 35.409 ( 0.543 0.000 0.890) 1.043 35.457 ( -1.115 0.000 -0.863) 1.410 35.558 ( -0.206 0.000 -0.604) 0.638 88.779 ( 1.138 0.000 -0.523) 1.253 88.821 ( 8.880 0.000 -13.109) 15.833 88.970 ( 3.657 0.000 0.280) 3.668 89.289 ( 4.690 0.000 6.247) 7.812 97.655 ( 1.055 0.000 -0.007) 1.055 97.656 ( 1.583 0.000 0.375) 1.626 97.759 ( 3.580 0.000 -6.784) 7.671 97.775 ( 4.010 0.000 1.418) 4.253 98.680 ( 0.464 0.000 0.523) 0.699 98.708 ( -0.556 0.000 0.412) 0.692 98.758 ( -1.585 0.000 1.502) 2.184 98.824 ( -1.477 0.000 -1.376) 2.018 99.611 ( -0.037 0.000 0.841) 0.842 99.691 ( -2.628 0.000 0.178) 2.634 99.887 ( -2.005 0.000 -6.569) 6.868 100.463 ( -0.482 0.000 3.168) 3.204 ======================= Grid point 3 (4/92) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.219 ( 14.120 0.000 6.365) 15.489 1.365 ( 15.933 0.000 10.546) 19.107 1.792 ( 11.099 0.000 -1.096) 11.153 1.815 ( 4.767 0.000 -8.535) 9.776 1.816 ( -0.973 0.000 -1.636) 1.904 1.977 ( -3.757 0.000 6.436) 7.452 2.092 ( 6.077 0.000 0.878) 6.140 2.175 ( 4.617 0.000 6.202) 7.732 2.297 ( -1.539 0.000 6.012) 6.206 2.345 ( -0.592 0.000 0.685) 0.905 2.443 ( -2.813 0.000 -1.070) 3.010 2.511 ( -2.323 0.000 5.682) 6.139 2.547 ( 1.870 0.000 8.510) 8.713 2.566 ( -8.613 0.000 2.543) 8.980 2.756 ( -0.397 0.000 1.677) 1.723 2.830 ( -2.333 0.000 -0.197) 2.341 2.943 ( -0.473 0.000 4.392) 4.417 2.971 ( -4.753 0.000 1.928) 5.130 3.111 ( -0.295 0.000 -5.726) 5.734 3.124 ( 1.518 0.000 -2.348) 2.796 3.227 ( -3.080 0.000 -8.770) 9.295 3.308 ( -2.772 0.000 -2.374) 3.650 3.314 ( 0.510 0.000 -8.159) 8.175 3.638 ( 6.549 0.000 -6.037) 8.907 4.371 ( -3.508 0.000 1.893) 3.986 4.490 ( 3.317 0.000 -0.011) 3.317 4.651 ( -0.441 0.000 -3.313) 3.342 4.665 ( -3.256 0.000 -1.956) 3.798 4.794 ( -4.540 0.000 1.223) 4.702 4.896 ( 1.493 0.000 1.610) 2.196 4.992 ( 4.759 0.000 -0.996) 4.863 5.119 ( -3.758 0.000 2.629) 4.586 5.190 ( -7.836 0.000 -3.757) 8.690 5.405 ( 0.315 0.000 -6.739) 6.746 5.457 ( 0.011 0.000 2.153) 2.153 5.578 ( 0.416 0.000 1.685) 1.735 5.579 ( -13.300 0.000 -2.058) 13.458 5.587 ( -0.618 0.000 1.614) 1.729 5.723 ( -3.803 0.000 4.820) 6.139 5.742 ( -9.879 0.000 -0.209) 9.881 5.913 ( -0.626 0.000 -3.424) 3.481 5.936 ( -2.723 0.000 5.174) 5.847 6.152 ( 4.189 0.000 -1.609) 4.488 6.190 ( 6.608 0.000 2.652) 7.120 6.263 ( 2.389 0.000 -2.818) 3.694 6.345 ( -1.033 0.000 -3.124) 3.290 6.595 ( -4.779 0.000 -1.619) 5.046 6.628 ( -1.675 0.000 -10.315) 10.450 6.874 ( -5.604 0.000 -1.870) 5.908 7.202 ( -10.695 0.000 -9.426) 14.256 7.205 ( 3.561 0.000 1.485) 3.858 7.227 ( 1.224 0.000 -0.152) 1.233 7.422 ( 3.272 0.000 -0.202) 3.279 7.662 ( -15.618 0.000 11.778) 19.561 7.750 ( -4.777 0.000 10.359) 11.407 8.124 ( -1.203 0.000 6.054) 6.172 8.148 ( -4.631 0.000 2.910) 5.469 8.494 ( 0.113 0.000 -5.666) 5.667 8.639 ( -0.248 0.000 -3.209) 3.219 8.723 ( -4.559 0.000 3.208) 5.574 9.005 ( 2.960 0.000 3.655) 4.704 9.014 ( 0.772 0.000 -4.411) 4.478 9.224 ( 2.601 0.000 5.138) 5.759 9.389 ( -1.324 0.000 -4.084) 4.293 9.598 ( 6.985 0.000 -0.347) 6.993 9.680 ( 10.297 0.000 2.261) 10.542 9.782 ( 4.182 0.000 -5.223) 6.690 10.025 ( 4.833 0.000 -2.158) 5.293 10.334 ( 3.008 0.000 3.395) 4.536 10.602 ( 2.010 0.000 2.209) 2.986 10.618 ( -1.692 0.000 -4.134) 4.466 11.286 ( 4.973 0.000 3.505) 6.084 20.459 ( -0.123 0.000 -0.693) 0.704 20.541 ( 1.164 0.000 0.185) 1.179 20.778 ( -1.518 0.000 -0.058) 1.519 20.892 ( -0.929 0.000 0.074) 0.932 22.729 ( -1.879 0.000 -2.695) 3.285 22.904 ( 2.244 0.000 2.838) 3.618 23.028 ( -0.997 0.000 -2.289) 2.497 23.196 ( 2.560 0.000 2.285) 3.431 24.616 ( -2.446 0.000 0.172) 2.452 24.795 ( 0.799 0.000 2.146) 2.290 24.809 ( -0.773 0.000 -0.557) 0.953 24.939 ( 0.893 0.000 0.741) 1.160 25.659 ( -5.409 0.000 -1.424) 5.594 25.677 ( -4.563 0.000 1.623) 4.843 25.976 ( -1.934 0.000 0.996) 2.176 26.043 ( -2.089 0.000 0.095) 2.091 28.302 ( -0.042 0.000 -0.296) 0.299 28.354 ( 1.932 0.000 0.555) 2.010 28.504 ( -0.549 0.000 -0.512) 0.751 28.585 ( -0.858 0.000 1.492) 1.721 28.627 ( 0.161 0.000 0.453) 0.481 28.680 ( 0.082 0.000 -2.100) 2.102 28.843 ( -0.845 0.000 0.384) 0.928 28.973 ( -0.829 0.000 -0.024) 0.829 32.344 ( 1.701 0.000 0.480) 1.767 32.440 ( -0.984 0.000 1.172) 1.530 32.441 ( 0.813 0.000 0.124) 0.823 32.521 ( -1.266 0.000 -0.773) 1.483 35.382 ( 0.933 0.000 1.243) 1.554 35.426 ( 0.322 0.000 0.641) 0.718 35.431 ( -0.832 0.000 -0.836) 1.179 35.548 ( -0.244 0.000 -0.587) 0.636 88.792 ( 0.967 0.000 -0.475) 1.077 88.830 ( 4.523 0.000 -6.349) 7.796 89.041 ( 3.753 0.000 0.689) 3.816 89.424 ( 3.276 0.000 5.841) 6.697 97.675 ( 1.062 0.000 0.434) 1.147 97.687 ( 1.458 0.000 0.436) 1.522 97.743 ( 1.604 0.000 -4.205) 4.500 97.860 ( 3.843 0.000 1.663) 4.187 98.694 ( 0.560 0.000 0.431) 0.707 98.701 ( -0.629 0.000 0.176) 0.653 98.746 ( -1.281 0.000 0.851) 1.538 98.787 ( -1.245 0.000 -1.068) 1.640 99.620 ( 0.027 0.000 0.753) 0.754 99.652 ( -2.042 0.000 0.415) 2.084 99.782 ( -1.860 0.000 -6.657) 6.912 100.487 ( 0.022 0.000 2.021) 2.021 ======================= Grid point 4 (5/92) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.434 ( 5.525 0.000 2.084) 5.905 1.641 ( 5.385 0.000 5.308) 7.561 1.783 ( -0.701 0.000 -0.999) 1.221 1.784 ( 2.722 0.000 -6.146) 6.722 1.924 ( 4.669 0.000 2.616) 5.352 1.999 ( -1.568 0.000 7.196) 7.365 2.155 ( 2.601 0.000 -6.641) 7.132 2.230 ( 4.445 0.000 -3.278) 5.523 2.329 ( -5.554 0.000 2.389) 6.046 2.363 ( 1.314 0.000 2.704) 3.007 2.372 ( -7.612 0.000 1.878) 7.841 2.486 ( -2.154 0.000 2.274) 3.132 2.564 ( 5.318 0.000 4.031) 6.673 2.680 ( 0.583 0.000 2.576) 2.641 2.742 ( -1.017 0.000 -1.370) 1.706 2.835 ( 0.727 0.000 6.556) 6.596 2.877 ( -3.225 0.000 0.698) 3.300 3.061 ( -2.594 0.000 -8.007) 8.417 3.061 ( 3.682 0.000 2.263) 4.322 3.066 ( -1.269 0.000 1.462) 1.936 3.151 ( 1.451 0.000 -1.697) 2.232 3.225 ( -1.064 0.000 -6.663) 6.747 3.244 ( -2.080 0.000 -0.857) 2.249 3.677 ( 2.852 0.000 -2.140) 3.566 4.344 ( -1.291 0.000 0.691) 1.464 4.529 ( 1.413 0.000 0.358) 1.458 4.607 ( -1.752 0.000 -1.336) 2.203 4.611 ( -0.852 0.000 -1.138) 1.422 4.757 ( -1.616 0.000 0.914) 1.857 4.952 ( 3.220 0.000 0.491) 3.257 5.040 ( -6.225 0.000 -0.877) 6.287 5.047 ( 1.996 0.000 -0.695) 2.114 5.085 ( -1.190 0.000 0.422) 1.263 5.347 ( -0.888 0.000 -2.717) 2.858 5.415 ( -3.440 0.000 -0.870) 3.548 5.489 ( 0.859 0.000 2.591) 2.730 5.581 ( -1.983 0.000 0.016) 1.983 5.597 ( -4.192 0.000 -1.195) 4.359 5.618 ( 0.372 0.000 1.966) 2.001 5.734 ( 2.983 0.000 -0.155) 2.987 5.832 ( -5.925 0.000 -0.744) 5.972 5.930 ( -1.158 0.000 0.803) 1.409 6.184 ( 1.553 0.000 -1.100) 1.903 6.243 ( 1.487 0.000 -1.795) 2.331 6.311 ( 0.623 0.000 -1.736) 1.844 6.362 ( 2.616 0.000 5.687) 6.260 6.502 ( -4.011 0.000 -0.519) 4.044 6.547 ( 2.758 0.000 -6.354) 6.926 6.767 ( -4.749 0.000 -0.801) 4.816 7.009 ( -3.483 0.000 -3.349) 4.832 7.245 ( 0.299 0.000 0.308) 0.429 7.270 ( 1.819 0.000 0.986) 2.069 7.476 ( 5.651 0.000 -3.518) 6.656 7.560 ( -9.556 0.000 7.697) 12.271 7.761 ( -2.052 0.000 3.311) 3.895 8.126 ( -1.245 0.000 1.349) 1.836 8.160 ( -1.007 0.000 3.582) 3.720 8.454 ( 0.838 0.000 -3.264) 3.370 8.605 ( -0.375 0.000 -1.487) 1.533 8.684 ( -2.637 0.000 1.599) 3.084 8.990 ( 0.352 0.000 -1.691) 1.727 9.065 ( 0.935 0.000 1.384) 1.670 9.295 ( 1.125 0.000 1.870) 2.182 9.343 ( -0.182 0.000 -1.987) 1.996 9.674 ( 2.489 0.000 -0.099) 2.491 9.797 ( 2.023 0.000 -2.156) 2.956 9.822 ( 3.966 0.000 1.019) 4.095 10.058 ( 1.569 0.000 -1.166) 1.954 10.430 ( 3.834 0.000 3.498) 5.189 10.534 ( -3.488 0.000 -3.269) 4.780 10.638 ( 0.520 0.000 0.769) 0.928 11.370 ( 1.676 0.000 1.476) 2.233 20.452 ( -0.046 0.000 -0.300) 0.303 20.558 ( 0.529 0.000 0.050) 0.531 20.758 ( -0.649 0.000 -0.009) 0.649 20.882 ( -0.373 0.000 0.029) 0.374 22.686 ( -0.758 0.000 -1.036) 1.284 22.953 ( 0.907 0.000 1.143) 1.460 22.998 ( -0.395 0.000 -0.924) 1.005 23.246 ( 1.105 0.000 0.949) 1.457 24.588 ( -0.855 0.000 -0.048) 0.856 24.795 ( -0.343 0.000 -0.283) 0.445 24.819 ( 0.188 0.000 0.890) 0.910 24.957 ( 0.520 0.000 0.264) 0.583 25.581 ( -2.232 0.000 -0.607) 2.313 25.634 ( -1.798 0.000 0.653) 1.913 25.958 ( -0.877 0.000 0.340) 0.941 26.018 ( -0.831 0.000 -0.005) 0.831 28.299 ( 0.027 0.000 -0.168) 0.170 28.385 ( 0.994 0.000 0.225) 1.019 28.493 ( -0.208 0.000 -0.208) 0.295 28.590 ( -0.298 0.000 0.942) 0.988 28.633 ( 0.053 0.000 0.196) 0.203 28.658 ( -0.219 0.000 -1.249) 1.268 28.836 ( -0.342 0.000 0.189) 0.391 28.963 ( -0.324 0.000 -0.002) 0.324 32.372 ( 1.003 0.000 0.203) 1.024 32.433 ( -0.657 0.000 0.345) 0.742 32.461 ( 1.078 0.000 0.560) 1.215 32.491 ( -1.268 0.000 -0.838) 1.520 35.405 ( 0.476 0.000 0.596) 0.763 35.415 ( -0.307 0.000 -0.335) 0.454 35.432 ( 0.017 0.000 0.143) 0.144 35.540 ( -0.109 0.000 -0.243) 0.266 88.799 ( 0.373 0.000 -0.195) 0.421 88.835 ( 1.427 0.000 -1.934) 2.404 89.094 ( 1.638 0.000 0.350) 1.675 89.506 ( 1.022 0.000 2.430) 2.636 97.698 ( 0.585 0.000 1.139) 1.281 97.708 ( 0.590 0.000 0.192) 0.620 97.724 ( 0.313 0.000 -2.388) 2.409 97.922 ( 1.605 0.000 0.818) 1.801 98.693 ( -0.239 0.000 -0.019) 0.239 98.706 ( 0.412 0.000 0.152) 0.439 98.735 ( -0.673 0.000 0.297) 0.736 98.764 ( -0.537 0.000 -0.359) 0.646 99.626 ( 0.026 0.000 0.301) 0.302 99.643 ( -0.262 0.000 1.470) 1.493 99.696 ( -1.207 0.000 -4.113) 4.287 100.503 ( 0.052 0.000 0.714) 0.715 ======================= Grid point 9 (6/92) ======================= q-point: ( 0.00 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.457 ( 0.000 20.646 0.000) 20.646 0.503 ( 0.000 23.289 0.000) 23.289 0.801 ( 0.000 35.573 0.000) 35.573 1.740 ( 0.000 -6.216 0.000) 6.216 1.852 ( 0.000 2.477 0.000) 2.477 2.027 ( 0.000 2.430 0.000) 2.430 2.063 ( 0.000 -1.439 0.000) 1.439 2.167 ( 0.000 1.641 0.000) 1.641 2.189 ( 0.000 -0.735 0.000) 0.735 2.279 ( 0.000 -3.617 0.000) 3.617 2.367 ( 0.000 -7.384 0.000) 7.384 2.506 ( 0.000 3.612 0.000) 3.612 2.542 ( 0.000 -2.255 0.000) 2.255 2.672 ( 0.000 -0.025 0.000) 0.025 2.758 ( 0.000 4.889 0.000) 4.889 2.847 ( 0.000 -2.570 0.000) 2.570 3.056 ( 0.000 11.211 0.000) 11.211 3.113 ( 0.000 -6.401 0.000) 6.401 3.222 ( 0.000 -3.252 0.000) 3.252 3.270 ( 0.000 -0.322 0.000) 0.322 3.354 ( 0.000 -2.325 0.000) 2.325 3.413 ( 0.000 3.229 0.000) 3.229 3.508 ( 0.000 2.614 0.000) 2.614 3.610 ( 0.000 -0.997 0.000) 0.997 4.453 ( 0.000 -4.983 0.000) 4.983 4.520 ( 0.000 -4.713 0.000) 4.713 4.812 ( 0.000 -0.426 0.000) 0.426 4.826 ( 0.000 -4.436 0.000) 4.436 4.929 ( 0.000 -4.766 0.000) 4.766 5.102 ( 0.000 -3.294 0.000) 3.294 5.119 ( 0.000 2.302 0.000) 2.302 5.192 ( 0.000 0.557 0.000) 0.557 5.310 ( 0.000 -0.886 0.000) 0.886 5.316 ( 0.000 3.074 0.000) 3.074 5.479 ( 0.000 -0.875 0.000) 0.875 5.515 ( 0.000 -0.815 0.000) 0.815 5.593 ( 0.000 -3.088 0.000) 3.088 5.604 ( 0.000 -6.857 0.000) 6.857 5.757 ( 0.000 1.604 0.000) 1.604 5.873 ( 0.000 -0.936 0.000) 0.936 6.055 ( 0.000 5.336 0.000) 5.336 6.113 ( 0.000 9.447 0.000) 9.447 6.157 ( 0.000 -6.179 0.000) 6.179 6.225 ( 0.000 -4.030 0.000) 4.030 6.327 ( 0.000 3.366 0.000) 3.366 6.368 ( 0.000 4.304 0.000) 4.304 6.593 ( 0.000 5.723 0.000) 5.723 6.962 ( 0.000 -0.201 0.000) 0.201 7.041 ( 0.000 1.157 0.000) 1.157 7.164 ( 0.000 -0.536 0.000) 0.536 7.286 ( 0.000 -1.117 0.000) 1.117 7.356 ( 0.000 8.094 0.000) 8.094 7.448 ( 0.000 5.268 0.000) 5.268 7.767 ( 0.000 3.429 0.000) 3.429 8.029 ( 0.000 -4.158 0.000) 4.158 8.214 ( 0.000 3.506 0.000) 3.506 8.399 ( 0.000 -0.436 0.000) 0.436 8.659 ( 0.000 -2.308 0.000) 2.308 8.672 ( 0.000 -3.342 0.000) 3.342 8.730 ( 0.000 -1.693 0.000) 1.693 8.740 ( 0.000 -1.021 0.000) 1.021 8.993 ( 0.000 -1.876 0.000) 1.876 9.038 ( 0.000 1.194 0.000) 1.194 9.203 ( 0.000 2.439 0.000) 2.439 9.335 ( 0.000 1.132 0.000) 1.132 9.593 ( 0.000 -9.165 0.000) 9.165 9.807 ( 0.000 0.714 0.000) 0.714 9.831 ( 0.000 -2.264 0.000) 2.264 10.278 ( 0.000 4.993 0.000) 4.993 10.338 ( 0.000 1.168 0.000) 1.168 10.575 ( 0.000 -0.459 0.000) 0.459 10.918 ( 0.000 -4.169 0.000) 4.169 20.502 ( 0.000 1.906 0.000) 1.906 20.793 ( 0.000 -3.094 0.000) 3.094 20.912 ( 0.000 1.493 0.000) 1.493 20.930 ( 0.000 0.315 0.000) 0.315 22.752 ( 0.000 0.885 0.000) 0.885 22.869 ( 0.000 -0.932 0.000) 0.932 23.054 ( 0.000 1.108 0.000) 1.108 23.126 ( 0.000 -0.122 0.000) 0.122 24.651 ( 0.000 -0.632 0.000) 0.632 24.678 ( 0.000 -1.594 0.000) 1.594 24.858 ( 0.000 1.581 0.000) 1.581 24.896 ( 0.000 0.252 0.000) 0.252 25.849 ( 0.000 0.303 0.000) 0.303 25.902 ( 0.000 -0.130 0.000) 0.130 26.131 ( 0.000 1.288 0.000) 1.288 26.341 ( 0.000 -2.273 0.000) 2.273 28.295 ( 0.000 -0.418 0.000) 0.418 28.296 ( 0.000 -0.270 0.000) 0.270 28.540 ( 0.000 0.142 0.000) 0.142 28.568 ( 0.000 -0.271 0.000) 0.271 28.610 ( 0.000 0.109 0.000) 0.109 28.645 ( 0.000 1.631 0.000) 1.631 28.670 ( 0.000 -0.729 0.000) 0.729 28.857 ( 0.000 -1.471 0.000) 1.471 32.288 ( 0.000 0.702 0.000) 0.702 32.362 ( 0.000 -0.480 0.000) 0.480 32.441 ( 0.000 1.141 0.000) 1.141 32.576 ( 0.000 -0.877 0.000) 0.877 35.329 ( 0.000 0.861 0.000) 0.861 35.504 ( 0.000 1.063 0.000) 1.063 35.505 ( 0.000 -2.153 0.000) 2.153 35.579 ( 0.000 0.457 0.000) 0.457 88.673 ( 0.000 0.681 0.000) 0.681 88.756 ( 0.000 -0.578 0.000) 0.578 88.917 ( 0.000 0.665 0.000) 0.665 89.101 ( 0.000 -1.911 0.000) 1.911 97.632 ( 0.000 -0.035 0.000) 0.035 97.633 ( 0.000 -0.224 0.000) 0.224 97.651 ( 0.000 0.203 0.000) 0.203 97.678 ( 0.000 -0.374 0.000) 0.374 98.671 ( 0.000 0.558 0.000) 0.558 98.681 ( 0.000 -0.158 0.000) 0.158 98.920 ( 0.000 4.039 0.000) 4.039 99.414 ( 0.000 -4.579 0.000) 4.579 99.637 ( 0.000 2.357 0.000) 2.357 99.743 ( 0.000 0.173 0.000) 0.173 99.785 ( 0.000 0.705 0.000) 0.705 99.996 ( 0.000 -1.986 0.000) 1.986 ======================= Grid point 10 (7/92) ======================= q-point: ( 0.11 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.530 ( 10.121 15.987 3.363) 19.218 0.677 ( 11.770 14.068 15.226) 23.838 1.133 ( 25.033 25.233 6.201) 36.081 1.759 ( 1.983 -4.449 1.199) 5.016 1.871 ( -1.090 2.406 5.377) 5.991 1.983 ( 1.069 1.960 -10.969) 11.194 2.071 ( 1.201 -1.906 1.120) 2.516 2.164 ( -2.258 -5.736 0.973) 6.240 2.190 ( -1.841 5.999 4.226) 7.565 2.268 ( 0.072 -1.796 -0.875) 1.999 2.375 ( -2.125 -3.561 4.717) 6.281 2.503 ( 0.124 -0.695 -0.299) 0.767 2.547 ( -0.956 -3.513 3.407) 4.986 2.641 ( -2.956 0.696 -1.179) 3.257 2.787 ( 1.001 4.116 2.162) 4.756 2.851 ( -1.980 -1.938 3.212) 4.242 3.017 ( -3.577 9.132 -0.515) 9.821 3.107 ( -0.273 -5.253 -0.914) 5.339 3.186 ( -4.449 -1.981 0.513) 4.898 3.252 ( -0.347 0.508 -2.414) 2.491 3.340 ( 0.504 -2.915 -4.354) 5.264 3.394 ( -0.602 1.965 -2.383) 3.147 3.515 ( 1.738 3.415 -2.546) 4.601 3.597 ( 3.188 -0.700 -6.203) 7.010 4.428 ( -2.877 -4.061 0.272) 4.984 4.494 ( -3.909 1.169 0.505) 4.111 4.681 ( -3.265 -0.848 -9.566) 10.143 4.806 ( -1.813 -3.629 -1.721) 4.407 4.844 ( -0.620 0.655 2.336) 2.504 5.011 ( -4.904 3.696 -0.340) 6.150 5.078 ( -1.598 1.679 -8.132) 8.456 5.134 ( -2.888 -0.284 0.881) 3.033 5.269 ( 4.090 0.221 3.788) 5.579 5.394 ( -2.490 -4.125 -2.546) 5.449 5.515 ( 1.269 -0.471 -0.495) 1.441 5.535 ( -2.284 -0.355 1.219) 2.613 5.626 ( -0.983 -5.258 2.649) 5.969 5.701 ( 1.478 -6.057 6.534) 9.031 5.747 ( 3.093 -0.784 -2.857) 4.283 5.873 ( -0.191 -1.950 0.832) 2.129 6.023 ( -9.707 -1.953 5.781) 11.466 6.088 ( -2.997 8.828 -2.386) 9.624 6.103 ( 2.859 4.309 1.605) 5.414 6.170 ( -8.631 2.089 0.294) 8.885 6.311 ( 0.672 3.007 -1.707) 3.523 6.455 ( -0.115 3.073 -0.720) 3.158 6.664 ( 7.623 -0.653 0.895) 7.703 6.975 ( -3.982 -3.300 -3.953) 6.509 7.043 ( 0.384 -0.964 1.335) 1.691 7.116 ( -3.706 2.228 -4.418) 6.182 7.244 ( 1.884 2.336 -4.517) 5.423 7.311 ( 1.476 0.416 0.088) 1.536 7.538 ( -2.207 2.842 11.796) 12.333 7.814 ( -6.247 -4.634 10.241) 12.860 8.005 ( -10.742 6.763 -10.147) 16.250 8.021 ( -1.713 -3.859 1.781) 4.583 8.402 ( -7.974 -0.247 6.147) 10.072 8.641 ( -0.618 -1.858 -2.244) 2.978 8.692 ( 1.528 -0.967 0.510) 1.879 8.707 ( -0.766 -1.617 -2.470) 3.050 8.785 ( 2.945 0.144 2.933) 4.158 9.037 ( 1.622 0.721 5.968) 6.226 9.106 ( 6.647 0.717 -3.628) 7.606 9.236 ( 6.485 3.073 0.476) 7.192 9.329 ( -0.643 -1.770 0.075) 1.884 9.545 ( -0.551 -4.929 -3.026) 5.810 9.793 ( 6.521 -0.595 -7.381) 9.867 9.864 ( -0.590 1.193 3.050) 3.328 10.255 ( -2.523 3.983 2.857) 5.513 10.408 ( 5.561 1.039 1.842) 5.949 10.631 ( 6.481 -3.927 -5.678) 9.469 10.965 ( 4.232 -4.528 1.791) 6.451 20.507 ( 0.460 1.717 0.127) 1.782 20.663 ( -7.539 4.911 -4.761) 10.179 20.853 ( -1.576 2.477 -0.940) 3.083 20.928 ( -0.978 0.522 0.509) 1.220 22.774 ( 1.368 0.713 1.954) 2.489 22.853 ( -0.899 -0.306 -1.709) 1.955 23.070 ( 0.994 0.226 0.977) 1.412 23.112 ( -0.557 -0.018 -1.355) 1.466 24.657 ( -1.970 -2.204 2.511) 3.879 24.686 ( 0.185 -2.090 0.830) 2.256 24.860 ( 0.289 1.802 0.235) 1.840 24.910 ( 0.478 0.631 1.333) 1.551 25.821 ( -4.086 0.381 0.574) 4.144 25.866 ( -3.430 0.154 -0.298) 3.446 26.113 ( -0.832 1.519 -2.639) 3.156 26.166 ( -9.438 6.092 -0.712) 11.256 28.285 ( 0.710 -0.137 0.262) 0.769 28.310 ( -1.240 -0.232 2.039) 2.398 28.536 ( -0.314 0.211 -0.287) 0.475 28.601 ( -0.084 -0.284 0.122) 0.321 28.623 ( -1.572 0.804 0.765) 1.925 28.673 ( 2.001 -1.307 -0.456) 2.433 28.796 ( 8.802 -8.664 3.515) 12.841 28.852 ( -0.489 -1.392 -0.014) 1.475 32.295 ( 0.701 0.623 0.255) 0.972 32.394 ( 0.385 -1.718 3.057) 3.528 32.442 ( 0.069 1.095 0.071) 1.100 32.564 ( -0.821 -0.386 -0.405) 0.994 35.337 ( 0.473 0.781 0.734) 1.171 35.453 ( -3.120 1.242 -0.495) 3.395 35.495 ( -0.239 1.363 -1.284) 1.887 35.566 ( -0.478 0.172 -0.284) 0.582 88.734 ( 9.557 -2.818 -8.745) 13.257 88.761 ( 1.631 -0.786 -1.579) 2.402 88.937 ( 2.940 0.986 -1.002) 3.258 89.147 ( 3.556 -1.749 2.860) 4.887 97.631 ( 0.835 -0.044 -0.270) 0.878 97.642 ( 0.558 0.031 0.381) 0.677 97.686 ( 3.685 -1.851 -1.737) 4.474 97.712 ( 4.050 -1.295 -1.494) 4.507 98.666 ( -0.090 0.522 -0.020) 0.530 98.696 ( 0.666 -0.363 0.747) 1.065 98.895 ( -2.229 4.207 -1.266) 4.927 99.064 ( -11.394 11.700 -7.880) 18.133 99.615 ( -0.015 1.314 0.734) 1.505 99.733 ( -1.584 0.608 0.053) 1.698 99.953 ( -0.859 -1.897 -3.415) 4.000 100.172 ( 9.554 -13.940 10.728) 20.017 ======================= Grid point 11 (8/92) ======================= q-point: ( 0.22 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.852 ( 19.173 4.081 5.916) 20.476 1.064 ( 14.149 9.044 14.917) 22.461 1.604 ( 20.925 13.891 5.607) 25.734 1.831 ( 3.902 -0.781 1.661) 4.312 1.887 ( 4.357 1.113 -10.234) 11.178 1.943 ( -0.089 3.840 5.408) 6.634 2.077 ( 0.822 -1.978 0.423) 2.183 2.085 ( -5.194 1.038 1.200) 5.431 2.252 ( -0.493 -0.079 2.374) 2.426 2.297 ( 1.451 -3.847 7.311) 8.388 2.398 ( -1.062 1.886 5.828) 6.217 2.493 ( -1.886 -3.357 0.211) 3.856 2.557 ( -4.465 1.752 -1.597) 5.055 2.586 ( -0.497 -4.835 4.671) 6.741 2.794 ( -4.648 3.079 4.066) 6.900 2.857 ( -1.188 -0.282 3.420) 3.631 2.950 ( -3.612 3.797 0.341) 5.252 3.067 ( -2.555 -2.913 -4.185) 5.703 3.114 ( -2.706 -1.696 -0.362) 3.214 3.201 ( -2.387 2.170 -2.907) 4.342 3.281 ( 0.032 -2.875 -7.094) 7.655 3.345 ( -1.480 -0.285 -3.247) 3.579 3.488 ( 1.352 4.862 -7.074) 8.690 3.606 ( 6.012 0.135 -7.019) 9.243 4.379 ( -2.329 -2.097 0.339) 3.152 4.457 ( -1.579 0.941 1.323) 2.265 4.624 ( 1.310 -4.245 -3.353) 5.566 4.726 ( -4.956 -2.823 -2.296) 6.149 4.847 ( -2.839 -2.066 1.298) 3.744 4.942 ( -1.291 4.251 -1.992) 4.869 4.994 ( -0.824 3.651 -0.891) 3.847 5.110 ( -2.436 -2.610 3.526) 5.018 5.321 ( -2.596 -3.434 -3.220) 5.375 5.363 ( 1.435 -1.828 -1.086) 2.565 5.472 ( 0.058 -0.662 -5.239) 5.281 5.525 ( -1.702 -1.283 4.151) 4.666 5.602 ( -3.941 -1.149 2.345) 4.728 5.742 ( -1.640 0.648 3.811) 4.199 5.769 ( -2.400 -5.583 1.312) 6.217 5.840 ( -5.682 -1.287 -2.442) 6.317 5.922 ( -12.750 1.116 2.852) 13.112 5.977 ( -0.066 -1.537 0.516) 1.623 6.073 ( -1.190 4.364 0.885) 4.609 6.195 ( 5.298 6.001 0.714) 8.036 6.297 ( -0.059 3.375 -3.620) 4.949 6.400 ( -1.528 0.613 -5.164) 5.420 6.748 ( 1.707 3.048 -1.010) 3.637 6.780 ( -7.597 -2.965 -7.603) 11.150 6.950 ( -7.242 -0.256 -5.363) 9.015 7.083 ( 0.114 -3.021 2.371) 3.842 7.255 ( 2.681 2.105 -1.497) 3.723 7.395 ( 5.342 -0.613 1.264) 5.523 7.532 ( -10.654 1.773 1.419) 10.893 7.708 ( -12.550 -2.521 7.861) 15.021 7.821 ( -7.330 6.897 6.155) 11.798 8.024 ( -1.316 -2.368 2.965) 4.016 8.311 ( -8.253 2.860 4.525) 9.837 8.584 ( -1.234 0.657 -5.175) 5.360 8.666 ( 0.379 -0.581 -4.146) 4.203 8.727 ( -0.182 -3.126 3.483) 4.683 8.870 ( 1.691 2.282 4.439) 5.270 9.091 ( 1.910 2.197 -0.931) 3.057 9.187 ( 4.909 1.553 1.934) 5.500 9.312 ( -0.660 -5.704 -0.859) 5.805 9.439 ( 13.617 2.144 1.815) 13.904 9.568 ( 5.363 0.429 -1.107) 5.492 9.798 ( 2.958 0.187 -6.676) 7.304 9.922 ( 5.368 -1.436 -0.335) 5.567 10.266 ( 0.120 1.299 2.804) 3.092 10.515 ( 4.156 0.225 1.699) 4.496 10.644 ( 2.168 -2.957 -4.703) 5.963 11.082 ( 6.197 -5.689 3.057) 8.950 20.515 ( 0.026 2.042 -0.273) 2.060 20.551 ( -2.018 3.185 -1.570) 4.085 20.822 ( -1.700 1.549 -0.237) 2.312 20.913 ( -1.262 0.319 0.217) 1.320 22.801 ( -1.620 0.435 -2.592) 3.088 22.836 ( 2.115 0.438 2.480) 3.288 23.067 ( -1.091 -0.424 -1.948) 2.273 23.123 ( 1.985 -0.298 1.953) 2.801 24.633 ( -2.770 -1.911 0.940) 3.494 24.697 ( -0.165 -3.466 0.959) 3.600 24.873 ( 0.669 2.745 0.704) 2.912 24.935 ( 0.809 1.276 1.169) 1.910 25.740 ( -5.705 0.337 0.693) 5.757 25.793 ( -4.938 1.013 -0.438) 5.060 26.041 ( -3.513 3.078 -0.909) 4.758 26.087 ( -3.443 0.821 0.808) 3.631 28.305 ( 0.074 -0.122 0.474) 0.495 28.314 ( 1.178 -0.162 0.523) 1.299 28.525 ( -0.473 0.441 -0.521) 0.830 28.594 ( -1.279 0.435 1.067) 1.722 28.613 ( -0.266 -0.589 0.074) 0.650 28.692 ( 1.332 0.024 -0.920) 1.619 28.840 ( -0.862 -1.537 -0.043) 1.762 28.903 ( 2.215 -6.036 1.231) 6.546 32.316 ( 1.244 0.417 0.496) 1.403 32.422 ( -0.246 -1.318 1.898) 2.324 32.445 ( 0.295 1.119 0.020) 1.157 32.546 ( -0.786 -0.164 -0.540) 0.968 35.359 ( 0.810 0.585 1.196) 1.559 35.422 ( -0.898 0.512 0.321) 1.082 35.474 ( -0.682 1.523 -1.014) 1.953 35.556 ( -0.311 -0.205 -0.539) 0.655 88.767 ( 1.463 -1.113 -0.880) 2.038 88.784 ( 6.443 -2.310 -7.414) 10.090 88.990 ( 4.375 1.572 -0.646) 4.693 89.263 ( 4.674 -2.406 5.111) 7.332 97.648 ( 1.360 -0.278 -0.202) 1.402 97.662 ( 1.285 0.233 0.476) 1.390 97.722 ( 3.442 -2.230 -3.605) 5.460 97.766 ( 3.617 -1.001 0.644) 3.808 98.669 ( 0.339 0.323 0.146) 0.491 98.713 ( 0.430 -0.309 0.812) 0.970 98.831 ( -3.161 4.829 -1.100) 5.875 98.907 ( -4.175 6.324 -1.947) 7.824 99.628 ( 0.210 1.706 1.110) 2.046 99.697 ( -2.546 0.550 -0.116) 2.607 99.878 ( -1.593 -0.657 -5.834) 6.083 100.338 ( 2.825 -9.670 4.833) 11.174 ======================= Grid point 12 (9/92) ======================= q-point: ( 0.33 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.220 ( 16.032 1.675 6.230) 17.281 1.434 ( 12.640 5.751 11.573) 18.077 1.820 ( 5.819 1.561 -8.501) 10.420 1.835 ( 2.154 3.949 -0.571) 4.535 1.922 ( 1.521 4.237 -1.837) 4.862 1.986 ( -0.962 1.775 3.705) 4.219 2.082 ( 4.277 -0.126 4.023) 5.873 2.204 ( 6.116 2.955 1.611) 6.981 2.293 ( 3.936 -0.268 6.078) 7.246 2.345 ( -3.411 -1.419 3.290) 4.947 2.422 ( -4.425 -4.342 0.139) 6.201 2.450 ( -2.325 1.494 2.779) 3.919 2.550 ( 2.091 0.945 7.823) 8.153 2.595 ( -4.027 -1.029 2.641) 4.925 2.755 ( -4.827 0.952 6.186) 7.904 2.859 ( -1.853 1.815 -0.215) 2.603 2.945 ( 0.757 -2.636 3.970) 4.825 2.957 ( -3.867 0.134 -3.034) 4.916 3.078 ( -0.305 -2.238 -2.843) 3.631 3.133 ( -1.044 -0.175 -3.425) 3.584 3.184 ( -1.743 -1.161 -8.669) 8.918 3.284 ( -1.908 0.094 -3.039) 3.590 3.420 ( -0.284 5.857 -6.971) 9.109 3.634 ( 5.412 -0.362 -5.818) 7.954 4.358 ( -1.928 -0.843 1.467) 2.565 4.458 ( 0.570 -2.747 0.511) 2.852 4.610 ( -0.507 -3.436 -1.415) 3.750 4.621 ( -4.200 -2.862 -1.799) 5.392 4.793 ( -3.576 -1.362 0.529) 3.863 4.934 ( 1.852 3.272 -0.703) 3.825 5.021 ( 3.842 2.621 -1.181) 4.799 5.109 ( -2.963 -0.910 1.845) 3.607 5.211 ( -6.390 -0.200 -0.197) 6.396 5.331 ( 0.221 -4.160 -4.522) 6.148 5.426 ( -1.624 -3.863 -2.210) 4.737 5.532 ( -2.795 -2.793 0.883) 4.049 5.578 ( -3.045 -1.073 -0.036) 3.229 5.594 ( -8.479 -0.370 -0.536) 8.504 5.707 ( -9.323 0.426 2.449) 9.649 5.760 ( -4.174 1.383 3.832) 5.832 5.807 ( -1.896 -3.234 -0.052) 3.749 6.014 ( 0.418 -0.287 -0.097) 0.516 6.160 ( 6.467 -0.848 5.137) 8.302 6.178 ( -3.428 2.721 -5.135) 6.746 6.295 ( 3.905 3.103 -1.459) 5.197 6.328 ( -0.569 -1.048 -4.431) 4.589 6.608 ( -2.668 -1.470 -7.075) 7.703 6.713 ( -4.495 8.064 -1.710) 9.390 6.799 ( -5.276 -4.413 -2.409) 7.288 7.081 ( -3.963 -5.074 -0.337) 6.447 7.277 ( 1.194 0.947 -1.479) 2.124 7.340 ( -2.341 5.947 -3.744) 7.407 7.501 ( 4.434 4.803 1.309) 6.667 7.642 ( -10.708 1.610 12.940) 16.873 7.796 ( -5.079 4.255 6.305) 9.146 8.040 ( -1.168 -2.412 4.009) 4.822 8.237 ( -5.901 2.382 3.228) 7.135 8.513 ( 0.238 1.310 -5.749) 5.901 8.626 ( -0.166 -0.594 -3.428) 3.483 8.745 ( -2.444 -0.758 3.293) 4.170 8.913 ( 0.450 0.658 0.561) 0.975 9.139 ( 2.772 5.429 2.693) 6.664 9.257 ( 4.068 -5.751 -4.480) 8.349 9.313 ( -0.340 3.061 3.814) 4.902 9.654 ( 7.864 3.351 0.592) 8.569 9.669 ( 7.497 -1.028 1.147) 7.653 9.779 ( 3.851 -1.215 -6.387) 7.556 9.996 ( 4.046 -2.534 -1.317) 4.952 10.319 ( 2.354 -0.322 3.283) 4.053 10.559 ( -0.558 -1.542 -0.413) 1.691 10.627 ( 1.169 -1.021 -1.887) 2.443 11.211 ( 4.810 -6.763 2.975) 8.817 20.492 ( -0.878 2.530 -0.941) 2.838 20.547 ( 0.778 0.463 0.082) 0.910 20.793 ( -1.557 1.355 -0.077) 2.066 20.894 ( -1.080 0.094 0.109) 1.090 22.740 ( -1.766 0.976 -2.624) 3.310 22.898 ( 1.834 -0.709 1.909) 2.741 23.029 ( -0.797 0.307 -1.407) 1.646 23.184 ( 2.184 -1.113 2.218) 3.306 24.596 ( -2.121 -1.488 0.115) 2.594 24.698 ( -0.634 -4.606 0.506) 4.677 24.896 ( 0.864 3.768 0.952) 3.981 24.960 ( 0.901 1.611 0.722) 1.982 25.658 ( -4.368 0.653 -0.193) 4.420 25.705 ( -4.997 1.644 0.264) 5.267 25.988 ( -2.709 0.944 0.430) 2.901 26.040 ( -2.553 -0.221 0.009) 2.563 28.305 ( 0.034 0.238 -0.225) 0.329 28.349 ( 1.850 -0.472 0.475) 1.968 28.512 ( -0.330 0.739 -0.507) 0.955 28.587 ( -1.131 0.213 1.334) 1.761 28.609 ( -0.063 -1.267 -0.368) 1.321 28.699 ( 0.617 1.290 -0.788) 1.633 28.824 ( -0.929 -1.781 0.051) 2.009 28.929 ( 0.331 -3.540 0.493) 3.589 32.344 ( 1.433 0.067 0.451) 1.504 32.426 ( -0.988 -1.135 1.021) 1.818 32.456 ( 0.990 1.224 0.026) 1.575 32.526 ( -0.874 0.307 -0.608) 1.108 35.386 ( 0.784 0.338 1.112) 1.402 35.417 ( -0.205 -0.237 0.144) 0.345 35.455 ( -0.581 1.496 -0.509) 1.684 35.545 ( -0.274 -0.264 -0.511) 0.637 88.780 ( 1.021 -0.958 -0.515) 1.492 88.806 ( 3.785 -1.837 -4.394) 6.084 89.059 ( 3.914 1.656 0.111) 4.252 89.388 ( 3.418 -3.192 4.898) 6.772 97.669 ( 1.212 -0.354 0.116) 1.268 97.690 ( 1.291 0.175 0.501) 1.396 97.727 ( 1.734 -1.216 -3.142) 3.790 97.840 ( 3.474 -1.748 1.390) 4.130 98.679 ( 0.647 0.232 0.068) 0.690 98.727 ( 0.184 0.275 0.746) 0.816 98.781 ( -1.954 3.595 -0.221) 4.097 98.835 ( -2.907 3.448 -1.151) 4.654 99.633 ( -1.208 0.976 0.043) 1.553 99.663 ( -0.830 0.968 0.463) 1.357 99.792 ( -1.309 1.249 -5.315) 5.615 100.407 ( 1.138 -6.954 2.554) 7.495 ======================= Grid point 13 (10/92) ======================= q-point: ( 0.44 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.468 ( 6.596 3.037 2.773) 7.773 1.674 ( 3.770 2.537 5.020) 6.771 1.811 ( 3.649 2.719 -4.473) 6.381 1.852 ( 0.645 5.932 -1.587) 6.175 1.943 ( 1.554 1.165 2.353) 3.052 2.023 ( -0.171 2.205 6.012) 6.406 2.137 ( 0.848 -0.672 -6.700) 6.787 2.254 ( 4.510 1.850 -2.246) 5.368 2.289 ( -2.231 -3.705 0.824) 4.403 2.350 ( -5.663 0.684 2.330) 6.162 2.422 ( -0.597 1.521 3.593) 3.947 2.462 ( -1.482 -0.660 2.009) 2.582 2.577 ( 2.368 0.977 2.147) 3.343 2.667 ( 1.334 -0.829 4.131) 4.419 2.768 ( -1.429 0.499 3.222) 3.559 2.831 ( -0.676 -0.163 2.572) 2.665 2.872 ( -2.354 -0.240 -0.756) 2.484 3.037 ( -0.680 -1.890 -2.477) 3.189 3.048 ( 2.009 -1.151 -2.946) 3.747 3.070 ( 0.585 0.130 -0.510) 0.787 3.106 ( 0.446 -2.727 0.111) 2.766 3.207 ( -2.792 0.105 -4.294) 5.123 3.351 ( -0.887 6.872 -2.831) 7.485 3.656 ( 2.268 -1.650 -2.254) 3.598 4.342 ( -1.098 -0.145 0.611) 1.265 4.489 ( 2.074 -4.493 0.925) 5.034 4.544 ( -2.707 -3.324 -1.468) 4.532 4.592 ( -0.539 -1.894 -0.444) 2.019 4.755 ( -1.511 -0.244 0.537) 1.622 4.967 ( 2.404 1.581 -0.960) 3.033 5.019 ( -5.323 0.879 -0.471) 5.415 5.076 ( 4.124 0.956 -1.884) 4.634 5.156 ( -3.676 1.884 2.884) 5.038 5.295 ( 0.049 -3.001 -2.534) 3.928 5.358 ( -2.661 -5.035 -0.510) 5.718 5.475 ( -0.528 -1.077 -0.356) 1.251 5.497 ( -3.428 -4.697 0.229) 5.820 5.569 ( -3.196 -4.220 0.388) 5.308 5.639 ( 2.238 0.803 1.002) 2.580 5.743 ( -0.408 0.487 -0.247) 0.682 5.778 ( -4.497 -2.885 1.642) 5.589 5.943 ( -2.579 2.414 -2.432) 4.289 6.138 ( 0.611 -3.281 -1.359) 3.603 6.279 ( 0.082 -1.811 -1.078) 2.109 6.329 ( 3.690 -2.623 6.102) 7.598 6.340 ( 2.147 6.770 -1.036) 7.177 6.525 ( 1.065 -0.897 -6.104) 6.261 6.635 ( -2.662 8.073 -0.710) 8.530 6.689 ( -5.100 -2.829 -0.594) 5.862 6.988 ( -2.764 -2.715 -1.610) 4.195 7.299 ( 1.729 1.143 0.108) 2.075 7.330 ( 0.283 4.895 0.118) 4.905 7.572 ( 3.718 7.034 -1.437) 8.084 7.612 ( -5.393 5.986 6.493) 10.348 7.779 ( -2.137 2.392 2.247) 3.916 8.072 ( 0.245 -2.986 3.016) 4.252 8.176 ( -3.428 -0.446 0.289) 3.469 8.480 ( 0.982 2.153 -2.638) 3.544 8.595 ( -0.449 -0.327 -1.097) 1.229 8.723 ( -2.074 0.957 1.039) 2.509 8.918 ( 0.402 -0.462 -0.401) 0.732 9.208 ( 1.221 8.626 2.403) 9.038 9.259 ( 1.353 -5.659 -2.304) 6.259 9.343 ( 0.070 3.606 1.160) 3.789 9.735 ( 2.524 4.250 0.158) 4.946 9.748 ( 1.722 -4.262 -1.436) 4.816 9.816 ( 3.475 -1.574 -0.669) 3.873 10.028 ( 1.225 -2.550 -0.569) 2.886 10.407 ( 3.858 -1.310 3.026) 5.075 10.501 ( -3.547 -1.748 -2.360) 4.605 10.638 ( 0.591 -0.567 -0.074) 0.822 11.290 ( 1.699 -7.221 1.260) 7.524 20.476 ( -0.244 1.975 -0.347) 2.020 20.558 ( 0.390 0.055 0.051) 0.397 20.773 ( -0.649 1.320 -0.012) 1.471 20.882 ( -0.421 -0.028 0.040) 0.424 22.698 ( -0.732 1.112 -1.033) 1.685 22.925 ( 0.375 -2.275 0.144) 2.310 23.018 ( 0.050 1.595 0.047) 1.596 23.229 ( 0.960 -1.513 0.940) 2.023 24.572 ( -0.787 -1.306 -0.033) 1.525 24.692 ( -0.357 -5.019 0.102) 5.033 24.916 ( 0.379 4.416 0.504) 4.460 24.976 ( 0.444 1.558 0.203) 1.632 25.601 ( -1.741 1.716 -0.454) 2.486 25.648 ( -2.048 1.160 0.444) 2.395 25.960 ( -1.060 0.141 0.244) 1.097 26.009 ( -0.992 -0.766 -0.066) 1.255 28.303 ( 0.055 0.365 -0.146) 0.397 28.377 ( 0.902 -0.710 0.181) 1.162 28.505 ( -0.063 1.023 -0.203) 1.045 28.584 ( -0.559 -0.466 0.766) 1.056 28.603 ( -0.009 -1.278 -0.436) 1.350 28.699 ( 0.144 2.382 -0.295) 2.405 28.813 ( -0.414 -2.156 0.042) 2.196 28.934 ( -0.001 -2.471 0.148) 2.475 32.369 ( 0.944 -0.237 0.193) 0.992 32.416 ( -0.831 -1.184 0.265) 1.470 32.476 ( 1.006 1.107 0.280) 1.522 32.505 ( -0.883 0.966 -0.489) 1.397 35.399 ( 0.040 -0.109 0.133) 0.176 35.424 ( 0.584 0.098 0.588) 0.834 35.442 ( -0.560 1.136 -0.415) 1.333 35.538 ( -0.109 -0.234 -0.196) 0.324 88.789 ( 0.396 -0.916 -0.207) 1.019 88.817 ( 1.244 -1.546 -1.416) 2.437 89.109 ( 1.617 1.471 0.163) 2.192 89.465 ( 1.138 -3.600 2.042) 4.292 97.688 ( 0.603 -0.564 0.506) 0.968 97.708 ( 0.359 -0.425 -0.124) 0.570 97.720 ( 0.575 0.028 -1.260) 1.385 97.895 ( 1.462 -2.316 0.685) 2.823 98.690 ( 0.538 0.368 0.019) 0.652 98.733 ( -0.166 1.465 0.332) 1.511 98.762 ( -0.146 2.267 0.117) 2.275 98.786 ( -1.678 1.952 -0.591) 2.641 99.606 ( -0.892 -0.417 -0.299) 1.029 99.669 ( 0.272 0.227 0.411) 0.542 99.733 ( -0.660 4.329 -2.165) 4.885 100.437 ( 0.344 -5.916 0.846) 5.986 ======================= Grid point 18 (11/92) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.874 ( 0.000 17.990 0.000) 17.990 0.996 ( 0.000 22.480 0.000) 22.480 1.390 ( 0.000 7.161 0.000) 7.161 1.685 ( 0.000 11.887 0.000) 11.887 1.864 ( 0.000 -14.783 0.000) 14.783 1.920 ( 0.000 3.713 0.000) 3.713 2.097 ( 0.000 3.484 0.000) 3.484 2.110 ( 0.000 -4.239 0.000) 4.239 2.197 ( 0.000 1.435 0.000) 1.435 2.226 ( 0.000 -3.263 0.000) 3.263 2.401 ( 0.000 8.196 0.000) 8.196 2.484 ( 0.000 -3.383 0.000) 3.383 2.543 ( 0.000 -1.320 0.000) 1.320 2.669 ( 0.000 1.120 0.000) 1.120 2.744 ( 0.000 -8.063 0.000) 8.063 2.899 ( 0.000 6.992 0.000) 6.992 2.912 ( 0.000 -10.449 0.000) 10.449 3.137 ( 0.000 -4.092 0.000) 4.092 3.245 ( 0.000 3.267 0.000) 3.267 3.313 ( 0.000 -1.628 0.000) 1.628 3.319 ( 0.000 7.395 0.000) 7.395 3.487 ( 0.000 3.490 0.000) 3.490 3.552 ( 0.000 -0.085 0.000) 0.085 3.579 ( 0.000 -1.157 0.000) 1.157 4.348 ( 0.000 -3.881 0.000) 3.881 4.393 ( 0.000 -6.006 0.000) 6.006 4.730 ( 0.000 -3.529 0.000) 3.529 4.755 ( 0.000 -4.104 0.000) 4.104 4.903 ( 0.000 2.572 0.000) 2.572 5.066 ( 0.000 -0.694 0.000) 0.694 5.169 ( 0.000 -2.522 0.000) 2.522 5.179 ( 0.000 2.221 0.000) 2.221 5.303 ( 0.000 0.551 0.000) 0.551 5.344 ( 0.000 -0.693 0.000) 0.693 5.449 ( 0.000 -1.783 0.000) 1.783 5.466 ( 0.000 -2.319 0.000) 2.319 5.523 ( 0.000 -1.882 0.000) 1.882 5.524 ( 0.000 -2.223 0.000) 2.223 5.815 ( 0.000 3.321 0.000) 3.321 5.854 ( 0.000 -0.295 0.000) 0.295 6.033 ( 0.000 -4.184 0.000) 4.184 6.109 ( 0.000 -5.356 0.000) 5.356 6.178 ( 0.000 5.381 0.000) 5.381 6.258 ( 0.000 4.055 0.000) 4.055 6.383 ( 0.000 1.231 0.000) 1.231 6.415 ( 0.000 -1.404 0.000) 1.404 6.810 ( 0.000 12.600 0.000) 12.600 6.977 ( 0.000 1.399 0.000) 1.399 7.088 ( 0.000 3.141 0.000) 3.141 7.196 ( 0.000 4.224 0.000) 4.224 7.240 ( 0.000 -3.095 0.000) 3.095 7.483 ( 0.000 1.032 0.000) 1.032 7.569 ( 0.000 5.456 0.000) 5.456 7.786 ( 0.000 -3.988 0.000) 3.988 8.008 ( 0.000 5.648 0.000) 5.648 8.294 ( 0.000 2.459 0.000) 2.459 8.388 ( 0.000 -0.376 0.000) 0.376 8.507 ( 0.000 -8.884 0.000) 8.884 8.656 ( 0.000 0.605 0.000) 0.605 8.696 ( 0.000 -1.245 0.000) 1.245 8.760 ( 0.000 2.567 0.000) 2.567 8.938 ( 0.000 -3.160 0.000) 3.160 9.054 ( 0.000 1.042 0.000) 1.042 9.257 ( 0.000 0.695 0.000) 0.695 9.366 ( 0.000 -9.075 0.000) 9.075 9.367 ( 0.000 1.002 0.000) 1.002 9.795 ( 0.000 -1.125 0.000) 1.125 9.800 ( 0.000 -1.118 0.000) 1.118 10.376 ( 0.000 3.699 0.000) 3.699 10.394 ( 0.000 3.455 0.000) 3.455 10.572 ( 0.000 0.718 0.000) 0.718 10.796 ( 0.000 -6.873 0.000) 6.873 20.559 ( 0.000 3.252 0.000) 3.252 20.719 ( 0.000 -3.743 0.000) 3.743 20.936 ( 0.000 0.714 0.000) 0.714 20.938 ( 0.000 0.389 0.000) 0.389 22.777 ( 0.000 1.437 0.000) 1.437 22.843 ( 0.000 -1.409 0.000) 1.409 23.082 ( 0.000 1.329 0.000) 1.329 23.120 ( 0.000 -0.412 0.000) 0.412 24.636 ( 0.000 -0.649 0.000) 0.649 24.646 ( 0.000 -1.251 0.000) 1.251 24.890 ( 0.000 1.204 0.000) 1.204 24.903 ( 0.000 0.354 0.000) 0.354 25.861 ( 0.000 0.734 0.000) 0.734 25.896 ( 0.000 -0.547 0.000) 0.547 26.167 ( 0.000 2.035 0.000) 2.035 26.280 ( 0.000 -3.101 0.000) 3.101 28.286 ( 0.000 -0.317 0.000) 0.317 28.289 ( 0.000 -0.343 0.000) 0.343 28.545 ( 0.000 0.285 0.000) 0.285 28.561 ( 0.000 -0.401 0.000) 0.401 28.616 ( 0.000 0.470 0.000) 0.470 28.651 ( 0.000 -1.010 0.000) 1.010 28.691 ( 0.000 2.616 0.000) 2.616 28.812 ( 0.000 -2.541 0.000) 2.541 32.308 ( 0.000 1.045 0.000) 1.045 32.349 ( 0.000 -0.739 0.000) 0.739 32.473 ( 0.000 1.724 0.000) 1.724 32.550 ( 0.000 -1.553 0.000) 1.553 35.357 ( 0.000 1.687 0.000) 1.687 35.454 ( 0.000 -2.547 0.000) 2.547 35.532 ( 0.000 1.489 0.000) 1.489 35.580 ( 0.000 -0.404 0.000) 0.404 88.692 ( 0.000 1.069 0.000) 1.069 88.739 ( 0.000 -0.968 0.000) 0.968 88.941 ( 0.000 1.617 0.000) 1.617 89.047 ( 0.000 -2.845 0.000) 2.845 97.629 ( 0.000 -0.090 0.000) 0.090 97.631 ( 0.000 -0.083 0.000) 0.083 97.655 ( 0.000 0.204 0.000) 0.204 97.668 ( 0.000 -0.441 0.000) 0.441 98.683 ( 0.000 0.256 0.000) 0.256 98.684 ( 0.000 0.450 0.000) 0.450 99.030 ( 0.000 5.913 0.000) 5.913 99.298 ( 0.000 -5.970 0.000) 5.970 99.684 ( 0.000 1.977 0.000) 1.977 99.740 ( 0.000 -0.547 0.000) 0.547 99.815 ( 0.000 2.103 0.000) 2.103 99.940 ( 0.000 -3.107 0.000) 3.107 ======================= Grid point 19 (12/92) ======================= q-point: ( 0.11 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.963 ( 0.186 21.068 1.912) 21.155 1.008 ( 6.329 15.820 10.910) 20.233 1.538 ( 10.641 -0.299 4.821) 11.686 1.738 ( 6.102 12.488 -0.581) 13.912 1.849 ( -0.753 -13.186 -0.735) 13.228 1.945 ( 0.624 3.441 3.883) 5.225 2.050 ( 0.361 1.538 -6.448) 6.638 2.128 ( 2.326 -0.165 0.630) 2.416 2.219 ( 2.111 0.741 0.061) 2.238 2.287 ( 1.369 -3.926 6.282) 7.533 2.368 ( -2.636 8.556 -1.236) 9.038 2.470 ( -1.761 -3.090 3.105) 4.722 2.524 ( -1.853 0.998 -1.743) 2.733 2.661 ( -1.885 1.127 -0.093) 2.199 2.768 ( -0.044 -5.595 3.550) 6.626 2.851 ( -2.207 -3.937 1.137) 4.654 2.956 ( 0.215 -2.165 1.560) 2.677 3.113 ( -3.046 -2.917 0.553) 4.253 3.192 ( -4.029 3.811 -2.630) 6.138 3.289 ( -0.480 -0.872 -3.434) 3.575 3.316 ( -0.632 4.582 -0.468) 4.649 3.444 ( -3.701 2.101 -2.187) 4.784 3.570 ( 3.509 0.641 -2.366) 4.281 3.579 ( 3.989 -0.230 -6.009) 7.217 4.344 ( -1.065 -2.903 1.302) 3.355 4.416 ( 1.609 -5.570 0.691) 5.839 4.648 ( -6.168 -1.354 -4.258) 7.616 4.716 ( -1.088 -4.209 -2.291) 4.914 4.891 ( -5.044 4.021 5.661) 8.582 5.035 ( -2.667 -0.263 0.795) 2.795 5.109 ( -5.699 1.336 -2.095) 6.217 5.170 ( 0.027 1.723 -6.107) 6.345 5.261 ( -0.442 -1.975 2.244) 3.022 5.308 ( -2.291 -3.994 -0.767) 4.668 5.469 ( 3.222 -3.583 -3.467) 5.936 5.511 ( 1.845 -2.570 0.952) 3.304 5.536 ( -0.595 0.238 1.398) 1.537 5.603 ( 2.709 -2.912 5.167) 6.521 5.791 ( -0.411 3.118 -1.376) 3.433 5.854 ( -1.738 -0.192 2.411) 2.978 5.977 ( -6.482 -0.781 4.665) 8.025 6.119 ( -4.774 -3.921 1.701) 6.408 6.212 ( 3.523 4.967 -1.026) 6.175 6.268 ( 1.738 4.449 -1.412) 4.981 6.363 ( 0.210 1.861 -2.186) 2.879 6.500 ( 4.813 -2.421 4.361) 6.932 6.673 ( -5.080 6.928 -8.817) 12.311 6.981 ( -8.005 2.058 -5.194) 9.762 7.025 ( -2.029 -1.137 4.671) 5.218 7.175 ( -1.616 -6.452 -4.918) 8.272 7.209 ( -3.075 4.879 -1.187) 5.888 7.345 ( -3.632 0.746 -3.428) 5.050 7.633 ( -1.939 5.095 8.182) 9.832 7.774 ( -8.592 -1.301 10.379) 13.537 8.011 ( -1.538 4.164 1.081) 4.569 8.182 ( -4.041 8.737 -7.313) 12.089 8.337 ( -5.007 -5.827 0.668) 7.712 8.537 ( 0.170 -6.287 2.469) 6.756 8.679 ( -1.120 2.295 1.039) 2.756 8.747 ( 2.201 1.554 -3.183) 4.170 8.798 ( 7.550 1.296 3.568) 8.450 9.002 ( 4.663 -4.811 1.387) 6.842 9.088 ( 3.265 0.067 -0.922) 3.393 9.255 ( 1.237 -5.155 -1.557) 5.526 9.332 ( 2.124 3.364 1.806) 4.370 9.455 ( 6.055 -1.674 0.140) 6.284 9.779 ( 3.364 -0.451 -5.063) 6.095 9.830 ( 1.164 -2.763 0.584) 3.054 10.359 ( -1.901 4.676 0.772) 5.106 10.455 ( 5.821 2.558 0.207) 6.362 10.576 ( 1.003 -0.537 -1.305) 1.731 10.831 ( 3.219 -7.530 1.233) 8.282 20.557 ( -0.190 2.788 -0.059) 2.795 20.675 ( -3.343 -1.810 -1.932) 4.264 20.904 ( -1.723 1.780 -1.207) 2.756 20.936 ( -1.255 0.118 0.624) 1.407 22.795 ( 1.093 1.173 1.415) 2.138 22.841 ( 0.035 -0.759 -0.664) 1.009 23.080 ( -0.294 0.670 0.143) 0.745 23.108 ( -0.553 -0.366 -0.944) 1.154 24.626 ( -1.278 -0.843 0.260) 1.553 24.643 ( -0.606 -1.671 0.273) 1.798 24.898 ( 0.786 1.492 0.456) 1.747 24.922 ( 1.107 0.323 1.134) 1.617 25.833 ( -3.518 0.802 0.294) 3.620 25.866 ( -2.990 -0.278 -0.213) 3.011 26.145 ( -2.133 1.661 -0.764) 2.810 26.214 ( -5.621 -0.520 -1.379) 5.811 28.284 ( 0.551 0.110 0.143) 0.579 28.302 ( -0.213 -0.532 1.294) 1.415 28.543 ( 0.034 0.514 -0.296) 0.594 28.585 ( 1.242 -1.245 -0.339) 1.791 28.631 ( -0.921 -0.185 0.688) 1.164 28.646 ( 0.911 -0.513 2.071) 2.320 28.724 ( 3.703 0.297 -0.195) 3.720 28.811 ( -0.031 -2.309 -0.126) 2.313 32.314 ( 0.509 1.080 0.364) 1.248 32.365 ( 0.678 -1.203 1.412) 1.975 32.473 ( 0.194 1.700 -0.189) 1.721 32.545 ( -0.252 -1.311 -0.388) 1.390 35.362 ( 0.263 1.495 0.558) 1.618 35.440 ( -1.293 -1.626 -0.060) 2.079 35.527 ( -0.249 1.423 -0.781) 1.642 35.568 ( -0.829 -0.234 -0.504) 0.998 88.709 ( 3.152 0.011 -2.199) 3.843 88.741 ( 0.743 -1.016 -0.735) 1.457 88.968 ( 3.350 2.000 -0.382) 3.920 89.091 ( 3.622 -3.157 1.937) 5.181 97.631 ( 0.757 0.080 -0.392) 0.856 97.640 ( 0.871 -0.247 0.179) 0.923 97.667 ( 1.756 -0.059 -0.658) 1.876 97.691 ( 2.279 -0.884 0.044) 2.445 98.681 ( 0.048 0.705 0.122) 0.717 98.693 ( 0.476 0.042 0.566) 0.741 99.000 ( -2.571 5.339 -1.254) 6.057 99.172 ( -7.716 -0.263 -5.205) 9.311 99.668 ( 0.003 3.387 0.785) 3.477 99.748 ( -1.406 0.515 0.165) 1.507 99.903 ( 1.342 -2.320 -1.219) 2.944 99.967 ( 5.678 -5.964 5.085) 9.678 ======================= Grid point 20 (13/92) ======================= q-point: ( 0.22 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.073 ( 9.861 14.615 3.536) 17.981 1.289 ( 8.953 10.654 14.549) 20.133 1.753 ( 6.315 -6.269 5.689) 10.562 1.815 ( 3.591 -4.462 -1.895) 6.033 1.880 ( 4.776 4.201 3.998) 7.513 1.987 ( 2.262 4.329 -2.615) 5.540 2.056 ( 6.841 1.562 -2.243) 7.367 2.176 ( 2.288 -4.069 -0.102) 4.670 2.252 ( -2.523 7.767 5.319) 9.745 2.316 ( -1.424 4.314 1.368) 4.744 2.387 ( 3.581 -3.672 3.436) 6.173 2.460 ( -3.167 0.556 -0.623) 3.275 2.518 ( 0.923 0.891 6.254) 6.384 2.604 ( -3.429 1.490 -1.031) 3.878 2.775 ( -4.073 -3.909 4.670) 7.326 2.854 ( -1.445 -3.495 2.569) 4.572 2.940 ( -3.433 -0.471 1.026) 3.614 3.061 ( -2.377 -2.138 -1.172) 3.405 3.078 ( -3.806 2.733 -5.552) 7.265 3.223 ( -1.900 -1.256 -5.293) 5.762 3.289 ( -2.136 2.641 -1.188) 3.599 3.340 ( -3.810 -0.049 -3.081) 4.900 3.573 ( 3.817 2.787 -7.471) 8.841 3.610 ( 5.534 0.248 -5.527) 7.826 4.342 ( -0.607 -0.845 1.199) 1.588 4.437 ( -1.421 -3.083 1.599) 3.753 4.541 ( -1.329 -1.846 -2.980) 3.750 4.649 ( -3.994 -4.153 -2.297) 6.203 4.827 ( -7.128 1.064 3.106) 7.847 4.997 ( -4.905 -3.300 1.119) 6.017 5.048 ( 0.467 3.457 2.289) 4.173 5.101 ( 0.048 3.669 -4.174) 5.558 5.234 ( -0.314 -3.396 -3.235) 4.701 5.323 ( -0.902 -4.230 -0.280) 4.335 5.431 ( -2.517 -2.173 -3.757) 5.017 5.482 ( -2.946 -3.564 0.278) 4.633 5.568 ( 0.417 0.623 2.312) 2.431 5.674 ( -2.316 -2.746 4.697) 5.913 5.780 ( -1.574 2.262 2.208) 3.531 5.844 ( -0.005 0.382 -2.965) 2.990 5.923 ( -7.651 0.242 6.310) 9.920 5.988 ( -11.175 0.401 2.259) 11.408 6.190 ( -1.997 7.285 -6.387) 9.893 6.287 ( 4.950 3.117 -1.816) 6.125 6.361 ( 1.262 -0.300 -4.374) 4.562 6.465 ( -5.794 6.965 -2.777) 9.476 6.668 ( 1.963 -8.287 -2.510) 8.879 6.711 ( -8.645 -3.105 -3.277) 9.753 7.004 ( -5.974 1.389 -2.565) 6.648 7.082 ( -5.191 2.865 2.250) 6.342 7.165 ( 0.675 -6.769 1.330) 6.932 7.339 ( 1.478 -3.826 0.568) 4.140 7.650 ( -4.988 7.655 4.444) 10.160 7.739 ( -6.586 4.067 9.660) 12.379 7.947 ( -4.417 2.803 -0.579) 5.263 8.112 ( -0.868 10.695 -0.210) 10.732 8.263 ( -4.684 -6.846 0.777) 8.331 8.559 ( 0.497 -4.228 -0.222) 4.263 8.626 ( -1.150 0.613 -3.440) 3.679 8.732 ( -2.035 0.261 -1.417) 2.493 8.964 ( 3.696 4.904 6.927) 9.257 9.072 ( 6.799 -5.458 -3.848) 9.530 9.133 ( 2.781 1.741 0.710) 3.357 9.304 ( 1.964 -1.542 4.538) 5.179 9.468 ( 10.038 1.265 1.037) 10.170 9.577 ( 7.304 -0.003 1.447) 7.446 9.774 ( 2.610 -0.710 -6.263) 6.822 9.868 ( 4.645 -3.119 -1.739) 5.859 10.342 ( -1.119 4.953 1.268) 5.233 10.550 ( 5.131 -1.358 -1.706) 5.575 10.570 ( 0.103 1.269 -0.588) 1.402 10.917 ( 4.794 -9.148 1.906) 10.503 20.553 ( -0.167 1.772 -0.004) 1.780 20.598 ( -2.894 0.673 -1.801) 3.474 20.864 ( -1.974 2.057 -0.448) 2.886 20.916 ( -1.664 -0.199 0.234) 1.693 22.815 ( -0.719 0.850 -1.623) 1.968 22.842 ( 1.421 0.004 1.064) 1.775 23.064 ( -1.037 0.362 -0.815) 1.368 23.109 ( 0.806 -1.038 1.279) 1.834 24.600 ( -1.986 -0.956 0.151) 2.209 24.631 ( -1.120 -2.454 0.223) 2.707 24.925 ( 1.456 1.965 0.973) 2.632 24.957 ( 1.458 0.569 1.232) 1.992 25.760 ( -5.027 1.341 0.230) 5.208 25.804 ( -4.225 -0.074 -0.110) 4.227 26.084 ( -3.805 1.179 -1.330) 4.200 26.108 ( -5.433 0.597 -0.122) 5.467 28.303 ( 0.821 -0.007 0.595) 1.014 28.311 ( 0.616 -0.196 0.334) 0.728 28.539 ( -0.006 0.883 -0.592) 1.063 28.589 ( 0.154 -1.148 -0.602) 1.305 28.614 ( -1.582 1.045 1.052) 2.168 28.687 ( 1.132 -0.999 1.339) 2.018 28.781 ( 1.817 -2.422 -0.295) 3.042 28.817 ( 1.261 -2.161 0.585) 2.570 32.331 ( 0.817 0.976 0.581) 1.399 32.389 ( 0.220 -1.572 1.361) 2.091 32.477 ( 0.539 1.656 -0.242) 1.758 32.536 ( -0.191 -0.812 -0.516) 0.981 35.377 ( 0.512 1.034 0.916) 1.474 35.421 ( -0.902 -0.601 0.104) 1.089 35.509 ( -0.723 1.475 -0.878) 1.863 35.549 ( -0.634 -0.444 -0.565) 0.958 88.739 ( 2.863 -0.960 -2.013) 3.629 88.750 ( 1.802 -1.134 -1.486) 2.597 89.035 ( 4.808 2.694 -0.248) 5.516 89.192 ( 4.793 -3.943 3.104) 6.939 97.646 ( 1.401 0.109 -0.394) 1.459 97.662 ( 1.634 -0.355 -0.032) 1.672 97.692 ( 2.196 -0.230 -1.082) 2.459 97.737 ( 2.850 -1.564 0.504) 3.290 98.686 ( 0.408 0.977 0.104) 1.064 98.710 ( 0.628 -0.102 0.750) 0.984 98.930 ( -3.735 4.319 -1.364) 5.870 99.009 ( -6.133 2.234 -3.136) 7.241 99.683 ( -0.066 2.939 0.751) 3.034 99.712 ( -2.221 0.690 -0.833) 2.470 99.874 ( 0.016 0.866 -3.030) 3.152 100.122 ( 4.692 -9.546 4.854) 11.692 ======================= Grid point 21 (14/92) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.322 ( 13.045 7.524 5.191) 15.929 1.562 ( 6.228 3.896 10.975) 13.207 1.820 ( 5.033 -0.976 -2.077) 5.531 1.929 ( 6.131 2.002 1.579) 6.640 1.977 ( 3.040 4.503 -1.930) 5.765 2.050 ( 4.891 3.539 1.227) 6.161 2.113 ( -0.380 2.621 2.951) 3.965 2.199 ( 1.140 -6.540 3.173) 7.358 2.276 ( 1.365 2.783 -3.218) 4.468 2.343 ( -0.587 -0.522 3.786) 3.867 2.381 ( -3.722 -0.489 5.003) 6.255 2.471 ( -1.188 -1.374 2.119) 2.791 2.570 ( -0.678 0.668 3.257) 3.394 2.618 ( 1.930 5.960 5.520) 8.349 2.749 ( -5.340 -3.765 4.939) 8.191 2.838 ( -1.584 -3.957 0.705) 4.320 2.908 ( -1.254 2.555 3.467) 4.486 2.965 ( -1.269 0.766 -7.277) 7.426 3.023 ( -0.143 -2.539 -1.816) 3.125 3.120 ( -3.068 -1.192 -5.432) 6.351 3.200 ( -2.887 1.672 -5.216) 6.192 3.283 ( -2.116 -0.807 -1.720) 2.844 3.541 ( 1.506 4.861 -6.530) 8.279 3.627 ( 3.712 -0.193 -5.546) 6.677 4.350 ( -0.558 0.276 1.378) 1.513 4.403 ( -2.157 -1.583 -0.270) 2.689 4.521 ( -0.820 -4.386 0.003) 4.462 4.552 ( -3.925 -3.597 -1.820) 5.627 4.769 ( -2.959 0.560 2.522) 3.928 4.973 ( 0.560 -3.864 1.141) 4.068 5.062 ( 0.067 1.146 -1.419) 1.825 5.102 ( 1.403 4.018 0.834) 4.336 5.178 ( -3.409 -0.556 -2.780) 4.434 5.280 ( 0.556 -3.351 -2.896) 4.464 5.324 ( -5.225 -3.328 -3.567) 7.149 5.423 ( -4.396 -7.129 -0.482) 8.389 5.563 ( -5.179 0.373 -0.085) 5.193 5.581 ( -8.518 -0.212 1.432) 8.640 5.748 ( -10.513 3.101 3.720) 11.575 5.795 ( -3.599 1.733 2.301) 4.609 5.812 ( -1.993 1.724 -1.721) 3.147 5.952 ( 1.410 -4.382 1.066) 4.725 6.159 ( 2.323 0.643 1.275) 2.727 6.217 ( -5.860 -0.319 -7.160) 9.258 6.304 ( -0.034 2.519 -5.038) 5.633 6.436 ( 2.482 7.178 0.960) 7.655 6.556 ( -0.823 -3.309 -3.060) 4.581 6.692 ( -4.100 -5.741 -2.279) 7.413 6.882 ( -2.549 5.991 -0.804) 6.560 7.033 ( -6.022 1.015 1.895) 6.394 7.204 ( 1.512 -4.865 2.225) 5.559 7.372 ( 0.640 -3.592 2.578) 4.467 7.639 ( 1.971 9.015 1.290) 9.318 7.750 ( -4.187 5.316 7.324) 9.972 7.888 ( -3.886 2.427 1.919) 4.967 8.100 ( -0.439 8.048 -0.096) 8.061 8.190 ( -5.689 -5.602 1.016) 8.049 8.537 ( 0.648 0.111 -3.668) 3.726 8.602 ( 0.516 -2.216 -2.003) 3.031 8.681 ( -2.132 -4.028 -0.494) 4.584 9.031 ( 0.230 7.768 1.581) 7.930 9.152 ( 4.970 0.218 -2.343) 5.499 9.228 ( 4.721 1.771 6.010) 7.845 9.382 ( 1.103 -0.099 4.294) 4.435 9.612 ( 4.476 -2.933 0.178) 5.354 9.686 ( 4.259 -3.558 -1.639) 5.786 9.770 ( 5.853 3.716 -3.815) 7.913 9.928 ( 4.094 -3.256 -1.551) 5.456 10.358 ( 1.236 3.563 1.649) 4.116 10.531 ( -1.367 -2.952 -2.165) 3.907 10.617 ( 2.724 3.104 -0.311) 4.142 11.015 ( 4.069 -10.887 1.856) 11.770 20.542 ( -1.243 1.711 -0.730) 2.237 20.558 ( -0.170 0.522 -0.246) 0.602 20.831 ( -1.640 2.006 -0.111) 2.594 20.891 ( -1.369 -0.496 0.113) 1.461 22.771 ( -1.374 1.896 -2.324) 3.299 22.868 ( 0.596 -2.016 -0.188) 2.111 23.051 ( -0.083 1.723 0.484) 1.791 23.149 ( 1.404 -2.119 2.015) 3.244 24.568 ( -1.760 -0.839 -0.046) 1.950 24.613 ( -1.148 -3.116 0.082) 3.322 24.962 ( 1.522 2.345 1.063) 2.991 24.991 ( 1.247 1.015 0.833) 1.811 25.687 ( -3.671 1.758 -0.035) 4.070 25.730 ( -4.309 0.464 -0.025) 4.334 26.007 ( -3.728 0.753 -0.322) 3.817 26.033 ( -3.566 -0.435 -0.257) 3.601 28.312 ( 0.299 0.427 -0.063) 0.525 28.336 ( 1.445 -0.664 0.313) 1.621 28.533 ( 0.116 1.078 -0.651) 1.265 28.580 ( -0.353 -1.210 -0.653) 1.419 28.604 ( -1.009 1.466 1.120) 2.103 28.715 ( 0.674 -0.874 1.205) 1.634 28.779 ( -0.310 -1.158 -0.908) 1.504 28.853 ( 1.341 -3.059 0.701) 3.413 32.351 ( 0.835 0.588 0.448) 1.115 32.398 ( -0.525 -1.422 0.723) 1.679 32.487 ( 0.896 1.506 -0.085) 1.754 32.528 ( -0.151 -0.205 -0.400) 0.475 35.395 ( 0.471 0.518 0.788) 1.054 35.413 ( -0.164 -0.201 0.178) 0.314 35.488 ( -0.767 1.472 -0.585) 1.760 35.535 ( -0.410 -0.663 -0.418) 0.884 88.758 ( 1.233 -0.912 -0.642) 1.663 88.768 ( 2.303 -1.459 -1.902) 3.324 89.111 ( 4.015 3.176 0.114) 5.121 89.298 ( 3.714 -4.827 2.965) 6.774 97.665 ( 1.249 0.046 -0.232) 1.272 97.686 ( 1.402 -0.737 -0.676) 1.722 97.715 ( 1.598 0.539 -0.528) 1.767 97.793 ( 2.682 -2.468 0.858) 3.744 98.697 ( 0.828 1.169 -0.074) 1.434 98.729 ( 0.844 -0.072 0.653) 1.070 98.860 ( -3.216 3.276 -0.603) 4.630 98.899 ( -4.350 1.941 -1.559) 5.012 99.653 ( -2.418 0.941 -1.127) 2.828 99.681 ( -0.597 0.261 -1.216) 1.380 99.859 ( 0.797 5.441 -0.975) 5.585 100.221 ( 2.456 -9.621 2.861) 10.333 ======================= Grid point 22 (15/92) ======================= q-point: ( 0.44 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.555 ( 7.163 4.718 3.388) 9.223 1.706 ( 1.882 -0.517 4.431) 4.842 1.895 ( 4.436 4.500 -3.197) 7.082 1.963 ( -1.083 0.973 -1.217) 1.898 2.012 ( 1.829 7.995 0.133) 8.202 2.079 ( 2.620 2.463 1.759) 4.003 2.170 ( -2.683 3.969 -0.326) 4.802 2.209 ( -2.068 -3.392 0.286) 3.983 2.278 ( 6.297 -0.939 0.226) 6.371 2.348 ( -0.643 -0.224 0.336) 0.759 2.414 ( -2.960 -1.554 4.267) 5.420 2.463 ( -0.604 -0.625 0.972) 1.304 2.586 ( -1.773 -0.381 2.532) 3.114 2.705 ( 1.666 4.831 5.312) 7.371 2.718 ( -1.879 -4.683 1.317) 5.215 2.826 ( -2.024 -0.045 3.670) 4.192 2.872 ( 0.012 -0.070 -5.387) 5.387 2.976 ( -0.217 -3.140 -1.029) 3.311 3.025 ( 2.342 -0.680 0.121) 2.442 3.048 ( 1.570 -1.037 -1.188) 2.225 3.112 ( -1.016 1.716 -2.275) 3.026 3.200 ( -4.244 -1.209 -3.850) 5.856 3.502 ( 0.021 6.308 -2.330) 6.725 3.623 ( 1.257 -1.154 -2.483) 3.013 4.333 ( -1.569 -0.902 0.351) 1.843 4.404 ( 1.509 -1.322 0.269) 2.024 4.468 ( -2.680 -4.377 -0.692) 5.179 4.527 ( -0.145 -3.775 0.035) 3.778 4.772 ( -0.009 2.564 1.510) 2.975 5.010 ( 1.265 -0.032 0.201) 1.282 5.046 ( 0.935 -2.874 -1.228) 3.262 5.079 ( -3.878 2.480 -2.195) 5.100 5.122 ( -1.531 1.892 2.179) 3.267 5.227 ( -1.081 -6.253 -1.372) 6.492 5.269 ( -0.460 -2.496 -2.058) 3.267 5.360 ( -1.283 -7.811 -0.272) 7.920 5.467 ( -2.032 -0.244 -1.248) 2.397 5.480 ( -5.223 -1.723 0.867) 5.567 5.654 ( -1.784 0.720 0.507) 1.990 5.725 ( -5.757 -2.281 0.144) 6.194 5.788 ( -0.080 4.312 -0.873) 4.401 6.007 ( 3.955 -1.755 1.381) 4.542 6.105 ( -3.777 3.851 -1.293) 5.547 6.232 ( 0.146 -2.089 -1.003) 2.322 6.278 ( 3.396 -0.739 3.391) 4.856 6.473 ( 0.028 -1.470 -4.534) 4.767 6.507 ( -0.330 4.166 -1.576) 4.466 6.602 ( -2.331 -2.242 0.260) 3.244 6.875 ( 0.280 7.853 0.956) 7.916 6.941 ( -4.142 1.250 -0.791) 4.398 7.247 ( 0.893 -3.163 1.068) 3.456 7.412 ( 0.663 -0.399 1.814) 1.972 7.711 ( 3.074 6.197 1.514) 7.081 7.747 ( -1.970 5.432 1.849) 6.067 7.859 ( -1.347 1.940 1.088) 2.600 8.097 ( 0.485 6.543 -0.793) 6.609 8.107 ( -4.221 -4.477 0.771) 6.202 8.531 ( 1.723 1.738 -1.317) 2.779 8.579 ( -1.185 -2.814 -1.021) 3.219 8.651 ( -0.871 -5.077 -0.315) 5.161 9.038 ( -0.048 9.617 0.173) 9.619 9.197 ( 2.462 1.626 -1.161) 3.171 9.356 ( 1.569 1.348 6.066) 6.409 9.423 ( 0.571 4.729 0.949) 4.857 9.598 ( -0.199 -8.371 -4.215) 9.375 9.740 ( 2.461 -4.942 -0.033) 5.521 9.834 ( 2.555 4.095 -0.518) 4.855 9.964 ( 1.301 -2.846 -0.220) 3.136 10.412 ( 2.726 1.235 1.734) 3.459 10.477 ( -2.475 -1.028 -1.933) 3.304 10.643 ( 0.821 3.177 -0.134) 3.285 11.078 ( 1.575 -11.835 0.809) 11.967 20.521 ( -0.425 1.879 -0.311) 1.951 20.558 ( 0.067 -0.097 0.001) 0.118 20.810 ( -0.649 2.012 -0.011) 2.114 20.876 ( -0.522 -0.661 0.046) 0.843 22.734 ( -0.635 2.281 -0.986) 2.565 22.864 ( -0.086 -3.246 -0.513) 3.287 23.063 ( 0.302 2.530 0.619) 2.622 23.184 ( 0.680 -2.603 0.905) 2.838 24.546 ( -0.699 -0.750 -0.046) 1.026 24.599 ( -0.498 -3.429 -0.002) 3.465 24.992 ( 0.766 2.549 0.575) 2.723 25.011 ( 0.429 1.349 0.191) 1.428 25.644 ( -1.166 2.060 -0.220) 2.377 25.674 ( -2.061 0.908 0.126) 2.256 25.963 ( -1.391 0.147 0.044) 1.400 25.988 ( -1.377 -1.048 -0.176) 1.739 28.315 ( 0.152 0.701 -0.088) 0.723 28.357 ( 0.642 -1.115 0.099) 1.291 28.530 ( 0.161 1.079 -0.290) 1.128 28.569 ( -0.305 -0.956 -0.256) 1.035 28.602 ( -0.349 1.437 0.448) 1.545 28.737 ( 0.481 -1.761 1.156) 2.161 28.761 ( -0.492 0.469 -1.047) 1.248 28.872 ( 0.377 -3.012 0.240) 3.045 32.366 ( 0.593 0.081 0.173) 0.623 32.391 ( -0.591 -1.031 0.171) 1.201 32.501 ( 0.669 1.157 0.083) 1.339 32.521 ( -0.281 0.421 -0.217) 0.551 35.402 ( -0.022 0.332 0.068) 0.339 35.420 ( 0.324 -0.330 0.359) 0.586 35.473 ( -0.403 1.590 -0.265) 1.662 35.528 ( -0.145 -0.747 -0.131) 0.772 88.767 ( 0.447 -0.845 -0.222) 0.982 88.781 ( 0.860 -1.535 -0.693) 1.891 89.160 ( 1.567 3.327 0.121) 3.679 89.365 ( 1.346 -5.348 1.238) 5.652 97.680 ( 0.538 -0.177 0.091) 0.573 97.693 ( 0.426 -0.747 -0.643) 1.074 97.732 ( 0.641 1.127 -0.013) 1.297 97.833 ( 1.135 -3.163 0.423) 3.387 98.710 ( 0.672 1.285 -0.084) 1.452 98.750 ( 0.795 0.053 0.328) 0.862 98.817 ( -1.226 2.343 -0.098) 2.647 98.831 ( -2.324 1.753 -0.551) 2.963 99.612 ( -1.032 0.841 -0.654) 1.483 99.660 ( -0.327 -0.873 -0.780) 1.216 99.867 ( 0.429 7.824 -0.013) 7.835 100.268 ( 0.775 -9.300 0.957) 9.381 ======================= Grid point 27 (16/92) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 46 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.219 ( 0.000 -13.796 0.000) 13.796 1.219 ( 0.000 13.796 0.000) 13.796 1.459 ( 0.000 -20.407 0.000) 20.407 1.459 ( 0.000 20.407 0.000) 20.407 2.002 ( 0.000 -2.890 0.000) 2.890 2.002 ( 0.000 2.890 0.000) 2.890 2.120 ( 0.000 -7.939 0.000) 7.939 2.120 ( 0.000 7.939 0.000) 7.939 2.186 ( 0.000 -1.600 0.000) 1.600 2.186 ( 0.000 1.600 0.000) 1.600 2.440 ( 0.000 -2.741 0.000) 2.741 2.440 ( 0.000 2.741 0.000) 2.741 2.560 ( 0.000 -6.684 0.000) 6.684 2.560 ( 0.000 6.684 0.000) 6.684 2.744 ( 0.000 -5.666 0.000) 5.666 2.744 ( 0.000 5.666 0.000) 5.666 3.037 ( 0.000 -5.569 0.000) 5.569 3.037 ( 0.000 5.569 0.000) 5.569 3.281 ( 0.000 -1.385 0.000) 1.385 3.281 ( 0.000 1.385 0.000) 1.385 3.478 ( 0.000 -5.759 0.000) 5.759 3.478 ( 0.000 5.759 0.000) 5.759 3.555 ( 0.000 -2.426 0.000) 2.426 3.555 ( 0.000 2.426 0.000) 2.426 4.312 ( 0.000 -0.947 0.000) 0.947 4.312 ( 0.000 0.947 0.000) 0.947 4.698 ( 0.000 -0.699 0.000) 0.699 4.698 ( 0.000 0.699 0.000) 0.699 4.994 ( 0.000 -5.216 0.000) 5.216 4.994 ( 0.000 5.216 0.000) 5.216 5.176 ( 0.000 -2.300 0.000) 2.300 5.176 ( 0.000 2.300 0.000) 2.300 5.318 ( 0.000 -0.759 0.000) 0.759 5.318 ( 0.000 0.759 0.000) 0.759 5.435 ( 0.000 -0.599 0.000) 0.599 5.435 ( 0.000 0.599 0.000) 0.599 5.502 ( 0.000 -0.055 0.000) 0.055 5.502 ( 0.000 0.055 0.000) 0.055 5.860 ( 0.000 -0.092 0.000) 0.092 5.860 ( 0.000 0.092 0.000) 0.092 6.011 ( 0.000 -2.711 0.000) 2.711 6.011 ( 0.000 2.711 0.000) 2.711 6.277 ( 0.000 -3.045 0.000) 3.045 6.277 ( 0.000 3.045 0.000) 3.045 6.384 ( 0.000 -0.190 0.000) 0.190 6.384 ( 0.000 0.190 0.000) 0.190 6.984 ( 0.000 -2.490 0.000) 2.490 6.984 ( 0.000 2.490 0.000) 2.490 7.163 ( 0.000 -3.713 0.000) 3.713 7.163 ( 0.000 3.713 0.000) 3.713 7.364 ( 0.000 -9.926 0.000) 9.926 7.364 ( 0.000 9.926 0.000) 9.926 7.677 ( 0.000 -4.863 0.000) 4.863 7.677 ( 0.000 4.863 0.000) 4.863 8.210 ( 0.000 -10.207 0.000) 10.207 8.210 ( 0.000 10.207 0.000) 10.207 8.392 ( 0.000 -1.030 0.000) 1.030 8.392 ( 0.000 1.030 0.000) 1.030 8.676 ( 0.000 -0.858 0.000) 0.858 8.676 ( 0.000 0.858 0.000) 0.858 8.851 ( 0.000 -4.993 0.000) 4.993 8.851 ( 0.000 4.993 0.000) 4.993 9.124 ( 0.000 -6.388 0.000) 6.388 9.124 ( 0.000 6.388 0.000) 6.388 9.354 ( 0.000 -2.060 0.000) 2.060 9.354 ( 0.000 2.060 0.000) 2.060 9.783 ( 0.000 -0.114 0.000) 0.114 9.783 ( 0.000 0.114 0.000) 0.114 10.428 ( 0.000 -0.824 0.000) 0.824 10.428 ( 0.000 0.824 0.000) 0.824 10.646 ( 0.000 -6.225 0.000) 6.225 10.646 ( 0.000 6.225 0.000) 6.225 20.636 ( 0.000 -3.832 0.000) 3.832 20.636 ( 0.000 3.832 0.000) 3.832 20.943 ( 0.000 -0.034 0.000) 0.034 20.943 ( 0.000 0.034 0.000) 0.034 22.810 ( 0.000 -1.579 0.000) 1.579 22.810 ( 0.000 1.579 0.000) 1.579 23.106 ( 0.000 -0.914 0.000) 0.914 23.106 ( 0.000 0.914 0.000) 0.914 24.630 ( 0.000 -0.195 0.000) 0.195 24.630 ( 0.000 0.195 0.000) 0.195 24.906 ( 0.000 -0.230 0.000) 0.230 24.906 ( 0.000 0.230 0.000) 0.230 25.879 ( 0.000 -0.915 0.000) 0.915 25.879 ( 0.000 0.915 0.000) 0.915 26.217 ( 0.000 -2.650 0.000) 2.650 26.217 ( 0.000 2.650 0.000) 2.650 28.284 ( 0.000 -0.092 0.000) 0.092 28.284 ( 0.000 0.092 0.000) 0.092 28.552 ( 0.000 -0.386 0.000) 0.386 28.552 ( 0.000 0.386 0.000) 0.386 28.630 ( 0.000 -0.830 0.000) 0.830 28.630 ( 0.000 0.830 0.000) 0.830 28.752 ( 0.000 -2.952 0.000) 2.952 28.752 ( 0.000 2.952 0.000) 2.952 32.330 ( 0.000 -0.986 0.000) 0.986 32.330 ( 0.000 0.986 0.000) 0.986 32.512 ( 0.000 -1.861 0.000) 1.861 32.512 ( 0.000 1.861 0.000) 1.861 35.400 ( 0.000 -2.323 0.000) 2.323 35.400 ( 0.000 2.323 0.000) 2.323 35.562 ( 0.000 -1.176 0.000) 1.176 35.562 ( 0.000 1.176 0.000) 1.176 88.716 ( 0.000 -1.130 0.000) 1.130 88.716 ( 0.000 1.130 0.000) 1.130 88.987 ( 0.000 -2.582 0.000) 2.582 88.987 ( 0.000 2.582 0.000) 2.582 97.629 ( 0.000 -0.067 0.000) 0.067 97.629 ( 0.000 0.067 0.000) 0.067 97.660 ( 0.000 -0.291 0.000) 0.291 97.660 ( 0.000 0.291 0.000) 0.291 98.687 ( 0.000 -0.089 0.000) 0.089 98.687 ( 0.000 0.089 0.000) 0.089 99.164 ( 0.000 -6.392 0.000) 6.392 99.164 ( 0.000 6.392 0.000) 6.392 99.720 ( 0.000 -1.301 0.000) 1.301 99.720 ( 0.000 1.301 0.000) 1.301 99.871 ( 0.000 -3.067 0.000) 3.067 99.871 ( 0.000 3.067 0.000) 3.067 ======================= Grid point 29 (17/92) ======================= q-point: ( 0.11 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.279 ( 0.996 -5.958 7.494) 9.625 1.279 ( 0.996 5.958 7.494) 9.625 1.486 ( 3.694 -13.198 1.665) 13.806 1.486 ( 3.694 13.198 1.665) 13.806 1.998 ( 0.322 -5.026 -1.480) 5.250 1.998 ( 0.322 5.026 -1.480) 5.250 2.110 ( 0.637 -8.151 -0.631) 8.200 2.110 ( 0.637 8.151 -0.631) 8.200 2.216 ( 4.928 -1.429 -2.274) 5.612 2.216 ( 4.928 1.429 -2.274) 5.612 2.485 ( -0.395 -2.828 2.164) 3.582 2.485 ( -0.395 2.828 2.164) 3.582 2.572 ( 1.082 -8.672 3.534) 9.427 2.572 ( 1.082 8.672 3.534) 9.427 2.714 ( -2.744 -4.265 0.768) 5.129 2.714 ( -2.744 4.265 0.768) 5.129 3.030 ( -2.245 -4.570 1.596) 5.336 3.030 ( -2.245 4.570 1.596) 5.336 3.249 ( -1.327 -2.139 -3.933) 4.670 3.249 ( -1.327 2.139 -3.933) 4.670 3.432 ( -4.910 -3.847 -0.363) 6.249 3.432 ( -4.910 3.847 -0.363) 6.249 3.574 ( 4.959 -0.941 -4.416) 6.707 3.574 ( 4.959 0.941 -4.416) 6.707 4.328 ( 0.955 -1.818 1.275) 2.417 4.328 ( 0.955 1.818 1.275) 2.417 4.649 ( -3.172 -1.639 -2.548) 4.387 4.649 ( -3.172 1.639 -2.548) 4.387 4.997 ( -6.245 -4.310 5.367) 9.294 4.997 ( -6.245 4.310 5.367) 9.294 5.146 ( 0.301 -2.942 -1.138) 3.169 5.146 ( 0.301 2.942 -1.138) 3.169 5.238 ( -4.030 -1.541 -3.476) 5.541 5.238 ( -4.030 1.541 -3.476) 5.541 5.465 ( 3.012 -1.897 -1.791) 3.985 5.465 ( 3.012 1.897 -1.791) 3.985 5.555 ( 1.932 -1.617 2.458) 3.520 5.555 ( 1.932 1.617 2.458) 3.520 5.844 ( -2.891 -1.299 2.348) 3.944 5.844 ( -2.891 1.299 2.348) 3.944 6.016 ( -1.963 -4.314 2.897) 5.555 6.016 ( -1.963 4.314 2.897) 5.555 6.294 ( 2.643 -1.839 -1.903) 3.740 6.294 ( 2.643 1.839 -1.903) 3.740 6.417 ( 3.754 -3.473 -0.102) 5.115 6.417 ( 3.754 3.473 -0.102) 5.115 6.884 ( -11.499 -9.960 -6.141) 16.406 6.884 ( -11.499 9.960 -6.141) 16.406 7.062 ( -3.317 -3.330 -2.200) 5.190 7.062 ( -3.317 3.330 -2.200) 5.190 7.309 ( -4.257 -3.766 -1.799) 5.962 7.309 ( -4.257 3.766 -1.799) 5.962 7.726 ( -2.691 -3.317 10.220) 11.077 7.726 ( -2.691 3.317 10.220) 11.077 8.162 ( -4.677 -8.258 -1.530) 9.614 8.162 ( -4.677 8.258 -1.530) 9.614 8.381 ( 0.949 -8.160 -1.661) 8.381 8.381 ( 0.949 8.160 -1.661) 8.381 8.739 ( 1.290 -2.055 1.653) 2.936 8.739 ( 1.290 2.055 1.653) 2.936 8.877 ( 5.002 -5.845 -0.316) 7.699 8.877 ( 5.002 5.845 -0.316) 7.699 9.131 ( 2.433 -4.218 0.314) 4.879 9.131 ( 2.433 4.218 0.314) 4.879 9.412 ( 5.372 -3.197 0.991) 6.329 9.412 ( 5.372 3.197 0.991) 6.329 9.785 ( 1.546 -1.189 -1.762) 2.628 9.785 ( 1.546 1.189 -1.762) 2.628 10.443 ( 1.656 -3.008 -0.788) 3.523 10.443 ( 1.656 3.008 -0.788) 3.523 10.663 ( 1.716 -7.357 0.691) 7.586 10.663 ( 1.716 7.357 0.691) 7.586 20.620 ( -1.329 -2.967 -0.638) 3.313 20.620 ( -1.329 2.967 -0.638) 3.313 20.930 ( -1.345 -0.721 -0.160) 1.534 20.930 ( -1.345 0.721 -0.160) 1.534 22.821 ( 0.727 -1.140 0.491) 1.438 22.821 ( 0.727 1.140 0.491) 1.438 23.096 ( -0.727 -0.735 -0.525) 1.160 23.096 ( -0.727 0.735 -0.525) 1.160 24.620 ( -1.074 -0.408 0.013) 1.149 24.620 ( -1.074 0.408 0.013) 1.149 24.920 ( 1.141 -0.539 0.731) 1.458 24.920 ( 1.141 0.539 0.731) 1.458 25.853 ( -3.006 -0.890 -0.001) 3.135 25.853 ( -3.006 0.890 -0.001) 3.135 26.183 ( -3.348 -1.849 -0.721) 3.892 26.183 ( -3.348 1.849 -0.721) 3.892 28.290 ( 0.382 -0.466 0.576) 0.834 28.290 ( 0.382 0.466 0.576) 0.834 28.559 ( 0.693 -0.979 -0.248) 1.225 28.559 ( 0.693 0.979 -0.248) 1.225 28.635 ( -0.081 -0.513 1.058) 1.179 28.635 ( -0.081 0.513 1.058) 1.179 28.759 ( 1.023 -2.356 -0.291) 2.585 28.759 ( 1.023 2.356 -0.291) 2.585 32.339 ( 0.500 -1.213 0.712) 1.493 32.339 ( 0.500 1.213 0.712) 1.493 32.511 ( 0.123 -1.748 -0.313) 1.780 32.511 ( 0.123 1.748 -0.313) 1.780 35.400 ( -0.219 -1.933 0.269) 1.963 35.400 ( -0.219 1.933 0.269) 1.963 35.554 ( -0.601 -1.024 -0.537) 1.303 35.554 ( -0.601 1.024 -0.537) 1.303 88.720 ( 1.039 -0.832 -0.823) 1.565 88.720 ( 1.039 0.832 -0.823) 1.565 89.023 ( 3.556 -2.987 0.684) 4.694 89.023 ( 3.556 2.987 0.684) 4.694 97.634 ( 0.852 -0.222 -0.224) 0.908 97.634 ( 0.852 0.222 -0.224) 0.908 97.674 ( 1.547 -0.640 -0.037) 1.675 97.674 ( 1.547 0.640 -0.037) 1.675 98.692 ( 0.269 -0.256 0.396) 0.542 98.692 ( 0.269 0.256 0.396) 0.542 99.110 ( -4.162 -4.555 -2.368) 6.610 99.110 ( -4.162 4.555 -2.368) 6.610 99.735 ( 0.016 -2.150 1.067) 2.401 99.735 ( 0.016 2.150 1.067) 2.401 99.887 ( 2.015 -1.527 0.471) 2.572 99.887 ( 2.015 1.527 0.471) 2.572 ======================= Grid point 31 (18/92) ======================= q-point: ( 0.22 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.373 ( 2.690 -8.976 5.397) 10.813 1.373 ( 2.690 8.976 5.397) 10.813 1.650 ( 8.723 -3.804 8.022) 12.447 1.650 ( 8.723 3.804 8.022) 12.447 2.007 ( 2.279 -4.735 0.400) 5.271 2.007 ( 2.279 4.735 0.400) 5.271 2.125 ( 3.078 -5.332 -3.046) 6.869 2.125 ( 3.078 5.332 -3.046) 6.869 2.294 ( 2.401 -2.560 3.980) 5.306 2.294 ( 2.401 2.560 3.980) 5.306 2.438 ( -3.233 -3.862 -1.886) 5.378 2.438 ( -3.233 3.862 -1.886) 5.378 2.609 ( -0.688 -1.656 0.019) 1.793 2.609 ( -0.688 1.656 0.019) 1.793 2.734 ( -0.276 -4.208 6.877) 8.067 2.734 ( -0.276 4.208 6.877) 8.067 2.994 ( -3.150 -3.427 0.552) 4.688 2.994 ( -3.150 3.427 0.552) 4.688 3.160 ( -2.351 -4.011 -6.406) 7.915 3.160 ( -2.351 4.011 -6.406) 7.915 3.332 ( -5.101 -1.106 -1.511) 5.434 3.332 ( -5.101 1.106 -1.511) 5.434 3.609 ( 5.373 -0.692 -6.119) 8.173 3.609 ( 5.373 0.692 -6.119) 8.173 4.360 ( 0.563 -2.671 1.805) 3.272 4.360 ( 0.563 2.671 1.805) 3.272 4.564 ( -3.605 -3.212 -2.538) 5.454 4.564 ( -3.605 3.212 -2.538) 5.454 4.894 ( -8.350 -4.674 2.720) 9.948 4.894 ( -8.350 4.674 2.720) 9.948 5.157 ( -0.252 -4.742 -0.946) 4.842 5.157 ( -0.252 4.742 -0.946) 4.842 5.190 ( 1.338 -4.955 -0.819) 5.197 5.190 ( 1.338 4.955 -0.819) 5.197 5.425 ( -3.895 -1.333 -3.188) 5.207 5.425 ( -3.895 1.333 -3.188) 5.207 5.616 ( 0.557 -2.872 3.295) 4.407 5.616 ( 0.557 2.872 3.295) 4.407 5.825 ( -0.916 -1.758 0.694) 2.100 5.825 ( -0.916 1.758 0.694) 2.100 5.961 ( -9.995 -2.333 4.532) 11.220 5.961 ( -9.995 2.333 4.532) 11.220 6.307 ( 1.205 -2.475 -6.219) 6.801 6.307 ( 1.205 2.475 -6.219) 6.801 6.445 ( 0.121 -9.602 -3.767) 10.315 6.445 ( 0.121 9.602 -3.767) 10.315 6.623 ( -6.919 -5.426 -2.101) 9.040 6.623 ( -6.919 5.426 -2.101) 9.040 7.025 ( -2.712 -2.323 1.667) 3.941 7.025 ( -2.712 2.323 1.667) 3.941 7.227 ( -3.119 -6.101 0.352) 6.861 7.227 ( -3.119 6.101 0.352) 6.861 7.775 ( -3.732 -2.204 8.878) 9.879 7.775 ( -3.732 2.204 8.878) 9.879 8.056 ( -3.295 -8.336 -4.208) 9.902 8.056 ( -3.295 8.336 -4.208) 9.902 8.389 ( -0.270 -11.308 1.038) 11.359 8.389 ( -0.270 11.308 1.038) 11.359 8.681 ( -2.653 -3.529 -4.783) 6.509 8.681 ( -2.653 3.529 -4.783) 6.509 9.029 ( 7.416 -1.068 4.743) 8.867 9.029 ( 7.416 1.068 4.743) 8.867 9.206 ( 3.651 -5.510 2.191) 6.963 9.206 ( 3.651 5.510 2.191) 6.964 9.526 ( 6.374 -3.632 0.791) 7.379 9.526 ( 6.374 3.632 0.791) 7.379 9.805 ( 4.208 -2.733 -3.039) 5.866 9.805 ( 4.208 2.733 -3.039) 5.866 10.450 ( 0.587 -5.014 -1.307) 5.215 10.450 ( 0.587 5.014 -1.307) 5.215 10.715 ( 3.223 -8.976 0.853) 9.575 10.715 ( 3.223 8.976 0.853) 9.575 20.588 ( -1.463 -1.282 -0.691) 2.064 20.588 ( -1.463 1.282 -0.691) 2.064 20.901 ( -1.900 -1.222 -0.114) 2.262 20.901 ( -1.900 1.222 -0.114) 2.262 22.833 ( 0.375 -0.746 -0.464) 0.955 22.833 ( 0.375 0.746 -0.464) 0.955 23.083 ( -0.363 -1.226 0.401) 1.340 23.083 ( -0.363 1.226 0.401) 1.340 24.597 ( -1.657 -0.711 -0.049) 1.803 24.597 ( -1.657 0.711 -0.049) 1.803 24.955 ( 1.729 -0.757 1.108) 2.189 24.955 ( 1.729 0.757 1.108) 2.189 25.789 ( -4.294 -1.171 0.011) 4.451 25.789 ( -4.294 1.171 0.011) 4.451 26.105 ( -4.779 -0.753 -0.778) 4.900 26.105 ( -4.779 0.753 -0.778) 4.900 28.306 ( 0.764 -0.211 0.449) 0.911 28.306 ( 0.764 0.211 0.449) 0.911 28.562 ( 0.266 -1.249 -0.740) 1.476 28.562 ( 0.266 1.249 -0.740) 1.476 28.647 ( -0.298 -2.033 1.600) 2.604 28.647 ( -0.298 2.033 1.600) 2.604 28.778 ( 1.482 -1.373 -0.201) 2.030 28.778 ( 1.482 1.373 -0.201) 2.030 32.357 ( 0.462 -1.403 0.858) 1.709 32.357 ( 0.462 1.403 0.858) 1.709 32.511 ( 0.359 -1.452 -0.397) 1.548 32.511 ( 0.359 1.452 -0.397) 1.548 35.401 ( -0.087 -1.127 0.470) 1.224 35.401 ( -0.087 1.127 0.470) 1.224 35.535 ( -0.796 -0.938 -0.681) 1.406 35.535 ( -0.796 0.938 -0.681) 1.406 88.733 ( 1.677 -0.351 -1.107) 2.040 88.733 ( 1.677 0.351 -1.107) 2.040 89.106 ( 4.871 -3.795 1.168) 6.285 89.106 ( 4.871 3.795 1.168) 6.285 97.652 ( 1.563 -0.447 -0.457) 1.689 97.652 ( 1.563 0.447 -0.457) 1.689 97.706 ( 2.094 -1.213 0.120) 2.423 97.706 ( 2.094 1.213 0.120) 2.423 98.704 ( 0.562 -0.543 0.460) 0.907 98.704 ( 0.562 0.543 0.460) 0.907 99.004 ( -5.055 -2.236 -2.206) 5.952 99.004 ( -5.055 2.236 -2.206) 5.952 99.720 ( -1.621 -0.289 -1.095) 1.977 99.720 ( -1.621 0.289 -1.095) 1.977 99.948 ( 3.168 -6.233 2.051) 7.287 99.948 ( 3.168 6.233 2.051) 7.287 ======================= Grid point 33 (19/92) ======================= q-point: ( 0.33 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.502 ( 6.092 -7.830 4.951) 11.087 1.502 ( 6.092 7.830 4.951) 11.087 1.882 ( 8.876 -5.176 5.108) 11.474 1.882 ( 8.876 5.176 5.108) 11.474 2.075 ( 2.216 -4.607 3.147) 6.004 2.075 ( 2.216 4.607 3.147) 6.004 2.141 ( 3.661 -2.440 -3.746) 5.778 2.141 ( 3.661 2.440 -3.746) 5.778 2.306 ( -4.320 -1.818 2.350) 5.243 2.306 ( -4.320 1.818 2.350) 5.243 2.417 ( -1.067 -3.193 3.856) 5.119 2.417 ( -1.067 3.193 3.856) 5.119 2.609 ( 0.522 -4.046 1.467) 4.335 2.609 ( 0.522 4.046 1.467) 4.335 2.770 ( -2.149 -4.322 3.699) 6.081 2.770 ( -2.149 4.322 3.699) 6.081 2.955 ( -1.521 -1.883 -0.060) 2.422 2.955 ( -1.521 1.883 -0.060) 2.422 3.053 ( -1.746 -4.629 -6.318) 8.024 3.053 ( -1.746 4.629 -6.318) 8.024 3.245 ( -2.927 -2.349 -2.763) 4.661 3.245 ( -2.927 2.349 -2.763) 4.661 3.613 ( 2.770 -1.726 -5.666) 6.539 3.613 ( 2.770 1.726 -5.666) 6.539 4.374 ( -0.963 -1.844 0.965) 2.293 4.374 ( -0.963 1.844 0.965) 2.293 4.482 ( -3.057 -1.840 -1.404) 3.834 4.482 ( -3.057 1.840 -1.404) 3.834 4.838 ( -2.198 -5.649 3.654) 7.078 4.838 ( -2.198 5.649 3.654) 7.078 5.139 ( 0.210 -3.943 -2.686) 4.776 5.139 ( 0.210 3.943 -2.686) 4.776 5.198 ( 0.961 -3.945 -1.503) 4.330 5.198 ( 0.961 3.945 -1.503) 4.330 5.305 ( -6.159 -2.170 -2.482) 6.986 5.305 ( -6.159 2.170 -2.482) 6.986 5.577 ( -8.124 -0.492 1.090) 8.211 5.577 ( -8.124 0.492 1.090) 8.211 5.811 ( -9.925 -1.314 1.297) 10.095 5.811 ( -9.925 1.314 1.297) 10.095 5.855 ( 2.681 -3.764 0.944) 4.717 5.855 ( 2.681 3.764 0.944) 4.717 6.182 ( -3.096 -1.675 -3.993) 5.323 6.182 ( -3.096 1.675 -3.993) 5.323 6.437 ( 1.716 -7.452 -4.023) 8.640 6.437 ( 1.716 7.452 -4.023) 8.640 6.571 ( -1.917 -5.252 0.603) 5.623 6.571 ( -1.917 5.252 0.603) 5.623 6.990 ( -2.912 -4.977 1.046) 5.860 6.990 ( -2.912 4.977 1.046) 5.860 7.241 ( 1.184 -6.931 4.004) 8.092 7.241 ( 1.184 6.931 4.004) 8.092 7.796 ( -2.352 -2.433 5.089) 6.112 7.796 ( -2.352 2.433 5.089) 6.112 7.976 ( -1.815 -8.467 -3.018) 9.171 7.976 ( -1.815 8.467 -3.018) 9.171 8.380 ( -2.014 -12.525 1.028) 12.728 8.380 ( -2.014 12.525 1.028) 12.728 8.613 ( 0.536 -2.402 -4.259) 4.919 8.613 ( 0.536 2.402 -4.259) 4.919 9.181 ( 5.058 -5.536 3.693) 8.359 9.181 ( 5.058 5.536 3.693) 8.359 9.274 ( 1.484 -8.086 2.860) 8.705 9.274 ( 1.484 8.086 2.860) 8.705 9.607 ( 2.913 -2.484 -0.807) 3.912 9.607 ( 2.913 2.484 -0.807) 3.912 9.859 ( 5.090 -3.644 -2.079) 6.596 9.859 ( 5.090 3.644 -2.079) 6.596 10.443 ( 0.392 -4.274 -1.145) 4.442 10.443 ( 0.392 4.274 -1.145) 4.442 10.776 ( 2.773 -10.416 0.763) 10.806 10.776 ( 2.773 10.416 0.763) 10.806 20.562 ( -0.879 -0.295 -0.430) 1.022 20.562 ( -0.879 0.295 -0.430) 1.022 20.870 ( -1.585 -1.484 -0.009) 2.171 20.870 ( -1.585 1.484 -0.009) 2.171 22.818 ( -0.599 -2.410 -1.610) 2.960 22.818 ( -0.599 2.410 -1.610) 2.960 23.098 ( 0.651 -2.464 1.572) 2.994 23.098 ( 0.651 2.464 1.572) 2.994 24.569 ( -1.506 -1.008 -0.110) 1.815 24.569 ( -1.506 1.008 -0.110) 1.815 24.995 ( 1.609 -0.705 1.000) 2.021 24.995 ( 1.609 0.705 1.000) 2.021 25.721 ( -3.621 -1.181 -0.054) 3.809 25.721 ( -3.621 1.181 -0.054) 3.809 26.022 ( -4.064 -0.632 -0.476) 4.141 26.022 ( -4.064 0.632 -0.476) 4.141 28.323 ( 0.809 -0.575 0.125) 1.001 28.323 ( 0.809 0.575 0.125) 1.001 28.555 ( 0.006 -1.075 -0.765) 1.319 28.555 ( 0.006 1.075 -0.765) 1.319 28.656 ( -0.459 -3.199 1.286) 3.478 28.656 ( -0.459 3.199 1.286) 3.478 28.799 ( 1.046 -2.029 -0.040) 2.283 28.799 ( 1.046 2.029 -0.040) 2.283 32.369 ( 0.135 -1.140 0.531) 1.265 32.369 ( 0.135 1.140 0.531) 1.265 32.515 ( 0.495 -1.019 -0.235) 1.157 32.515 ( 0.495 1.019 -0.235) 1.157 35.406 ( 0.116 -0.439 0.415) 0.615 35.406 ( 0.116 0.439 0.415) 0.615 35.516 ( -0.645 -1.115 -0.471) 1.372 35.516 ( -0.645 1.115 -0.471) 1.372 88.749 ( 1.466 -0.212 -0.885) 1.726 88.749 ( 1.466 0.212 -0.885) 1.726 89.195 ( 3.931 -4.550 1.199) 6.131 89.195 ( 3.931 4.550 1.199) 6.131 97.671 ( 1.298 -0.505 -0.580) 1.508 97.671 ( 1.298 0.505 -0.580) 1.508 97.743 ( 1.943 -1.949 0.358) 2.775 97.743 ( 1.943 1.949 0.358) 2.775 98.720 ( 0.948 -0.830 0.231) 1.281 98.720 ( 0.948 0.830 0.231) 1.281 98.908 ( -4.184 -1.020 -1.134) 4.453 98.908 ( -4.184 1.020 -1.134) 4.453 99.673 ( -1.761 -0.807 -1.782) 2.632 99.673 ( -1.761 0.807 -1.782) 2.632 100.018 ( 2.331 -8.864 1.881) 9.356 100.018 ( 2.331 8.864 1.881) 9.356 ======================= Grid point 35 (20/92) ======================= q-point: ( 0.44 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.652 ( 4.758 -3.952 3.680) 7.197 1.652 ( 4.758 3.952 3.680) 7.197 1.967 ( 0.380 -1.482 -3.936) 4.223 1.967 ( 0.380 1.482 -3.936) 4.223 2.119 ( 0.043 -2.371 4.955) 5.493 2.119 ( 0.043 2.371 4.955) 5.493 2.195 ( 4.024 -5.396 -2.162) 7.070 2.195 ( 4.024 5.396 -2.162) 7.070 2.291 ( -0.318 -5.074 1.802) 5.394 2.291 ( -0.318 5.074 1.802) 5.394 2.425 ( -1.386 -2.093 2.128) 3.291 2.425 ( -1.386 2.093 2.128) 3.291 2.614 ( -2.077 -3.474 1.162) 4.211 2.614 ( -2.077 3.474 1.162) 4.211 2.800 ( 0.635 -2.715 4.770) 5.525 2.800 ( 0.635 2.715 4.770) 5.525 2.908 ( -1.629 -3.332 -4.505) 5.836 2.908 ( -1.629 3.332 -4.505) 5.836 3.026 ( 2.789 -0.780 0.762) 2.994 3.026 ( 2.789 0.780 0.762) 2.994 3.157 ( -3.346 -2.361 -3.792) 5.581 3.157 ( -3.346 2.361 -3.792) 5.581 3.595 ( 0.674 -2.275 -2.284) 3.294 3.595 ( 0.674 2.275 -2.284) 3.294 4.352 ( -1.342 -3.366 -0.120) 3.625 4.352 ( -1.342 3.366 -0.120) 3.625 4.451 ( -0.403 -2.898 0.034) 2.926 4.451 ( -0.403 2.898 0.034) 2.926 4.873 ( 0.985 -6.600 2.458) 7.112 4.873 ( 0.985 6.600 2.458) 7.112 5.105 ( -0.896 -4.458 -1.287) 4.726 5.105 ( -0.896 4.458 -1.287) 4.726 5.176 ( -2.485 -4.981 -2.478) 6.094 5.176 ( -2.485 4.981 -2.478) 6.094 5.210 ( -0.910 -5.721 -0.539) 5.818 5.210 ( -0.910 5.721 -0.539) 5.818 5.466 ( -3.826 -0.135 0.287) 3.839 5.466 ( -3.826 0.135 0.287) 3.839 5.683 ( -4.225 -1.708 -1.019) 4.670 5.683 ( -4.225 1.708 -1.019) 4.670 5.904 ( 1.437 -5.873 0.359) 6.057 5.904 ( 1.437 5.873 0.359) 6.057 6.183 ( 1.311 -2.375 3.954) 4.795 6.183 ( 1.311 2.375 3.954) 4.795 6.363 ( -2.239 -6.806 -5.941) 9.307 6.363 ( -2.239 6.806 -5.941) 9.307 6.571 ( 0.212 -1.237 0.818) 1.498 6.571 ( 0.212 1.237 0.818) 1.498 6.963 ( -1.191 -3.500 0.494) 3.730 6.963 ( -1.191 3.500 0.494) 3.730 7.300 ( 0.868 -7.527 2.106) 7.864 7.300 ( 0.868 7.527 2.106) 7.864 7.811 ( -0.344 -1.141 1.616) 2.008 7.811 ( -0.344 1.141 1.616) 2.008 7.933 ( -0.747 -8.274 -0.918) 8.359 7.933 ( -0.747 8.274 -0.918) 8.359 8.357 ( -1.155 -12.992 0.202) 13.045 8.357 ( -1.155 12.992 0.202) 13.045 8.595 ( 0.631 -2.121 -1.573) 2.715 8.595 ( 0.631 2.121 -1.573) 2.715 9.254 ( 1.290 -8.826 0.368) 8.928 9.254 ( 1.290 8.826 0.368) 8.928 9.333 ( 1.264 -9.318 2.815) 9.816 9.333 ( 1.264 9.318 2.815) 9.816 9.615 ( 0.340 -6.274 -1.546) 6.470 9.615 ( 0.340 6.274 -1.546) 6.470 9.909 ( 1.957 -2.779 -0.343) 3.416 9.909 ( 1.957 2.779 -0.343) 3.416 10.441 ( 0.281 -1.741 -0.502) 1.834 10.441 ( 0.281 1.741 -0.502) 1.834 10.816 ( 1.102 -11.563 0.368) 11.621 10.816 ( 1.102 11.563 0.368) 11.621 20.550 ( -0.270 -0.804 -0.143) 0.860 20.550 ( -0.270 0.804 -0.143) 0.860 20.851 ( -0.610 -1.617 0.018) 1.729 20.851 ( -0.610 1.617 0.018) 1.729 22.794 ( -0.423 -3.161 -0.830) 3.295 22.794 ( -0.423 3.161 -0.830) 3.295 23.123 ( 0.460 -2.955 0.824) 3.102 23.123 ( 0.460 2.955 0.824) 3.102 24.549 ( -0.614 -1.177 -0.061) 1.329 24.549 ( -0.614 1.177 -0.061) 1.329 25.023 ( 0.687 -0.392 0.412) 0.892 25.023 ( 0.687 0.392 0.412) 0.892 25.677 ( -1.439 -0.745 -0.060) 1.621 25.677 ( -1.439 0.745 -0.060) 1.621 25.970 ( -1.586 -0.604 -0.144) 1.703 25.970 ( -1.586 0.604 -0.144) 1.703 28.333 ( 0.351 -1.011 0.000) 1.070 28.333 ( 0.351 1.011 0.000) 1.070 28.549 ( -0.018 -0.830 -0.323) 0.891 28.549 ( -0.018 0.830 -0.323) 0.891 28.660 ( -0.214 -3.638 0.494) 3.677 28.660 ( -0.214 3.638 0.494) 3.677 28.810 ( 0.339 -2.693 -0.001) 2.714 28.810 ( 0.339 2.693 -0.001) 2.714 32.374 ( -0.005 -0.592 0.155) 0.612 32.374 ( -0.005 0.592 0.155) 0.612 32.520 ( 0.237 -0.513 -0.060) 0.568 32.520 ( 0.237 0.513 -0.060) 0.568 35.411 ( 0.086 -0.463 0.149) 0.494 35.411 ( 0.086 0.463 0.149) 0.494 35.505 ( -0.249 -1.324 -0.148) 1.356 35.505 ( -0.249 1.324 -0.148) 1.356 88.760 ( 0.569 -0.286 -0.333) 0.719 88.760 ( 0.569 0.286 -0.333) 0.719 89.251 ( 1.487 -4.968 0.521) 5.211 89.251 ( 1.487 4.968 0.521) 5.211 97.681 ( 0.470 -0.305 -0.266) 0.620 97.681 ( 0.470 0.305 -0.266) 0.620 97.771 ( 0.823 -2.475 0.199) 2.615 97.771 ( 0.823 2.475 0.199) 2.615 98.738 ( 0.801 -1.090 0.022) 1.353 98.738 ( 0.801 1.090 0.022) 1.353 98.848 ( -1.962 -0.320 -0.273) 2.006 98.848 ( -1.962 0.320 -0.273) 2.006 99.636 ( -0.740 -1.249 -0.813) 1.665 99.636 ( -0.740 1.249 -0.813) 1.665 100.059 ( 0.831 -9.708 0.719) 9.770 100.059 ( 0.831 9.708 0.719) 9.770 ======================= Grid point 63 (21/92) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.416 ( 0.162 0.000 20.262) 20.262 0.474 ( -7.473 0.000 21.713) 22.963 0.902 ( -4.199 0.000 39.431) 39.654 1.692 ( 2.792 0.000 -11.388) 11.725 1.781 ( 0.758 0.000 -16.108) 16.126 1.922 ( 1.365 0.000 6.955) 7.088 2.134 ( 5.152 0.000 11.074) 12.214 2.144 ( -0.609 0.000 1.200) 1.346 2.231 ( -2.017 0.000 -3.337) 3.900 2.376 ( -1.478 0.000 7.123) 7.274 2.527 ( -3.645 0.000 3.240) 4.877 2.585 ( 1.477 0.000 6.896) 7.053 2.602 ( 1.374 0.000 -1.772) 2.243 2.669 ( 0.467 0.000 7.452) 7.467 2.765 ( -1.674 0.000 -0.039) 1.674 2.821 ( 2.768 0.000 -3.434) 4.411 2.922 ( 1.581 0.000 2.421) 2.891 3.179 ( -2.020 0.000 -2.870) 3.510 3.218 ( -0.528 0.000 -3.757) 3.794 3.250 ( 3.188 0.000 -8.838) 9.396 3.286 ( -3.740 0.000 -3.851) 5.368 3.305 ( 0.961 0.000 -3.480) 3.610 3.420 ( -0.255 0.000 -4.948) 4.954 3.546 ( -2.645 0.000 -5.526) 6.126 4.346 ( -0.965 0.000 1.536) 1.814 4.462 ( 2.136 0.000 -2.387) 3.203 4.679 ( -7.192 0.000 6.766) 9.875 4.833 ( 1.395 0.000 1.546) 2.082 4.882 ( -1.936 0.000 0.173) 1.944 5.026 ( -0.682 0.000 1.232) 1.408 5.149 ( -0.259 0.000 3.018) 3.029 5.203 ( -1.278 0.000 1.026) 1.639 5.278 ( 0.075 0.000 5.950) 5.950 5.396 ( -0.321 0.000 -8.729) 8.734 5.526 ( 0.655 0.000 3.702) 3.760 5.528 ( 1.519 0.000 -3.870) 4.158 5.688 ( -1.020 0.000 -4.129) 4.254 5.793 ( 3.304 0.000 1.833) 3.778 5.893 ( 3.280 0.000 -0.884) 3.397 5.896 ( -4.636 0.000 2.630) 5.330 5.928 ( -0.350 0.000 0.628) 0.719 5.996 ( -1.535 0.000 0.807) 1.734 6.197 ( 2.117 0.000 -4.713) 5.166 6.233 ( -1.691 0.000 -3.841) 4.197 6.342 ( -2.003 0.000 -0.130) 2.007 6.408 ( -3.469 0.000 -1.902) 3.956 6.542 ( 5.581 0.000 -1.833) 5.874 6.893 ( 1.884 0.000 -14.343) 14.466 7.050 ( -1.654 0.000 0.488) 1.724 7.151 ( 1.612 0.000 -2.106) 2.652 7.223 ( -5.344 0.000 -0.407) 5.359 7.229 ( 4.226 0.000 0.282) 4.235 7.641 ( 6.038 0.000 15.738) 16.857 8.049 ( -5.122 0.000 -0.080) 5.122 8.103 ( 1.617 0.000 2.223) 2.748 8.197 ( -14.325 0.000 3.675) 14.789 8.502 ( 11.262 0.000 6.432) 12.969 8.683 ( -3.303 0.000 0.389) 3.326 8.711 ( -7.250 0.000 -0.456) 7.264 8.721 ( 1.501 0.000 0.183) 1.512 8.799 ( 0.471 0.000 2.727) 2.768 8.931 ( 4.348 0.000 -1.167) 4.502 9.055 ( 1.390 0.000 -0.546) 1.493 9.186 ( -1.635 0.000 0.552) 1.726 9.405 ( -7.222 0.000 6.692) 9.846 9.488 ( 10.056 0.000 -7.212) 12.374 9.590 ( 7.274 0.000 -8.592) 11.258 9.926 ( 6.718 0.000 -5.630) 8.765 10.252 ( -9.451 0.000 2.950) 9.900 10.324 ( 4.793 0.000 -0.493) 4.818 10.716 ( -18.994 0.000 3.658) 19.343 10.949 ( 3.463 0.000 -1.252) 3.683 20.478 ( -0.422 0.000 -0.138) 0.444 20.495 ( 1.041 0.000 -0.572) 1.188 20.850 ( -0.706 0.000 1.000) 1.224 20.920 ( 0.492 0.000 -0.567) 0.751 22.754 ( 1.954 0.000 1.108) 2.246 22.865 ( -2.043 0.000 -1.268) 2.405 23.045 ( 1.739 0.000 0.450) 1.796 23.115 ( -1.451 0.000 -0.988) 1.756 24.712 ( 1.082 0.000 1.102) 1.544 24.815 ( -1.670 0.000 -1.410) 2.186 24.873 ( 0.488 0.000 0.949) 1.067 24.895 ( 0.861 0.000 0.108) 0.868 25.849 ( 1.009 0.000 0.296) 1.051 25.896 ( -0.394 0.000 -0.619) 0.734 26.022 ( -0.429 0.000 3.223) 3.251 26.306 ( -9.540 0.000 -2.877) 9.965 28.301 ( -0.496 0.000 2.239) 2.294 28.479 ( -10.019 0.000 -0.429) 10.028 28.539 ( 0.557 0.000 -0.480) 0.735 28.596 ( 2.031 0.000 -1.357) 2.443 28.616 ( -0.676 0.000 1.411) 1.564 28.694 ( -2.466 0.000 1.087) 2.695 28.756 ( 16.311 0.000 0.309) 16.314 28.848 ( 1.499 0.000 -2.163) 2.632 32.294 ( -0.431 0.000 1.204) 1.279 32.413 ( 0.516 0.000 -1.315) 1.413 32.509 ( 1.855 0.000 0.509) 1.923 32.559 ( 0.174 0.000 -0.575) 0.601 35.339 ( -0.012 0.000 1.701) 1.701 35.408 ( -0.457 0.000 2.028) 2.079 35.528 ( -1.446 0.000 -2.553) 2.934 35.565 ( -1.042 0.000 -1.027) 1.463 88.767 ( -2.597 0.000 0.537) 2.652 88.885 ( 0.887 0.000 -2.106) 2.285 89.053 ( -45.714 0.000 1.208) 45.730 89.107 ( 5.533 0.000 0.209) 5.537 97.618 ( 0.462 0.000 -0.357) 0.584 97.625 ( -2.565 0.000 -0.634) 2.642 97.662 ( -5.009 0.000 0.691) 5.056 97.684 ( 0.909 0.000 0.097) 0.914 98.677 ( -0.350 0.000 1.075) 1.130 98.714 ( 0.228 0.000 0.275) 0.357 98.795 ( 1.483 0.000 -0.118) 1.488 98.856 ( -0.318 0.000 -1.421) 1.456 99.614 ( -0.059 0.000 1.050) 1.051 99.723 ( 0.914 0.000 -1.409) 1.680 100.019 ( -5.767 0.000 0.914) 5.839 100.066 ( 29.222 0.000 -0.212) 29.223 ======================= Grid point 64 (22/92) ======================= q-point: ( 0.11 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.732 ( 12.679 0.000 15.720) 20.196 0.744 ( 11.502 0.000 17.531) 20.967 1.350 ( 9.996 0.000 25.653) 27.531 1.642 ( 3.225 0.000 -13.695) 14.069 1.647 ( 6.952 0.000 -12.567) 14.361 1.995 ( -0.035 0.000 3.877) 3.877 2.148 ( -1.341 0.000 3.790) 4.020 2.183 ( -3.345 0.000 4.604) 5.691 2.359 ( 5.145 0.000 12.366) 13.394 2.399 ( -2.915 0.000 4.257) 5.160 2.464 ( -5.661 0.000 3.857) 6.850 2.593 ( -2.089 0.000 -0.181) 2.096 2.664 ( -1.040 0.000 4.333) 4.456 2.710 ( -1.986 0.000 0.012) 1.986 2.753 ( -1.016 0.000 4.153) 4.275 2.840 ( 2.355 0.000 -1.500) 2.792 2.967 ( -0.015 0.000 3.267) 3.267 3.076 ( 0.711 0.000 -11.897) 11.918 3.117 ( -2.643 0.000 -6.822) 7.316 3.217 ( -0.480 0.000 -3.215) 3.251 3.229 ( 3.437 0.000 -7.155) 7.938 3.282 ( -1.834 0.000 -0.487) 1.897 3.326 ( -2.109 0.000 -7.393) 7.688 3.482 ( 0.854 0.000 -4.202) 4.288 4.371 ( 2.022 0.000 1.373) 2.444 4.474 ( 1.167 0.000 -1.524) 1.919 4.656 ( -3.612 0.000 5.516) 6.593 4.821 ( -4.774 0.000 -0.999) 4.877 4.872 ( 0.239 0.000 1.787) 1.803 4.982 ( -5.111 0.000 1.392) 5.297 5.099 ( -9.589 0.000 5.342) 10.977 5.215 ( 0.125 0.000 2.848) 2.851 5.308 ( 1.442 0.000 -8.344) 8.468 5.383 ( 2.553 0.000 5.543) 6.102 5.429 ( -5.131 0.000 -6.451) 8.243 5.605 ( 1.525 0.000 6.438) 6.616 5.653 ( -1.144 0.000 -1.981) 2.287 5.809 ( -1.603 0.000 -1.992) 2.557 5.859 ( -0.676 0.000 -0.028) 0.677 5.935 ( 0.821 0.000 -2.141) 2.293 5.986 ( 0.078 0.000 3.422) 3.423 5.986 ( 5.180 0.000 2.102) 5.591 6.111 ( -7.859 0.000 -1.836) 8.071 6.157 ( -1.588 0.000 -4.080) 4.378 6.223 ( -7.111 0.000 1.244) 7.219 6.360 ( -1.276 0.000 -0.717) 1.463 6.601 ( 4.387 0.000 -3.615) 5.685 6.744 ( -2.468 0.000 -12.755) 12.991 7.053 ( -2.751 0.000 0.564) 2.808 7.133 ( -2.768 0.000 0.482) 2.810 7.152 ( 1.565 0.000 -2.033) 2.566 7.306 ( 3.779 0.000 -1.163) 3.954 7.770 ( -19.363 0.000 -3.225) 19.629 7.883 ( 1.614 0.000 15.930) 16.011 8.103 ( -7.279 0.000 6.264) 9.603 8.139 ( -0.567 0.000 2.965) 3.019 8.568 ( -6.226 0.000 -3.315) 7.054 8.585 ( -14.471 0.000 5.968) 15.653 8.640 ( -1.631 0.000 3.840) 4.172 8.766 ( 2.669 0.000 -0.734) 2.768 8.868 ( 4.270 0.000 3.255) 5.369 8.970 ( 4.018 0.000 -3.418) 5.275 9.089 ( 4.834 0.000 -2.183) 5.304 9.239 ( 7.999 0.000 2.507) 8.382 9.432 ( 1.930 0.000 5.800) 6.113 9.452 ( -1.166 0.000 -7.681) 7.769 9.594 ( 5.430 0.000 -12.453) 13.585 9.892 ( -1.024 0.000 -0.779) 1.286 10.263 ( 5.332 0.000 0.629) 5.369 10.452 ( 7.763 0.000 1.981) 8.012 10.621 ( -3.160 0.000 3.628) 4.811 11.040 ( 7.951 0.000 0.176) 7.953 20.468 ( -0.453 0.000 -0.342) 0.567 20.503 ( 0.893 0.000 -0.388) 0.974 20.839 ( -1.717 0.000 0.966) 1.969 20.916 ( -0.209 0.000 -0.544) 0.582 22.804 ( -2.631 0.000 -2.450) 3.595 22.817 ( 2.967 0.000 2.415) 3.826 23.072 ( -1.729 0.000 -1.954) 2.609 23.097 ( 3.042 0.000 1.305) 3.310 24.746 ( -4.247 0.000 -0.785) 4.319 24.752 ( 1.585 0.000 1.927) 2.496 24.859 ( -2.077 0.000 0.882) 2.257 24.912 ( 0.845 0.000 0.319) 0.904 25.836 ( -3.052 0.000 0.999) 3.212 25.847 ( -4.364 0.000 -1.063) 4.492 26.048 ( -1.518 0.000 4.009) 4.287 26.158 ( -6.104 0.000 0.383) 6.116 28.320 ( -0.159 0.000 2.287) 2.293 28.367 ( -5.127 0.000 1.819) 5.440 28.534 ( -0.556 0.000 -0.371) 0.669 28.609 ( 0.569 0.000 -0.279) 0.634 28.626 ( -0.418 0.000 1.693) 1.743 28.669 ( -0.739 0.000 -0.567) 0.931 28.847 ( 0.940 0.000 -1.817) 2.046 28.909 ( 6.865 0.000 -4.462) 8.188 32.308 ( 0.351 0.000 1.364) 1.408 32.410 ( 0.918 0.000 -1.397) 1.672 32.500 ( -2.184 0.000 1.353) 2.569 32.550 ( -0.437 0.000 -0.866) 0.970 35.363 ( 0.267 0.000 2.290) 2.306 35.427 ( -0.301 0.000 2.367) 2.386 35.473 ( -1.908 0.000 -1.630) 2.510 35.546 ( 0.056 0.000 -1.446) 1.448 88.704 ( -3.354 0.000 3.325) 4.722 88.798 ( -3.811 0.000 3.696) 5.309 88.903 ( 3.459 0.000 -1.327) 3.705 89.245 ( 7.862 0.000 3.872) 8.764 97.621 ( 2.130 0.000 -1.458) 2.581 97.634 ( 1.428 0.000 0.132) 1.434 97.663 ( 1.296 0.000 -0.130) 1.303 97.724 ( 3.453 0.000 0.728) 3.529 98.685 ( -0.067 0.000 1.011) 1.013 98.720 ( -0.128 0.000 0.487) 0.504 98.794 ( -0.960 0.000 0.574) 1.118 98.825 ( -1.090 0.000 -2.060) 2.331 99.624 ( -0.186 0.000 1.228) 1.242 99.713 ( -0.294 0.000 -1.390) 1.421 99.903 ( -6.735 0.000 -2.575) 7.210 100.349 ( 12.048 0.000 -5.594) 13.283 ======================= Grid point 65 (23/92) ======================= q-point: ( 0.22 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.107 ( 11.635 0.000 13.044) 17.479 1.136 ( 18.465 0.000 8.820) 20.464 1.530 ( 10.660 0.000 -14.838) 18.270 1.638 ( 8.105 0.000 -13.292) 15.569 1.748 ( 3.194 0.000 11.821) 12.245 2.017 ( 0.766 0.000 0.354) 0.844 2.200 ( -5.372 0.000 9.128) 10.591 2.217 ( 1.762 0.000 7.886) 8.080 2.380 ( -2.500 0.000 2.942) 3.861 2.396 ( -2.378 0.000 2.872) 3.729 2.521 ( -5.945 0.000 1.060) 6.039 2.599 ( 4.520 0.000 10.754) 11.666 2.642 ( -5.532 0.000 3.245) 6.413 2.679 ( -5.588 0.000 -5.993) 8.194 2.717 ( 2.153 0.000 -0.875) 2.324 2.842 ( -0.335 0.000 -2.164) 2.190 2.973 ( 0.016 0.000 -1.943) 1.943 2.999 ( 6.004 0.000 -10.822) 12.376 3.095 ( -0.503 0.000 7.309) 7.327 3.158 ( -5.599 0.000 1.486) 5.793 3.162 ( -1.258 0.000 -9.318) 9.403 3.246 ( -1.581 0.000 -0.621) 1.699 3.266 ( 2.015 0.000 -3.962) 4.445 3.469 ( 3.476 0.000 -4.450) 5.647 4.432 ( 3.632 0.000 0.781) 3.715 4.468 ( -2.280 0.000 1.996) 3.031 4.662 ( -1.979 0.000 3.801) 4.285 4.721 ( -5.274 0.000 -1.088) 5.385 4.866 ( -2.357 0.000 0.173) 2.363 4.928 ( -2.759 0.000 2.034) 3.427 5.009 ( -6.255 0.000 4.353) 7.620 5.221 ( -3.622 0.000 3.342) 4.928 5.245 ( -4.042 0.000 -4.481) 6.035 5.287 ( 1.476 0.000 -8.423) 8.551 5.474 ( 1.735 0.000 4.862) 5.162 5.602 ( -1.489 0.000 -2.745) 3.123 5.651 ( -3.547 0.000 4.340) 5.605 5.720 ( -5.528 0.000 -3.651) 6.625 5.854 ( -1.958 0.000 -2.733) 3.362 5.868 ( -5.133 0.000 -1.008) 5.231 5.945 ( -9.140 0.000 4.011) 9.981 6.084 ( 1.050 0.000 -2.746) 2.940 6.090 ( 3.593 0.000 2.880) 4.604 6.093 ( -1.704 0.000 7.253) 7.450 6.193 ( 4.043 0.000 0.552) 4.081 6.317 ( -1.350 0.000 -4.308) 4.515 6.562 ( -3.914 0.000 -9.840) 10.590 6.611 ( 0.669 0.000 -1.962) 2.073 6.951 ( -6.162 0.000 -1.058) 6.252 7.169 ( 3.098 0.000 -1.926) 3.648 7.170 ( 2.749 0.000 2.046) 3.427 7.252 ( -6.510 0.000 -7.191) 9.700 7.498 ( -9.966 0.000 2.806) 10.354 7.967 ( -8.374 0.000 9.021) 12.308 8.036 ( -10.119 0.000 7.325) 12.492 8.192 ( 1.942 0.000 5.953) 6.261 8.352 ( -17.991 0.000 5.498) 18.812 8.434 ( -2.685 0.000 -7.553) 8.016 8.623 ( -1.172 0.000 -0.542) 1.291 8.785 ( -0.373 0.000 0.311) 0.486 8.974 ( 0.519 0.000 -1.039) 1.161 8.984 ( 4.104 0.000 3.196) 5.202 9.175 ( 6.423 0.000 -1.834) 6.680 9.339 ( -2.250 0.000 -6.664) 7.034 9.450 ( 12.100 0.000 1.411) 12.182 9.559 ( 9.199 0.000 -13.057) 15.972 9.569 ( 6.405 0.000 6.515) 9.136 9.922 ( 4.655 0.000 -2.068) 5.093 10.363 ( 3.491 0.000 3.977) 5.292 10.575 ( 4.181 0.000 1.640) 4.491 10.608 ( -2.009 0.000 1.169) 2.324 11.194 ( 8.905 0.000 0.960) 8.956 20.457 ( -0.370 0.000 -0.323) 0.491 20.518 ( 1.330 0.000 -0.349) 1.375 20.816 ( -2.230 0.000 1.028) 2.456 20.903 ( -0.627 0.000 -0.616) 0.878 22.737 ( -2.229 0.000 -2.072) 3.043 22.892 ( 2.716 0.000 2.374) 3.607 23.024 ( -1.348 0.000 -1.864) 2.301 23.165 ( 3.296 0.000 1.223) 3.516 24.674 ( -3.778 0.000 -0.100) 3.779 24.797 ( 1.311 0.000 1.662) 2.117 24.833 ( -1.869 0.000 0.466) 1.926 24.928 ( 0.884 0.000 -0.042) 0.885 25.742 ( -6.248 0.000 -1.334) 6.388 25.780 ( -5.043 0.000 1.418) 5.239 26.046 ( -3.564 0.000 3.423) 4.941 26.085 ( -3.171 0.000 -0.438) 3.201 28.323 ( -2.245 0.000 0.952) 2.439 28.342 ( 0.506 0.000 1.439) 1.526 28.520 ( -0.805 0.000 0.119) 0.813 28.612 ( -0.519 0.000 0.888) 1.028 28.635 ( -0.548 0.000 1.406) 1.509 28.655 ( 0.352 0.000 -1.715) 1.751 28.841 ( 0.451 0.000 -1.518) 1.583 28.941 ( 2.682 0.000 -3.313) 4.263 32.332 ( 0.851 0.000 1.310) 1.562 32.416 ( 1.477 0.000 -1.147) 1.870 32.481 ( -1.882 0.000 1.454) 2.379 32.526 ( -0.920 0.000 -1.456) 1.722 35.393 ( 0.235 0.000 2.391) 2.402 35.432 ( -0.912 0.000 -1.590) 1.833 35.444 ( -0.600 0.000 2.124) 2.207 35.533 ( 0.382 0.000 -1.646) 1.690 88.735 ( 2.325 0.000 1.984) 3.056 88.796 ( -0.732 0.000 2.038) 2.165 88.964 ( 4.885 0.000 -0.932) 4.973 89.422 ( 5.899 0.000 6.382) 8.691 97.644 ( 2.403 0.000 -1.186) 2.680 97.663 ( 1.741 0.000 0.282) 1.764 97.683 ( 1.459 0.000 -0.532) 1.553 97.810 ( 4.780 0.000 2.029) 5.193 98.695 ( 0.108 0.000 0.668) 0.677 98.717 ( -0.867 0.000 0.345) 0.933 98.781 ( -1.526 0.000 0.932) 1.788 98.785 ( -0.751 0.000 -2.103) 2.233 99.632 ( -0.334 0.000 1.043) 1.095 99.688 ( -1.225 0.000 -0.623) 1.374 99.764 ( -4.765 0.000 -4.567) 6.600 100.434 ( 5.377 0.000 -3.833) 6.604 ======================= Grid point 66 (24/92) ======================= q-point: ( 0.33 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.374 ( 7.758 0.000 5.817) 9.697 1.455 ( 15.434 0.000 -4.591) 16.102 1.631 ( 11.159 0.000 -1.224) 11.226 1.640 ( 7.462 0.000 -10.452) 12.842 1.837 ( 3.124 0.000 1.670) 3.542 2.011 ( -0.956 0.000 -2.785) 2.945 2.201 ( -3.574 0.000 7.715) 8.503 2.214 ( -3.972 0.000 -3.249) 5.132 2.406 ( -1.393 0.000 2.843) 3.166 2.411 ( -4.340 0.000 1.488) 4.588 2.469 ( -5.548 0.000 -9.945) 11.388 2.513 ( 4.378 0.000 2.964) 5.287 2.589 ( -5.016 0.000 3.643) 6.199 2.710 ( -0.505 0.000 1.874) 1.941 2.763 ( -0.338 0.000 3.295) 3.313 2.816 ( 3.483 0.000 -7.129) 7.935 2.974 ( 0.736 0.000 2.765) 2.861 3.040 ( 6.117 0.000 -3.178) 6.893 3.050 ( -1.823 0.000 -2.229) 2.880 3.056 ( -7.091 0.000 2.056) 7.383 3.185 ( -1.971 0.000 4.635) 5.037 3.226 ( -2.114 0.000 7.528) 7.819 3.243 ( -0.399 0.000 -2.919) 2.946 3.521 ( 8.025 0.000 -4.099) 9.011 4.438 ( -5.241 0.000 4.351) 6.812 4.495 ( 3.261 0.000 0.198) 3.267 4.637 ( -3.659 0.000 -0.620) 3.711 4.665 ( -2.347 0.000 3.344) 4.086 4.816 ( -3.459 0.000 0.860) 3.564 4.938 ( 0.535 0.000 2.611) 2.665 4.994 ( 0.713 0.000 0.691) 0.993 5.119 ( -4.954 0.000 -2.569) 5.580 5.165 ( -5.913 0.000 1.855) 6.197 5.271 ( 3.398 0.000 -4.846) 5.919 5.528 ( -8.446 0.000 -2.963) 8.951 5.534 ( -1.065 0.000 4.561) 4.684 5.591 ( 1.756 0.000 -1.884) 2.575 5.624 ( -2.821 0.000 2.777) 3.959 5.737 ( -5.279 0.000 -2.493) 5.838 5.752 ( -9.513 0.000 1.825) 9.686 5.914 ( -3.609 0.000 1.568) 3.935 5.962 ( -4.516 0.000 -3.238) 5.557 6.168 ( 1.421 0.000 3.836) 4.091 6.204 ( 3.586 0.000 2.333) 4.278 6.249 ( 1.250 0.000 -5.078) 5.230 6.359 ( 6.815 0.000 7.539) 10.163 6.435 ( 0.495 0.000 -6.465) 6.484 6.580 ( -3.429 0.000 0.269) 3.439 6.848 ( -5.572 0.000 -0.289) 5.579 7.052 ( -7.077 0.000 -2.922) 7.657 7.219 ( 3.459 0.000 -0.359) 3.478 7.234 ( 2.968 0.000 0.423) 2.998 7.432 ( -2.517 0.000 0.537) 2.573 7.859 ( -8.238 0.000 -0.751) 8.272 7.897 ( -16.798 0.000 8.739) 18.935 8.171 ( -6.067 0.000 -1.574) 6.268 8.226 ( -4.454 0.000 -0.505) 4.482 8.384 ( 4.463 0.000 -0.719) 4.520 8.606 ( -0.511 0.000 0.473) 0.696 8.738 ( -4.393 0.000 -2.295) 4.957 8.987 ( 0.468 0.000 2.224) 2.273 9.042 ( 2.083 0.000 -1.294) 2.452 9.240 ( 4.447 0.000 -3.372) 5.581 9.277 ( 2.039 0.000 -3.905) 4.405 9.619 ( 6.377 0.000 1.726) 6.606 9.640 ( 11.446 0.000 -5.821) 12.841 9.752 ( 6.688 0.000 4.744) 8.199 9.976 ( 5.003 0.000 -3.002) 5.835 10.455 ( 1.846 0.000 4.322) 4.699 10.577 ( -3.692 0.000 2.407) 4.407 10.626 ( 1.361 0.000 -0.210) 1.377 11.319 ( 5.094 0.000 -0.527) 5.121 20.452 ( -0.090 0.000 0.044) 0.100 20.537 ( 1.374 0.000 -0.522) 1.470 20.791 ( -2.151 0.000 1.181) 2.454 20.885 ( -0.513 0.000 -0.705) 0.872 22.694 ( -1.169 0.000 -0.449) 1.253 22.946 ( 1.385 0.000 0.893) 1.648 22.995 ( -0.358 0.000 -0.689) 0.777 23.221 ( 2.369 0.000 0.058) 2.370 24.623 ( -2.598 0.000 0.513) 2.649 24.811 ( -1.295 0.000 0.579) 1.418 24.820 ( 0.245 0.000 -0.089) 0.260 24.943 ( 1.134 0.000 -0.356) 1.188 25.632 ( -4.938 0.000 -1.019) 5.042 25.707 ( -5.131 0.000 1.076) 5.243 26.010 ( -3.884 0.000 1.967) 4.354 26.037 ( -1.865 0.000 -0.724) 2.000 28.307 ( -0.809 0.000 0.664) 1.047 28.369 ( 1.255 0.000 0.705) 1.440 28.512 ( -0.789 0.000 0.896) 1.194 28.606 ( -0.947 0.000 -0.131) 0.956 28.637 ( -0.573 0.000 0.675) 0.885 28.649 ( 0.464 0.000 -0.185) 0.500 28.830 ( 0.211 0.000 -1.623) 1.637 28.942 ( 1.342 0.000 -2.506) 2.842 32.360 ( 0.946 0.000 0.959) 1.347 32.435 ( 1.954 0.000 -0.663) 2.064 32.465 ( -1.808 0.000 1.125) 2.130 32.492 ( -0.868 0.000 -1.916) 2.103 35.409 ( -0.064 0.000 -1.163) 1.164 35.417 ( -0.215 0.000 1.920) 1.932 35.450 ( -0.981 0.000 1.433) 1.737 35.525 ( 0.680 0.000 -1.409) 1.565 88.796 ( 1.076 0.000 2.496) 2.718 88.816 ( 1.096 0.000 2.465) 2.697 89.032 ( 4.509 0.000 -1.514) 4.756 89.539 ( 0.375 0.000 4.732) 4.746 97.671 ( 2.077 0.000 -1.188) 2.392 97.692 ( 1.393 0.000 -0.013) 1.393 97.704 ( 1.173 0.000 0.838) 1.442 97.905 ( 2.900 0.000 2.621) 3.909 98.701 ( -0.833 0.000 -0.212) 0.859 98.702 ( 0.221 0.000 0.201) 0.298 98.760 ( -0.111 0.000 -1.382) 1.386 98.764 ( -1.745 0.000 0.878) 1.954 99.634 ( -0.451 0.000 0.541) 0.704 99.665 ( -2.022 0.000 -2.159) 2.958 99.675 ( 0.019 0.000 0.114) 0.116 100.461 ( 2.940 0.000 -3.823) 4.823 ======================= Grid point 67 (25/92) ======================= q-point: ( 0.44 0.00 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( 1.843 0.000 2.206) 2.875 1.619 ( 13.152 0.000 -6.824) 14.817 1.634 ( 4.910 0.000 -11.283) 12.305 1.665 ( -4.069 0.000 -4.002) 5.708 1.939 ( -2.385 0.000 -3.238) 4.022 2.006 ( 9.359 0.000 1.781) 9.527 2.109 ( -0.191 0.000 -4.760) 4.764 2.266 ( 0.917 0.000 8.507) 8.556 2.293 ( -0.969 0.000 -6.533) 6.605 2.346 ( -3.889 0.000 -1.223) 4.077 2.395 ( -3.127 0.000 -0.617) 3.187 2.502 ( -6.229 0.000 -1.816) 6.488 2.600 ( 2.115 0.000 0.258) 2.131 2.675 ( -3.273 0.000 -5.532) 6.428 2.749 ( 1.618 0.000 -6.007) 6.221 2.750 ( -2.419 0.000 -0.863) 2.569 2.939 ( -8.559 0.000 4.994) 9.910 3.063 ( -1.364 0.000 4.622) 4.819 3.097 ( 6.706 0.000 1.076) 6.792 3.116 ( 2.125 0.000 2.258) 3.101 3.143 ( -2.487 0.000 2.288) 3.379 3.221 ( 0.317 0.000 -0.025) 0.318 3.321 ( -0.842 0.000 10.807) 10.840 3.619 ( 7.443 0.000 -2.627) 7.893 4.398 ( -4.998 0.000 4.564) 6.769 4.545 ( 1.018 0.000 0.945) 1.389 4.592 ( -0.027 0.000 -0.054) 0.060 4.663 ( -1.730 0.000 3.225) 3.660 4.775 ( -3.441 0.000 2.139) 4.052 4.978 ( 1.172 0.000 1.539) 1.934 5.027 ( -4.310 0.000 -0.467) 4.335 5.027 ( 2.957 0.000 -1.451) 3.294 5.104 ( -2.795 0.000 1.885) 3.371 5.300 ( 4.127 0.000 -0.369) 4.144 5.419 ( -1.281 0.000 -0.428) 1.351 5.512 ( -3.736 0.000 -0.788) 3.819 5.622 ( -6.623 0.000 3.263) 7.383 5.632 ( -2.363 0.000 4.409) 5.002 5.634 ( -3.893 0.000 -1.047) 4.031 5.674 ( 7.401 0.000 -2.344) 7.763 5.825 ( -4.057 0.000 -1.535) 4.337 5.903 ( 0.288 0.000 -2.078) 2.098 6.228 ( 0.492 0.000 4.802) 4.827 6.267 ( 3.974 0.000 -2.141) 4.514 6.277 ( 2.119 0.000 1.812) 2.788 6.336 ( -2.494 0.000 -3.152) 4.020 6.531 ( -3.518 0.000 3.442) 4.922 6.600 ( 7.436 0.000 7.740) 10.733 6.761 ( -4.660 0.000 0.868) 4.740 6.986 ( 0.664 0.000 0.226) 0.701 7.256 ( 0.013 0.000 0.896) 0.896 7.262 ( 1.031 0.000 -1.891) 2.154 7.413 ( 1.188 0.000 -1.819) 2.173 7.703 ( -14.485 0.000 5.527) 15.504 7.712 ( -3.484 0.000 -7.728) 8.477 8.090 ( -0.657 0.000 -4.046) 4.099 8.117 ( -2.440 0.000 -6.299) 6.755 8.487 ( 2.566 0.000 5.952) 6.481 8.619 ( -1.441 0.000 -8.081) 8.208 8.624 ( 0.415 0.000 3.038) 3.066 9.032 ( 0.079 0.000 5.034) 5.035 9.045 ( 0.737 0.000 -2.559) 2.664 9.244 ( 1.776 0.000 -5.765) 6.033 9.304 ( 3.565 0.000 -1.003) 3.703 9.702 ( 1.322 0.000 2.018) 2.413 9.766 ( 6.654 0.000 -0.649) 6.686 9.850 ( 0.387 0.000 1.826) 1.867 10.027 ( 4.786 0.000 -2.510) 5.405 10.473 ( -2.378 0.000 -1.005) 2.582 10.583 ( -2.081 0.000 9.171) 9.404 10.626 ( 0.218 0.000 -1.841) 1.853 11.344 ( 1.027 0.000 -3.926) 4.058 20.456 ( 0.133 0.000 0.668) 0.681 20.549 ( 0.841 0.000 -0.790) 1.154 20.774 ( -1.414 0.000 1.328) 1.940 20.873 ( 0.064 0.000 -0.792) 0.794 22.692 ( 0.253 0.000 1.593) 1.613 22.951 ( -0.487 0.000 -1.311) 1.398 23.000 ( 0.720 0.000 1.078) 1.297 23.236 ( 0.375 0.000 -1.773) 1.812 24.599 ( -1.254 0.000 1.105) 1.671 24.805 ( -0.498 0.000 1.212) 1.311 24.807 ( -0.245 0.000 -2.078) 2.093 24.952 ( 0.497 0.000 -0.797) 0.940 25.574 ( -1.074 0.000 -0.028) 1.074 25.642 ( -3.038 0.000 0.072) 3.039 25.972 ( -2.206 0.000 0.862) 2.368 26.010 ( -0.360 0.000 -0.655) 0.747 28.307 ( -0.241 0.000 0.865) 0.898 28.390 ( 0.413 0.000 0.112) 0.428 28.513 ( -0.705 0.000 1.733) 1.871 28.581 ( -0.825 0.000 -1.280) 1.523 28.631 ( -0.426 0.000 -0.110) 0.440 28.668 ( 0.698 0.000 1.790) 1.922 28.816 ( 0.545 0.000 -1.913) 1.989 28.937 ( 1.180 0.000 -2.291) 2.577 32.379 ( 0.220 0.000 0.397) 0.454 32.446 ( -1.631 0.000 0.789) 1.812 32.461 ( -0.397 0.000 -1.537) 1.587 32.465 ( 2.091 0.000 -0.490) 2.148 35.406 ( 0.675 0.000 -0.444) 0.807 35.420 ( -1.223 0.000 0.666) 1.393 35.446 ( -0.925 0.000 1.145) 1.472 35.526 ( 0.975 0.000 -0.965) 1.372 88.819 ( -0.574 0.000 2.255) 2.327 88.885 ( 1.061 0.000 5.753) 5.850 89.070 ( 2.402 0.000 -2.499) 3.466 89.531 ( -3.732 0.000 -0.479) 3.762 97.683 ( 0.776 0.000 -0.913) 1.198 97.706 ( 0.473 0.000 -0.403) 0.622 97.744 ( 1.345 0.000 2.562) 2.893 97.943 ( -0.809 0.000 0.924) 1.228 98.692 ( -0.064 0.000 -0.059) 0.086 98.706 ( 0.177 0.000 -0.192) 0.261 98.744 ( -1.477 0.000 0.502) 1.560 98.752 ( 0.621 0.000 -0.771) 0.990 99.626 ( -0.214 0.000 -1.591) 1.605 99.628 ( -0.522 0.000 -0.076) 0.528 99.724 ( 1.782 0.000 5.458) 5.742 100.453 ( 1.880 0.000 -5.187) 5.517 ======================= Grid point 68 (26/92) ======================= q-point: (-0.44 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.409 ( -12.703 0.000 -0.504) 12.713 1.434 ( -11.122 0.000 -13.008) 17.114 1.630 ( 9.554 0.000 -11.785) 15.172 1.762 ( 9.779 0.000 -3.559) 10.407 1.909 ( 1.142 0.000 0.065) 1.144 2.038 ( -5.557 0.000 8.755) 10.369 2.142 ( 6.045 0.000 -7.806) 9.873 2.227 ( -10.189 0.000 -5.112) 11.399 2.259 ( -3.785 0.000 -3.817) 5.375 2.356 ( 8.866 0.000 1.404) 8.976 2.372 ( -0.976 0.000 4.319) 4.428 2.434 ( 1.483 0.000 -2.070) 2.546 2.507 ( -4.388 0.000 -8.043) 9.162 2.568 ( -9.187 0.000 3.522) 9.839 2.679 ( -0.008 0.000 -5.138) 5.138 2.776 ( 3.524 0.000 -0.973) 3.656 2.894 ( -0.817 0.000 0.572) 0.997 3.004 ( -4.872 0.000 1.730) 5.170 3.146 ( -0.061 0.000 0.639) 0.642 3.193 ( -0.738 0.000 6.992) 7.031 3.231 ( 7.446 0.000 0.806) 7.490 3.262 ( 2.203 0.000 3.370) 4.026 3.411 ( -0.432 0.000 7.944) 7.956 3.700 ( 3.771 0.000 -0.174) 3.775 4.372 ( -3.278 0.000 3.611) 4.877 4.538 ( -1.735 0.000 1.308) 2.173 4.643 ( 2.869 0.000 1.661) 3.315 4.679 ( 0.997 0.000 0.437) 1.088 4.771 ( -1.043 0.000 5.677) 5.772 4.940 ( -5.018 0.000 -1.040) 5.125 5.047 ( 1.907 0.000 -1.763) 2.597 5.057 ( 8.214 0.000 0.188) 8.216 5.093 ( -3.054 0.000 2.493) 3.943 5.406 ( 5.496 0.000 3.754) 6.656 5.444 ( -1.723 0.000 -1.149) 2.072 5.453 ( 5.379 0.000 -0.747) 5.431 5.592 ( -1.551 0.000 1.901) 2.453 5.600 ( 0.591 0.000 0.502) 0.775 5.643 ( -0.532 0.000 2.528) 2.583 5.643 ( -1.011 0.000 -6.060) 6.144 5.886 ( -1.131 0.000 -2.146) 2.426 5.903 ( 6.579 0.000 4.291) 7.855 6.224 ( -2.941 0.000 -5.482) 6.221 6.229 ( -2.920 0.000 0.077) 2.921 6.340 ( -1.335 0.000 5.381) 5.544 6.345 ( 3.602 0.000 3.031) 4.707 6.557 ( 1.181 0.000 4.827) 4.969 6.727 ( -1.508 0.000 7.319) 7.473 6.797 ( 6.913 0.000 3.218) 7.625 7.075 ( 10.069 0.000 -0.829) 10.103 7.235 ( -1.292 0.000 -1.627) 2.077 7.237 ( -1.899 0.000 -0.154) 1.906 7.408 ( 1.288 0.000 -5.287) 5.442 7.581 ( -7.000 0.000 7.986) 10.619 7.584 ( 0.442 0.000 -11.773) 11.781 8.037 ( 0.770 0.000 -5.836) 5.886 8.063 ( 2.081 0.000 -3.063) 3.703 8.497 ( 1.819 0.000 -7.858) 8.065 8.630 ( 3.281 0.000 4.205) 5.334 8.676 ( 0.586 0.000 4.485) 4.523 9.006 ( -1.810 0.000 -3.251) 3.721 9.089 ( -0.704 0.000 6.293) 6.332 9.177 ( -0.962 0.000 -7.843) 7.902 9.355 ( 3.526 0.000 -1.248) 3.740 9.708 ( -3.489 0.000 2.567) 4.331 9.800 ( -6.737 0.000 -0.975) 6.807 9.827 ( 1.166 0.000 -0.026) 1.166 10.071 ( 2.206 0.000 -1.083) 2.457 10.406 ( -4.854 0.000 1.256) 5.014 10.598 ( -0.738 0.000 -2.714) 2.812 10.667 ( -0.351 0.000 9.634) 9.640 11.282 ( -1.412 0.000 -6.595) 6.744 20.468 ( 0.063 0.000 1.087) 1.089 20.545 ( -0.089 0.000 -1.046) 1.050 20.774 ( -0.219 0.000 1.385) 1.402 20.872 ( 0.843 0.000 -0.843) 1.192 22.734 ( 1.519 0.000 3.262) 3.598 22.906 ( -1.945 0.000 -3.043) 3.612 23.037 ( 1.240 0.000 2.552) 2.838 23.198 ( -1.507 0.000 -3.274) 3.604 24.603 ( -0.029 0.000 1.411) 1.412 24.775 ( -0.217 0.000 -2.989) 2.997 24.818 ( -0.033 0.000 1.843) 1.843 24.939 ( -0.504 0.000 -1.462) 1.547 25.599 ( 3.290 0.000 1.007) 3.441 25.616 ( 0.587 0.000 -0.971) 1.134 25.959 ( -0.228 0.000 0.384) 0.447 26.012 ( 1.262 0.000 -0.440) 1.337 28.315 ( -0.273 0.000 1.225) 1.255 28.381 ( -1.341 0.000 -0.284) 1.370 28.524 ( -0.673 0.000 2.407) 2.499 28.559 ( 0.007 0.000 -1.434) 1.434 28.622 ( -0.176 0.000 -0.604) 0.629 28.702 ( 0.526 0.000 2.355) 2.413 28.810 ( 1.270 0.000 -1.948) 2.325 28.933 ( 1.599 0.000 -2.770) 3.198 32.371 ( -1.432 0.000 0.162) 1.441 32.431 ( -0.770 0.000 0.171) 0.789 32.441 ( -0.095 0.000 -1.212) 1.216 32.498 ( 2.024 0.000 -0.172) 2.031 35.396 ( -1.690 0.000 -0.232) 1.705 35.421 ( 1.184 0.000 0.293) 1.219 35.440 ( -1.193 0.000 0.853) 1.467 35.536 ( 1.121 0.000 -0.617) 1.280 88.829 ( -1.391 0.000 2.575) 2.926 88.972 ( -0.484 0.000 10.256) 10.267 89.057 ( -0.358 0.000 -2.922) 2.943 89.426 ( -4.683 0.000 -5.203) 7.000 97.681 ( -0.205 0.000 -0.307) 0.369 97.699 ( -0.614 0.000 -0.624) 0.875 97.799 ( 0.874 0.000 4.229) 4.319 97.904 ( -3.329 0.000 -1.042) 3.488 98.693 ( 0.154 0.000 -0.010) 0.154 98.702 ( -0.469 0.000 -0.168) 0.498 98.729 ( -0.358 0.000 -0.326) 0.484 98.767 ( 1.736 0.000 -0.027) 1.737 99.617 ( -0.462 0.000 -0.516) 0.693 99.622 ( 1.047 0.000 -0.431) 1.132 99.834 ( 1.986 0.000 8.486) 8.715 100.414 ( 1.599 0.000 -7.675) 7.840 ======================= Grid point 69 (27/92) ======================= q-point: (-0.33 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.066 ( -15.382 0.000 -13.459) 20.439 1.137 ( -18.481 0.000 -0.709) 18.494 1.659 ( 7.437 0.000 -8.871) 11.576 1.827 ( -8.993 0.000 2.589) 9.359 1.946 ( 1.129 0.000 -2.004) 2.300 1.956 ( -10.078 0.000 3.031) 10.524 2.034 ( -4.418 0.000 -2.861) 5.264 2.128 ( 0.802 0.000 -1.378) 1.594 2.205 ( 0.104 0.000 1.831) 1.834 2.316 ( -5.138 0.000 -5.467) 7.502 2.343 ( -0.699 0.000 -1.952) 2.073 2.469 ( 0.051 0.000 0.982) 0.984 2.521 ( 7.380 0.000 -1.601) 7.552 2.541 ( 2.975 0.000 3.681) 4.733 2.661 ( 2.576 0.000 -2.869) 3.855 2.815 ( 3.123 0.000 -2.519) 4.012 2.845 ( -1.901 0.000 -3.890) 4.330 3.037 ( 2.944 0.000 5.302) 6.065 3.145 ( -0.337 0.000 0.500) 0.603 3.244 ( -0.683 0.000 4.836) 4.884 3.323 ( 3.331 0.000 0.195) 3.337 3.364 ( 5.053 0.000 2.249) 5.530 3.470 ( -0.917 0.000 4.769) 4.856 3.734 ( -0.597 0.000 1.678) 1.781 4.370 ( -0.317 0.000 2.035) 2.060 4.510 ( -4.509 0.000 2.058) 4.957 4.700 ( 2.286 0.000 -1.260) 2.610 4.708 ( 3.753 0.000 1.224) 3.947 4.863 ( 2.288 0.000 7.773) 8.103 4.868 ( -1.427 0.000 -0.468) 1.502 5.048 ( -5.664 0.000 4.952) 7.523 5.060 ( 2.470 0.000 -2.121) 3.256 5.240 ( 12.114 0.000 -0.780) 12.139 5.439 ( 0.807 0.000 0.112) 0.815 5.505 ( 2.063 0.000 -4.272) 4.744 5.513 ( 4.049 0.000 1.337) 4.264 5.538 ( -6.235 0.000 -2.550) 6.736 5.636 ( 7.619 0.000 -1.269) 7.724 5.678 ( 5.057 0.000 7.298) 8.879 5.736 ( 8.371 0.000 -0.979) 8.428 5.808 ( -1.814 0.000 -5.325) 5.626 6.007 ( -0.134 0.000 4.291) 4.293 6.137 ( -3.303 0.000 -1.092) 3.479 6.150 ( -4.372 0.000 -3.434) 5.560 6.355 ( -2.278 0.000 3.055) 3.810 6.418 ( 0.362 0.000 4.325) 4.340 6.649 ( 3.150 0.000 2.984) 4.339 6.828 ( 4.822 0.000 6.133) 7.802 6.932 ( 4.847 0.000 3.073) 5.739 7.162 ( 3.454 0.000 -6.239) 7.131 7.220 ( -0.983 0.000 4.165) 4.280 7.254 ( 2.672 0.000 -5.581) 6.188 7.428 ( 13.477 0.000 -3.074) 13.823 7.473 ( 1.530 0.000 -12.632) 12.724 7.662 ( 0.872 0.000 17.080) 17.102 8.016 ( 2.414 0.000 -3.423) 4.189 8.096 ( 4.424 0.000 -1.088) 4.556 8.473 ( 7.344 0.000 -10.371) 12.708 8.717 ( 0.730 0.000 5.214) 5.265 8.725 ( -0.410 0.000 3.821) 3.843 8.919 ( -3.938 0.000 -3.669) 5.383 9.059 ( -2.168 0.000 -8.558) 8.828 9.137 ( -1.379 0.000 5.736) 5.899 9.385 ( 3.348 0.000 -4.065) 5.266 9.607 ( -12.610 0.000 -1.001) 12.650 9.664 ( -6.466 0.000 2.109) 6.801 9.809 ( -1.563 0.000 -2.494) 2.944 10.060 ( -2.937 0.000 -0.036) 2.937 10.357 ( -4.727 0.000 4.712) 6.674 10.541 ( -2.492 0.000 -3.154) 4.020 10.774 ( 0.137 0.000 11.041) 11.042 11.169 ( -3.077 0.000 -7.234) 7.862 20.479 ( -0.134 0.000 1.054) 1.062 20.525 ( -0.734 0.000 -1.273) 1.469 20.794 ( 0.684 0.000 1.339) 1.503 20.882 ( 1.410 0.000 -0.835) 1.639 22.803 ( 1.854 0.000 3.846) 4.270 22.834 ( -2.307 0.000 -3.381) 4.093 23.087 ( 0.983 0.000 2.973) 3.131 23.129 ( -2.006 0.000 -3.641) 4.157 24.624 ( 0.610 0.000 1.462) 1.584 24.739 ( -0.346 0.000 -2.795) 2.817 24.838 ( -0.191 0.000 1.996) 2.005 24.911 ( -0.567 0.000 -1.731) 1.822 25.642 ( 3.977 0.000 -1.434) 4.227 25.692 ( 5.790 0.000 1.505) 5.983 25.968 ( 0.834 0.000 0.287) 0.882 26.042 ( 2.432 0.000 0.265) 2.447 28.321 ( -0.669 0.000 1.453) 1.600 28.347 ( -2.181 0.000 -0.184) 2.189 28.540 ( -0.770 0.000 2.772) 2.877 28.552 ( 0.944 0.000 -1.443) 1.724 28.614 ( 0.039 0.000 -0.711) 0.712 28.728 ( -0.392 0.000 2.092) 2.129 28.817 ( 1.853 0.000 -1.727) 2.532 28.929 ( 2.251 0.000 -4.076) 4.656 32.343 ( -2.140 0.000 0.502) 2.198 32.418 ( -0.687 0.000 -0.758) 1.023 32.431 ( 0.084 0.000 -0.812) 0.817 32.526 ( 1.676 0.000 -0.270) 1.698 35.364 ( -1.597 0.000 -0.382) 1.642 35.426 ( -1.456 0.000 0.649) 1.594 35.449 ( 1.361 0.000 0.928) 1.648 35.548 ( 1.033 0.000 -0.586) 1.188 88.827 ( -2.230 0.000 2.693) 3.496 89.006 ( -1.988 0.000 -2.387) 3.106 89.100 ( -1.217 0.000 17.673) 17.714 89.282 ( -4.183 0.000 -7.403) 8.503 97.671 ( -0.827 0.000 0.074) 0.830 97.675 ( -1.310 0.000 -0.601) 1.441 97.825 ( -4.061 0.000 -1.737) 4.417 97.864 ( 0.319 0.000 6.394) 6.402 98.689 ( -0.898 0.000 0.044) 0.899 98.697 ( 0.341 0.000 -0.118) 0.360 98.723 ( 0.515 0.000 -1.315) 1.412 98.803 ( 2.170 0.000 0.360) 2.199 99.605 ( -0.227 0.000 -0.556) 0.601 99.647 ( 2.127 0.000 -0.134) 2.131 99.953 ( 0.823 0.000 8.934) 8.972 100.338 ( 1.705 0.000 -12.197) 12.315 ======================= Grid point 70 (28/92) ======================= q-point: (-0.22 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.664 ( -18.981 0.000 -6.672) 20.119 0.795 ( -22.529 0.000 1.069) 22.555 1.418 ( -38.379 0.000 11.395) 40.035 1.709 ( 6.101 0.000 -2.673) 6.660 1.873 ( -2.595 0.000 -1.864) 3.195 1.962 ( 3.765 0.000 -4.125) 5.585 2.002 ( 0.336 0.000 -6.202) 6.211 2.157 ( 2.692 0.000 -3.332) 4.284 2.223 ( -2.723 0.000 8.409) 8.839 2.269 ( 1.369 0.000 4.943) 5.129 2.322 ( 1.822 0.000 -4.360) 4.725 2.517 ( 3.701 0.000 0.839) 3.795 2.591 ( 3.281 0.000 -2.627) 4.203 2.600 ( -0.751 0.000 3.484) 3.564 2.715 ( 4.667 0.000 0.421) 4.686 2.802 ( 1.294 0.000 -1.784) 2.204 2.825 ( 2.204 0.000 -3.631) 4.248 3.153 ( 4.207 0.000 3.931) 5.758 3.156 ( 0.706 0.000 1.152) 1.351 3.273 ( -0.079 0.000 1.894) 1.896 3.351 ( 1.375 0.000 -2.465) 2.822 3.441 ( 2.860 0.000 -0.543) 2.911 3.473 ( -2.403 0.000 0.824) 2.540 3.717 ( -3.130 0.000 0.988) 3.282 4.410 ( 3.062 0.000 0.892) 3.189 4.436 ( -6.028 0.000 1.833) 6.300 4.728 ( 2.489 0.000 -1.317) 2.816 4.809 ( 6.052 0.000 1.661) 6.276 4.881 ( 2.463 0.000 0.473) 2.508 4.908 ( -3.583 0.000 1.825) 4.021 5.065 ( 0.784 0.000 2.928) 3.031 5.156 ( 5.795 0.000 11.089) 12.512 5.344 ( -8.142 0.000 -3.579) 8.894 5.385 ( 7.047 0.000 -2.144) 7.366 5.473 ( 0.583 0.000 -2.638) 2.702 5.493 ( 3.629 0.000 -5.933) 6.955 5.604 ( 4.370 0.000 2.749) 5.163 5.729 ( 0.414 0.000 -3.003) 3.031 5.767 ( 5.093 0.000 4.464) 6.773 5.871 ( 6.947 0.000 -1.187) 7.048 5.874 ( 9.064 0.000 0.829) 9.102 6.007 ( -4.250 0.000 0.743) 4.315 6.037 ( -1.483 0.000 -1.435) 2.064 6.078 ( -3.291 0.000 0.272) 3.302 6.335 ( -2.725 0.000 1.306) 3.022 6.450 ( -0.968 0.000 2.980) 3.133 6.653 ( -2.461 0.000 -3.744) 4.481 6.949 ( 4.516 0.000 -2.479) 5.151 7.059 ( 7.613 0.000 4.852) 9.028 7.172 ( 2.647 0.000 -1.793) 3.197 7.188 ( 0.603 0.000 -7.703) 7.726 7.286 ( 0.043 0.000 5.558) 5.558 7.375 ( 0.354 0.000 -6.248) 6.258 7.689 ( 18.406 0.000 -1.265) 18.449 7.962 ( 8.334 0.000 20.081) 21.741 8.035 ( 2.309 0.000 -0.928) 2.488 8.185 ( 7.031 0.000 0.449) 7.045 8.525 ( 9.874 0.000 -6.255) 11.689 8.732 ( -1.108 0.000 -0.358) 1.164 8.761 ( -0.539 0.000 2.764) 2.816 8.813 ( -4.522 0.000 -2.201) 5.030 8.945 ( -1.707 0.000 -6.045) 6.282 9.161 ( -2.092 0.000 3.906) 4.431 9.357 ( -13.565 0.000 -2.370) 13.771 9.375 ( 3.347 0.000 -8.279) 8.930 9.580 ( -8.323 0.000 4.779) 9.598 9.725 ( -2.685 0.000 -6.359) 6.903 9.989 ( -5.261 0.000 0.397) 5.276 10.342 ( -5.187 0.000 7.408) 9.043 10.446 ( -4.626 0.000 -3.407) 5.745 10.910 ( 0.780 0.000 13.330) 13.353 11.041 ( -3.322 0.000 -5.939) 6.805 20.485 ( -0.278 0.000 0.699) 0.752 20.498 ( -0.764 0.000 -1.392) 1.588 20.821 ( 0.804 0.000 1.194) 1.439 20.898 ( 1.488 0.000 -0.786) 1.682 22.769 ( -1.543 0.000 -2.287) 2.759 22.865 ( 0.991 0.000 2.957) 3.119 23.067 ( -1.080 0.000 -2.849) 3.047 23.125 ( 0.188 0.000 2.169) 2.177 24.652 ( 0.299 0.000 2.671) 2.688 24.708 ( -0.294 0.000 -1.772) 1.796 24.851 ( -0.648 0.000 1.669) 1.790 24.890 ( 0.056 0.000 -1.379) 1.381 25.711 ( 5.729 0.000 -1.079) 5.830 25.804 ( 5.460 0.000 1.206) 5.591 25.987 ( 0.650 0.000 0.646) 0.917 26.106 ( 3.574 0.000 3.487) 4.994 28.312 ( -1.950 0.000 0.377) 1.987 28.324 ( -0.956 0.000 1.846) 2.079 28.556 ( -0.989 0.000 2.917) 3.080 28.559 ( 1.716 0.000 -1.508) 2.284 28.608 ( 0.142 0.000 -0.544) 0.563 28.733 ( -1.549 0.000 2.015) 2.542 28.832 ( 2.038 0.000 -1.869) 2.765 28.911 ( 1.940 0.000 -7.169) 7.427 32.317 ( -1.973 0.000 1.183) 2.301 32.392 ( -1.111 0.000 -0.966) 1.472 32.425 ( 0.182 0.000 -0.778) 0.799 32.547 ( 1.200 0.000 -0.405) 1.266 35.339 ( -1.148 0.000 0.040) 1.149 35.409 ( -1.362 0.000 0.852) 1.606 35.486 ( 1.405 0.000 1.843) 2.317 35.556 ( 0.786 0.000 -0.895) 1.191 88.813 ( -2.642 0.000 2.411) 3.577 88.951 ( -1.897 0.000 -1.486) 2.410 89.145 ( -2.578 0.000 -7.051) 7.508 89.346 ( 2.703 0.000 28.800) 28.926 97.647 ( -1.294 0.000 -0.489) 1.383 97.656 ( -1.015 0.000 0.198) 1.034 97.744 ( -3.333 0.000 -1.433) 3.628 97.954 ( 1.175 0.000 8.795) 8.873 98.676 ( -0.723 0.000 0.107) 0.731 98.702 ( 0.404 0.000 -0.112) 0.420 98.711 ( 0.170 0.000 -2.337) 2.343 98.841 ( 1.862 0.000 0.128) 1.867 99.599 ( 0.057 0.000 -0.189) 0.197 99.683 ( 2.440 0.000 -0.496) 2.490 100.040 ( -1.012 0.000 7.346) 7.415 100.182 ( -0.364 0.000 -22.186) 22.189 ======================= Grid point 71 (29/92) ======================= q-point: (-0.11 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.403 ( -13.468 0.000 16.757) 21.498 0.456 ( -21.590 0.000 8.279) 23.123 0.938 ( -38.596 0.000 24.589) 45.763 1.771 ( 1.701 0.000 -4.939) 5.223 1.834 ( 1.094 0.000 1.172) 1.604 1.921 ( 1.011 0.000 -11.363) 11.408 1.984 ( 2.417 0.000 3.244) 4.046 2.143 ( 0.374 0.000 -1.551) 1.595 2.293 ( 0.801 0.000 -5.611) 5.668 2.302 ( -0.533 0.000 9.260) 9.275 2.408 ( 5.690 0.000 6.913) 8.954 2.587 ( 1.710 0.000 3.993) 4.344 2.593 ( -4.631 0.000 4.263) 6.295 2.601 ( 1.547 0.000 -2.192) 2.684 2.767 ( 0.758 0.000 0.863) 1.149 2.820 ( 2.269 0.000 -3.952) 4.557 2.858 ( 5.056 0.000 -0.322) 5.067 3.185 ( 0.808 0.000 1.231) 1.472 3.235 ( 1.909 0.000 0.318) 1.936 3.289 ( 1.021 0.000 0.109) 1.027 3.316 ( 0.556 0.000 -6.908) 6.930 3.406 ( -3.592 0.000 -3.764) 5.203 3.452 ( 0.844 0.000 -2.550) 2.687 3.651 ( -3.823 0.000 -2.632) 4.642 4.370 ( -3.941 0.000 1.682) 4.285 4.464 ( 2.642 0.000 -1.962) 3.291 4.736 ( -1.107 0.000 -1.080) 1.546 4.847 ( -5.053 0.000 1.269) 5.210 4.884 ( 0.663 0.000 1.485) 1.626 4.968 ( 5.686 0.000 0.906) 5.758 5.106 ( 1.506 0.000 1.242) 1.952 5.196 ( -2.142 0.000 -2.034) 2.954 5.326 ( -2.549 0.000 -1.429) 2.922 5.445 ( 4.297 0.000 -4.798) 6.441 5.474 ( 2.946 0.000 2.741) 4.024 5.500 ( 4.526 0.000 -4.981) 6.730 5.701 ( 3.437 0.000 2.802) 4.435 5.804 ( -5.111 0.000 -3.217) 6.039 5.823 ( 6.341 0.000 5.646) 8.491 5.895 ( 1.441 0.000 2.018) 2.480 5.961 ( -4.247 0.000 2.491) 4.924 5.981 ( 4.553 0.000 5.163) 6.884 6.076 ( 6.176 0.000 8.306) 10.350 6.137 ( 9.470 0.000 -2.450) 9.782 6.297 ( -2.732 0.000 0.048) 2.732 6.463 ( 0.503 0.000 0.466) 0.685 6.538 ( -3.677 0.000 -4.918) 6.141 6.959 ( 3.924 0.000 -7.470) 8.438 7.144 ( 2.473 0.000 -4.691) 5.302 7.146 ( -0.680 0.000 -6.521) 6.556 7.192 ( 1.361 0.000 -0.730) 1.545 7.311 ( 1.968 0.000 -3.944) 4.408 7.408 ( 1.118 0.000 11.485) 11.539 7.967 ( 10.535 0.000 4.087) 11.300 8.062 ( 1.691 0.000 -0.199) 1.703 8.243 ( 7.858 0.000 9.346) 12.210 8.321 ( 0.710 0.000 4.362) 4.420 8.674 ( 4.459 0.000 6.717) 8.062 8.704 ( 1.479 0.000 -3.123) 3.456 8.742 ( 2.267 0.000 -2.258) 3.200 8.777 ( -2.111 0.000 3.779) 4.329 8.882 ( 0.173 0.000 -2.121) 2.128 9.106 ( -6.179 0.000 -0.838) 6.236 9.205 ( -2.618 0.000 1.126) 2.850 9.339 ( 6.260 0.000 -8.497) 10.554 9.489 ( -9.725 0.000 6.296) 11.585 9.612 ( -0.314 0.000 -7.679) 7.686 9.912 ( -2.456 0.000 -1.392) 2.823 10.333 ( -6.166 0.000 7.722) 9.882 10.336 ( -3.300 0.000 -2.988) 4.452 10.953 ( -0.841 0.000 -3.461) 3.562 11.027 ( -3.321 0.000 1.383) 3.597 20.480 ( 0.228 0.000 -0.304) 0.380 20.484 ( -0.364 0.000 0.242) 0.438 20.842 ( 0.246 0.000 1.039) 1.068 20.913 ( 1.127 0.000 -0.682) 1.317 22.739 ( -0.143 0.000 -0.805) 0.817 22.890 ( -0.597 0.000 0.912) 1.090 23.036 ( 0.188 0.000 -1.503) 1.515 23.136 ( -0.729 0.000 0.605) 0.947 24.696 ( 0.294 0.000 -0.305) 0.424 24.732 ( 4.357 0.000 8.120) 9.215 24.852 ( -0.941 0.000 1.053) 1.412 24.885 ( 0.605 0.000 -0.614) 0.861 25.796 ( 4.916 0.000 -0.305) 4.926 25.880 ( 2.725 0.000 -0.054) 2.725 26.002 ( -0.197 0.000 1.676) 1.688 26.280 ( 10.174 0.000 7.505) 12.643 28.295 ( -1.185 0.000 1.338) 1.787 28.370 ( 4.987 0.000 6.368) 8.088 28.572 ( -0.963 0.000 3.643) 3.768 28.575 ( 2.219 0.000 -1.601) 2.736 28.607 ( 0.198 0.000 -0.226) 0.301 28.721 ( -2.517 0.000 1.941) 3.179 28.784 ( -7.315 0.000 -11.968) 14.027 28.843 ( 1.926 0.000 -2.195) 2.920 32.300 ( -1.627 0.000 0.984) 1.901 32.399 ( 2.225 0.000 4.728) 5.226 32.419 ( 0.298 0.000 -1.028) 1.070 32.558 ( 0.697 0.000 -0.487) 0.850 35.329 ( -0.536 0.000 0.838) 0.995 35.402 ( -0.938 0.000 1.403) 1.688 35.543 ( 2.528 0.000 1.164) 2.783 35.557 ( 1.053 0.000 -0.425) 1.135 88.793 ( -2.390 0.000 1.707) 2.937 88.911 ( -1.097 0.000 -1.715) 2.035 89.069 ( 1.215 0.000 -3.976) 4.158 89.733 ( 4.966 0.000 3.962) 6.353 97.625 ( -0.628 0.000 -0.508) 0.807 97.643 ( -0.742 0.000 0.142) 0.756 97.692 ( -1.514 0.000 -0.621) 1.636 98.009 ( -6.102 0.000 -10.289) 11.963 98.674 ( -0.088 0.000 1.389) 1.391 98.693 ( 1.756 0.000 2.902) 3.392 98.708 ( 0.361 0.000 0.041) 0.363 98.862 ( 0.902 0.000 -0.578) 1.072 99.603 ( 0.247 0.000 0.558) 0.611 99.712 ( 1.934 0.000 -1.038) 2.195 99.817 ( -9.900 0.000 -16.600) 19.328 100.067 ( -3.388 0.000 4.462) 5.603 ======================= Grid point 72 (30/92) ======================= q-point: ( 0.00 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.666 ( -8.988 17.477 13.047) 23.589 0.724 ( 2.790 18.199 14.168) 23.232 1.119 ( -2.458 18.014 27.929) 33.326 1.692 ( 2.293 0.207 -7.510) 7.855 1.808 ( 0.131 2.497 -13.976) 14.198 1.953 ( 1.074 0.810 5.986) 6.135 2.054 ( 2.203 -0.914 2.332) 3.336 2.183 ( 1.508 -3.805 4.043) 5.753 2.235 ( -0.020 -0.962 -1.523) 1.802 2.317 ( -2.435 -1.572 5.753) 6.442 2.430 ( 2.729 -4.459 4.856) 7.135 2.558 ( -3.841 -1.509 2.749) 4.959 2.603 ( -0.969 -2.042 3.981) 4.578 2.687 ( -2.405 0.857 1.822) 3.137 2.779 ( 3.102 5.088 2.511) 6.466 2.886 ( 1.749 -2.293 2.621) 3.897 2.985 ( 2.602 6.354 -3.661) 7.781 3.155 ( -3.126 -2.216 -1.897) 4.275 3.193 ( -0.167 -1.965 -6.205) 6.511 3.232 ( 3.135 -0.161 -1.692) 3.566 3.268 ( 0.313 -2.146 -4.391) 4.897 3.338 ( -2.793 3.249 -6.147) 7.493 3.464 ( 0.251 3.127 -3.995) 5.080 3.539 ( -2.732 -0.602 -5.200) 5.904 4.418 ( 2.104 -3.582 -1.557) 4.436 4.511 ( 2.228 6.763 -11.128) 13.211 4.612 ( -5.439 -4.921 4.076) 8.392 4.802 ( 1.226 -3.161 -0.165) 3.394 4.891 ( -0.946 0.994 2.728) 3.054 5.021 ( -1.277 1.935 -1.222) 2.621 5.135 ( 0.885 -2.689 -0.208) 2.839 5.219 ( -4.456 2.660 5.646) 7.669 5.280 ( 0.083 0.411 5.435) 5.451 5.380 ( -1.144 -1.710 -7.775) 8.043 5.496 ( 1.061 -2.443 2.385) 3.575 5.540 ( 2.207 -1.061 -0.807) 2.578 5.617 ( 4.223 -8.099 1.628) 9.277 5.677 ( -0.214 -1.514 -1.870) 2.416 5.739 ( -1.985 -5.236 1.452) 5.784 5.911 ( -1.541 -0.210 0.165) 1.564 6.045 ( 0.995 5.392 -0.666) 5.524 6.098 ( -0.486 6.443 -1.854) 6.722 6.190 ( 2.698 -1.755 -2.032) 3.806 6.249 ( -3.269 -0.738 -2.329) 4.082 6.359 ( -4.220 2.849 1.063) 5.202 6.446 ( -0.157 2.781 0.379) 2.811 6.552 ( 6.164 -0.312 2.294) 6.584 6.940 ( 0.465 0.571 -8.441) 8.473 7.048 ( 0.603 -1.243 2.372) 2.745 7.122 ( -1.086 2.854 -0.606) 3.113 7.164 ( 3.246 1.446 -1.577) 3.888 7.315 ( -3.648 3.304 -3.203) 5.873 7.660 ( 5.337 1.480 12.607) 13.770 7.955 ( -2.361 -1.008 8.208) 8.600 8.064 ( -0.945 -3.197 2.798) 4.352 8.216 ( -12.095 1.209 2.695) 12.450 8.484 ( 8.006 -1.997 4.121) 9.223 8.632 ( -1.342 -2.275 -2.324) 3.518 8.677 ( 3.115 -3.931 1.145) 5.144 8.738 ( -7.078 0.787 0.776) 7.164 8.781 ( 0.749 -1.555 3.819) 4.191 8.952 ( 3.786 1.260 0.859) 4.081 9.089 ( -1.625 2.368 0.531) 2.921 9.211 ( -0.710 2.198 0.210) 2.320 9.379 ( -1.033 -1.302 3.406) 3.790 9.470 ( 1.831 -5.934 -8.699) 10.688 9.623 ( 1.127 3.515 -7.452) 8.316 9.920 ( -0.282 -2.997 -2.097) 3.669 10.233 ( 1.164 2.389 -0.234) 2.668 10.328 ( 4.077 0.685 -1.110) 4.280 10.658 ( -9.531 -3.093 5.150) 11.266 10.904 ( 3.151 -4.139 -1.382) 5.382 20.499 ( 0.421 1.923 -0.209) 1.979 20.643 ( 0.144 5.341 -8.259) 9.837 20.866 ( -0.638 1.745 0.427) 1.907 20.935 ( 0.483 1.042 -0.551) 1.274 22.762 ( 1.968 0.746 0.986) 2.324 22.859 ( -1.562 -0.623 -0.964) 1.938 23.055 ( 1.341 0.865 0.193) 1.607 23.115 ( -1.373 -0.089 -0.963) 1.680 24.688 ( 0.670 -1.849 0.830) 2.135 24.718 ( -0.745 -4.946 2.048) 5.405 24.871 ( -0.402 1.485 1.244) 1.979 24.922 ( 0.304 0.428 1.255) 1.360 25.851 ( 0.858 0.239 0.208) 0.914 25.889 ( 0.045 -0.189 -0.750) 0.775 26.091 ( 0.177 3.552 -0.399) 3.579 26.301 ( -5.009 -1.009 -3.009) 5.930 28.297 ( -0.588 -0.207 2.068) 2.160 28.421 ( -4.182 -4.273 2.875) 6.634 28.542 ( -0.604 0.321 -0.198) 0.712 28.596 ( 0.285 -0.536 1.598) 1.710 28.624 ( 1.483 1.025 -0.749) 1.953 28.657 ( 6.888 -3.096 3.308) 8.244 28.686 ( -1.619 -0.811 1.075) 2.106 28.832 ( 1.378 -1.447 -2.160) 2.943 32.301 ( -0.465 0.695 1.202) 1.464 32.407 ( 0.806 -1.214 0.284) 1.485 32.453 ( 0.454 -1.012 2.090) 2.366 32.562 ( 0.107 -0.633 -1.083) 1.259 35.347 ( -0.048 0.762 1.609) 1.781 35.450 ( 0.527 1.806 -0.508) 1.949 35.515 ( -1.206 -0.772 -1.551) 2.111 35.570 ( -0.643 0.235 -1.098) 1.294 88.750 ( -3.718 -1.368 1.390) 4.199 88.863 ( -9.928 -4.663 4.312) 11.786 88.909 ( -7.668 -1.454 2.559) 8.214 89.098 ( 3.165 -1.985 -0.388) 3.756 97.618 ( -0.096 0.123 -0.534) 0.556 97.629 ( 0.124 0.100 -0.609) 0.630 97.660 ( -2.889 -0.161 0.585) 2.952 97.679 ( 0.648 -0.416 0.078) 0.775 98.677 ( -0.657 0.386 0.614) 0.979 98.692 ( 0.669 -0.265 0.760) 1.046 98.903 ( -0.568 4.113 -1.382) 4.376 99.070 ( -2.894 11.466 -13.077) 17.631 99.625 ( -0.123 1.349 0.990) 1.678 99.736 ( 0.238 1.160 -1.329) 1.780 99.957 ( 12.626 -5.649 4.553) 14.562 100.007 ( 0.918 -2.621 0.764) 2.880 ======================= Grid point 73 (31/92) ======================= q-point: ( 0.11 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.753 ( 3.814 9.753 15.523) 18.725 0.996 ( 10.822 14.312 13.090) 22.210 1.497 ( 10.477 11.640 18.375) 24.143 1.677 ( 5.672 2.352 -11.090) 12.676 1.677 ( 3.729 3.640 -9.579) 10.904 2.030 ( 0.249 1.800 4.329) 4.694 2.088 ( 0.280 -3.731 3.441) 5.083 2.176 ( -3.710 -2.212 2.042) 4.778 2.287 ( -0.363 -3.060 4.189) 5.200 2.378 ( 1.516 -3.113 9.410) 10.027 2.498 ( -2.321 -0.780 5.119) 5.674 2.538 ( -1.048 -2.095 4.299) 4.896 2.597 ( -2.456 0.280 -1.585) 2.936 2.663 ( -2.492 -3.520 4.231) 6.042 2.845 ( 0.493 5.525 2.245) 5.985 2.926 ( 0.450 -3.122 1.283) 3.405 2.968 ( -1.705 5.639 -3.928) 7.081 3.062 ( -1.855 -1.620 -5.700) 6.209 3.124 ( -0.190 0.086 -2.895) 2.902 3.188 ( -0.460 -1.144 -8.080) 8.173 3.226 ( 0.006 0.755 -6.697) 6.740 3.290 ( 0.427 1.619 0.568) 1.768 3.378 ( -1.342 2.292 -7.980) 8.410 3.489 ( 1.226 0.897 -3.328) 3.658 4.398 ( -0.908 -0.437 -1.502) 1.809 4.470 ( 2.296 1.263 -3.766) 4.588 4.608 ( -2.361 -4.373 5.921) 7.730 4.781 ( -3.559 -4.244 -0.568) 5.568 4.895 ( -1.748 2.593 1.101) 3.315 4.965 ( -2.819 1.180 -0.667) 3.128 5.121 ( -8.396 -0.530 4.836) 9.704 5.179 ( -2.097 -1.618 2.600) 3.712 5.290 ( -0.131 -2.474 -5.459) 5.995 5.360 ( 1.498 0.298 3.244) 3.585 5.451 ( -4.782 -0.868 -3.360) 5.909 5.582 ( 1.579 -1.173 4.196) 4.634 5.675 ( -1.425 1.049 -0.522) 1.845 5.720 ( 4.635 -7.625 -0.114) 8.924 5.749 ( 2.675 -3.723 0.894) 4.671 5.861 ( -2.206 -1.691 -2.450) 3.705 6.012 ( -2.199 2.913 -1.368) 3.898 6.107 ( -1.059 5.236 0.934) 5.423 6.140 ( -0.822 -0.556 -0.097) 0.997 6.166 ( -4.871 1.918 -2.200) 5.679 6.302 ( -3.801 5.489 1.193) 6.782 6.380 ( -3.011 1.098 -3.501) 4.746 6.678 ( 4.192 3.616 -1.290) 5.684 6.787 ( -4.149 2.777 -9.394) 10.638 7.033 ( -5.813 -0.897 -0.506) 5.904 7.116 ( -1.694 0.769 2.472) 3.094 7.189 ( 1.963 2.194 -2.604) 3.930 7.310 ( 4.957 -1.081 -0.111) 5.075 7.750 ( -14.362 -0.412 -0.637) 14.382 7.888 ( -0.103 0.172 9.855) 9.857 8.086 ( -2.446 -0.774 5.650) 6.205 8.112 ( -9.633 -0.138 8.368) 12.761 8.525 ( -8.093 -5.096 4.537) 10.585 8.562 ( -3.078 -1.669 -4.323) 5.563 8.632 ( -1.747 -0.988 -3.564) 4.090 8.774 ( -1.288 1.445 6.262) 6.555 8.860 ( 4.835 1.910 3.907) 6.503 9.043 ( 6.278 1.911 -1.180) 6.668 9.089 ( 2.987 0.259 -1.536) 3.369 9.254 ( 6.513 0.256 0.333) 6.527 9.365 ( -3.335 -2.844 0.300) 4.393 9.444 ( 5.470 -0.263 -1.669) 5.725 9.612 ( 5.541 1.163 -9.040) 10.667 9.879 ( 0.046 -1.987 -2.092) 2.885 10.287 ( 4.317 2.212 -0.201) 4.855 10.432 ( 7.407 -1.140 0.368) 7.503 10.606 ( -3.019 -1.324 3.122) 4.540 10.982 ( 7.115 -5.100 -0.249) 8.757 20.507 ( 0.542 1.982 -0.048) 2.055 20.557 ( -1.737 4.165 -3.604) 5.775 20.854 ( -1.642 1.372 0.822) 2.292 20.927 ( -0.542 0.802 -0.524) 1.101 22.806 ( -1.869 0.249 -1.689) 2.531 22.822 ( 2.293 0.352 1.568) 2.800 23.069 ( -1.495 -0.064 -1.417) 2.061 23.100 ( 2.425 0.159 0.807) 2.560 24.695 ( -2.790 -3.282 0.325) 4.319 24.709 ( 0.219 -3.077 1.327) 3.358 24.882 ( -0.156 1.858 1.411) 2.338 24.934 ( 0.387 1.139 0.488) 1.298 25.830 ( -3.921 -0.089 0.157) 3.926 25.856 ( -2.786 0.335 -0.404) 2.835 26.083 ( -1.884 2.302 1.487) 3.326 26.177 ( -5.920 1.267 -0.629) 6.087 28.316 ( -0.125 -0.349 2.229) 2.260 28.361 ( -4.257 -0.577 1.868) 4.685 28.534 ( -0.433 0.125 -0.377) 0.588 28.610 ( -0.214 -0.431 1.056) 1.160 28.632 ( -0.683 0.810 0.184) 1.076 28.662 ( 0.419 -0.377 -0.395) 0.688 28.816 ( 5.323 -5.186 -1.199) 7.528 28.834 ( 2.781 -2.375 -1.444) 3.932 32.314 ( 0.234 0.615 1.355) 1.506 32.414 ( 1.083 0.174 -1.089) 1.546 32.472 ( -1.025 -1.586 2.104) 2.827 32.546 ( -0.428 -0.538 -1.199) 1.382 35.369 ( 0.213 0.586 2.152) 2.241 35.447 ( -1.056 0.756 0.630) 1.443 35.477 ( -0.989 0.848 -1.136) 1.729 35.548 ( -0.193 0.116 -1.409) 1.427 88.705 ( -2.144 0.219 2.797) 3.531 88.788 ( -3.176 -0.892 3.244) 4.627 88.914 ( 3.521 1.070 -1.239) 3.883 89.209 ( 7.367 -3.151 2.696) 8.454 97.618 ( 1.276 -0.057 -0.809) 1.512 97.642 ( 1.812 0.434 -0.663) 1.978 97.655 ( 0.656 -0.465 0.380) 0.889 97.716 ( 3.197 -0.733 0.548) 3.325 98.675 ( -0.421 0.193 0.676) 0.820 98.713 ( 0.752 -0.449 0.706) 1.125 98.863 ( -2.209 4.716 -1.179) 5.339 98.936 ( -2.819 7.519 -3.905) 8.930 99.640 ( 0.020 1.593 1.424) 2.136 99.720 ( -0.533 0.633 -1.288) 1.530 99.889 ( -5.857 -1.219 -2.399) 6.446 100.238 ( 11.185 -8.528 -1.177) 14.114 ======================= Grid point 74 (32/92) ======================= q-point: ( 0.22 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.063 ( 13.137 2.478 12.364) 18.210 1.315 ( 12.459 10.328 8.622) 18.337 1.599 ( 8.930 6.081 -12.870) 16.804 1.675 ( 7.887 3.874 -10.665) 13.819 1.821 ( 3.036 3.902 6.244) 7.964 2.053 ( 0.456 1.799 0.702) 1.984 2.145 ( -3.451 -3.099 5.759) 7.394 2.191 ( 2.582 -1.449 6.840) 7.453 2.323 ( 0.124 -2.367 4.937) 5.477 2.442 ( -3.903 0.951 2.051) 4.511 2.490 ( -2.103 -5.875 1.936) 6.534 2.533 ( -2.267 -0.255 3.353) 4.055 2.622 ( -0.165 1.606 5.910) 6.127 2.666 ( -1.442 -1.519 2.899) 3.576 2.835 ( -1.279 5.089 -1.510) 5.460 2.863 ( -1.936 1.827 -4.744) 5.440 2.933 ( 0.451 -2.123 -1.262) 2.511 2.995 ( 0.325 -3.770 -4.622) 5.974 3.079 ( -1.842 -2.430 -1.251) 3.296 3.131 ( -3.399 0.356 -0.344) 3.435 3.194 ( 0.150 5.328 -0.892) 5.404 3.256 ( -0.849 0.153 -3.467) 3.573 3.311 ( 1.016 2.452 -3.554) 4.435 3.488 ( 3.392 1.420 -3.987) 5.424 4.395 ( 0.687 -2.206 0.829) 2.454 4.469 ( -0.298 -0.689 -0.017) 0.751 4.635 ( -1.522 -3.017 4.488) 5.618 4.688 ( -5.718 -3.028 -1.069) 6.558 4.854 ( -2.923 0.090 -0.272) 2.937 4.934 ( -1.590 1.298 0.837) 2.217 5.024 ( -5.830 0.420 1.891) 6.144 5.169 ( -2.509 -1.915 0.713) 3.236 5.250 ( 1.632 -2.822 -4.674) 5.699 5.310 ( -5.134 1.862 -0.398) 5.476 5.427 ( -0.005 -3.829 1.778) 4.222 5.598 ( -3.728 -1.811 -0.084) 4.146 5.628 ( -3.143 -0.768 1.041) 3.398 5.708 ( -4.078 0.016 -5.120) 6.546 5.759 ( -0.456 -3.970 -0.918) 4.100 5.847 ( -0.310 -2.168 1.539) 2.677 5.979 ( -8.612 1.884 3.398) 9.448 6.062 ( -2.694 -0.210 4.815) 5.521 6.084 ( 1.558 0.283 -1.360) 2.088 6.216 ( 4.548 4.805 1.554) 6.796 6.229 ( -4.580 5.474 0.756) 7.177 6.294 ( -1.870 -1.906 -4.808) 5.500 6.581 ( -4.296 0.747 -7.695) 8.844 6.735 ( -0.277 8.670 -1.736) 8.847 6.884 ( -7.578 -4.629 -0.794) 8.915 7.127 ( -1.610 -2.078 0.452) 2.668 7.213 ( 3.597 2.484 -2.033) 4.821 7.329 ( -1.541 4.519 -4.190) 6.352 7.530 ( -6.606 2.215 1.823) 7.202 7.950 ( -8.158 -1.666 9.372) 12.536 8.029 ( -11.313 0.224 8.992) 14.453 8.101 ( -1.271 -3.053 3.370) 4.722 8.409 ( -10.784 -0.334 3.976) 11.498 8.440 ( -1.174 0.746 -7.941) 8.062 8.592 ( 0.312 -1.894 -2.259) 2.965 8.802 ( -0.693 -0.264 3.452) 3.531 8.928 ( -1.224 3.932 1.172) 4.282 9.121 ( 4.339 5.158 3.922) 7.798 9.151 ( 3.627 -5.319 -2.812) 7.025 9.300 ( 2.289 1.682 -3.150) 4.241 9.482 ( 12.246 2.183 1.050) 12.484 9.529 ( 8.876 -0.312 -6.056) 10.750 9.621 ( 4.786 1.665 -1.660) 5.332 9.896 ( 4.457 -2.712 -2.819) 5.930 10.359 ( 2.242 -0.191 3.591) 4.237 10.537 ( 3.560 -1.584 0.479) 3.926 10.597 ( -0.652 -1.997 0.980) 2.318 11.117 ( 8.335 -6.822 0.094) 10.771 20.497 ( -0.927 2.945 -1.055) 3.263 20.531 ( 0.737 1.146 -0.262) 1.388 20.831 ( -2.226 1.263 0.916) 2.718 20.909 ( -0.901 0.445 -0.563) 1.152 22.746 ( -2.087 0.830 -2.034) 3.030 22.884 ( 2.184 -0.840 1.553) 2.809 23.030 ( -1.057 0.688 -1.129) 1.692 23.159 ( 2.913 -0.604 1.167) 3.196 24.646 ( -3.120 -2.047 0.207) 3.737 24.718 ( -0.714 -4.275 0.811) 4.409 24.896 ( 0.370 3.026 1.106) 3.243 24.949 ( 0.895 1.519 0.011) 1.763 25.741 ( -5.769 0.287 -0.645) 5.812 25.794 ( -4.699 0.802 0.497) 4.793 26.057 ( -3.683 0.855 2.279) 4.415 26.092 ( -3.927 0.523 -0.531) 3.997 28.325 ( -2.034 0.142 1.041) 2.289 28.339 ( 0.535 -0.296 1.506) 1.626 28.522 ( -0.624 0.238 -0.030) 0.669 28.611 ( -0.789 -1.406 0.335) 1.646 28.616 ( -0.976 0.326 0.622) 1.203 28.676 ( 1.222 1.293 -0.465) 1.839 28.819 ( 0.489 -2.063 -1.831) 2.802 28.892 ( 3.318 -3.780 -1.734) 5.320 32.335 ( 0.644 0.328 1.148) 1.356 32.426 ( 1.610 0.606 -0.921) 1.951 32.466 ( -1.663 -1.032 1.204) 2.298 32.526 ( -0.435 -0.095 -1.178) 1.259 35.397 ( 0.150 0.341 2.181) 2.212 35.428 ( -0.916 -0.183 -0.528) 1.073 35.464 ( -0.718 1.404 0.588) 1.683 35.533 ( 0.264 -0.007 -1.406) 1.431 88.734 ( 1.819 -0.094 1.938) 2.659 88.785 ( -0.780 -0.899 1.984) 2.313 88.977 ( 5.050 1.346 -0.949) 5.311 89.368 ( 6.073 -4.690 4.621) 8.957 97.638 ( 2.023 -0.346 -0.736) 2.181 97.668 ( 2.004 0.139 -0.638) 2.107 97.675 ( 1.201 -0.419 0.300) 1.306 97.792 ( 4.324 -1.572 1.475) 4.832 98.676 ( -0.047 -0.059 0.335) 0.344 98.730 ( 0.489 -0.228 0.655) 0.849 98.816 ( -2.454 4.477 -0.134) 5.107 98.865 ( -2.569 4.615 -1.612) 5.523 99.650 ( -0.442 1.494 0.708) 1.711 99.691 ( -1.787 0.290 -0.437) 1.862 99.772 ( -3.253 1.036 -3.808) 5.114 100.353 ( 5.672 -6.926 -2.153) 9.208 ======================= Grid point 75 (33/92) ======================= q-point: ( 0.33 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.383 ( 10.967 1.918 7.449) 13.396 1.533 ( 11.447 6.268 -5.946) 14.341 1.675 ( 7.660 3.902 -3.411) 9.249 1.701 ( 7.787 5.196 -6.440) 11.362 1.868 ( 3.129 1.842 -0.254) 3.640 2.046 ( -0.738 2.728 -2.693) 3.904 2.158 ( -1.513 -2.553 5.137) 5.933 2.230 ( -2.340 0.535 -1.663) 2.920 2.300 ( -2.029 -4.286 -1.714) 5.042 2.433 ( -3.616 -0.565 -2.975) 4.717 2.501 ( 0.629 -1.060 3.004) 3.247 2.527 ( -1.250 -0.143 3.954) 4.149 2.579 ( -4.196 3.271 1.242) 5.464 2.697 ( -1.191 0.625 -0.678) 1.506 2.802 ( 1.735 -1.024 -5.044) 5.432 2.847 ( -2.037 3.351 3.989) 5.594 2.932 ( 0.164 -4.413 -0.949) 4.516 2.985 ( 2.764 -1.010 0.386) 2.968 3.037 ( -2.434 -0.343 -0.693) 2.554 3.105 ( -2.760 0.107 4.691) 5.443 3.148 ( -0.993 -1.681 2.471) 3.150 3.229 ( -3.248 2.425 0.102) 4.054 3.328 ( 1.301 4.782 1.840) 5.286 3.527 ( 6.447 0.338 -3.566) 7.375 4.417 ( -2.201 -1.519 3.532) 4.430 4.465 ( 0.779 -3.085 0.403) 3.208 4.592 ( -4.616 -2.806 -0.273) 5.409 4.644 ( -2.322 -2.579 3.141) 4.681 4.802 ( -3.311 -0.563 0.948) 3.489 4.938 ( 0.756 0.575 0.875) 1.292 4.980 ( 1.072 -1.279 -2.764) 3.228 5.106 ( -4.747 0.434 -0.179) 4.770 5.239 ( -0.142 1.769 -1.614) 2.398 5.253 ( -1.658 0.263 0.408) 1.728 5.412 ( -4.063 -7.968 -0.306) 8.949 5.522 ( -3.953 -3.051 -0.662) 5.037 5.552 ( -0.565 -3.304 -1.998) 3.903 5.596 ( -5.677 -1.195 0.609) 5.833 5.742 ( -2.137 2.148 1.564) 3.410 5.797 ( -10.310 0.469 1.627) 10.448 5.878 ( -3.485 -0.316 3.740) 5.122 5.971 ( -5.772 -0.070 -4.687) 7.435 6.129 ( 0.736 -1.459 2.003) 2.585 6.229 ( 1.746 -1.753 -4.210) 4.883 6.302 ( 3.134 6.110 2.653) 7.362 6.324 ( 5.571 -1.505 7.588) 9.533 6.456 ( -1.302 1.688 -5.161) 5.584 6.689 ( -3.058 6.303 0.038) 7.006 6.783 ( -5.982 -2.270 0.216) 6.402 7.024 ( -5.721 -2.504 -3.142) 6.991 7.255 ( 3.019 1.670 -0.538) 3.492 7.303 ( 1.761 5.518 -0.939) 5.868 7.520 ( 0.872 5.997 0.440) 6.076 7.840 ( -9.207 -1.287 0.140) 9.298 7.921 ( -13.113 2.828 8.565) 15.915 8.098 ( -1.409 -3.505 0.104) 3.779 8.245 ( -6.749 -0.703 -4.755) 8.286 8.429 ( 2.728 3.036 1.249) 4.269 8.587 ( 0.398 -0.987 -0.139) 1.074 8.782 ( -4.624 1.212 -0.608) 4.819 8.915 ( 0.329 0.017 0.569) 0.657 9.172 ( 3.400 -3.383 -2.445) 5.383 9.206 ( 1.445 8.077 0.573) 8.225 9.318 ( 3.424 3.462 -2.265) 5.371 9.611 ( 10.189 -0.842 -4.760) 11.277 9.670 ( 6.770 2.103 0.502) 7.107 9.736 ( 5.863 -1.412 3.634) 7.041 9.947 ( 5.335 -2.867 -3.377) 6.935 10.432 ( 1.158 -1.848 4.441) 4.947 10.538 ( -2.728 -1.540 0.455) 3.165 10.621 ( 1.403 -1.508 0.783) 2.204 11.231 ( 5.438 -7.773 -1.202) 9.562 20.478 ( -0.374 2.156 -0.267) 2.204 20.544 ( 0.882 0.627 -0.204) 1.102 20.804 ( -2.118 1.157 1.013) 2.617 20.888 ( -0.704 0.195 -0.627) 0.963 22.704 ( -1.077 0.985 -0.526) 1.551 22.917 ( 0.840 -2.272 0.153) 2.427 23.017 ( 0.012 1.733 -0.011) 1.733 23.209 ( 2.024 -1.135 0.090) 2.322 24.603 ( -2.378 -1.499 0.542) 2.863 24.706 ( -1.086 -4.846 0.211) 4.970 24.913 ( 0.425 3.878 0.308) 3.913 24.962 ( 1.035 1.607 -0.406) 1.954 25.645 ( -4.385 1.232 -0.740) 4.615 25.718 ( -4.937 0.839 0.670) 5.053 26.012 ( -4.010 0.154 1.573) 4.310 26.034 ( -2.310 -0.299 -0.591) 2.403 28.312 ( -0.774 0.422 0.789) 1.183 28.366 ( 1.123 -0.278 0.950) 1.497 28.515 ( -0.518 0.332 0.568) 0.837 28.592 ( -0.811 -1.387 -0.896) 1.840 28.615 ( -0.743 -0.301 1.117) 1.375 28.689 ( 0.710 2.158 -0.055) 2.273 28.805 ( 0.240 -2.230 -1.826) 2.893 28.912 ( 1.600 -2.486 -1.769) 3.445 32.358 ( 0.821 -0.102 0.713) 1.092 32.441 ( -0.743 -1.293 0.046) 1.492 32.453 ( 0.960 1.047 -0.276) 1.447 32.507 ( -0.536 0.770 -0.921) 1.314 35.404 ( -0.330 -0.065 -0.214) 0.398 35.428 ( 0.227 0.362 1.456) 1.517 35.455 ( -1.160 0.694 0.477) 1.433 35.527 ( 0.481 0.047 -1.048) 1.154 88.787 ( 0.929 -0.774 2.418) 2.703 88.803 ( 0.764 -1.134 2.163) 2.559 89.048 ( 4.547 1.568 -1.274) 4.976 89.477 ( 1.498 -5.290 3.206) 6.364 97.664 ( 1.864 -0.434 -0.677) 2.030 97.690 ( 1.334 -0.388 -0.291) 1.419 97.703 ( 1.312 0.099 0.752) 1.516 97.874 ( 2.887 -2.601 1.734) 4.255 98.682 ( 0.462 0.058 0.164) 0.494 98.741 ( 0.112 0.354 0.389) 0.537 98.779 ( -1.857 3.690 0.033) 4.131 98.813 ( -2.388 3.063 -0.538) 3.921 99.623 ( -1.907 -0.181 -0.891) 2.112 99.673 ( -0.169 -0.228 0.442) 0.525 99.722 ( -0.109 4.458 -0.831) 4.536 100.396 ( 3.063 -5.790 -3.072) 7.235 ======================= Grid point 76 (34/92) ======================= q-point: ( 0.44 0.17 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( 0.833 3.264 2.162) 4.002 1.628 ( 6.500 1.234 -10.611) 12.504 1.681 ( 4.489 3.741 -5.461) 7.998 1.744 ( 2.828 6.889 -5.793) 9.435 1.954 ( 0.629 0.735 -0.768) 1.236 2.026 ( 5.824 2.031 -1.022) 6.252 2.122 ( -0.917 0.693 -4.961) 5.093 2.232 ( 2.421 -1.871 2.720) 4.094 2.280 ( -1.251 -1.681 0.529) 2.161 2.329 ( -1.324 0.893 -2.076) 2.620 2.463 ( -7.140 2.298 -1.795) 7.712 2.491 ( -3.511 -0.548 -0.341) 3.570 2.576 ( 0.239 -1.481 -0.016) 1.500 2.641 ( -0.504 -1.048 -5.245) 5.372 2.739 ( -1.190 0.601 -7.527) 7.645 2.807 ( -3.277 -0.025 -0.180) 3.282 2.911 ( -3.552 -0.505 3.456) 4.982 3.041 ( 0.473 -1.532 0.355) 1.642 3.092 ( 2.527 -0.969 7.562) 8.032 3.119 ( 0.879 -0.036 3.307) 3.422 3.161 ( -4.507 1.913 2.661) 5.572 3.218 ( 1.525 -0.392 4.232) 4.515 3.378 ( 0.463 4.941 5.979) 7.770 3.614 ( 6.474 -0.485 -1.402) 6.642 4.391 ( -4.450 -0.784 3.874) 5.952 4.513 ( 2.634 -4.855 1.315) 5.678 4.531 ( -2.695 -2.426 0.442) 3.653 4.635 ( -1.870 -2.594 2.465) 4.038 4.767 ( -3.015 -0.251 1.694) 3.467 4.954 ( 1.433 0.089 0.141) 1.442 5.003 ( 5.132 -2.204 -4.054) 6.901 5.034 ( -3.539 0.590 0.769) 3.669 5.189 ( -3.631 3.973 0.745) 5.433 5.282 ( 3.073 -1.278 1.498) 3.650 5.344 ( -0.708 -5.212 -1.081) 5.370 5.492 ( -1.963 -6.448 1.023) 6.817 5.516 ( -3.278 -0.202 0.784) 3.377 5.576 ( -0.207 -6.604 0.308) 6.614 5.657 ( -2.467 0.330 -0.317) 2.509 5.729 ( -3.913 3.094 1.561) 5.227 5.798 ( -3.975 -2.176 -0.397) 4.549 5.931 ( 1.613 3.983 1.212) 4.465 6.165 ( 0.923 -4.081 2.714) 4.987 6.245 ( 3.143 -1.243 -1.882) 3.868 6.326 ( -3.559 -0.560 -3.620) 5.107 6.377 ( 1.298 6.303 4.231) 7.702 6.560 ( 6.303 -2.431 6.090) 9.095 6.654 ( -1.930 9.418 2.962) 10.060 6.685 ( -5.220 -4.453 0.950) 6.927 6.952 ( 0.412 -2.863 -1.898) 3.459 7.292 ( 1.869 -0.338 -0.620) 1.997 7.312 ( 0.781 4.434 -1.775) 4.840 7.523 ( -0.159 8.857 -2.674) 9.253 7.690 ( -5.591 -0.327 -4.515) 7.194 7.797 ( -8.724 6.798 3.839) 11.707 8.052 ( -2.370 -2.294 -3.761) 5.002 8.128 ( -0.323 0.135 -4.039) 4.054 8.514 ( 1.839 2.110 5.363) 6.050 8.591 ( 0.445 -0.250 -0.781) 0.933 8.694 ( -1.303 2.522 -2.895) 4.055 8.933 ( 0.029 -1.760 1.074) 2.062 9.193 ( 0.033 7.084 -1.776) 7.303 9.220 ( 3.565 -2.580 -2.169) 4.906 9.342 ( 0.783 4.353 -0.702) 4.479 9.721 ( 4.419 0.747 -0.411) 4.500 9.747 ( 2.613 -1.335 0.814) 3.045 9.834 ( 1.979 -1.793 1.814) 3.228 9.994 ( 4.101 -2.958 -2.906) 5.832 10.460 ( -2.213 -0.953 -0.894) 2.570 10.512 ( -1.302 -3.207 4.606) 5.762 10.648 ( 0.094 -0.218 2.223) 2.236 11.261 ( 1.591 -7.430 -3.942) 8.560 20.478 ( 0.138 1.805 0.500) 1.878 20.553 ( 0.513 0.298 -0.519) 0.788 20.786 ( -1.298 1.096 1.122) 2.036 20.875 ( -0.049 0.057 -0.719) 0.723 22.703 ( 0.332 1.038 1.513) 1.864 22.925 ( 0.174 -2.197 -0.208) 2.213 23.018 ( 0.033 1.476 -0.032) 1.477 23.220 ( 0.211 -1.461 -1.720) 2.266 24.582 ( -1.181 -1.395 0.967) 2.068 24.693 ( -0.527 -4.955 -0.145) 4.985 24.913 ( -0.093 4.437 -0.626) 4.482 24.971 ( 0.512 1.554 -0.721) 1.788 25.595 ( -0.871 1.842 -0.015) 2.037 25.654 ( -2.890 0.984 0.067) 3.054 25.971 ( -2.078 -0.082 0.693) 2.192 26.004 ( -0.604 -0.611 -0.396) 0.945 28.313 ( -0.321 0.518 0.994) 1.166 28.388 ( 0.197 -0.276 0.568) 0.662 28.518 ( -0.358 0.414 1.189) 1.309 28.570 ( -0.339 -0.872 -1.237) 1.551 28.614 ( -0.601 -0.792 0.752) 1.246 28.700 ( 0.438 2.059 0.431) 2.148 28.793 ( 0.721 -2.120 -1.770) 2.854 28.913 ( 0.971 -2.034 -1.941) 2.974 32.374 ( 0.339 -0.319 0.288) 0.548 32.418 ( -1.090 -1.427 -0.196) 1.806 32.476 ( 1.147 1.034 -0.156) 1.552 32.490 ( -0.050 1.408 -0.712) 1.578 35.401 ( 0.116 -0.075 0.010) 0.138 35.435 ( -1.250 0.660 -0.167) 1.423 35.445 ( -0.110 0.296 1.331) 1.368 35.527 ( 0.713 -0.040 -0.774) 1.053 88.809 ( -0.590 -0.865 2.212) 2.448 88.857 ( 0.726 -2.190 4.424) 4.990 89.091 ( 2.359 1.881 -1.588) 3.410 89.480 ( -2.408 -4.423 -0.987) 5.132 97.679 ( 0.745 -0.249 -0.575) 0.974 97.705 ( 0.606 -0.055 -0.259) 0.661 97.736 ( 1.040 -0.594 1.995) 2.327 97.908 ( -0.253 -2.863 0.395) 2.901 98.693 ( 0.402 0.412 0.198) 0.609 98.738 ( -0.817 1.811 0.029) 1.987 98.766 ( 0.630 2.008 -0.020) 2.104 98.776 ( -1.613 2.260 -0.009) 2.776 99.601 ( -0.085 -0.333 -0.061) 0.350 99.671 ( -0.455 1.190 -0.359) 1.323 99.748 ( 1.443 3.120 3.738) 5.079 100.393 ( 1.643 -5.362 -4.726) 7.333 ======================= Grid point 77 (35/92) ======================= q-point: (-0.44 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.412 ( -12.665 1.786 -4.396) 13.525 1.491 ( -9.736 3.566 -8.050) 13.127 1.670 ( 7.570 3.777 -12.150) 14.805 1.817 ( 9.871 4.592 -3.677) 11.491 1.935 ( -0.288 2.044 0.159) 2.071 2.058 ( -3.827 1.592 6.418) 7.640 2.123 ( 1.705 -1.260 -7.170) 7.477 2.221 ( -3.081 -0.275 -4.759) 5.676 2.260 ( -0.282 -3.103 -3.665) 4.811 2.352 ( 3.773 0.315 4.317) 5.742 2.381 ( -2.721 2.999 1.004) 4.172 2.446 ( -1.140 -0.242 -2.232) 2.517 2.507 ( -1.640 0.607 -3.114) 3.571 2.580 ( -6.190 0.679 0.402) 6.241 2.640 ( -0.285 -1.165 -5.024) 5.166 2.792 ( 2.482 -0.547 -1.733) 3.077 2.914 ( 0.376 1.623 -0.709) 1.810 2.997 ( -3.891 -0.504 2.261) 4.528 3.112 ( -1.678 -2.623 2.381) 3.920 3.180 ( 1.664 -1.046 3.445) 3.966 3.245 ( 1.515 1.235 5.897) 6.213 3.279 ( 1.984 1.346 4.564) 5.155 3.465 ( 1.735 4.467 5.920) 7.617 3.694 ( 3.375 -0.419 0.684) 3.469 4.367 ( -2.859 -0.642 2.924) 4.140 4.491 ( -2.822 -3.928 1.551) 5.079 4.578 ( 2.922 -3.919 1.015) 4.992 4.646 ( -0.469 -3.339 2.661) 4.296 4.749 ( 0.050 -1.597 1.170) 1.981 4.988 ( -2.844 3.021 0.911) 4.247 5.022 ( 3.606 -1.546 -2.649) 4.734 5.055 ( 8.198 -0.354 -1.449) 8.333 5.139 ( -4.023 2.595 1.995) 5.186 5.359 ( 2.012 -3.860 1.029) 4.473 5.380 ( 5.042 -3.038 2.856) 6.543 5.475 ( 1.491 -1.311 -1.603) 2.552 5.530 ( 1.054 -3.597 2.838) 4.702 5.566 ( 1.920 -4.194 0.576) 4.649 5.602 ( -2.213 -0.769 -3.258) 4.013 5.691 ( -0.365 1.804 -0.582) 1.931 5.817 ( 0.085 -0.341 2.836) 2.857 6.007 ( 4.077 3.739 2.456) 6.052 6.157 ( -2.553 -3.400 -3.227) 5.338 6.236 ( -2.540 -0.717 1.306) 2.945 6.306 ( 3.179 -0.592 1.943) 3.772 6.416 ( -2.551 3.712 4.684) 6.499 6.631 ( 0.101 0.052 2.076) 2.079 6.668 ( 2.722 2.332 2.497) 4.368 6.764 ( 4.555 -1.502 6.741) 8.273 6.982 ( 5.661 -5.576 -3.347) 8.622 7.293 ( -0.110 -0.990 -0.217) 1.020 7.322 ( 2.474 1.808 -0.667) 3.136 7.448 ( -1.718 9.691 -7.014) 12.086 7.557 ( -3.706 1.551 -6.510) 7.650 7.740 ( -2.602 8.933 3.431) 9.916 7.985 ( -0.071 -1.270 -3.338) 3.572 8.125 ( 3.516 2.459 -3.103) 5.295 8.534 ( 1.632 2.403 -4.062) 4.994 8.641 ( 2.394 0.487 3.668) 4.407 8.693 ( 0.566 1.157 1.966) 2.350 8.924 ( -1.608 -2.071 -0.633) 2.697 9.167 ( -1.990 3.770 0.710) 4.321 9.234 ( 2.006 2.419 -5.656) 6.471 9.339 ( -0.836 0.358 1.329) 1.610 9.719 ( -2.630 0.503 -0.642) 2.753 9.766 ( -3.653 -1.960 0.266) 4.154 9.849 ( -0.636 0.638 0.766) 1.183 10.021 ( 1.964 -4.297 -1.504) 4.958 10.391 ( -5.195 -0.692 1.323) 5.405 10.544 ( 0.949 -2.458 0.247) 2.646 10.680 ( -1.078 -0.437 5.862) 5.976 11.209 ( -1.114 -6.602 -6.116) 9.069 20.491 ( 0.476 1.869 0.952) 2.151 20.549 ( -0.073 0.326 -0.773) 0.842 20.787 ( -0.059 1.106 1.188) 1.624 20.873 ( 0.822 0.026 -0.789) 1.140 22.745 ( 1.502 1.000 3.161) 3.640 22.903 ( -1.531 -0.463 -2.242) 2.754 23.033 ( 0.943 -0.167 1.759) 2.003 23.182 ( -1.356 -1.417 -3.198) 3.751 24.584 ( 0.055 -1.424 1.226) 1.880 24.686 ( 0.159 -4.619 -0.620) 4.663 24.901 ( -0.589 4.114 -0.439) 4.179 24.961 ( -0.454 1.712 -1.263) 2.175 25.612 ( 1.641 1.319 0.451) 2.153 25.638 ( 2.056 1.644 -0.379) 2.660 25.962 ( 0.332 0.288 0.456) 0.633 26.006 ( 1.337 -0.528 -0.296) 1.468 28.319 ( -0.455 0.426 1.298) 1.440 28.380 ( -1.566 -0.135 0.229) 1.589 28.528 ( -0.311 0.404 1.703) 1.777 28.557 ( 0.398 -0.154 -1.230) 1.302 28.611 ( -0.246 -0.825 0.015) 0.861 28.712 ( 0.193 0.580 0.764) 0.978 28.794 ( 1.425 -1.391 -1.327) 2.393 28.904 ( 0.825 -2.350 -2.514) 3.539 32.367 ( -1.332 -0.274 0.093) 1.363 32.409 ( 0.198 -1.166 -0.395) 1.247 32.467 ( -0.793 1.463 -0.427) 1.718 32.508 ( 1.610 0.738 -0.231) 1.786 35.397 ( -1.221 0.163 -0.026) 1.232 35.419 ( -0.149 -0.080 0.069) 0.183 35.455 ( 0.054 1.106 0.853) 1.397 35.534 ( 0.977 -0.217 -0.565) 1.149 88.818 ( -1.411 -0.933 2.482) 3.004 88.913 ( -0.828 -3.931 6.117) 7.318 89.095 ( -0.525 2.376 -0.038) 2.434 89.392 ( -3.865 -2.938 -4.816) 6.838 97.679 ( -0.265 -0.071 -0.101) 0.292 97.701 ( -0.554 0.208 -0.572) 0.823 97.777 ( 0.321 -1.709 3.411) 3.829 97.878 ( -2.688 -2.277 -1.091) 3.688 98.694 ( -0.672 0.639 0.351) 0.991 98.725 ( -0.467 1.120 -0.496) 1.311 98.763 ( 0.175 2.800 0.133) 2.808 98.796 ( 2.602 2.393 0.278) 3.546 99.614 ( 1.137 0.451 0.543) 1.339 99.654 ( -0.525 2.126 -0.994) 2.405 99.836 ( 1.669 0.458 7.145) 7.352 100.350 ( 0.798 -5.571 -7.161) 9.108 ======================= Grid point 78 (36/92) ======================= q-point: (-0.33 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.099 ( -15.669 3.635 -8.862) 18.365 1.191 ( -17.383 5.474 -3.158) 18.496 1.683 ( 6.273 2.380 -7.588) 10.128 1.897 ( 1.508 -0.040 -5.565) 5.766 1.972 ( 5.540 1.939 -1.030) 5.959 1.991 ( -8.152 1.742 2.365) 8.665 2.021 ( -10.688 3.005 3.667) 11.692 2.162 ( 0.967 2.159 -4.819) 5.369 2.209 ( -8.464 3.577 2.697) 9.576 2.276 ( -0.703 -4.582 -2.232) 5.145 2.360 ( -2.469 2.432 -3.076) 4.634 2.453 ( 1.833 -1.712 -0.220) 2.518 2.526 ( 3.132 1.763 1.997) 4.112 2.539 ( 0.585 -1.893 0.796) 2.135 2.644 ( 5.290 -0.123 -2.367) 5.797 2.816 ( 1.645 0.316 -3.277) 3.680 2.877 ( 1.892 1.081 -2.787) 3.538 3.048 ( 2.891 0.454 4.030) 4.980 3.114 ( -0.578 -2.368 1.788) 3.023 3.232 ( -0.013 -0.351 3.735) 3.751 3.306 ( 2.721 -1.419 0.630) 3.133 3.363 ( 0.550 0.794 4.863) 4.959 3.542 ( 1.203 4.826 3.169) 5.898 3.732 ( -0.648 -0.188 1.957) 2.071 4.357 ( -0.904 -1.066 1.368) 1.956 4.469 ( -2.215 -2.720 2.046) 4.061 4.638 ( 2.487 -4.558 -0.366) 5.205 4.673 ( 2.632 -3.064 2.325) 4.661 4.789 ( 2.525 -3.484 0.639) 4.350 4.975 ( -0.932 4.309 2.359) 5.000 5.020 ( 1.733 -3.355 -2.753) 4.673 5.078 ( -3.371 2.750 3.689) 5.704 5.248 ( 10.711 0.223 0.376) 10.720 5.405 ( 0.099 -2.466 2.007) 3.181 5.467 ( 3.917 -4.016 -2.415) 6.108 5.492 ( 0.035 -1.897 -1.156) 2.221 5.509 ( 0.372 -0.639 -4.203) 4.267 5.633 ( 8.085 -4.377 -0.243) 9.196 5.669 ( 2.765 0.079 3.395) 4.379 5.723 ( 6.471 1.251 0.216) 6.594 5.809 ( 0.434 1.226 0.262) 1.327 6.049 ( -4.442 -2.156 2.022) 5.335 6.065 ( -0.305 2.471 -2.419) 3.471 6.255 ( -1.978 5.726 -1.247) 6.185 6.347 ( -0.341 1.417 4.470) 4.702 6.444 ( -0.031 0.391 5.284) 5.298 6.695 ( 5.282 -2.621 0.133) 5.898 6.762 ( 4.021 1.901 4.006) 5.986 6.907 ( 5.597 -1.866 4.901) 7.670 7.032 ( 4.319 -8.159 -3.590) 9.905 7.305 ( -0.361 -1.268 2.145) 2.518 7.354 ( 3.952 4.173 -10.232) 11.736 7.399 ( 6.772 -1.390 -5.032) 8.550 7.436 ( -2.075 6.355 -2.957) 7.310 7.798 ( 2.019 8.531 10.196) 13.447 7.977 ( 1.403 -0.117 -0.985) 1.718 8.168 ( 4.973 3.815 -2.319) 6.683 8.539 ( 6.200 3.931 -6.943) 10.104 8.690 ( -0.037 -2.610 2.031) 3.307 8.730 ( -0.189 0.236 3.000) 3.015 8.872 ( -3.617 -0.132 -0.285) 3.631 9.126 ( -2.270 3.434 -4.190) 5.874 9.190 ( -1.029 3.747 -0.844) 3.976 9.347 ( -0.296 -3.460 1.466) 3.769 9.624 ( -11.159 1.448 -1.581) 11.363 9.642 ( -5.291 -1.810 -0.937) 5.670 9.842 ( -0.507 2.271 -0.953) 2.514 10.013 ( -2.151 -3.965 -0.174) 4.514 10.331 ( -5.185 -1.367 3.676) 6.501 10.535 ( -1.000 0.152 -1.954) 2.200 10.737 ( -1.457 -3.330 8.436) 9.186 11.106 ( -2.860 -5.696 -6.591) 9.169 20.511 ( 0.693 2.113 0.552) 2.291 20.539 ( 0.218 1.332 -0.497) 1.438 20.807 ( 0.918 1.225 1.191) 1.940 20.884 ( 1.460 0.111 -0.800) 1.669 22.809 ( 1.351 0.546 3.201) 3.517 22.840 ( -1.949 0.539 -2.827) 3.476 23.075 ( 0.829 -0.943 2.313) 2.632 23.122 ( -1.283 -0.732 -3.025) 3.366 24.606 ( 0.785 -1.389 1.319) 2.070 24.682 ( 0.392 -3.645 -1.089) 3.824 24.887 ( -1.023 3.036 0.343) 3.222 24.934 ( -0.801 1.762 -1.422) 2.402 25.649 ( 3.763 0.953 -0.781) 3.960 25.712 ( 5.350 1.336 0.723) 5.562 25.992 ( 2.567 1.742 0.507) 3.143 26.040 ( 2.714 -0.179 0.260) 2.732 28.322 ( -0.939 0.118 1.337) 1.638 28.348 ( -2.349 0.038 0.303) 2.369 28.542 ( -0.341 0.315 1.993) 2.046 28.556 ( 0.977 0.348 -1.086) 1.501 28.607 ( 0.153 -0.566 -0.491) 0.765 28.719 ( -0.418 -0.902 0.860) 1.314 28.808 ( 1.663 -0.839 -1.129) 2.178 28.885 ( 0.419 -3.397 -3.446) 4.857 32.342 ( -1.804 -0.019 0.340) 1.835 32.405 ( -0.164 -0.881 -0.778) 1.186 32.450 ( -0.528 1.459 -0.450) 1.615 32.530 ( 1.368 0.225 -0.239) 1.407 35.370 ( -1.490 0.509 -0.322) 1.607 35.420 ( -0.347 -0.219 0.497) 0.645 35.472 ( 0.925 1.517 0.968) 2.024 35.545 ( 0.997 -0.266 -0.535) 1.163 88.814 ( -2.218 -1.042 2.527) 3.521 88.947 ( -1.870 -4.769 3.651) 6.290 89.097 ( -3.294 0.224 7.672) 8.353 89.267 ( -3.683 -1.550 -6.130) 7.317 97.669 ( -1.005 -0.046 0.155) 1.018 97.678 ( -1.228 0.262 -0.573) 1.380 97.800 ( -3.090 -2.419 0.312) 3.936 97.823 ( -1.499 -2.539 2.625) 3.948 98.683 ( -0.999 0.592 0.508) 1.268 98.711 ( -0.375 0.137 -0.680) 0.788 98.788 ( 2.606 4.662 0.382) 5.354 98.852 ( 3.709 4.053 0.319) 5.503 99.622 ( -0.425 1.739 -0.793) 1.958 99.659 ( 2.016 1.113 0.208) 2.313 99.939 ( 0.669 -1.161 7.971) 8.083 100.263 ( -0.148 -6.328 -10.880) 12.587 ======================= Grid point 79 (37/92) ======================= q-point: (-0.22 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.750 ( -16.172 8.687 -3.780) 18.742 0.880 ( -19.411 8.679 3.426) 21.537 1.643 ( -30.769 16.073 7.215) 35.456 1.727 ( 3.815 0.097 -2.007) 4.311 1.817 ( -1.455 -0.894 -3.460) 3.859 1.997 ( 1.432 -0.460 -3.135) 3.477 2.037 ( 3.941 2.661 -4.965) 6.875 2.155 ( 1.215 1.634 -2.496) 3.221 2.166 ( -2.075 -3.956 5.839) 7.352 2.277 ( 0.870 -1.113 1.511) 2.069 2.316 ( -0.217 0.650 -1.059) 1.262 2.489 ( 2.838 -2.492 0.279) 3.787 2.534 ( -0.026 -1.372 0.962) 1.676 2.624 ( 2.112 0.389 4.059) 4.592 2.731 ( 6.359 -0.162 -1.065) 6.450 2.785 ( -0.071 1.446 -3.232) 3.541 2.924 ( 5.197 4.426 -2.325) 7.211 3.108 ( 1.807 -2.052 0.583) 2.796 3.156 ( 1.128 -2.061 3.871) 4.529 3.258 ( 0.333 0.292 0.470) 0.646 3.352 ( 2.702 -1.843 -0.058) 3.271 3.387 ( -0.765 -0.350 -0.057) 0.843 3.560 ( -1.141 4.409 -0.180) 4.558 3.714 ( -3.432 -0.344 1.093) 3.619 4.370 ( 1.458 -2.843 -0.234) 3.204 4.465 ( 0.062 1.298 1.880) 2.286 4.658 ( 1.968 -5.405 -1.068) 5.851 4.782 ( 5.053 -2.761 2.173) 6.154 4.818 ( 1.115 -3.922 -0.665) 4.131 4.965 ( -0.636 3.575 1.083) 3.789 5.066 ( 4.256 -2.041 0.138) 4.722 5.157 ( 3.993 1.458 10.183) 11.034 5.324 ( -6.415 -1.662 -4.362) 7.934 5.379 ( 3.972 -1.694 0.656) 4.368 5.440 ( 2.564 -1.093 -4.530) 5.318 5.514 ( 4.988 -0.481 -7.455) 8.982 5.524 ( 0.665 -2.082 0.359) 2.215 5.696 ( -0.869 -3.556 3.287) 4.920 5.755 ( 5.793 -2.469 1.821) 6.556 5.869 ( 7.041 -0.508 0.706) 7.094 5.893 ( 1.026 0.021 0.357) 1.087 6.002 ( 4.835 -0.767 1.204) 5.041 6.081 ( 1.163 8.331 1.419) 8.531 6.160 ( -4.361 5.361 -2.355) 7.301 6.366 ( -2.345 2.942 2.656) 4.605 6.469 ( -1.228 0.569 0.997) 1.681 6.710 ( -1.004 2.013 -4.739) 5.246 6.914 ( 7.059 -2.252 3.108) 8.035 7.014 ( 2.632 -3.215 -2.307) 4.752 7.068 ( 4.559 -3.323 -0.293) 5.649 7.280 ( -0.306 5.294 -3.331) 6.262 7.325 ( -0.417 -0.472 -1.084) 1.254 7.435 ( 2.265 5.538 2.984) 6.686 7.527 ( 14.187 -8.711 -4.745) 17.311 7.982 ( 2.622 -2.312 1.268) 3.718 8.046 ( 5.441 6.869 15.692) 17.973 8.238 ( 5.706 3.321 -1.077) 6.689 8.585 ( 6.155 0.648 -4.444) 7.619 8.696 ( -0.740 -3.481 0.336) 3.574 8.737 ( 1.695 0.512 -2.893) 3.392 8.818 ( -5.320 2.190 4.638) 7.390 9.018 ( -2.953 4.198 -6.217) 8.062 9.183 ( -1.301 1.375 1.896) 2.679 9.357 ( 0.422 -3.674 0.463) 3.727 9.398 ( -12.561 3.426 -2.050) 13.180 9.541 ( -4.741 -2.440 -1.672) 5.588 9.806 ( -0.611 4.972 -4.102) 6.475 9.958 ( -3.969 -2.540 0.548) 4.743 10.292 ( -5.147 -2.453 4.734) 7.411 10.469 ( -4.323 1.925 -2.156) 5.200 10.796 ( -3.308 -7.945 8.967) 12.429 10.989 ( -2.994 -4.707 -5.362) 7.738 20.509 ( -0.294 1.420 -0.734) 1.626 20.574 ( 4.153 4.604 0.006) 6.201 20.838 ( 1.246 1.635 1.042) 2.304 20.901 ( 1.522 0.238 -0.731) 1.705 22.773 ( -1.528 0.522 -2.397) 2.890 22.864 ( 0.560 -0.189 2.356) 2.429 23.064 ( -0.486 -0.118 -2.098) 2.157 23.122 ( 0.343 -0.346 1.852) 1.915 24.635 ( 0.698 -1.271 1.927) 2.412 24.676 ( 0.303 -2.364 -0.969) 2.573 24.876 ( -0.994 1.934 0.931) 2.365 24.909 ( -0.672 1.439 -0.857) 1.805 25.722 ( 5.755 0.983 -0.823) 5.896 25.805 ( 4.546 0.130 0.491) 4.574 26.048 ( 3.619 3.422 -0.832) 5.050 26.116 ( 4.932 0.916 3.664) 6.212 28.310 ( -1.774 -0.124 0.716) 1.917 28.324 ( -1.445 -0.024 1.569) 2.133 28.557 ( -0.845 0.144 2.529) 2.670 28.566 ( 1.801 0.599 -1.486) 2.411 28.606 ( 0.388 -0.220 -0.527) 0.690 28.714 ( -1.550 -1.993 0.904) 2.682 28.821 ( 1.544 -0.999 -2.007) 2.722 28.834 ( -2.012 -4.593 -4.067) 6.456 32.319 ( -1.634 0.247 0.870) 1.867 32.386 ( -1.024 -0.553 -0.670) 1.342 32.441 ( -0.048 1.343 -0.539) 1.448 32.548 ( 1.177 -0.081 -0.338) 1.227 35.347 ( -1.050 0.713 0.085) 1.272 35.422 ( 0.308 0.614 0.370) 0.780 35.504 ( 1.290 1.246 1.515) 2.348 35.554 ( 0.840 -0.093 -0.738) 1.122 88.799 ( -2.529 -1.100 2.226) 3.544 88.933 ( -1.739 -2.516 0.247) 3.068 89.101 ( -4.926 -4.204 0.827) 6.529 89.205 ( -4.215 -6.512 10.966) 13.433 97.648 ( -1.289 0.105 -0.357) 1.341 97.655 ( -1.137 -0.035 0.039) 1.138 97.732 ( -3.096 -1.045 -1.156) 3.466 97.834 ( -3.393 -6.344 4.294) 8.379 98.675 ( -0.644 0.548 0.632) 1.055 98.698 ( -0.472 -0.195 -0.537) 0.741 98.855 ( 3.969 5.075 0.819) 6.494 98.937 ( 7.375 9.075 0.290) 11.698 99.609 ( -0.109 1.213 -0.505) 1.319 99.697 ( 2.140 1.159 -0.127) 2.437 100.016 ( -1.070 -2.123 6.655) 7.067 100.095 ( -3.406 -6.385 -16.567) 18.079 ======================= Grid point 80 (38/92) ======================= q-point: (-0.11 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.595 ( -5.653 16.545 12.644) 21.577 0.672 ( -12.761 15.384 10.820) 22.729 1.214 ( -30.140 21.010 12.770) 38.896 1.736 ( -0.576 -3.212 -1.969) 3.811 1.843 ( 2.802 2.169 2.604) 4.397 1.977 ( 0.013 2.198 -9.858) 10.101 1.987 ( 2.230 0.772 -1.722) 2.921 2.153 ( 0.943 -0.833 -1.120) 1.685 2.226 ( 2.085 -3.961 2.114) 4.950 2.300 ( -1.705 -0.678 3.524) 3.973 2.344 ( 2.599 -3.440 2.295) 4.884 2.542 ( 1.267 -2.421 3.199) 4.207 2.571 ( -0.425 1.202 4.932) 5.094 2.677 ( 0.459 -0.424 2.386) 2.467 2.748 ( -0.169 4.420 -1.658) 4.724 2.820 ( 4.072 -2.086 0.693) 4.628 2.972 ( 3.941 5.836 -3.521) 7.873 3.157 ( 2.130 -0.237 2.245) 3.104 3.192 ( 0.396 -4.929 0.766) 5.004 3.247 ( 0.430 -1.378 -3.774) 4.041 3.341 ( -1.334 -1.828 -4.685) 5.203 3.391 ( 1.547 2.519 -1.061) 3.141 3.509 ( -2.024 3.394 -3.149) 5.053 3.644 ( -4.087 -0.654 -2.377) 4.773 4.390 ( 2.410 -3.286 -1.502) 4.343 4.519 ( 4.309 3.093 -1.061) 5.410 4.672 ( 1.530 -5.008 -3.879) 6.517 4.790 ( -0.179 -3.025 -0.990) 3.188 4.872 ( 0.545 -1.916 2.398) 3.118 5.007 ( 3.168 3.242 0.540) 4.565 5.140 ( 2.363 1.922 -0.508) 3.088 5.193 ( -0.970 0.002 -1.590) 1.862 5.305 ( -2.063 -0.888 -1.110) 2.505 5.405 ( 3.060 -5.225 4.111) 7.318 5.445 ( 3.200 -1.211 -5.808) 6.741 5.523 ( 0.516 -0.745 -0.481) 1.026 5.542 ( 4.013 -4.284 0.085) 5.871 5.709 ( -4.636 -6.821 6.402) 10.441 5.793 ( -4.602 0.283 -1.555) 4.866 5.880 ( 3.719 -1.929 1.833) 4.573 6.014 ( 7.367 0.796 3.454) 8.175 6.079 ( 0.553 2.043 0.162) 2.123 6.115 ( 1.601 6.487 -0.708) 6.719 6.206 ( 8.598 4.132 5.226) 10.877 6.335 ( -2.303 4.018 -1.039) 4.746 6.453 ( -2.178 -1.727 1.752) 3.285 6.597 ( -3.679 3.693 -6.504) 8.335 6.975 ( 1.943 -1.767 -5.504) 6.098 7.008 ( 0.564 -2.249 1.210) 2.616 7.131 ( 3.516 -0.035 -1.805) 3.952 7.211 ( -1.308 2.103 -6.532) 6.986 7.401 ( 1.993 5.678 -3.701) 7.065 7.449 ( 1.520 2.553 9.567) 10.018 7.782 ( 8.700 -5.365 10.675) 14.779 8.020 ( 1.965 -3.214 1.602) 4.094 8.283 ( 7.846 2.765 3.176) 8.905 8.327 ( -1.728 1.452 8.389) 8.688 8.634 ( 3.514 -5.885 -0.964) 6.921 8.666 ( -0.353 -2.642 -3.127) 4.108 8.750 ( 0.569 -0.125 0.561) 0.808 8.795 ( -3.236 2.107 3.854) 5.455 8.928 ( -2.017 3.152 -0.987) 3.870 9.153 ( -4.779 2.643 -0.493) 5.483 9.231 ( -3.470 2.624 -0.152) 4.353 9.372 ( -0.841 -3.535 2.219) 4.257 9.479 ( 3.224 -1.785 -6.183) 7.198 9.730 ( -1.549 6.275 -7.375) 9.807 9.919 ( -0.253 -0.287 -0.226) 0.444 10.256 ( -4.901 -2.671 4.258) 7.021 10.359 ( -4.897 1.873 -2.300) 5.725 10.780 ( -9.143 -10.878 5.968) 15.413 10.910 ( -0.858 -4.218 -3.110) 5.310 20.499 ( 0.028 1.823 -0.558) 1.906 20.657 ( 7.234 5.240 -4.927) 10.201 20.864 ( 0.826 2.269 0.118) 2.417 20.920 ( 1.429 0.555 -0.216) 1.549 22.743 ( 0.104 0.687 -0.805) 1.064 22.879 ( -0.602 -1.061 0.596) 1.358 23.047 ( 0.295 0.988 -0.957) 1.407 23.134 ( -0.611 -0.233 0.575) 0.871 24.674 ( 0.599 -1.754 0.433) 1.903 24.678 ( 0.594 -2.479 3.236) 4.119 24.872 ( -0.925 1.574 0.985) 2.074 24.901 ( 0.187 0.817 0.759) 1.131 25.806 ( 4.715 0.667 -0.619) 4.802 25.868 ( 2.760 -0.216 -0.030) 2.769 26.083 ( 2.143 3.598 -1.424) 4.423 26.280 ( 7.901 -0.798 3.104) 8.526 28.295 ( -1.170 0.038 1.139) 1.633 28.347 ( 1.736 -1.583 4.767) 5.314 28.569 ( -1.121 -0.167 3.122) 3.321 28.583 ( 2.001 0.565 -1.594) 2.620 28.608 ( 0.246 0.074 -0.475) 0.540 28.659 ( -6.107 -4.139 -2.014) 7.647 28.729 ( -4.368 -0.789 -0.192) 4.442 28.830 ( 1.622 -1.234 -2.055) 2.895 32.305 ( -1.285 0.496 0.987) 1.695 32.377 ( -0.045 -0.956 1.963) 2.184 32.437 ( 0.291 1.221 -0.358) 1.305 32.561 ( 0.995 -0.324 -0.626) 1.219 35.339 ( -0.501 0.812 0.826) 1.262 35.438 ( 1.437 1.414 -0.462) 2.069 35.533 ( 0.407 -0.684 -0.174) 0.815 35.567 ( 1.505 0.602 0.104) 1.624 88.779 ( -2.364 -1.093 1.642) 3.079 88.906 ( -1.215 -1.186 -0.754) 1.858 89.027 ( -2.825 -4.687 -0.490) 5.494 89.206 ( -15.371 -18.369 11.779) 26.691 97.627 ( -0.586 0.168 -0.532) 0.809 97.640 ( -0.808 -0.250 0.044) 0.847 97.684 ( -1.468 -0.607 -0.477) 1.659 97.769 ( -8.001 -6.484 0.917) 10.339 98.677 ( 0.075 0.282 0.784) 0.837 98.685 ( -0.686 0.096 -0.026) 0.694 98.904 ( 1.601 3.817 -0.404) 4.159 99.131 ( 15.753 11.740 -7.000) 20.856 99.616 ( 1.089 1.657 0.884) 2.171 99.723 ( 1.784 0.673 -0.350) 1.938 99.814 ( -7.039 0.035 -10.425) 12.579 100.041 ( -2.992 -2.406 3.852) 5.439 ======================= Grid point 81 (39/92) ======================= q-point: ( 0.00 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.069 ( -3.353 18.573 9.457) 21.110 1.108 ( -0.316 17.190 12.622) 21.329 1.480 ( 1.333 7.004 8.885) 11.392 1.747 ( -1.585 9.575 3.461) 10.303 1.832 ( -0.544 -7.314 -3.280) 8.034 1.940 ( 2.465 0.260 -2.395) 3.446 1.994 ( -2.893 -0.389 -4.223) 5.134 2.081 ( 3.008 -3.502 0.875) 4.699 2.179 ( 2.896 -2.832 2.047) 4.538 2.372 ( -0.745 -2.076 7.936) 8.237 2.405 ( -1.974 6.692 0.637) 7.006 2.541 ( -1.047 -2.676 4.516) 5.353 2.556 ( -2.010 0.953 0.788) 2.360 2.690 ( -0.993 0.141 1.559) 1.854 2.797 ( 1.632 -5.662 4.330) 7.312 2.894 ( -1.083 -5.356 0.851) 5.530 2.935 ( 3.420 1.813 0.856) 3.965 3.131 ( 0.238 -1.984 -1.373) 2.425 3.175 ( 0.781 0.072 -7.643) 7.683 3.219 ( 1.628 -1.345 -7.452) 7.746 3.321 ( 1.429 6.928 1.301) 7.192 3.415 ( -2.336 3.577 -6.521) 7.796 3.512 ( -3.617 -0.458 -5.581) 6.666 3.526 ( 0.318 0.504 -2.035) 2.120 4.343 ( 1.751 -2.555 0.268) 3.109 4.441 ( -1.403 -6.870 3.430) 7.806 4.605 ( 0.795 0.822 -8.795) 8.869 4.707 ( -0.409 -4.621 -1.871) 5.002 4.954 ( 4.215 4.101 3.470) 6.829 5.091 ( 1.501 1.641 -3.107) 3.821 5.129 ( -3.028 3.426 -0.163) 4.575 5.210 ( -6.473 -2.020 6.525) 9.411 5.308 ( -1.377 0.448 1.275) 1.929 5.339 ( -1.082 -0.695 -2.298) 2.634 5.434 ( -1.972 -3.292 0.342) 3.852 5.468 ( 4.800 -3.388 3.645) 6.914 5.527 ( 2.577 -1.855 -1.024) 3.336 5.608 ( 0.029 -4.390 3.213) 5.440 5.743 ( 0.820 4.018 -3.551) 5.425 5.905 ( -0.252 -0.850 -0.506) 1.020 6.099 ( -0.083 -3.321 -1.270) 3.557 6.131 ( 1.026 0.796 -0.297) 1.332 6.179 ( 2.707 -1.779 3.691) 4.911 6.230 ( -0.494 2.463 -1.202) 2.785 6.382 ( -3.339 0.063 -0.028) 3.340 6.472 ( 3.783 -3.354 7.088) 8.706 6.654 ( -3.008 12.237 -9.311) 15.668 6.998 ( 0.865 4.478 -1.873) 4.930 7.073 ( 0.343 1.477 -0.813) 1.720 7.128 ( -0.978 -5.385 -5.811) 7.982 7.211 ( 0.903 5.191 0.259) 5.276 7.381 ( -5.561 1.303 -5.174) 7.706 7.721 ( 5.400 4.045 9.672) 11.793 7.941 ( 0.968 -3.644 7.515) 8.408 8.081 ( -1.092 6.890 7.170) 10.003 8.237 ( -4.924 1.257 -2.391) 5.616 8.394 ( -3.201 -5.518 -1.966) 6.675 8.532 ( 5.298 -9.111 2.205) 10.768 8.673 ( 3.058 5.062 2.391) 6.379 8.745 ( 0.412 -0.567 4.012) 4.072 8.759 ( -6.130 1.084 0.256) 6.230 8.975 ( -0.075 0.274 3.643) 3.654 9.117 ( -3.655 -0.018 3.419) 5.005 9.240 ( -3.576 -5.213 -2.978) 6.988 9.298 ( 5.175 -1.711 -3.816) 6.653 9.379 ( 0.933 -0.299 1.237) 1.578 9.683 ( 0.005 2.216 -5.944) 6.344 9.827 ( -0.531 -4.520 -1.519) 4.798 10.329 ( 2.785 4.873 -2.839) 6.290 10.371 ( 2.006 2.998 -2.008) 4.128 10.607 ( -3.434 -1.288 2.777) 4.601 10.782 ( 2.438 -6.753 -1.289) 7.294 20.553 ( 0.258 2.998 -0.352) 3.030 20.669 ( 0.055 -1.385 -3.902) 4.141 20.909 ( -0.360 1.840 -0.511) 1.943 20.949 ( 0.281 0.130 -0.220) 0.380 22.784 ( 1.543 1.269 0.664) 2.106 22.840 ( -0.461 -1.101 -0.343) 1.242 23.078 ( 0.431 1.088 -0.287) 1.204 23.110 ( -1.032 -0.355 -0.871) 1.397 24.648 ( -0.238 -1.435 0.707) 1.617 24.654 ( -0.154 -1.608 0.717) 1.767 24.903 ( -0.313 1.290 1.169) 1.769 24.926 ( 0.218 0.030 1.497) 1.514 25.860 ( 0.557 0.581 0.009) 0.805 25.885 ( 0.081 -0.314 -0.722) 0.791 26.153 ( 0.006 2.440 -0.662) 2.529 26.260 ( -1.314 -2.529 -1.875) 3.411 28.296 ( -0.652 0.220 1.829) 1.954 28.347 ( -0.892 -2.448 2.981) 3.959 28.553 ( -1.246 0.648 0.456) 1.477 28.580 ( -0.448 -0.674 2.010) 2.167 28.629 ( 1.475 -0.229 1.094) 1.851 28.646 ( 3.011 -0.153 -0.667) 3.088 28.684 ( -1.697 1.419 -0.436) 2.254 28.790 ( 1.082 -2.417 -2.040) 3.343 32.322 ( -0.350 1.148 1.250) 1.733 32.375 ( 0.375 -1.346 1.766) 2.252 32.466 ( 0.190 1.416 -0.450) 1.497 32.538 ( 0.121 -1.526 -1.044) 1.853 35.371 ( -0.071 1.440 1.278) 1.927 35.448 ( 0.118 -1.592 -0.163) 1.605 35.523 ( -0.310 1.325 -0.894) 1.628 35.568 ( -0.265 -0.413 -1.063) 1.171 88.733 ( -3.262 0.104 2.409) 4.056 88.788 ( -5.003 -2.236 4.276) 6.951 88.926 ( 0.098 1.677 -1.043) 1.978 89.040 ( 2.936 -3.124 -0.807) 4.362 97.623 ( -0.334 0.258 -0.321) 0.530 97.630 ( 0.407 0.032 -0.275) 0.492 97.656 ( -1.003 -0.118 0.118) 1.017 97.668 ( 0.385 -0.555 -0.042) 0.677 98.688 ( -0.076 0.535 0.584) 0.796 98.695 ( 0.054 0.286 0.792) 0.843 99.007 ( -0.309 5.257 -1.731) 5.544 99.174 ( -1.483 -0.305 -8.337) 8.473 99.675 ( 0.260 2.991 0.659) 3.074 99.766 ( -0.624 1.078 -0.367) 1.299 99.859 ( 7.087 -2.752 3.505) 8.372 99.942 ( -2.167 -3.410 0.096) 4.041 ======================= Grid point 82 (40/92) ======================= q-point: ( 0.11 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.073 ( -2.184 17.808 8.693) 19.936 1.315 ( 6.662 14.610 12.392) 20.283 1.680 ( 7.469 -0.143 5.581) 9.325 1.771 ( -1.164 0.497 -2.391) 2.705 1.788 ( 6.257 9.830 -5.020) 12.688 1.937 ( 0.775 -3.766 0.240) 3.853 2.000 ( 1.894 -2.657 4.117) 5.253 2.139 ( 2.620 -4.670 2.135) 5.765 2.281 ( 5.372 -1.804 3.934) 6.899 2.354 ( -3.089 4.113 0.517) 5.170 2.442 ( -1.854 -2.763 7.335) 8.054 2.525 ( -2.707 -0.042 1.953) 3.338 2.595 ( -0.924 0.194 6.870) 6.935 2.651 ( -2.978 1.397 -0.031) 3.289 2.845 ( 0.018 -4.187 1.514) 4.452 2.925 ( -0.535 -2.521 5.081) 5.697 2.943 ( -0.384 -0.764 -4.229) 4.314 3.031 ( -3.312 -1.035 -8.456) 9.140 3.128 ( -1.796 -0.002 -0.688) 1.923 3.200 ( -0.304 -0.108 -2.124) 2.149 3.301 ( 1.714 6.553 -9.110) 11.352 3.347 ( -0.947 3.315 0.464) 3.479 3.399 ( -0.133 -0.044 -8.718) 8.719 3.507 ( 0.816 -0.045 -2.771) 2.889 4.363 ( -0.229 -1.257 0.819) 1.518 4.476 ( 1.732 -5.240 2.056) 5.889 4.516 ( -2.356 0.809 -3.173) 4.034 4.670 ( -1.690 -5.313 -2.210) 5.997 4.991 ( -5.675 6.032 1.090) 8.353 5.040 ( -1.090 4.753 -2.980) 5.715 5.093 ( -2.762 -0.642 3.530) 4.528 5.143 ( -6.957 -2.212 3.812) 8.235 5.224 ( -2.881 -2.861 -2.381) 4.707 5.379 ( -3.547 -2.976 2.817) 5.419 5.395 ( 0.561 -0.175 -1.796) 1.890 5.525 ( -0.079 -6.040 0.929) 6.112 5.586 ( 1.867 -0.469 3.161) 3.701 5.672 ( 4.754 -3.553 2.667) 6.506 5.759 ( 2.799 3.978 -2.512) 5.475 5.844 ( -3.176 -0.511 -4.411) 5.459 6.062 ( -1.589 1.931 2.330) 3.418 6.153 ( 0.064 -0.045 -1.595) 1.596 6.188 ( -3.092 2.932 0.554) 4.297 6.217 ( -0.723 3.311 -2.228) 4.056 6.332 ( -2.969 -0.162 -0.579) 3.029 6.502 ( -3.514 8.983 -5.140) 10.930 6.641 ( 2.993 -7.229 7.220) 10.647 6.810 ( -10.007 -0.260 -7.777) 12.676 7.056 ( -3.301 1.483 -2.020) 4.145 7.152 ( 1.707 -5.313 1.219) 5.712 7.180 ( -4.661 3.824 -0.989) 6.110 7.286 ( 2.668 -0.216 -1.210) 2.937 7.807 ( -8.917 5.857 1.327) 10.751 7.917 ( -2.125 2.649 5.609) 6.556 8.064 ( -5.038 -0.394 5.497) 7.467 8.194 ( -6.197 4.499 4.255) 8.761 8.346 ( -2.975 -7.755 3.052) 8.849 8.549 ( -1.868 -1.417 -2.203) 3.217 8.618 ( -4.566 0.309 -4.111) 6.152 8.777 ( 0.563 -3.031 2.253) 3.818 8.921 ( 9.961 3.127 7.657) 12.947 9.006 ( 0.293 -1.668 0.867) 1.903 9.122 ( 0.189 1.259 1.386) 1.882 9.200 ( 6.963 -4.332 -1.989) 8.438 9.366 ( 5.504 2.153 0.435) 5.927 9.467 ( 6.607 1.092 1.305) 6.823 9.645 ( 2.480 2.071 -6.152) 6.949 9.800 ( 0.833 -4.625 -3.418) 5.811 10.348 ( 2.094 3.135 -1.498) 4.057 10.430 ( 6.563 0.565 -1.966) 6.874 10.583 ( -2.331 0.273 1.752) 2.929 10.837 ( 5.195 -7.991 -0.756) 9.561 20.554 ( 0.027 2.311 -0.037) 2.312 20.611 ( -1.795 0.675 -3.194) 3.725 20.892 ( -1.494 1.885 0.188) 2.413 20.939 ( -0.989 0.044 -0.374) 1.058 22.815 ( -0.885 0.478 -0.925) 1.367 22.827 ( 1.436 0.094 0.612) 1.564 23.073 ( -1.089 0.437 -0.779) 1.408 23.099 ( 1.323 -0.338 0.272) 1.392 24.639 ( -1.832 -1.653 0.615) 2.543 24.652 ( -0.732 -2.064 0.543) 2.257 24.920 ( 0.647 1.522 1.351) 2.136 24.949 ( 0.926 0.232 0.999) 1.382 25.836 ( -3.515 0.533 -0.113) 3.557 25.858 ( -2.323 -0.152 -0.347) 2.354 26.128 ( -2.468 1.837 -0.018) 3.077 26.187 ( -4.418 -0.468 -1.434) 4.669 28.311 ( -0.153 0.074 2.033) 2.040 28.342 ( -2.205 -1.052 1.884) 3.085 28.542 ( -0.547 0.650 -0.113) 0.857 28.589 ( -0.657 -1.286 0.955) 1.731 28.644 ( -1.105 0.207 0.456) 1.213 28.673 ( 1.508 0.940 -0.046) 1.778 28.720 ( 4.724 -2.383 0.032) 5.291 28.789 ( 1.524 -2.337 -1.847) 3.346 32.334 ( 0.057 1.245 1.353) 1.839 32.400 ( 0.552 -1.479 1.123) 1.937 32.466 ( 0.178 0.981 -0.139) 1.007 32.526 ( 0.103 -1.234 -1.250) 1.760 35.387 ( 0.046 1.050 1.686) 1.987 35.439 ( -0.928 -1.036 0.009) 1.391 35.509 ( -0.378 1.535 -0.699) 1.729 35.547 ( -0.469 -0.233 -1.323) 1.423 88.715 ( -1.335 0.740 2.110) 2.604 88.763 ( -2.342 -1.293 2.519) 3.674 88.953 ( 4.091 2.615 -0.999) 4.957 89.122 ( 6.328 -4.595 0.841) 7.865 97.621 ( 0.727 0.318 -0.450) 0.912 97.640 ( 0.949 -0.464 -0.168) 1.070 97.657 ( 1.086 0.545 -0.073) 1.218 97.696 ( 2.508 -1.095 0.230) 2.746 98.690 ( -0.334 0.922 0.555) 1.127 98.709 ( 0.532 0.017 0.809) 0.968 98.967 ( -2.351 4.576 -1.273) 5.300 99.049 ( -3.882 2.364 -5.021) 6.772 99.694 ( -0.032 3.099 1.107) 3.291 99.739 ( -1.440 1.090 -0.643) 1.917 99.863 ( -2.700 -0.643 -1.761) 3.287 100.050 ( 8.092 -8.183 1.857) 11.657 ======================= Grid point 83 (41/92) ======================= q-point: ( 0.22 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.220 ( 7.399 11.207 9.501) 16.450 1.556 ( 8.155 11.161 8.250) 16.098 1.721 ( 1.698 1.447 -5.586) 6.015 1.776 ( 6.726 -0.147 -5.563) 8.730 1.854 ( 5.404 6.654 -3.509) 9.262 2.007 ( 3.085 -2.793 1.896) 4.573 2.099 ( 4.249 -3.831 5.470) 7.915 2.187 ( 1.637 -2.698 -2.421) 3.978 2.311 ( -3.877 2.236 2.454) 5.104 2.400 ( -0.022 0.991 4.291) 4.404 2.492 ( -1.765 0.004 4.476) 4.811 2.516 ( 0.265 -0.636 5.323) 5.367 2.628 ( 0.930 -1.189 3.700) 3.997 2.655 ( -1.041 0.026 4.592) 4.709 2.853 ( -4.659 -4.990 -0.640) 6.857 2.864 ( 1.865 -1.115 -3.899) 4.463 2.894 ( -3.512 -1.033 -3.798) 5.275 2.933 ( -0.337 2.662 -1.491) 3.070 3.073 ( -5.129 0.396 2.528) 5.732 3.142 ( -3.311 -0.009 -2.077) 3.909 3.263 ( -3.933 0.967 -1.439) 4.298 3.316 ( -3.248 1.788 1.491) 3.996 3.355 ( 8.179 4.602 -8.834) 12.889 3.510 ( 3.271 0.069 -3.561) 4.835 4.366 ( 0.270 -0.052 0.498) 0.569 4.453 ( -2.773 -0.164 -0.785) 2.887 4.531 ( 0.819 -5.611 2.595) 6.236 4.605 ( -3.730 -4.494 -1.035) 5.931 4.888 ( -6.592 2.894 1.621) 7.379 4.979 ( -3.972 1.453 -0.595) 4.271 5.030 ( -1.900 1.212 -2.241) 3.178 5.140 ( -0.229 -1.144 0.579) 1.303 5.184 ( -1.326 -2.533 1.919) 3.443 5.289 ( -4.537 -2.978 -0.980) 5.515 5.378 ( -3.659 -0.496 -0.663) 3.752 5.489 ( -4.246 -6.790 -1.055) 8.077 5.621 ( -2.109 0.973 1.029) 2.541 5.715 ( -5.970 -0.493 -3.860) 7.126 5.759 ( 2.181 1.984 -0.299) 2.964 5.813 ( 5.574 -1.038 2.020) 6.019 6.019 ( -12.258 1.798 -0.566) 12.402 6.084 ( -7.825 -0.264 1.304) 7.937 6.118 ( 0.568 4.673 5.428) 7.185 6.221 ( -1.625 -1.211 -3.191) 3.780 6.249 ( -0.542 0.716 -3.396) 3.513 6.444 ( -1.002 9.446 0.425) 9.509 6.553 ( -5.155 -3.720 -4.142) 7.588 6.754 ( -3.197 -6.902 2.362) 7.965 6.911 ( -4.340 6.514 -3.559) 8.598 7.135 ( -3.785 2.395 0.868) 4.562 7.185 ( 2.334 -4.598 -0.024) 5.157 7.358 ( 2.881 -2.296 1.601) 4.017 7.645 ( -4.372 9.451 -2.076) 10.618 7.937 ( -6.766 0.670 6.556) 9.445 8.021 ( -6.646 -0.972 4.430) 8.046 8.128 ( -3.307 0.138 0.103) 3.312 8.310 ( -6.850 -2.121 4.034) 8.228 8.474 ( 0.339 1.746 -5.139) 5.438 8.559 ( 0.943 -1.279 -2.395) 2.875 8.759 ( -4.267 -7.170 3.002) 8.867 9.010 ( 0.984 2.447 -1.092) 2.855 9.101 ( 1.565 6.221 2.037) 6.730 9.200 ( 7.780 0.409 5.906) 9.776 9.346 ( 6.844 0.232 0.197) 6.851 9.507 ( 9.363 0.811 1.982) 9.605 9.586 ( 7.756 5.208 -7.834) 12.192 9.624 ( 2.054 -1.714 1.571) 3.102 9.804 ( 4.895 -5.086 -4.476) 8.359 10.371 ( 1.327 1.568 0.883) 2.236 10.510 ( 3.691 -3.640 -0.846) 5.253 10.571 ( 0.078 3.266 0.372) 3.289 10.928 ( 6.512 -10.070 -1.001) 12.033 20.551 ( -0.707 1.752 -0.444) 1.941 20.560 ( -0.848 1.282 -0.976) 1.821 20.865 ( -2.101 1.781 0.492) 2.798 20.914 ( -1.399 -0.148 -0.372) 1.455 22.773 ( -1.583 1.622 -1.776) 2.880 22.855 ( 0.797 -1.765 0.002) 1.937 23.056 ( -0.185 1.699 0.118) 1.713 23.137 ( 1.981 -1.484 1.031) 2.681 24.607 ( -2.419 -1.240 0.380) 2.744 24.639 ( -1.444 -2.846 0.440) 3.222 24.949 ( 1.264 1.905 0.982) 2.488 24.976 ( 1.335 0.782 0.343) 1.585 25.759 ( -4.877 1.253 -0.350) 5.048 25.802 ( -4.087 -0.150 -0.013) 4.090 26.076 ( -4.075 0.790 0.722) 4.213 26.099 ( -4.656 -0.020 -0.722) 4.712 28.328 ( -1.346 0.119 1.258) 1.847 28.333 ( 0.337 -0.230 1.564) 1.617 28.531 ( -0.409 0.645 -0.261) 0.807 28.579 ( -0.838 -1.470 -0.214) 1.706 28.632 ( -0.911 1.151 0.604) 1.587 28.702 ( 1.728 0.680 0.087) 1.859 28.759 ( 1.093 -2.592 -1.602) 3.237 28.817 ( 3.045 -2.890 -0.642) 4.246 32.349 ( 0.225 1.009 0.939) 1.397 32.414 ( -0.070 -1.611 0.570) 1.710 32.469 ( 0.578 1.219 -0.309) 1.384 32.518 ( 0.361 -0.658 -0.930) 1.195 35.406 ( -0.047 0.485 1.608) 1.680 35.424 ( -0.721 -0.245 -0.019) 0.762 35.495 ( -0.735 1.321 -0.263) 1.535 35.530 ( -0.057 -0.322 -0.987) 1.040 88.733 ( 0.752 0.067 1.738) 1.895 88.762 ( -0.704 -1.165 1.813) 2.268 89.026 ( 5.430 3.328 -0.755) 6.413 89.245 ( 6.156 -6.191 1.719) 8.898 97.636 ( 1.566 0.191 -0.405) 1.629 97.657 ( 1.294 -0.677 -0.205) 1.475 97.683 ( 1.840 0.808 0.041) 2.010 97.750 ( 3.328 -2.090 0.648) 3.983 98.691 ( 0.021 1.112 0.175) 1.126 98.726 ( 0.526 -0.261 0.647) 0.874 98.911 ( -3.318 3.785 -0.014) 5.034 98.948 ( -3.851 2.512 -2.121) 5.063 99.680 ( -1.398 0.961 -1.021) 1.980 99.697 ( -3.149 0.086 -0.441) 3.180 99.832 ( 1.006 4.995 -0.957) 5.184 100.172 ( 5.354 -9.233 0.048) 10.673 ======================= Grid point 84 (42/92) ======================= q-point: ( 0.33 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.469 ( 9.750 5.855 7.518) 13.634 1.695 ( 6.865 7.457 -7.628) 12.686 1.722 ( 1.899 -0.846 -0.451) 2.127 1.848 ( 8.110 5.443 -3.181) 10.272 1.907 ( 5.167 4.545 -2.636) 7.369 2.078 ( 4.043 -0.574 1.128) 4.236 2.126 ( 0.918 -0.152 -7.688) 7.744 2.222 ( 2.865 -2.358 0.927) 3.825 2.256 ( -4.206 0.663 1.021) 4.379 2.386 ( -2.774 -1.819 1.300) 3.563 2.493 ( -1.560 0.039 1.951) 2.499 2.526 ( -5.003 0.023 1.186) 5.141 2.655 ( -2.080 0.031 -0.397) 2.118 2.713 ( 1.366 3.242 -0.679) 3.583 2.750 ( -2.028 -5.866 -4.061) 7.417 2.831 ( -2.024 -1.064 -1.799) 2.909 2.884 ( 1.017 0.475 6.395) 6.493 2.988 ( 2.926 0.063 4.740) 5.571 3.043 ( -4.187 0.232 4.361) 6.050 3.069 ( -0.257 -0.667 0.312) 0.780 3.173 ( -5.522 1.660 1.627) 5.991 3.250 ( -4.346 -0.814 -0.832) 4.499 3.438 ( 4.817 5.032 0.253) 6.971 3.535 ( 4.143 0.337 -2.599) 4.902 4.388 ( 1.512 -1.428 0.059) 2.081 4.395 ( -3.749 -1.737 1.215) 4.307 4.530 ( -4.283 -3.112 0.518) 5.319 4.559 ( -1.196 -4.590 2.464) 5.345 4.820 ( -4.050 2.381 2.316) 5.238 4.936 ( 1.614 -1.284 -3.885) 4.399 4.992 ( 0.308 3.072 -2.099) 3.733 5.122 ( -1.529 0.114 -1.397) 2.074 5.204 ( -0.422 -2.930 3.389) 4.500 5.242 ( -1.507 -4.901 -0.464) 5.149 5.275 ( -6.044 -1.174 -0.160) 6.159 5.396 ( -3.727 -7.027 -1.711) 8.136 5.524 ( -5.305 0.921 -2.918) 6.124 5.592 ( -6.474 -0.190 -0.005) 6.477 5.760 ( -6.788 0.072 -0.360) 6.798 5.834 ( -4.933 3.134 3.622) 6.876 5.855 ( -8.822 -2.416 0.417) 9.157 5.967 ( 2.215 -1.307 0.275) 2.587 6.171 ( -3.217 4.813 2.958) 6.501 6.199 ( -0.172 0.674 -3.739) 3.803 6.253 ( 5.048 -2.772 5.526) 7.981 6.444 ( -1.424 0.128 -1.310) 1.940 6.493 ( 1.064 4.949 -0.116) 5.063 6.667 ( -4.956 -3.587 0.009) 6.118 6.887 ( -0.297 5.018 1.200) 5.169 7.024 ( -7.521 4.151 -1.955) 8.810 7.225 ( 2.102 -3.085 -0.363) 3.751 7.392 ( 1.306 0.147 -1.236) 1.804 7.647 ( 3.938 6.677 -0.464) 7.766 7.834 ( -6.467 0.889 -1.812) 6.775 7.956 ( -6.181 -1.086 3.313) 7.097 8.086 ( -1.935 -1.975 -1.086) 2.971 8.215 ( -7.061 3.525 2.015) 8.146 8.485 ( 3.132 1.950 0.569) 3.733 8.570 ( 1.153 -0.838 -0.053) 1.426 8.711 ( -4.610 -7.234 1.810) 8.767 9.012 ( 1.492 6.692 -2.370) 7.254 9.136 ( 2.708 2.614 -0.154) 3.767 9.364 ( 3.574 0.266 -0.830) 3.679 9.410 ( 2.344 8.409 2.976) 9.223 9.562 ( 2.690 -3.975 -2.125) 5.248 9.675 ( 5.322 -2.833 1.366) 6.182 9.733 ( 6.170 2.321 -0.063) 6.592 9.863 ( 7.335 -3.937 -4.269) 9.356 10.410 ( 1.472 0.216 1.682) 2.246 10.516 ( -2.555 -2.641 2.122) 4.243 10.604 ( 3.134 3.169 -0.941) 4.556 11.014 ( 5.254 -11.636 -1.979) 12.919 20.526 ( -0.714 1.999 -0.463) 2.172 20.557 ( -0.011 0.394 0.102) 0.407 20.836 ( -1.935 1.724 0.569) 2.653 20.888 ( -1.121 -0.355 -0.379) 1.235 22.738 ( -0.827 2.100 -0.607) 2.337 22.858 ( 0.207 -3.035 -0.318) 3.058 23.063 ( 0.274 2.466 0.291) 2.498 23.173 ( 1.308 -2.182 0.172) 2.550 24.574 ( -2.060 -0.962 0.494) 2.327 24.618 ( -1.428 -3.246 0.257) 3.555 24.979 ( 1.275 2.220 0.264) 2.574 24.997 ( 1.118 1.275 -0.335) 1.728 25.681 ( -3.624 1.945 -0.386) 4.131 25.731 ( -4.207 0.156 0.135) 4.212 26.014 ( -4.125 0.061 0.841) 4.210 26.025 ( -3.277 -0.437 -0.357) 3.326 28.324 ( -0.599 0.710 1.097) 1.437 28.357 ( 0.587 -0.631 1.354) 1.605 28.526 ( -0.002 0.606 -0.103) 0.615 28.563 ( -0.352 -1.174 -0.799) 1.463 28.623 ( -0.994 1.151 0.583) 1.629 28.729 ( 1.336 -0.253 0.119) 1.365 28.748 ( 0.105 -0.930 -1.877) 2.097 28.850 ( 1.810 -2.978 -0.858) 3.589 32.361 ( 0.367 0.497 0.433) 0.755 32.408 ( -0.921 -1.515 0.084) 1.774 32.482 ( 1.332 1.404 -0.295) 1.957 32.516 ( 0.225 0.031 -0.569) 0.613 35.408 ( -0.379 0.359 0.054) 0.525 35.427 ( -0.020 -0.322 1.116) 1.162 35.479 ( -0.768 1.356 -0.151) 1.566 35.523 ( 0.080 -0.445 -0.530) 0.696 88.768 ( 0.650 -0.800 2.094) 2.334 88.776 ( 0.211 -1.149 1.792) 2.139 89.103 ( 4.517 3.631 -0.901) 5.865 89.341 ( 3.282 -6.820 0.789) 7.609 97.660 ( 1.534 0.034 -0.241) 1.553 97.677 ( 1.175 -0.644 0.158) 1.349 97.713 ( 1.574 0.988 0.116) 1.862 97.809 ( 2.527 -3.140 0.605) 4.075 98.697 ( 0.662 1.163 0.078) 1.340 98.741 ( 0.698 -0.375 0.220) 0.822 98.859 ( -3.274 3.034 0.569) 4.500 98.875 ( -3.422 2.279 -0.336) 4.125 99.630 ( -2.118 0.700 -0.883) 2.399 99.664 ( -0.725 -0.576 0.132) 0.935 99.850 ( 1.362 7.376 -0.257) 7.505 100.232 ( 3.016 -8.972 -1.665) 9.611 ======================= Grid point 85 (43/92) ======================= q-point: ( 0.44 0.33 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.613 ( -0.169 3.646 1.089) 3.809 1.664 ( 0.541 1.506 -9.615) 9.748 1.775 ( 7.810 4.714 -3.835) 9.896 1.919 ( 3.474 4.692 -2.867) 6.505 1.961 ( 3.512 3.522 -2.424) 5.533 2.080 ( 3.550 2.028 -6.057) 7.308 2.116 ( 1.250 -0.433 -5.411) 5.570 2.217 ( 1.245 -0.767 2.998) 3.335 2.276 ( 0.095 1.432 0.753) 1.621 2.333 ( -2.609 -0.074 -2.499) 3.613 2.414 ( -5.482 -4.097 -2.848) 7.413 2.500 ( -1.730 0.123 2.495) 3.039 2.579 ( -3.342 -0.530 -2.430) 4.166 2.655 ( -1.000 1.510 -4.809) 5.138 2.718 ( 1.082 -3.670 -2.081) 4.356 2.767 ( -2.832 1.154 -3.809) 4.885 2.948 ( -2.579 1.991 4.285) 5.383 3.006 ( -0.883 -1.508 0.518) 1.823 3.075 ( -1.068 -0.218 7.069) 7.153 3.110 ( -1.834 -0.815 2.884) 3.514 3.193 ( -1.950 0.358 5.686) 6.022 3.207 ( 1.823 -0.418 7.796) 8.018 3.501 ( 2.138 5.592 2.264) 6.401 3.604 ( 4.840 -0.384 0.584) 4.890 4.348 ( -2.400 -2.564 0.989) 3.648 4.433 ( 2.072 -2.555 1.441) 3.592 4.471 ( -4.199 -2.422 1.952) 5.226 4.560 ( -1.505 -3.922 2.084) 4.689 4.786 ( -2.959 2.175 0.255) 3.681 4.934 ( 4.019 -3.639 -6.353) 8.352 4.994 ( 1.626 3.217 -0.752) 3.682 5.067 ( -1.466 2.380 0.300) 2.811 5.186 ( -1.682 -4.030 -1.043) 4.490 5.230 ( -1.469 -2.239 3.614) 4.498 5.259 ( 2.082 -3.540 1.390) 4.336 5.361 ( -0.388 -6.740 0.334) 6.759 5.453 ( -1.720 -1.715 -0.047) 2.429 5.506 ( -3.821 -1.080 1.504) 4.246 5.650 ( -2.933 -0.116 -0.567) 2.989 5.717 ( -4.345 -2.556 -0.313) 5.050 5.843 ( -2.207 5.205 5.059) 7.587 6.049 ( 4.204 1.956 -0.438) 4.658 6.083 ( -5.070 -0.077 1.146) 5.198 6.233 ( 0.558 -0.634 1.029) 1.331 6.291 ( -2.010 -0.372 -1.252) 2.397 6.493 ( 6.067 -3.609 6.394) 9.525 6.522 ( -0.266 5.125 1.605) 5.377 6.610 ( -3.108 -2.348 0.808) 3.978 6.889 ( -2.211 10.152 -0.014) 10.390 6.907 ( -1.180 0.162 -1.749) 2.116 7.232 ( 0.262 -3.592 -2.339) 4.294 7.371 ( 0.294 -1.054 -5.187) 5.301 7.692 ( 2.525 5.164 -3.736) 6.856 7.732 ( -2.493 5.595 -2.542) 6.632 7.895 ( -4.158 -0.086 1.518) 4.427 8.033 ( -0.478 -2.022 -3.105) 3.736 8.156 ( -3.406 6.604 3.191) 8.087 8.562 ( 2.577 0.445 3.789) 4.604 8.569 ( -1.156 -1.998 -0.575) 2.379 8.676 ( -1.249 -2.729 2.164) 3.700 9.009 ( 1.360 7.463 -2.919) 8.128 9.184 ( 3.244 0.084 -0.850) 3.354 9.324 ( -1.448 4.549 -4.479) 6.546 9.449 ( -1.873 4.029 0.546) 4.476 9.639 ( 2.437 -5.878 5.305) 8.284 9.734 ( 1.999 -4.188 -0.767) 4.703 9.809 ( 3.903 2.016 -0.934) 4.492 9.921 ( 3.879 -3.048 -3.456) 6.023 10.442 ( 0.167 -0.166 0.326) 0.402 10.501 ( -2.334 0.714 4.138) 4.804 10.638 ( 1.379 1.652 0.209) 2.162 11.048 ( 2.257 -11.756 -3.589) 12.497 20.520 ( 0.044 1.850 0.243) 1.866 20.557 ( 0.029 0.029 -0.092) 0.101 20.817 ( -1.005 1.690 0.600) 2.056 20.871 ( -0.320 -0.483 -0.465) 0.743 22.738 ( 0.464 2.207 1.321) 2.614 22.865 ( 0.515 -3.187 0.610) 3.285 23.060 ( -0.355 2.414 -0.850) 2.584 23.176 ( -0.105 -2.510 -1.559) 2.957 24.554 ( -1.005 -0.863 0.736) 1.515 24.602 ( -0.643 -3.320 0.201) 3.387 24.989 ( 0.187 2.526 -0.745) 2.640 25.006 ( 0.528 1.374 -0.668) 1.616 25.642 ( -0.724 2.168 -0.005) 2.285 25.676 ( -2.290 0.750 0.039) 2.410 25.969 ( -1.850 -0.075 0.446) 1.905 25.987 ( -1.099 -0.884 0.040) 1.411 28.329 ( -0.492 0.934 1.306) 1.679 28.375 ( -0.318 -0.927 1.363) 1.679 28.530 ( 0.470 0.625 0.171) 0.800 28.554 ( 0.432 -0.580 -0.969) 1.209 28.611 ( -1.047 0.816 0.393) 1.385 28.723 ( -0.069 -2.493 -2.168) 3.305 28.755 ( 1.099 1.364 0.337) 1.783 28.860 ( 0.739 -2.719 -1.279) 3.094 32.370 ( 0.209 -0.001 0.131) 0.247 32.392 ( -0.752 -1.013 -0.170) 1.273 32.500 ( 0.805 1.038 -0.144) 1.321 32.513 ( 0.210 0.641 -0.476) 0.826 35.405 ( -0.102 0.421 0.190) 0.473 35.430 ( -0.716 -0.549 0.406) 0.989 35.471 ( -0.059 1.502 0.236) 1.521 35.521 ( 0.299 -0.573 -0.446) 0.785 88.789 ( -0.532 -0.821 2.122) 2.336 88.809 ( 0.161 -1.956 2.881) 3.486 89.148 ( 2.071 3.480 -1.049) 4.183 89.363 ( -0.103 -5.941 -1.547) 6.140 97.677 ( 0.674 0.100 -0.019) 0.682 97.699 ( 0.747 -0.631 0.730) 1.220 97.734 ( 0.608 0.779 0.268) 1.024 97.837 ( 0.388 -3.477 -0.182) 3.504 98.712 ( 0.693 1.245 0.248) 1.447 98.754 ( 0.487 -0.098 -0.070) 0.501 98.822 ( -1.357 2.300 0.434) 2.705 98.829 ( -1.994 2.186 0.458) 2.994 99.611 ( -0.025 1.121 0.620) 1.281 99.670 ( 0.105 -0.924 1.591) 1.843 99.865 ( 0.638 7.239 -0.051) 7.267 100.238 ( 1.154 -8.603 -3.561) 9.382 ======================= Grid point 86 (44/92) ======================= q-point: (-0.44 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.484 ( -10.795 4.216 -3.853) 12.213 1.558 ( -4.734 2.147 -5.978) 7.922 1.783 ( 0.707 6.277 -11.836) 13.416 1.911 ( 6.316 2.793 -4.750) 8.382 1.994 ( 0.738 3.484 -0.933) 3.681 2.050 ( -1.402 -3.291 -7.674) 8.467 2.129 ( 1.784 0.656 1.683) 2.539 2.183 ( -4.405 -0.729 -1.408) 4.681 2.238 ( 1.379 2.271 -6.717) 7.223 2.338 ( 3.027 -1.123 4.230) 5.321 2.354 ( -2.803 -4.016 0.714) 4.950 2.480 ( -2.412 -1.011 1.020) 2.807 2.539 ( 0.887 2.027 -0.431) 2.254 2.611 ( -0.492 2.719 -2.565) 3.770 2.658 ( -3.566 2.097 -2.966) 5.090 2.755 ( 4.721 -1.628 -2.029) 5.391 2.929 ( -3.572 -0.055 -1.959) 4.075 2.990 ( -0.910 -0.754 3.224) 3.434 3.071 ( -2.298 -0.230 3.917) 4.547 3.148 ( 1.256 -1.946 3.837) 4.482 3.275 ( -1.358 1.329 6.903) 7.160 3.302 ( 1.048 0.480 7.412) 7.501 3.575 ( 2.763 5.062 3.374) 6.681 3.685 ( 2.763 -0.548 2.095) 3.510 4.340 ( -0.185 -1.259 1.146) 1.713 4.429 ( -3.568 -1.446 2.628) 4.661 4.485 ( 2.969 -4.282 0.472) 5.232 4.561 ( -1.189 -4.177 2.547) 5.035 4.730 ( -1.423 0.516 -1.560) 2.174 4.918 ( 1.828 -6.615 -5.645) 8.886 5.048 ( 3.403 2.558 -0.065) 4.258 5.102 ( 5.352 3.302 -0.225) 6.293 5.177 ( -2.510 1.956 3.393) 4.652 5.262 ( 4.780 -4.677 1.519) 6.857 5.322 ( 0.990 -2.909 2.698) 4.090 5.373 ( 1.400 -6.496 0.398) 6.658 5.471 ( 4.048 -1.494 0.003) 4.314 5.495 ( 0.428 -2.206 1.113) 2.508 5.627 ( 1.553 2.815 -0.973) 3.359 5.712 ( 1.695 0.118 -0.834) 1.893 5.859 ( -2.047 3.184 3.976) 5.490 6.019 ( -4.517 -2.880 2.289) 5.826 6.113 ( 3.788 0.044 -1.946) 4.259 6.203 ( 2.871 -2.886 1.766) 4.437 6.347 ( 1.716 5.533 5.416) 7.930 6.501 ( -3.932 3.550 0.902) 5.373 6.575 ( -1.387 -1.777 0.360) 2.282 6.670 ( 5.128 -5.340 6.779) 10.038 6.848 ( 0.578 6.350 -1.329) 6.513 6.921 ( 3.342 1.448 -2.756) 4.568 7.191 ( -0.920 -4.962 -3.585) 6.190 7.313 ( 1.018 -3.800 -6.259) 7.393 7.648 ( -1.843 6.407 -3.630) 7.591 7.677 ( -1.401 8.594 -3.909) 9.545 7.856 ( -1.014 1.748 1.035) 2.270 8.046 ( 5.056 2.520 -2.520) 6.186 8.156 ( -1.181 4.323 3.695) 5.808 8.548 ( 0.801 -3.186 -1.737) 3.716 8.626 ( 0.247 -0.304 3.162) 3.186 8.700 ( -0.021 -0.594 3.199) 3.254 8.993 ( 0.509 7.257 -3.118) 7.915 9.211 ( 1.359 -1.418 -1.713) 2.606 9.254 ( -3.364 3.527 -0.325) 4.884 9.386 ( -4.602 1.019 -1.410) 4.920 9.669 ( -2.834 -3.452 0.168) 4.469 9.746 ( -1.356 -2.863 0.656) 3.235 9.846 ( 0.323 0.629 1.157) 1.355 9.930 ( 2.395 -2.935 -3.133) 4.916 10.411 ( -4.113 2.617 1.475) 5.093 10.533 ( 1.159 0.510 2.234) 2.568 10.654 ( -0.901 -0.035 1.963) 2.160 11.016 ( -0.507 -10.812 -4.814) 11.846 20.531 ( 0.739 1.606 0.585) 1.863 20.556 ( 0.111 0.227 -0.229) 0.341 20.818 ( 0.317 1.657 0.656) 1.810 20.869 ( 0.756 -0.458 -0.539) 1.035 22.777 ( 1.338 1.978 2.797) 3.678 22.877 ( -0.233 -1.946 0.172) 1.968 23.044 ( -0.021 1.360 -0.571) 1.475 23.141 ( -1.047 -2.366 -2.906) 3.891 24.557 ( 0.246 -0.847 0.927) 1.280 24.601 ( 0.329 -3.106 0.092) 3.125 24.973 ( -0.959 2.477 -0.883) 2.799 24.996 ( -0.551 1.272 -1.080) 1.757 25.649 ( 0.897 1.845 0.166) 2.058 25.671 ( 2.308 1.158 -0.071) 2.583 25.968 ( 1.269 0.259 0.520) 1.395 25.991 ( 1.593 -0.791 0.045) 1.779 28.332 ( -0.914 0.789 1.488) 1.917 28.371 ( -1.789 -0.732 1.200) 2.275 28.543 ( 0.442 0.777 0.697) 1.133 28.557 ( 1.264 0.164 -1.197) 1.749 28.599 ( -0.724 0.182 0.232) 0.781 28.700 ( 0.144 -2.297 -2.086) 3.106 28.775 ( 0.829 0.396 0.399) 1.002 28.849 ( -0.033 -2.493 -1.753) 3.048 32.364 ( -0.930 0.044 -0.013) 0.931 32.386 ( 0.204 -0.934 -0.280) 0.997 32.497 ( -0.525 1.291 -0.245) 1.415 32.521 ( 0.842 0.321 -0.265) 0.939 35.404 ( -0.735 0.388 0.187) 0.852 35.417 ( -0.653 -0.118 0.073) 0.668 35.481 ( 0.649 1.258 0.495) 1.500 35.525 ( 0.759 -0.636 -0.388) 1.063 88.797 ( -1.398 -0.751 2.377) 2.858 88.836 ( -1.187 -2.917 3.757) 4.903 89.149 ( -0.914 2.868 -0.360) 3.032 89.312 ( -2.414 -4.254 -3.634) 6.094 97.681 ( -0.346 0.328 0.335) 0.582 97.707 ( -0.517 0.124 0.060) 0.535 97.744 ( -0.372 -0.785 1.456) 1.696 97.819 ( -1.623 -2.929 -0.972) 3.486 98.716 ( -0.793 1.251 0.482) 1.557 98.742 ( -1.282 0.403 -0.402) 1.403 98.825 ( 1.328 2.545 0.509) 2.915 98.846 ( 3.136 1.738 0.698) 3.653 99.637 ( 1.432 1.527 1.603) 2.637 99.690 ( 0.039 0.498 1.152) 1.256 99.879 ( 0.249 4.211 1.860) 4.610 100.195 ( -0.426 -8.326 -5.615) 10.051 ======================= Grid point 87 (45/92) ======================= q-point: (-0.33 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.241 ( -12.371 8.959 -4.304) 15.869 1.344 ( -12.256 7.499 -4.474) 15.049 1.718 ( 1.762 -0.821 -6.405) 6.693 1.836 ( -3.073 -5.375 -7.318) 9.585 1.932 ( -3.097 -0.130 -1.763) 3.566 2.065 ( 0.223 3.870 2.363) 4.540 2.118 ( 1.077 4.210 -2.215) 4.877 2.138 ( -0.427 -4.553 -2.881) 5.404 2.242 ( 4.639 2.480 -2.024) 5.636 2.304 ( -6.709 -0.849 4.803) 8.294 2.432 ( 1.287 0.770 1.673) 2.247 2.443 ( -2.947 1.553 -0.421) 3.358 2.517 ( -4.416 5.593 -0.972) 7.192 2.575 ( 1.034 2.177 1.819) 3.019 2.640 ( 4.725 -1.114 -3.758) 6.140 2.833 ( 5.643 -3.136 -0.677) 6.491 2.845 ( -1.719 0.973 -2.009) 2.817 3.020 ( 1.298 -2.922 0.432) 3.226 3.103 ( 0.780 1.850 3.642) 4.158 3.223 ( 3.148 -1.103 3.380) 4.749 3.305 ( -0.577 1.165 2.490) 2.809 3.366 ( -1.469 -0.803 5.088) 5.356 3.640 ( 0.970 3.981 2.019) 4.568 3.727 ( -0.796 -0.409 2.238) 2.410 4.338 ( -1.303 -0.293 0.186) 1.348 4.425 ( -0.270 -1.645 2.420) 2.939 4.527 ( 2.010 -4.383 -0.939) 4.912 4.601 ( 3.524 -3.759 2.538) 5.743 4.728 ( 2.467 -0.888 -0.621) 2.694 4.903 ( 3.024 -6.515 -2.743) 7.688 5.064 ( -1.142 3.950 -0.134) 4.114 5.144 ( -0.757 2.833 1.861) 3.473 5.236 ( 5.082 -1.219 1.992) 5.593 5.332 ( -0.578 -5.662 -0.573) 5.720 5.388 ( 3.389 -1.636 1.076) 3.914 5.425 ( 6.253 -3.678 0.201) 7.257 5.514 ( 2.745 0.886 -3.671) 4.669 5.552 ( 4.970 -1.709 -0.763) 5.311 5.688 ( 4.442 1.981 0.397) 4.880 5.750 ( 5.526 0.683 -1.411) 5.744 5.849 ( 0.603 1.750 1.702) 2.514 5.965 ( -4.848 -4.233 1.623) 6.637 6.182 ( 5.646 6.871 1.620) 9.039 6.361 ( 1.513 3.203 0.987) 3.677 6.425 ( 2.503 1.057 8.095) 8.538 6.440 ( -1.858 3.841 1.762) 4.616 6.591 ( 4.954 -4.711 0.497) 6.854 6.732 ( -1.633 -6.506 0.805) 6.756 6.921 ( 5.280 0.453 -0.050) 5.299 6.961 ( 6.883 3.750 -0.959) 7.897 7.151 ( 0.262 -6.812 -1.518) 6.984 7.286 ( 2.801 -5.811 -5.125) 8.239 7.571 ( -1.048 7.908 -5.894) 9.918 7.610 ( -1.523 7.467 -2.853) 8.137 7.902 ( 3.744 3.442 2.382) 5.616 8.112 ( 3.863 7.781 0.873) 8.731 8.197 ( 1.456 0.683 3.456) 3.812 8.552 ( 1.153 -3.508 -1.778) 4.099 8.647 ( -0.374 0.059 1.908) 1.946 8.729 ( 1.552 -0.995 -0.107) 1.847 8.956 ( -2.634 6.821 -0.557) 7.333 9.182 ( -2.601 1.383 -1.149) 3.162 9.219 ( -1.209 -2.215 -0.059) 2.524 9.280 ( -6.709 -1.036 0.089) 6.789 9.588 ( -5.324 -1.615 -1.553) 5.776 9.663 ( -6.780 0.022 -2.333) 7.170 9.855 ( -1.454 -0.715 2.023) 2.592 9.930 ( -0.179 -2.837 -1.347) 3.146 10.359 ( -3.661 4.414 1.547) 5.939 10.568 ( 0.990 2.040 0.180) 2.274 10.646 ( -3.582 -3.618 3.691) 6.289 10.939 ( -2.164 -9.287 -4.917) 10.729 20.547 ( 0.402 1.336 -0.243) 1.416 20.569 ( 1.834 0.845 0.500) 2.080 20.841 ( 1.461 1.665 0.734) 2.334 20.884 ( 1.581 -0.237 -0.541) 1.688 22.826 ( 0.448 1.003 2.014) 2.294 22.851 ( -1.305 0.296 -1.423) 1.954 23.058 ( 0.868 -0.336 1.023) 1.382 23.097 ( -0.180 -1.450 -2.095) 2.554 24.579 ( 1.078 -0.869 0.980) 1.696 24.612 ( 0.937 -2.588 -0.118) 2.755 24.944 ( -1.573 2.138 -0.339) 2.676 24.968 ( -1.321 1.085 -1.024) 1.993 25.683 ( 3.439 1.946 -0.346) 3.967 25.732 ( 4.311 0.285 0.134) 4.323 26.023 ( 4.418 0.915 0.695) 4.564 26.036 ( 3.453 -0.167 0.184) 3.462 28.328 ( -1.521 0.365 1.307) 2.039 28.346 ( -2.471 -0.286 1.054) 2.701 28.557 ( -0.285 0.856 1.556) 1.799 28.568 ( 1.890 0.905 -1.631) 2.655 28.593 ( -0.005 -0.492 -0.037) 0.493 28.682 ( -0.153 -2.661 -1.570) 3.093 28.789 ( 0.435 -0.573 0.119) 0.729 28.821 ( -0.887 -2.083 -2.028) 3.040 32.346 ( -1.193 0.451 0.098) 1.279 32.383 ( -0.217 -1.090 -0.466) 1.205 32.485 ( -0.537 1.633 -0.236) 1.735 32.530 ( 0.654 -0.286 -0.212) 0.745 35.385 ( -1.153 0.839 -0.139) 1.433 35.415 ( -0.093 -0.334 0.364) 0.502 35.502 ( 1.088 1.185 0.618) 1.723 35.537 ( 1.042 -0.505 -0.299) 1.196 88.792 ( -2.200 -0.710 2.403) 3.335 88.848 ( -2.487 -3.788 4.121) 6.125 89.116 ( -3.724 1.499 1.387) 4.248 89.218 ( -3.434 -2.727 -4.162) 6.045 97.672 ( -1.227 0.387 0.404) 1.348 97.687 ( -1.424 0.477 -0.400) 1.554 97.744 ( -1.987 -1.996 1.512) 3.196 97.774 ( -2.159 -2.136 -0.493) 3.077 98.702 ( -1.223 0.935 0.416) 1.595 98.716 ( -1.064 0.239 -0.523) 1.209 98.878 ( 3.818 3.570 0.780) 5.285 98.930 ( 5.756 2.153 1.026) 6.231 99.675 ( 0.408 2.645 0.163) 2.681 99.693 ( 0.918 1.920 0.346) 2.156 99.916 ( -0.025 -0.323 4.478) 4.490 100.105 ( -2.065 -7.637 -7.605) 10.974 ======================= Grid point 88 (46/92) ======================= q-point: (-0.22 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.023 ( -8.443 14.727 -1.674) 17.058 1.126 ( -11.999 12.942 3.283) 17.951 1.616 ( -5.410 -7.278 -3.119) 9.590 1.828 ( 3.199 -7.147 1.257) 7.930 1.889 ( -0.661 0.819 -0.698) 1.263 1.985 ( -10.008 8.648 1.919) 13.365 2.089 ( 1.521 -2.448 -2.980) 4.146 2.140 ( -4.510 3.786 -2.715) 6.484 2.223 ( -4.746 5.813 0.609) 7.529 2.322 ( 4.230 4.449 1.748) 6.383 2.330 ( -3.856 1.696 0.763) 4.281 2.433 ( 0.431 0.161 -1.059) 1.155 2.543 ( 1.245 0.577 5.405) 5.576 2.631 ( 2.089 0.252 0.936) 2.303 2.692 ( 4.940 -3.073 -2.134) 6.196 2.821 ( 0.385 -1.444 -0.729) 1.663 2.910 ( 3.653 -3.518 -1.297) 5.234 3.044 ( 2.453 -4.328 -1.246) 5.128 3.163 ( 2.595 4.235 2.501) 5.561 3.294 ( 0.436 1.915 0.103) 1.966 3.321 ( 0.793 -0.885 1.251) 1.725 3.384 ( 2.263 -0.448 -0.166) 2.313 3.639 ( -2.232 2.809 -0.235) 3.595 3.703 ( -3.928 -0.615 0.965) 4.091 4.318 ( -0.351 -1.279 -0.724) 1.511 4.443 ( -0.709 -4.573 1.825) 4.975 4.558 ( 4.390 -1.364 -1.904) 4.976 4.689 ( 3.325 -5.198 0.506) 6.191 4.785 ( 4.395 1.366 0.187) 4.607 4.983 ( 5.778 -4.476 2.067) 7.595 5.047 ( 1.462 3.442 0.318) 3.754 5.191 ( 2.819 0.680 2.787) 4.023 5.260 ( -3.391 -3.884 -3.426) 6.191 5.313 ( 1.235 -3.340 3.444) 4.954 5.446 ( 4.215 0.929 -3.948) 5.850 5.502 ( 1.251 0.213 -1.301) 1.817 5.509 ( 4.254 -0.753 -6.314) 7.651 5.594 ( -1.196 -3.563 2.942) 4.773 5.746 ( 3.070 0.935 2.040) 3.803 5.843 ( 3.231 -2.437 0.105) 4.048 5.891 ( -0.418 1.157 0.332) 1.274 5.986 ( 8.134 -1.397 1.145) 8.332 6.276 ( -3.304 5.844 -2.490) 7.160 6.289 ( 1.151 8.050 1.612) 8.290 6.424 ( -2.779 1.880 2.833) 4.391 6.487 ( -0.287 1.363 -1.775) 2.256 6.691 ( 1.530 -1.892 -0.410) 2.467 6.842 ( 12.176 -5.327 3.103) 13.647 6.952 ( 2.537 0.577 -1.713) 3.115 7.118 ( 7.578 4.497 0.763) 8.845 7.195 ( 2.784 -8.195 4.186) 9.614 7.309 ( 5.283 -3.544 0.431) 6.377 7.515 ( 4.651 5.895 -7.326) 10.491 7.571 ( -0.481 4.702 -2.052) 5.153 7.981 ( 2.601 3.125 0.688) 4.124 8.217 ( 5.771 3.577 2.953) 7.404 8.276 ( 1.493 3.284 7.974) 8.752 8.531 ( -1.811 -3.551 -1.236) 4.173 8.657 ( 0.163 -0.059 -0.525) 0.553 8.751 ( 3.439 -0.599 -4.248) 5.498 8.901 ( -5.974 5.503 4.329) 9.204 9.091 ( -5.253 2.442 -3.480) 6.758 9.192 ( -0.743 -1.217 -2.495) 2.874 9.217 ( -4.097 -8.007 6.513) 11.105 9.459 ( -9.559 1.800 -0.150) 9.728 9.521 ( -4.896 0.726 -3.571) 6.103 9.832 ( -1.948 -1.550 -1.010) 2.686 9.895 ( -3.003 -3.385 0.290) 4.534 10.329 ( -1.179 5.748 0.201) 5.871 10.536 ( -4.343 4.396 -1.630) 6.391 10.634 ( -2.619 -6.820 4.182) 8.418 10.851 ( -2.397 -7.724 -3.971) 9.009 20.549 ( 0.444 2.166 -0.468) 2.260 20.620 ( 3.703 -0.057 -0.010) 3.703 20.879 ( 2.106 1.691 0.619) 2.771 20.906 ( 1.670 0.128 -0.484) 1.743 22.794 ( -1.276 1.385 -2.066) 2.795 22.853 ( -0.365 -0.875 0.755) 1.212 23.067 ( 0.659 0.523 -0.561) 1.011 23.109 ( 0.820 -0.912 1.303) 1.790 24.609 ( 1.203 -0.926 1.026) 1.832 24.627 ( 1.023 -1.886 -0.188) 2.153 24.918 ( -1.513 1.682 0.402) 2.298 24.936 ( -1.511 0.878 -0.340) 1.780 25.751 ( 5.058 1.668 -0.494) 5.349 25.805 ( 4.194 -0.316 -0.020) 4.206 26.093 ( 3.912 1.265 -0.638) 4.161 26.131 ( 6.195 -0.002 1.666) 6.415 28.310 ( -1.840 0.123 1.028) 2.111 28.321 ( -1.900 -0.240 1.335) 2.335 28.565 ( -0.943 0.630 1.902) 2.215 28.583 ( 1.831 0.916 -1.574) 2.583 28.599 ( 0.863 -0.429 -0.251) 0.996 28.655 ( -1.645 -2.837 -1.094) 3.457 28.774 ( -2.471 -1.049 -0.771) 2.792 28.796 ( 0.695 -1.309 -1.247) 1.937 32.329 ( -1.113 0.709 0.475) 1.402 32.369 ( -0.857 -0.926 -0.219) 1.281 32.476 ( -0.244 1.780 -0.343) 1.829 32.538 ( 0.587 -0.856 -0.304) 1.082 35.368 ( -0.764 1.265 0.152) 1.486 35.422 ( 0.592 -0.663 0.281) 0.932 35.526 ( 0.875 0.839 0.426) 1.285 35.552 ( 1.201 -0.157 -0.216) 1.231 88.777 ( -2.484 -0.654 2.211) 3.389 88.842 ( -3.350 -4.240 4.070) 6.765 89.053 ( -5.558 0.098 1.204) 5.687 89.125 ( -3.856 -2.593 -1.694) 4.946 97.652 ( -1.377 0.258 0.046) 1.402 97.658 ( -1.516 0.270 -0.227) 1.556 97.707 ( -2.448 -0.979 -0.278) 2.651 97.743 ( -2.842 -2.590 1.223) 4.035 98.689 ( -0.743 0.631 0.264) 1.010 98.698 ( -0.653 0.129 -0.173) 0.688 98.953 ( 4.015 4.489 0.406) 6.036 99.060 ( 8.675 1.756 0.898) 8.896 99.659 ( -0.164 3.290 -1.105) 3.474 99.725 ( 1.271 1.168 0.233) 1.742 99.956 ( -2.162 -3.224 2.209) 4.466 99.970 ( -2.898 -4.433 -5.999) 8.002 ======================= Grid point 89 (47/92) ======================= q-point: (-0.11 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.971 ( -2.877 16.261 9.381) 18.992 1.047 ( -4.045 18.932 7.612) 20.802 1.509 ( -7.887 -2.690 2.768) 8.781 1.802 ( -9.871 14.434 2.081) 17.610 1.853 ( -0.299 -11.591 -0.006) 11.595 1.945 ( -0.578 5.216 5.078) 7.303 2.024 ( 1.752 2.346 -6.518) 7.146 2.110 ( 0.628 -0.066 -5.569) 5.604 2.135 ( -1.487 -2.683 -0.364) 3.089 2.315 ( -1.877 0.150 5.103) 5.439 2.403 ( 1.445 7.903 1.711) 8.214 2.480 ( 2.517 -3.320 3.920) 5.721 2.587 ( -2.289 -0.908 2.481) 3.495 2.660 ( 1.411 0.058 0.926) 1.689 2.743 ( 1.677 -5.591 1.470) 6.019 2.854 ( 3.692 -0.514 0.958) 3.848 2.918 ( -0.331 -4.311 -1.511) 4.580 3.087 ( 4.169 -3.491 -1.005) 5.529 3.220 ( 1.375 2.100 -1.209) 2.786 3.283 ( 2.142 6.236 -2.338) 6.996 3.295 ( -1.323 -1.924 -4.213) 4.817 3.447 ( 3.622 1.505 -1.074) 4.067 3.573 ( -3.281 2.211 -2.417) 4.637 3.625 ( -4.748 -0.972 -1.879) 5.198 4.317 ( 1.196 -2.327 -0.586) 2.681 4.442 ( -1.880 -7.157 2.299) 7.749 4.623 ( 6.138 -0.139 -5.181) 8.034 4.718 ( 2.057 -4.096 -2.150) 5.062 4.858 ( 2.940 1.854 2.211) 4.119 5.057 ( 2.822 -1.715 0.746) 3.385 5.138 ( 3.013 0.456 -0.464) 3.083 5.207 ( 1.111 0.835 3.178) 3.468 5.302 ( 2.287 0.156 2.665) 3.516 5.321 ( 0.720 -0.832 -0.836) 1.382 5.430 ( 1.461 -0.119 -6.798) 6.955 5.484 ( -1.878 -1.243 -0.351) 2.279 5.508 ( 1.460 -1.826 -1.844) 2.977 5.589 ( -4.317 -4.458 6.396) 8.911 5.803 ( -2.756 0.340 -2.643) 3.834 5.846 ( 5.189 -1.103 1.970) 5.659 5.978 ( 6.059 -0.988 4.457) 7.587 6.111 ( 3.981 -3.535 0.827) 5.387 6.192 ( -2.877 3.640 -2.431) 5.238 6.263 ( -2.181 2.738 -1.299) 3.733 6.418 ( -1.743 1.558 1.805) 2.954 6.443 ( -3.055 -0.283 -0.336) 3.087 6.729 ( 4.725 9.122 -5.977) 11.885 6.939 ( 3.844 -0.574 -1.628) 4.214 7.043 ( 4.695 3.174 1.049) 5.764 7.186 ( 1.863 4.881 -0.799) 5.286 7.213 ( -0.196 -1.900 -3.770) 4.226 7.491 ( 1.403 -1.239 1.699) 2.528 7.518 ( 5.340 4.845 0.683) 7.243 7.690 ( 13.537 -4.385 8.064) 16.356 8.018 ( 1.105 4.459 2.120) 5.059 8.306 ( 3.457 -0.832 -1.644) 3.918 8.400 ( -1.022 3.155 8.553) 9.174 8.481 ( -1.348 -6.765 -0.758) 6.940 8.639 ( 0.675 0.867 -2.465) 2.699 8.743 ( -1.064 -0.902 -0.000) 1.395 8.847 ( -5.936 3.572 3.137) 7.605 8.984 ( -5.814 1.688 2.607) 6.592 9.157 ( -3.101 -2.190 1.320) 4.020 9.248 ( 2.780 -7.665 0.353) 8.161 9.310 ( -5.813 4.120 -0.651) 7.154 9.428 ( -3.464 -1.605 -2.134) 4.373 9.766 ( -2.125 -0.584 -4.964) 5.431 9.853 ( -2.407 -4.431 0.757) 5.099 10.321 ( 1.306 6.224 -1.995) 6.665 10.424 ( -5.124 3.639 -2.171) 6.649 10.630 ( -2.987 -4.064 3.363) 6.062 10.788 ( -0.676 -6.817 -2.552) 7.311 20.552 ( 0.487 2.940 -0.482) 3.019 20.674 ( 3.311 -1.786 -2.057) 4.288 20.911 ( 1.249 1.541 -0.713) 2.108 20.931 ( 1.604 0.359 0.266) 1.665 22.769 ( 0.238 1.641 -0.816) 1.848 22.848 ( -0.474 -1.711 -0.002) 1.775 23.074 ( 0.526 1.438 -0.323) 1.565 23.124 ( -0.225 -0.695 0.406) 0.835 24.638 ( 0.736 -1.206 1.160) 1.829 24.641 ( 0.632 -1.311 0.049) 1.456 24.905 ( -1.013 1.247 0.929) 1.856 24.917 ( -0.887 0.561 0.827) 1.336 25.824 ( 3.869 1.053 -0.436) 4.033 25.864 ( 2.931 -0.355 -0.302) 2.968 26.140 ( 2.441 2.175 -0.797) 3.365 26.241 ( 4.688 -2.470 0.265) 5.306 28.297 ( -1.203 0.138 1.140) 1.663 28.319 ( -0.482 -1.003 2.649) 2.873 28.568 ( -1.214 0.133 2.151) 2.473 28.587 ( -1.076 -0.460 -0.562) 1.298 28.610 ( 0.126 0.162 -0.760) 0.787 28.618 ( 0.895 -0.266 -0.360) 1.001 28.724 ( -2.723 0.420 -0.099) 2.757 28.794 ( 0.882 -2.024 -1.699) 2.786 32.321 ( -0.810 0.877 0.890) 1.489 32.360 ( -0.508 -0.809 0.999) 1.382 32.469 ( 0.031 1.723 -0.515) 1.798 32.542 ( 0.430 -1.346 -0.623) 1.544 35.364 ( -0.343 1.508 0.695) 1.696 35.438 ( 1.007 -1.256 -0.035) 1.610 35.533 ( 0.073 0.778 -0.422) 0.888 35.570 ( 0.947 -0.301 -0.286) 1.034 88.758 ( -2.588 -0.497 2.086) 3.361 88.824 ( -4.538 -4.080 4.668) 7.683 88.971 ( -4.354 0.447 -0.080) 4.378 89.052 ( -2.951 -3.020 -0.789) 4.295 97.633 ( -0.603 0.332 -0.371) 0.782 97.636 ( -0.905 -0.018 0.032) 0.905 97.672 ( -1.363 -0.390 -0.181) 1.429 97.699 ( -3.305 -1.667 0.498) 3.735 98.684 ( -0.111 0.398 0.165) 0.445 98.691 ( -0.450 0.279 0.592) 0.794 99.005 ( 2.277 5.282 -0.826) 5.811 99.200 ( 7.546 -1.957 -3.750) 8.651 99.668 ( 1.555 2.605 0.309) 3.049 99.730 ( 0.602 -0.213 -0.705) 0.951 99.830 ( -3.018 1.720 -3.195) 4.719 99.971 ( -2.242 -3.808 2.521) 5.088 ======================= Grid point 90 (48/92) ======================= q-point: ( 0.00 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.383 ( 1.530 -10.833 12.369) 16.513 1.383 ( 1.530 10.833 12.369) 16.513 1.502 ( -2.724 -18.482 3.892) 19.082 1.502 ( -2.724 18.482 3.892) 19.082 1.967 ( 0.809 -4.949 -2.253) 5.498 1.967 ( 0.809 4.949 -2.253) 5.498 2.047 ( 2.427 -6.183 -5.521) 8.637 2.047 ( 2.427 6.183 -5.521) 8.637 2.203 ( -4.339 -11.882 1.992) 12.805 2.203 ( -4.339 11.882 1.992) 12.805 2.535 ( -0.071 -1.487 4.831) 5.056 2.535 ( -0.071 1.487 4.831) 5.056 2.612 ( 0.463 -7.539 5.619) 9.414 2.612 ( 0.463 7.539 5.619) 9.414 2.741 ( 0.595 -4.817 0.882) 4.934 2.741 ( 0.595 4.817 0.882) 4.934 3.052 ( 0.567 -5.052 0.145) 5.086 3.052 ( 0.567 5.052 0.145) 5.086 3.192 ( 1.390 -1.205 -7.314) 7.542 3.192 ( 1.390 1.205 -7.314) 7.542 3.442 ( 1.215 -3.074 -3.566) 4.862 3.442 ( 1.215 3.074 -3.566) 4.862 3.510 ( -3.165 -2.079 -3.325) 5.039 3.510 ( -3.165 2.079 -3.325) 5.039 4.336 ( 0.435 -2.289 2.191) 3.199 4.336 ( 0.435 2.289 2.191) 3.199 4.631 ( 0.082 -2.196 -4.472) 4.983 4.631 ( 0.082 2.196 -4.472) 4.983 5.045 ( 5.344 -4.160 2.376) 7.177 5.045 ( 5.344 4.160 2.376) 7.177 5.211 ( -4.689 -1.184 1.442) 5.046 5.211 ( -4.689 1.184 1.442) 5.046 5.303 ( -6.024 -2.548 -0.478) 6.559 5.303 ( -6.024 2.548 -0.478) 6.559 5.410 ( 1.777 -1.985 1.680) 3.149 5.410 ( 1.777 1.985 1.680) 3.149 5.532 ( 2.111 -2.158 1.139) 3.227 5.532 ( 2.111 2.158 1.139) 3.227 5.848 ( 2.623 -4.671 -2.256) 5.812 5.848 ( 2.623 4.671 -2.256) 5.812 6.072 ( 0.264 -1.458 3.744) 4.026 6.072 ( 0.264 1.458 3.744) 4.026 6.230 ( 1.412 -2.525 -2.922) 4.111 6.230 ( 1.412 2.525 -2.922) 4.111 6.405 ( -0.729 -2.331 2.675) 3.622 6.405 ( -0.729 2.331 2.675) 3.622 6.926 ( -1.705 -11.676 -6.568) 13.505 6.926 ( -1.705 11.676 -6.568) 13.505 7.077 ( -1.543 -1.435 -3.034) 3.694 7.077 ( -1.543 1.435 -3.034) 3.694 7.336 ( -2.571 -5.080 -2.442) 6.195 7.336 ( -2.571 5.080 -2.442) 6.195 7.828 ( 5.664 -5.908 9.580) 12.600 7.828 ( 5.664 5.908 9.580) 12.600 8.268 ( -7.656 -7.119 1.903) 10.626 8.268 ( -7.656 7.119 1.903) 10.626 8.320 ( 5.265 -7.857 -1.584) 9.590 8.320 ( 5.265 7.857 -1.584) 9.590 8.731 ( 0.350 -0.698 4.828) 4.891 8.731 ( 0.350 0.698 4.828) 4.891 8.889 ( -3.244 -8.560 0.123) 9.154 8.889 ( -3.244 8.560 0.123) 9.154 9.118 ( -1.818 -1.671 0.874) 2.620 9.118 ( -1.818 1.671 0.874) 2.620 9.349 ( 2.467 -2.632 -0.148) 3.610 9.349 ( 2.467 2.632 -0.148) 3.610 9.741 ( 0.412 -3.411 -3.757) 5.091 9.741 ( 0.412 3.411 -3.757) 5.091 10.402 ( 0.657 -1.260 -2.004) 2.456 10.402 ( 0.657 1.260 -2.004) 2.456 10.643 ( 0.885 -5.089 -0.270) 5.172 10.643 ( 0.885 5.089 -0.270) 5.172 20.619 ( 0.111 -2.937 -1.340) 3.230 20.619 ( 0.111 2.937 -1.340) 3.230 20.940 ( -0.029 -0.967 -0.252) 1.000 20.940 ( -0.029 0.967 -0.252) 1.000 22.813 ( 0.673 -1.335 0.227) 1.513 22.813 ( 0.673 1.335 0.227) 1.513 23.098 ( -0.427 -0.770 -0.669) 1.105 23.098 ( -0.427 0.770 -0.669) 1.105 24.635 ( -0.222 -0.150 0.403) 0.484 24.635 ( -0.222 0.150 0.403) 0.484 24.922 ( -0.046 -0.476 1.266) 1.353 24.922 ( -0.046 0.476 1.266) 1.353 25.874 ( 0.241 -0.662 -0.342) 0.784 25.874 ( 0.241 0.662 -0.342) 0.784 26.205 ( -0.242 -2.500 -1.022) 2.712 26.205 ( -0.242 2.500 -1.022) 2.712 28.310 ( -0.591 -1.101 2.066) 2.415 28.310 ( -0.591 1.101 2.066) 2.415 28.567 ( -1.067 -0.642 1.285) 1.789 28.567 ( -1.067 0.642 1.285) 1.789 28.633 ( 1.216 -0.534 0.239) 1.349 28.633 ( 1.216 0.534 0.239) 1.349 28.734 ( 0.510 -2.692 -1.658) 3.202 28.734 ( 0.510 2.692 -1.658) 3.202 32.348 ( -0.062 -1.239 1.461) 1.917 32.348 ( -0.062 1.239 1.461) 1.917 32.501 ( 0.179 -1.768 -0.935) 2.008 32.501 ( 0.179 1.768 -0.935) 2.008 35.408 ( -0.067 -1.903 0.678) 2.022 35.408 ( -0.067 1.903 0.678) 2.022 35.552 ( -0.113 -1.135 -0.936) 1.476 35.552 ( -0.113 1.135 -0.936) 1.476 88.751 ( -2.942 -1.368 2.810) 4.292 88.751 ( -2.942 1.368 2.810) 4.292 88.975 ( 1.598 -2.766 -1.116) 3.384 88.975 ( 1.598 2.766 -1.116) 3.384 97.628 ( -0.220 -0.220 -0.065) 0.318 97.628 ( -0.220 0.220 -0.065) 0.318 97.658 ( 0.090 -0.326 -0.190) 0.388 97.658 ( 0.090 0.326 -0.190) 0.388 98.697 ( 0.023 -0.207 0.761) 0.789 98.697 ( 0.023 0.207 0.761) 0.789 99.114 ( -0.460 -4.388 -3.775) 5.806 99.114 ( -0.460 4.388 -3.775) 5.806 99.741 ( 1.434 -2.854 1.500) 3.529 99.741 ( 1.434 2.854 1.500) 3.529 99.870 ( -0.322 -2.875 -0.111) 2.895 99.870 ( -0.322 2.875 -0.111) 2.895 ======================= Grid point 92 (49/92) ======================= q-point: ( 0.11 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.447 ( -3.560 -14.262 6.141) 15.931 1.447 ( -3.560 14.262 6.141) 15.931 1.616 ( 6.477 -7.119 8.636) 12.931 1.616 ( 6.477 7.119 8.636) 12.931 1.956 ( 1.719 -2.364 -3.233) 4.358 1.956 ( 1.719 2.364 -3.233) 4.358 2.044 ( 2.554 -5.397 -3.372) 6.858 2.044 ( 2.554 5.397 -3.372) 6.858 2.260 ( 5.403 -5.529 6.763) 10.271 2.260 ( 5.403 5.529 6.763) 10.271 2.510 ( -4.634 -2.769 0.499) 5.421 2.510 ( -4.634 2.769 0.499) 5.421 2.651 ( -2.222 -2.474 1.845) 3.802 2.651 ( -2.222 2.474 1.845) 3.802 2.810 ( 1.502 -3.232 7.578) 8.374 2.810 ( 1.502 3.232 7.578) 8.374 2.990 ( -1.800 -2.285 -7.194) 7.760 2.990 ( -1.800 2.285 -7.194) 7.760 3.164 ( -1.583 -2.598 -0.424) 3.072 3.164 ( -1.583 2.598 -0.424) 3.072 3.380 ( -0.435 -1.483 -7.544) 7.701 3.380 ( -0.435 1.483 -7.544) 7.701 3.457 ( 0.667 -4.728 -2.588) 5.431 3.457 ( 0.667 4.728 -2.588) 5.431 4.376 ( 0.726 -2.806 2.891) 4.094 4.376 ( 0.726 2.806 2.891) 4.094 4.570 ( -1.504 -3.761 -3.988) 5.684 4.570 ( -1.504 3.761 -3.988) 5.684 5.084 ( -8.026 -1.884 1.759) 8.430 5.084 ( -8.026 1.884 1.759) 8.430 5.123 ( -0.548 -2.026 -2.747) 3.457 5.123 ( -0.548 2.026 -2.747) 3.457 5.228 ( -3.943 -6.695 4.042) 8.759 5.228 ( -3.943 6.695 4.042) 8.759 5.440 ( -0.324 -2.526 -0.184) 2.554 5.440 ( -0.324 2.526 -0.184) 2.554 5.605 ( 4.068 -2.206 3.212) 5.633 5.605 ( 4.068 2.206 3.212) 5.633 5.823 ( -0.862 -1.772 -4.779) 5.169 5.823 ( -0.862 1.772 -4.779) 5.169 6.120 ( -0.539 -2.805 3.410) 4.448 6.120 ( -0.539 2.805 3.410) 4.448 6.227 ( 1.711 -1.526 -2.785) 3.608 6.227 ( 1.711 1.526 -2.785) 3.608 6.445 ( -1.587 -9.160 3.965) 10.106 6.445 ( -1.587 9.160 3.965) 10.106 6.708 ( -9.104 -8.826 -7.371) 14.667 6.708 ( -9.104 8.826 -7.371) 14.667 7.077 ( -0.961 -1.250 1.132) 1.941 7.077 ( -0.961 1.250 1.132) 1.941 7.257 ( -2.203 -2.720 -2.177) 4.122 7.257 ( -2.203 2.720 -2.177) 4.122 7.940 ( -2.956 -3.239 7.060) 8.311 7.940 ( -2.956 3.239 7.060) 8.311 8.096 ( -6.926 -5.692 -3.119) 9.492 8.096 ( -6.926 5.692 -3.119) 9.492 8.429 ( 0.027 -8.663 6.418) 10.782 8.429 ( 0.027 8.663 6.418) 10.782 8.679 ( -4.875 -4.504 -6.153) 9.050 8.679 ( -4.875 4.504 -6.153) 9.050 8.982 ( 8.180 -2.084 7.038) 10.991 8.982 ( 8.180 2.084 7.038) 10.991 9.135 ( 3.823 -1.027 0.225) 3.965 9.135 ( 3.823 1.027 0.225) 3.965 9.435 ( 6.099 -3.605 1.473) 7.236 9.435 ( 6.099 3.605 1.473) 7.236 9.709 ( 1.495 -3.765 -4.998) 6.433 9.709 ( 1.495 3.765 -4.998) 6.433 10.410 ( 2.224 -2.404 -1.860) 3.766 10.410 ( 2.224 2.404 -1.860) 3.766 10.666 ( 2.425 -7.010 -0.380) 7.427 10.666 ( 2.425 7.010 -0.380) 7.427 20.598 ( -0.874 -1.607 -1.138) 2.155 20.598 ( -0.874 1.607 -1.138) 2.155 20.926 ( -1.243 -1.171 -0.164) 1.716 20.926 ( -1.243 1.171 -0.164) 1.716 22.824 ( 0.286 -0.352 -0.211) 0.500 22.824 ( 0.286 0.352 -0.211) 0.500 23.086 ( -0.033 -0.702 -0.222) 0.737 23.086 ( -0.033 0.702 -0.222) 0.737 24.626 ( -1.363 -0.343 0.381) 1.456 24.626 ( -1.363 0.343 0.381) 1.456 24.944 ( 1.033 -0.690 1.199) 1.727 24.944 ( 1.033 0.690 1.199) 1.727 25.849 ( -2.740 -0.618 -0.256) 2.820 25.849 ( -2.740 0.618 -0.256) 2.820 26.164 ( -3.178 -1.507 -0.870) 3.623 26.164 ( -3.178 1.507 -0.870) 3.623 28.321 ( -0.667 -0.805 1.878) 2.149 28.321 ( -0.667 0.805 1.878) 2.149 28.562 ( -0.775 -1.157 0.429) 1.457 28.562 ( -0.775 1.157 0.429) 1.457 28.657 ( 0.710 -1.145 0.887) 1.613 28.657 ( 0.710 1.145 0.887) 1.613 28.737 ( 2.153 -2.327 -1.640) 3.569 28.737 ( 2.153 2.327 -1.640) 3.569 32.365 ( 0.107 -1.595 1.445) 2.155 32.365 ( 0.107 1.595 1.445) 2.155 32.496 ( 0.468 -1.533 -1.014) 1.897 32.496 ( 0.468 1.533 -1.014) 1.897 35.413 ( -0.315 -1.293 0.888) 1.600 35.413 ( -0.315 1.293 0.888) 1.600 35.535 ( -0.457 -0.915 -1.036) 1.456 35.535 ( -0.457 0.915 -1.036) 1.456 88.736 ( -1.674 -1.166 2.043) 2.887 88.736 ( -1.674 1.166 2.043) 2.887 89.026 ( 5.138 -4.103 -0.394) 6.586 89.026 ( 5.138 4.103 -0.394) 6.586 97.630 ( 0.603 -0.478 -0.154) 0.785 97.630 ( 0.603 0.478 -0.154) 0.785 97.673 ( 1.738 -0.927 -0.075) 1.971 97.673 ( 1.738 0.927 -0.075) 1.971 98.706 ( 0.073 -0.452 0.748) 0.877 98.706 ( 0.073 0.452 0.748) 0.877 99.044 ( -3.058 -2.340 -2.936) 4.842 99.044 ( -3.058 2.340 -2.936) 4.842 99.744 ( -2.088 -1.184 -0.175) 2.407 99.744 ( -2.088 1.184 -0.175) 2.407 99.904 ( 3.762 -4.931 0.793) 6.252 99.904 ( 3.762 4.931 0.793) 6.252 ======================= Grid point 94 (50/92) ======================= q-point: ( 0.22 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.492 ( 1.702 -12.832 5.912) 14.230 1.492 ( 1.702 12.832 5.912) 14.230 1.792 ( 6.168 -4.285 2.173) 7.818 1.792 ( 6.168 4.285 2.173) 7.818 1.968 ( 5.610 -0.013 -4.221) 7.021 1.968 ( 5.610 0.013 -4.221) 7.021 2.078 ( 3.789 -5.968 -0.815) 7.115 2.078 ( 3.789 5.968 -0.815) 7.115 2.394 ( -4.082 -4.423 1.876) 6.304 2.394 ( -4.082 4.423 1.876) 6.304 2.483 ( 3.007 -2.102 7.844) 8.660 2.483 ( 3.007 2.102 7.844) 8.660 2.622 ( -1.390 -0.813 0.800) 1.798 2.622 ( -1.390 0.813 0.800) 1.798 2.843 ( -2.619 -1.389 -2.378) 3.801 2.843 ( -2.619 1.389 -2.378) 3.801 2.916 ( 0.060 -3.400 -0.869) 3.510 2.916 ( 0.060 3.400 -0.869) 3.510 3.112 ( -5.046 -2.694 2.047) 6.075 3.112 ( -5.046 2.694 2.047) 6.075 3.293 ( -3.148 -1.775 -3.022) 4.711 3.293 ( -3.148 1.775 -3.022) 4.711 3.470 ( 4.888 -3.992 -4.188) 7.574 3.470 ( 4.888 3.992 -4.188) 7.574 4.404 ( -0.603 -3.517 1.190) 3.762 4.404 ( -0.603 3.517 1.190) 3.762 4.512 ( -1.702 -3.477 -1.191) 4.050 4.512 ( -1.702 3.477 -1.191) 4.050 4.955 ( -7.847 -2.830 2.392) 8.678 4.955 ( -7.847 2.830 2.392) 8.678 5.089 ( 0.491 -3.429 -3.303) 4.787 5.089 ( 0.491 3.429 -3.303) 4.787 5.206 ( -2.702 -4.088 1.158) 5.035 5.206 ( -2.702 4.088 1.158) 5.035 5.391 ( -5.165 -2.060 -0.273) 5.568 5.391 ( -5.165 2.060 -0.273) 5.568 5.670 ( -2.493 -3.045 -0.345) 3.950 5.670 ( -2.493 3.045 -0.345) 3.950 5.792 ( 4.088 -1.250 -0.181) 4.279 5.792 ( 4.088 1.250 -0.181) 4.279 6.060 ( -11.671 -1.827 0.152) 11.814 6.060 ( -11.671 1.827 0.152) 11.814 6.179 ( -2.236 -1.692 -2.422) 3.705 6.179 ( -2.236 1.692 -2.422) 3.705 6.399 ( -2.119 -9.930 0.794) 10.185 6.399 ( -2.119 9.930 0.794) 10.185 6.610 ( -1.636 -6.346 -0.108) 6.554 6.610 ( -1.636 6.346 -0.108) 6.554 7.039 ( -2.303 -6.028 -0.558) 6.477 7.039 ( -2.303 6.028 -0.558) 6.477 7.257 ( 0.815 -6.059 2.588) 6.639 7.257 ( 0.815 6.059 2.588) 6.639 7.882 ( -4.130 -9.949 -2.642) 11.091 7.882 ( -4.130 9.949 -2.642) 11.091 8.014 ( -5.085 -2.027 3.131) 6.306 8.014 ( -5.085 2.027 3.131) 6.306 8.450 ( -3.117 -7.303 3.058) 8.509 8.450 ( -3.117 7.303 3.058) 8.509 8.572 ( -0.946 -5.247 -2.412) 5.852 8.572 ( -0.946 5.247 -2.412) 5.852 9.115 ( 3.900 -5.282 -0.740) 6.607 9.115 ( 3.900 5.282 -0.740) 6.607 9.276 ( 6.674 -6.313 6.025) 10.986 9.276 ( 6.674 6.313 6.025) 10.986 9.554 ( 4.129 -3.518 2.310) 5.896 9.554 ( 4.129 3.518 2.310) 5.896 9.702 ( 6.367 -4.928 -6.406) 10.289 9.702 ( 6.367 4.928 -6.406) 10.289 10.426 ( 1.278 -3.440 -0.668) 3.730 10.426 ( 1.278 3.440 -0.668) 3.730 10.714 ( 3.930 -9.111 -0.922) 9.965 10.714 ( 3.930 9.111 -0.922) 9.965 20.572 ( -0.985 -0.241 -0.566) 1.161 20.572 ( -0.985 0.241 -0.566) 1.161 20.899 ( -1.796 -1.219 -0.014) 2.170 20.899 ( -1.796 1.219 -0.014) 2.170 22.813 ( -0.606 -2.037 -1.129) 2.407 22.813 ( -0.606 2.037 -1.129) 2.407 23.098 ( 0.880 -2.026 0.777) 2.342 23.098 ( 0.880 2.026 0.777) 2.342 24.601 ( -1.979 -0.701 0.333) 2.126 24.601 ( -1.979 0.701 0.333) 2.126 24.977 ( 1.597 -0.659 0.705) 1.866 24.977 ( 1.597 0.659 0.705) 1.866 25.787 ( -4.143 -1.156 -0.208) 4.307 25.787 ( -4.143 1.156 -0.208) 4.307 26.091 ( -4.532 -0.621 -0.300) 4.584 26.091 ( -4.532 0.621 -0.300) 4.584 28.329 ( -0.375 -0.078 1.471) 1.520 28.329 ( -0.375 0.078 1.471) 1.520 28.551 ( -0.525 -1.142 -0.329) 1.300 28.551 ( -0.525 1.142 -0.329) 1.300 28.670 ( 0.027 -2.356 0.348) 2.382 28.670 ( 0.027 2.356 0.348) 2.382 28.765 ( 2.444 -1.981 -0.920) 3.278 28.765 ( 2.444 1.981 -0.920) 3.278 32.378 ( -0.144 -1.587 0.830) 1.796 32.378 ( -0.144 1.587 0.830) 1.796 32.498 ( 0.871 -1.245 -0.715) 1.679 32.498 ( 0.871 1.245 -0.715) 1.679 35.416 ( -0.360 -0.438 0.779) 0.964 35.416 ( -0.360 0.438 0.779) 0.964 35.518 ( -0.458 -0.838 -0.674) 1.168 35.518 ( -0.458 0.838 -0.674) 1.168 88.741 ( -0.198 -0.702 1.655) 1.809 88.741 ( -0.198 0.702 1.655) 1.809 89.119 ( 5.861 -5.252 -0.028) 7.870 89.119 ( 5.861 5.252 -0.028) 7.870 97.644 ( 1.272 -0.511 -0.171) 1.381 97.644 ( 1.272 0.511 -0.171) 1.381 97.709 ( 2.394 -1.638 0.147) 2.905 97.709 ( 2.394 1.638 0.147) 2.905 98.714 ( 0.235 -0.911 0.364) 1.009 98.714 ( 0.235 0.911 0.364) 1.009 98.964 ( -3.864 -0.957 -1.059) 4.120 98.964 ( -3.864 0.957 -1.059) 4.120 99.693 ( -2.622 -0.396 -1.135) 2.884 99.693 ( -2.622 0.396 -1.135) 2.884 99.979 ( 3.812 -8.298 0.546) 9.148 99.979 ( 3.812 8.298 0.546) 9.148 ======================= Grid point 96 (51/92) ======================= q-point: ( 0.33 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.613 ( 4.898 -6.891 4.600) 9.625 1.613 ( 4.898 6.891 4.600) 9.625 1.843 ( 4.208 -4.483 -6.731) 9.117 1.843 ( 4.208 4.483 -6.731) 9.117 2.056 ( 7.470 -3.829 -2.834) 8.859 2.056 ( 7.470 3.829 -2.834) 8.859 2.130 ( 3.825 -2.718 -1.794) 5.024 2.130 ( 3.825 2.718 -1.794) 5.024 2.326 ( -4.411 -4.455 1.938) 6.562 2.326 ( -4.411 4.455 1.938) 6.562 2.520 ( -4.957 -2.067 3.089) 6.196 2.520 ( -4.957 2.067 3.089) 6.196 2.635 ( 0.466 -1.394 -4.161) 4.413 2.635 ( 0.466 1.394 -4.161) 4.413 2.798 ( -0.033 -2.543 -0.994) 2.730 2.798 ( -0.033 2.543 -0.994) 2.730 2.945 ( 0.570 -3.872 6.750) 7.803 2.945 ( 0.570 3.872 6.750) 7.803 3.057 ( -3.077 -1.017 2.303) 3.975 3.057 ( -3.077 1.017 2.303) 3.975 3.211 ( -4.826 -2.104 0.056) 5.265 3.211 ( -4.826 2.104 0.056) 5.265 3.520 ( 4.473 -2.237 -1.383) 5.189 3.520 ( 4.473 2.237 -1.383) 5.189 4.379 ( -1.843 -0.721 -0.848) 2.153 4.379 ( -1.843 0.721 -0.848) 2.153 4.491 ( -1.933 -0.773 2.272) 3.081 4.491 ( -1.933 0.773 2.272) 3.081 4.889 ( -2.391 -3.290 0.369) 4.084 4.889 ( -2.391 3.290 0.369) 4.084 5.074 ( 1.345 -4.063 -2.382) 4.898 5.074 ( 1.345 4.063 -2.382) 4.898 5.177 ( -1.581 -2.083 -0.089) 2.616 5.177 ( -1.581 2.083 -0.089) 2.616 5.286 ( -6.226 -2.834 0.493) 6.858 5.286 ( -6.226 2.834 0.493) 6.858 5.564 ( -6.477 -2.186 -1.724) 7.050 5.564 ( -6.477 2.186 -1.724) 7.050 5.789 ( -9.869 -2.581 -1.714) 10.344 5.789 ( -9.869 2.581 -1.714) 10.344 5.913 ( 0.893 -3.298 3.186) 4.672 5.913 ( 0.893 3.298 3.186) 4.672 6.195 ( 2.040 -1.496 2.991) 3.918 6.195 ( 2.040 1.496 2.991) 3.918 6.357 ( -3.457 -7.185 -1.413) 8.098 6.357 ( -3.457 7.185 -1.413) 8.098 6.586 ( -0.950 -3.561 0.544) 3.726 6.586 ( -0.950 3.561 0.544) 3.726 7.005 ( -2.453 -6.102 0.674) 6.611 7.005 ( -2.453 6.102 0.674) 6.611 7.289 ( 0.661 -7.626 -0.350) 7.662 7.289 ( 0.661 7.626 -0.350) 7.662 7.811 ( 0.353 -5.798 -4.395) 7.284 7.811 ( 0.353 5.798 -4.395) 7.284 7.959 ( -4.155 -3.920 1.702) 5.961 7.959 ( -4.155 3.920 1.702) 5.961 8.417 ( -3.929 -9.985 2.398) 10.995 8.417 ( -3.929 9.985 2.398) 10.995 8.578 ( 1.244 -2.807 1.490) 3.413 8.578 ( 1.244 2.807 1.490) 3.413 9.151 ( 4.313 -4.470 -4.686) 7.781 9.151 ( 4.313 4.470 -4.686) 7.781 9.407 ( 0.759 -5.798 6.150) 8.487 9.407 ( 0.759 5.798 6.150) 8.487 9.587 ( 0.723 -5.190 -0.422) 5.257 9.587 ( 0.723 5.190 -0.422) 5.257 9.794 ( 8.597 -2.957 -3.485) 9.736 9.794 ( 8.597 2.957 -3.485) 9.736 10.443 ( 0.531 -2.883 1.296) 3.205 10.443 ( 0.531 2.883 1.296) 3.205 10.766 ( 3.672 -10.573 -1.667) 11.316 10.766 ( 3.672 10.573 -1.667) 11.316 20.555 ( -0.609 -0.660 -0.130) 0.907 20.555 ( -0.609 0.660 -0.130) 0.907 20.870 ( -1.564 -1.295 0.038) 2.031 20.870 ( -1.564 1.295 0.038) 2.031 22.793 ( -0.396 -2.930 -0.539) 3.006 22.793 ( -0.396 2.930 -0.539) 3.006 23.120 ( 0.673 -2.687 0.276) 2.784 23.120 ( 0.673 2.687 0.276) 2.784 24.572 ( -1.762 -0.965 0.367) 2.042 24.572 ( -1.762 0.965 0.367) 2.042 25.007 ( 1.416 -0.421 -0.018) 1.477 25.007 ( 1.416 0.421 -0.018) 1.477 25.719 ( -3.535 -1.306 -0.153) 3.772 25.719 ( -3.535 1.306 -0.153) 3.772 26.017 ( -3.967 -0.268 0.120) 3.978 26.017 ( -3.967 0.268 0.120) 3.978 28.341 ( -0.135 -0.803 1.388) 1.609 28.341 ( -0.135 0.803 1.388) 1.609 28.541 ( 0.037 -0.859 -0.556) 1.024 28.541 ( 0.037 0.859 -0.556) 1.024 28.667 ( -0.328 -2.885 -0.288) 2.918 28.667 ( -0.328 2.885 -0.288) 2.918 28.790 ( 1.576 -2.570 -0.655) 3.085 28.790 ( 1.576 2.570 -0.655) 3.085 32.379 ( -0.289 -1.125 0.236) 1.185 32.379 ( -0.289 1.125 0.236) 1.185 32.507 ( 0.903 -0.837 -0.391) 1.292 32.507 ( 0.903 0.837 -0.391) 1.292 35.418 ( -0.264 -0.483 0.485) 0.733 35.418 ( -0.264 0.483 0.485) 0.733 35.506 ( -0.337 -1.084 -0.278) 1.168 35.506 ( -0.337 1.084 -0.278) 1.168 88.761 ( 0.248 -0.188 1.782) 1.809 88.761 ( 0.248 0.188 1.782) 1.809 89.204 ( 4.222 -5.681 -0.457) 7.092 89.204 ( 4.222 5.681 -0.457) 7.092 97.665 ( 1.237 -0.438 0.071) 1.314 97.665 ( 1.237 0.438 0.071) 1.314 97.749 ( 1.980 -2.305 0.115) 3.041 97.749 ( 1.980 2.305 0.115) 3.041 98.724 ( 0.744 -1.140 0.060) 1.363 98.724 ( 0.744 1.140 0.060) 1.363 98.897 ( -3.697 -0.368 0.231) 3.722 98.897 ( -3.697 0.368 0.231) 3.722 99.648 ( -1.509 -0.885 -0.339) 1.782 99.648 ( -1.509 0.885 -0.339) 1.782 100.031 ( 2.415 -9.239 -0.634) 9.570 100.031 ( 2.415 9.239 -0.634) 9.570 ======================= Grid point 98 (52/92) ======================= q-point: ( 0.44 -0.50 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.669 ( -0.998 -1.245 -3.481) 3.829 1.669 ( -0.998 1.245 -3.481) 3.829 1.874 ( 7.505 -4.185 -2.375) 8.916 1.874 ( 7.505 4.185 -2.375) 8.916 2.088 ( 0.109 -1.400 -7.267) 7.401 2.088 ( 0.109 1.400 -7.267) 7.401 2.163 ( 4.923 -5.044 -3.727) 7.973 2.163 ( 4.923 5.044 -3.727) 7.973 2.292 ( -2.422 -2.954 1.531) 4.116 2.292 ( -2.422 2.954 1.531) 4.116 2.449 ( -5.094 -5.610 0.399) 7.588 2.449 ( -5.094 5.610 0.399) 7.588 2.586 ( 0.197 -2.788 -2.761) 3.928 2.586 ( 0.197 2.788 -2.761) 3.928 2.764 ( -0.741 -2.213 -3.142) 3.914 2.764 ( -0.741 2.213 -3.142) 3.914 2.976 ( -2.997 -1.194 3.413) 4.697 2.976 ( -2.997 1.194 3.413) 4.697 3.088 ( -2.531 -1.112 3.690) 4.611 3.088 ( -2.531 1.112 3.690) 4.611 3.196 ( 0.939 -0.551 8.157) 8.230 3.196 ( 0.939 0.551 8.157) 8.230 3.585 ( 3.419 -1.990 1.268) 4.154 3.585 ( 3.419 1.990 1.268) 4.154 4.349 ( -0.739 -3.095 0.060) 3.183 4.349 ( -0.739 3.095 0.060) 3.183 4.486 ( -2.148 -2.620 2.822) 4.409 4.486 ( -2.148 2.620 2.822) 4.409 4.853 ( -0.953 -3.745 -3.456) 5.184 4.853 ( -0.954 3.745 -3.456) 5.184 5.077 ( 0.845 -4.224 -1.684) 4.625 5.077 ( 0.845 4.224 -1.684) 4.625 5.152 ( 1.602 -4.658 0.815) 4.993 5.152 ( 1.602 4.658 0.815) 4.993 5.247 ( -1.936 -3.203 3.392) 5.051 5.247 ( -1.936 3.203 3.392) 5.051 5.469 ( -3.237 -1.916 0.061) 3.762 5.469 ( -3.237 1.916 0.061) 3.762 5.671 ( -2.298 -1.736 0.087) 2.881 5.671 ( -2.298 1.736 0.087) 2.881 5.961 ( -0.910 -5.382 4.200) 6.887 5.961 ( -0.910 5.382 4.200) 6.887 6.169 ( -4.115 -3.857 -4.152) 7.004 6.169 ( -4.115 3.857 -4.152) 7.004 6.383 ( 3.845 -6.303 6.431) 9.791 6.383 ( 3.845 6.303 6.431) 9.791 6.578 ( -1.021 -1.097 0.003) 1.499 6.578 ( -1.021 1.097 0.003) 1.499 6.966 ( -2.183 -3.416 -0.280) 4.063 6.966 ( -2.183 3.416 -0.280) 4.063 7.263 ( -0.048 -6.762 -5.205) 8.534 7.263 ( -0.048 6.762 -5.205) 8.534 7.791 ( 1.196 -2.743 -3.051) 4.274 7.791 ( 1.196 2.743 -3.051) 4.274 7.922 ( -1.140 -5.584 0.045) 5.699 7.922 ( -1.140 5.584 0.045) 5.699 8.381 ( -2.809 -11.352 2.045) 11.872 8.381 ( -2.809 11.352 2.045) 11.872 8.625 ( 0.818 -2.615 3.406) 4.371 8.625 ( 0.818 2.615 3.406) 4.371 9.161 ( 3.551 -4.607 -5.649) 8.108 9.161 ( 3.551 4.607 -5.649) 8.108 9.416 ( -4.047 -5.329 1.625) 6.886 9.416 ( -4.047 5.329 1.625) 6.886 9.623 ( 1.742 -4.486 2.657) 5.497 9.623 ( 1.742 4.486 2.657) 5.497 9.866 ( 4.368 -2.528 -3.267) 6.011 9.866 ( 4.368 2.528 -3.267) 6.011 10.469 ( -0.391 -2.402 2.939) 3.816 10.469 ( -0.391 2.402 2.939) 3.816 10.792 ( 1.949 -11.074 -2.502) 11.519 10.792 ( 1.949 11.074 -2.502) 11.519 20.550 ( -0.094 -0.840 0.112) 0.853 20.550 ( -0.094 0.840 0.112) 0.853 20.851 ( -0.651 -1.344 -0.002) 1.494 20.851 ( -0.651 1.344 -0.002) 1.494 22.796 ( 0.539 -3.104 1.046) 3.319 22.796 ( 0.539 3.104 1.046) 3.319 23.118 ( -0.339 -2.839 -1.284) 3.134 23.118 ( -0.339 2.839 -1.284) 3.134 24.555 ( -0.804 -1.065 0.502) 1.426 24.555 ( -0.804 1.065 0.502) 1.426 25.019 ( 0.412 -0.284 -0.734) 0.889 25.019 ( 0.412 0.284 -0.734) 0.889 25.676 ( -1.299 -0.840 0.007) 1.547 25.676 ( -1.299 0.840 0.007) 1.547 25.972 ( -1.562 -0.413 0.292) 1.641 25.972 ( -1.562 0.413 0.292) 1.641 28.351 ( -0.572 -1.156 1.564) 2.027 28.351 ( -0.572 1.156 1.564) 2.027 28.542 ( 0.682 -0.537 -0.402) 0.956 28.542 ( 0.682 0.537 -0.402) 0.956 28.654 ( -0.430 -2.993 -0.909) 3.158 28.654 ( -0.430 2.993 -0.909) 3.158 28.803 ( 0.746 -2.520 -0.632) 2.703 28.803 ( 0.746 2.520 -0.632) 2.703 32.375 ( -0.248 -0.512 -0.020) 0.569 32.375 ( -0.248 0.512 -0.020) 0.569 32.516 ( 0.516 -0.342 -0.284) 0.681 32.516 ( 0.516 0.342 -0.284) 0.681 35.417 ( -0.338 -0.625 0.328) 0.783 35.417 ( -0.338 0.625 0.328) 0.783 35.501 ( 0.041 -1.212 -0.141) 1.221 35.501 ( 0.041 1.212 -0.141) 1.221 88.782 ( -0.279 -0.417 2.215) 2.271 88.782 ( -0.279 0.417 2.215) 2.271 89.241 ( 1.381 -5.126 -1.364) 5.481 89.241 ( 1.381 5.126 -1.364) 5.481 97.684 ( 0.631 -0.577 0.538) 1.010 97.684 ( 0.631 0.577 0.538) 1.010 97.770 ( 0.585 -2.524 -0.256) 2.604 97.770 ( 0.585 2.524 -0.256) 2.604 98.739 ( 0.787 -1.131 0.114) 1.382 98.739 ( 0.787 1.131 0.114) 1.382 98.851 ( -1.981 -0.250 0.541) 2.068 98.851 ( -1.981 0.250 0.541) 2.068 99.641 ( 0.051 -1.547 1.338) 2.046 99.641 ( 0.051 1.547 1.338) 2.046 100.043 ( 0.736 -9.087 -2.026) 9.340 100.043 ( 0.736 9.087 -2.026) 9.340 ======================= Grid point 100 (53/92) ======================= q-point: (-0.44 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.560 ( -5.901 -2.157 -3.804) 7.345 1.560 ( -5.901 2.157 -3.804) 7.345 1.916 ( -3.922 -4.940 -12.543) 14.040 1.916 ( -3.922 4.940 -12.543) 14.040 1.993 ( 4.587 -1.742 -0.887) 4.987 1.993 ( 4.587 1.742 -0.887) 4.987 2.180 ( 2.681 -3.646 -6.762) 8.137 2.180 ( 2.681 3.646 -6.762) 8.137 2.275 ( -3.264 -2.454 4.880) 6.363 2.275 ( -3.264 2.454 4.880) 6.363 2.393 ( -0.551 -5.591 0.044) 5.618 2.393 ( -0.551 5.591 0.044) 5.618 2.589 ( 1.307 -2.586 -0.824) 3.013 2.589 ( 1.307 2.586 -0.824) 3.013 2.728 ( -0.138 -2.208 -1.890) 2.910 2.728 ( -0.138 2.208 -1.890) 2.910 2.953 ( -2.250 -2.208 1.031) 3.317 2.953 ( -2.250 2.208 1.031) 3.317 3.100 ( 0.269 -2.275 3.854) 4.484 3.100 ( 0.269 2.275 3.854) 4.484 3.298 ( -0.972 -0.751 8.021) 8.115 3.298 ( -0.972 0.751 8.021) 8.115 3.658 ( 2.599 -2.388 2.486) 4.317 3.658 ( 2.599 2.388 2.486) 4.317 4.359 ( 0.913 -3.312 0.685) 3.503 4.359 ( 0.913 3.312 0.685) 3.503 4.481 ( -1.238 -2.807 2.441) 3.921 4.481 ( -1.238 2.807 2.441) 3.921 4.787 ( -1.013 -4.768 -4.010) 6.312 4.787 ( -1.013 4.768 -4.010) 6.312 5.111 ( 4.864 -2.889 -1.244) 5.793 5.111 ( 4.864 2.889 -1.244) 5.793 5.237 ( 1.623 -2.663 2.513) 4.005 5.237 ( 1.623 2.663 2.513) 4.005 5.256 ( 1.627 -4.259 2.881) 5.393 5.256 ( 1.627 4.259 2.881) 5.393 5.464 ( 2.458 -0.724 0.463) 2.603 5.464 ( 2.458 0.724 0.463) 2.603 5.689 ( 3.327 -2.272 -0.653) 4.082 5.689 ( 3.327 2.272 -0.653) 4.082 5.937 ( -5.883 -4.018 2.356) 7.504 5.937 ( -5.883 4.018 2.356) 7.504 6.140 ( 5.090 -2.337 0.887) 5.671 6.140 ( 5.090 2.337 0.887) 5.671 6.501 ( 0.086 -7.116 4.241) 8.284 6.501 ( 0.086 7.116 4.241) 8.284 6.560 ( -0.056 -2.323 1.507) 2.770 6.560 ( -0.056 2.323 1.507) 2.770 6.939 ( 0.682 -3.067 -1.866) 3.654 6.939 ( 0.682 3.067 -1.866) 3.654 7.193 ( -0.154 -5.604 -6.510) 8.591 7.193 ( -0.154 5.604 -6.510) 8.591 7.753 ( -2.110 -1.982 -2.885) 4.088 7.753 ( -2.110 1.982 -2.885) 4.088 7.946 ( 3.901 -7.214 0.141) 8.202 7.946 ( 3.901 7.214 0.141) 8.202 8.374 ( -0.671 -11.238 1.919) 11.420 8.374 ( -0.671 11.238 1.919) 11.420 8.665 ( -0.294 -2.461 2.985) 3.880 8.665 ( -0.294 2.461 2.985) 3.880 9.148 ( 1.266 -5.503 -4.429) 7.176 9.148 ( 1.266 5.503 -4.429) 7.176 9.341 ( -5.620 -4.094 0.216) 6.956 9.341 ( -5.620 4.094 0.216) 6.956 9.655 ( -1.555 -2.800 1.701) 3.627 9.655 ( -1.555 2.800 1.701) 3.627 9.886 ( 1.834 -2.009 -2.146) 3.465 9.886 ( 1.834 2.009 -2.146) 3.465 10.485 ( -1.702 -3.876 3.321) 5.380 10.485 ( -1.702 3.876 3.321) 5.380 10.779 ( 0.050 -10.180 -2.874) 10.578 10.779 ( 0.050 10.180 -2.874) 10.578 20.554 ( 0.460 -0.516 0.205) 0.721 20.554 ( 0.460 0.516 0.205) 0.721 20.851 ( 0.617 -1.264 -0.013) 1.406 20.851 ( 0.617 1.264 -0.013) 1.406 22.827 ( 0.824 -2.520 1.959) 3.297 22.827 ( 0.824 2.520 1.959) 3.297 23.087 ( -0.692 -2.450 -2.200) 3.365 23.087 ( -0.692 2.450 -2.200) 3.365 24.557 ( 0.365 -0.991 0.584) 1.207 24.557 ( 0.365 0.991 0.584) 1.207 25.005 ( -0.862 -0.537 -1.031) 1.447 25.005 ( -0.862 0.537 -1.031) 1.447 25.678 ( 1.443 -0.606 0.045) 1.565 25.678 ( 1.443 0.606 0.045) 1.565 25.976 ( 1.722 -0.551 0.376) 1.847 25.976 ( 1.722 0.551 0.376) 1.847 28.352 ( -1.469 -0.969 1.594) 2.374 28.352 ( -1.469 0.969 1.594) 2.374 28.554 ( 1.013 -0.401 -0.048) 1.090 28.554 ( 1.013 0.401 -0.048) 1.090 28.636 ( -0.205 -2.947 -1.389) 3.264 28.636 ( -0.205 2.947 -1.389) 3.264 28.803 ( 0.073 -1.824 -0.645) 1.936 28.803 ( 0.073 1.824 -0.645) 1.936 32.370 ( -0.319 -0.530 -0.129) 0.632 32.370 ( -0.319 0.530 -0.129) 0.632 32.518 ( 0.092 -0.578 -0.238) 0.632 32.518 ( 0.092 0.578 -0.238) 0.632 35.412 ( -0.625 -0.356 0.210) 0.750 35.412 ( -0.625 0.356 0.210) 0.750 35.507 ( 0.702 -1.062 -0.023) 1.273 35.507 ( 0.702 1.062 -0.023) 1.273 88.796 ( -1.318 -0.824 2.664) 3.084 88.796 ( -1.318 0.824 2.664) 3.084 89.222 ( -1.437 -3.886 -1.928) 4.570 89.222 ( -1.437 3.886 -1.928) 4.570 97.694 ( -0.424 -0.850 0.860) 1.282 97.694 ( -0.424 0.850 0.860) 1.282 97.762 ( -0.904 -2.089 -0.538) 2.338 97.762 ( -0.904 2.089 -0.538) 2.338 98.739 ( -1.110 -0.699 0.118) 1.317 98.739 ( -1.110 0.699 0.118) 1.317 98.860 ( 2.424 -0.533 0.678) 2.573 98.860 ( 2.424 0.533 0.678) 2.573 99.673 ( 1.050 -1.606 2.402) 3.074 99.673 ( 1.050 1.606 2.402) 3.074 100.015 ( -0.768 -7.936 -3.004) 8.520 100.015 ( -0.768 7.936 -3.004) 8.520 ======================= Grid point 102 (54/92) ======================= q-point: (-0.33 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.412 ( -7.238 -4.023 -3.056) 8.826 1.412 ( -7.238 4.023 -3.056) 8.826 1.709 ( -6.897 -3.767 -6.669) 10.307 1.709 ( -6.897 3.767 -6.669) 10.307 2.007 ( 0.108 -5.484 -2.480) 6.020 2.007 ( 0.108 5.484 -2.480) 6.020 2.159 ( 1.390 -2.432 -5.106) 5.824 2.159 ( 1.390 2.432 -5.106) 5.824 2.276 ( -0.771 -2.050 3.982) 4.545 2.276 ( -0.771 2.050 3.982) 4.545 2.437 ( 2.131 -1.750 3.154) 4.190 2.437 ( 2.131 1.750 3.154) 4.190 2.595 ( 1.521 -2.015 -1.411) 2.892 2.595 ( 1.521 2.015 -1.411) 2.892 2.706 ( -2.230 -6.935 -0.826) 7.332 2.706 ( -2.230 6.935 -0.826) 7.332 2.935 ( 0.437 -4.875 -1.021) 5.000 2.935 ( 0.437 4.875 -1.021) 5.000 3.170 ( 3.313 -3.589 3.349) 5.922 3.170 ( 3.313 3.589 3.349) 5.922 3.336 ( -1.668 -1.597 4.320) 4.899 3.336 ( -1.668 1.597 4.320) 4.899 3.705 ( -0.281 -1.929 1.891) 2.716 3.705 ( -0.281 1.929 1.891) 2.716 4.364 ( -1.118 -2.888 0.099) 3.099 4.364 ( -1.118 2.888 0.099) 3.099 4.521 ( 3.224 -2.955 1.452) 4.608 4.521 ( 3.224 2.955 1.452) 4.608 4.773 ( 3.553 -4.722 -1.324) 6.055 4.773 ( 3.553 4.722 -1.324) 6.055 5.155 ( 0.597 -3.705 -1.155) 3.926 5.155 ( 0.597 3.705 -1.155) 3.926 5.226 ( -0.955 -2.511 0.911) 2.837 5.226 ( -0.955 2.511 0.911) 2.837 5.378 ( 6.116 -0.654 2.500) 6.639 5.378 ( 6.116 0.654 2.500) 6.639 5.532 ( 4.682 -0.691 -2.088) 5.173 5.532 ( 4.682 0.691 -2.088) 5.173 5.739 ( 5.040 -1.944 -2.737) 6.056 5.739 ( 5.040 1.944 -2.737) 6.056 5.888 ( -2.015 -2.480 2.706) 4.187 5.888 ( -2.015 2.480 2.706) 4.187 6.327 ( 10.730 -5.600 5.870) 13.452 6.327 ( 10.730 5.600 5.870) 13.452 6.467 ( -3.424 -3.893 -0.451) 5.204 6.467 ( -3.424 3.893 -0.451) 5.204 6.595 ( -0.447 -5.907 2.258) 6.339 6.595 ( -0.447 5.907 2.258) 6.339 6.961 ( 3.430 -3.612 -0.624) 5.020 6.961 ( 3.430 3.612 -0.624) 5.020 7.151 ( 2.663 -5.958 -3.641) 7.473 7.151 ( 2.663 5.958 -3.641) 7.473 7.678 ( -1.637 -1.430 -4.700) 5.178 7.678 ( -1.637 1.430 -4.700) 5.178 8.029 ( 4.613 -7.658 1.111) 9.008 8.029 ( 4.613 7.658 1.111) 9.008 8.397 ( 0.161 -10.425 3.182) 10.901 8.397 ( 0.161 10.425 3.182) 10.901 8.683 ( 0.642 -2.597 0.471) 2.716 8.683 ( 0.642 2.597 0.471) 2.716 9.106 ( -3.054 -6.114 -0.647) 6.865 9.106 ( -3.054 6.114 -0.647) 6.865 9.243 ( -5.520 -2.435 -1.103) 6.133 9.243 ( -5.520 2.435 -1.103) 6.133 9.608 ( -4.422 -3.261 -0.608) 5.528 9.608 ( -4.422 3.261 -0.608) 5.528 9.877 ( -1.446 -2.326 -0.561) 2.796 9.877 ( -1.446 2.326 -0.561) 2.796 10.485 ( -1.894 -6.410 2.591) 7.168 10.485 ( -1.894 6.410 2.591) 7.168 10.737 ( -1.452 -8.677 -2.683) 9.197 10.737 ( -1.452 8.677 -2.683) 9.197 20.570 ( 1.168 -0.669 0.137) 1.353 20.570 ( 1.168 0.669 0.137) 1.353 20.871 ( 1.666 -1.020 0.047) 1.953 20.871 ( 1.666 1.020 0.047) 1.953 22.846 ( -0.484 -0.728 0.506) 1.010 22.846 ( -0.484 0.728 0.506) 1.010 23.067 ( 0.621 -1.115 -0.760) 1.485 23.067 ( 0.621 1.115 -0.760) 1.485 24.576 ( 1.158 -0.739 0.503) 1.463 24.576 ( 1.158 0.739 0.503) 1.463 24.974 ( -1.644 -0.584 -0.686) 1.875 24.974 ( -1.644 0.584 -0.686) 1.875 25.720 ( 3.546 -1.309 -0.119) 3.782 25.720 ( 3.546 1.309 -0.119) 3.782 26.033 ( 4.334 -0.175 0.413) 4.357 26.033 ( 4.334 0.175 0.413) 4.357 28.337 ( -2.118 -0.469 1.344) 2.552 28.337 ( -2.118 0.469 1.344) 2.552 28.572 ( 0.750 -0.588 0.391) 1.030 28.572 ( 0.750 0.588 0.391) 1.030 28.619 ( 0.136 -2.701 -1.605) 3.145 28.619 ( 0.136 2.701 -1.605) 3.145 28.792 ( -0.544 -0.788 -0.630) 1.146 28.792 ( -0.544 0.788 -0.630) 1.146 32.361 ( -0.617 -0.914 -0.150) 1.113 32.361 ( -0.617 0.914 -0.150) 1.113 32.516 ( -0.074 -1.100 -0.199) 1.120 32.516 ( -0.074 1.100 -0.199) 1.120 35.403 ( -0.590 -0.768 0.134) 0.978 35.403 ( -0.590 0.768 0.134) 0.978 35.523 ( 1.131 -0.804 0.114) 1.392 35.523 ( 1.131 0.804 0.114) 1.392 88.795 ( -2.307 -1.162 2.882) 3.870 88.795 ( -2.307 1.162 2.882) 3.870 89.160 ( -3.518 -2.523 -1.706) 4.653 89.160 ( -3.518 2.523 -1.706) 4.653 97.685 ( -1.591 -0.699 0.553) 1.824 97.685 ( -1.591 0.699 0.553) 1.824 97.736 ( -1.632 -1.177 -0.229) 2.025 97.736 ( -1.632 1.177 -0.229) 2.025 98.716 ( -1.319 -0.324 -0.076) 1.360 98.716 ( -1.319 0.324 -0.076) 1.360 98.935 ( 5.144 -1.486 0.990) 5.445 98.935 ( 5.144 1.486 0.990) 5.445 99.714 ( 0.926 -0.659 1.480) 1.866 99.714 ( 0.926 0.659 1.480) 1.866 99.962 ( -1.734 -4.941 -2.578) 5.837 99.962 ( -1.734 4.941 -2.578) 5.837 ======================= Grid point 104 (55/92) ======================= q-point: (-0.22 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.281 ( -4.868 -5.717 -0.915) 7.564 1.281 ( -4.868 5.717 -0.915) 7.564 1.570 ( -6.218 -9.416 1.070) 11.334 1.570 ( -6.218 9.416 1.070) 11.334 1.994 ( 0.558 -5.083 -1.207) 5.254 1.994 ( 0.558 5.083 -1.207) 5.254 2.115 ( -0.267 -4.226 -3.072) 5.231 2.115 ( -0.267 4.226 -3.072) 5.231 2.312 ( -1.494 -2.134 4.350) 5.070 2.312 ( -1.494 2.134 4.350) 5.070 2.494 ( 0.204 -6.267 2.260) 6.665 2.494 ( 0.204 6.267 2.260) 6.665 2.594 ( -4.547 -9.050 -1.036) 10.181 2.594 ( -4.547 9.050 -1.036) 10.181 2.648 ( 2.280 -3.644 -0.568) 4.336 2.648 ( 2.280 3.644 -0.568) 4.336 2.955 ( 3.515 -4.032 -1.739) 5.624 2.955 ( 3.515 4.032 -1.739) 5.624 3.258 ( 2.084 -3.786 2.317) 4.903 3.258 ( 2.084 3.786 2.317) 4.903 3.355 ( 2.519 -2.239 -0.481) 3.404 3.355 ( 2.519 2.239 -0.481) 3.404 3.683 ( -3.583 -1.436 0.376) 3.878 3.683 ( -3.583 1.436 0.376) 3.878 4.339 ( -1.400 -3.386 -0.245) 3.672 4.339 ( -1.400 3.386 -0.245) 3.672 4.590 ( 4.255 -3.450 -0.474) 5.498 4.590 ( 4.255 3.450 -0.474) 5.498 4.867 ( 6.206 -5.536 0.779) 8.352 4.867 ( 6.206 5.536 0.779) 8.352 5.132 ( 0.764 -4.360 -1.276) 4.606 5.132 ( 0.764 4.360 -1.276) 4.606 5.252 ( 0.800 -2.163 3.529) 4.215 5.252 ( 0.800 2.163 3.529) 4.215 5.470 ( 3.764 -1.456 -2.271) 4.631 5.470 ( 3.764 1.456 -2.271) 4.631 5.542 ( 0.006 -2.061 -2.349) 3.125 5.542 ( 0.006 2.061 -2.349) 3.125 5.785 ( 1.457 -2.529 1.124) 3.128 5.785 ( 1.457 2.529 1.124) 3.128 5.938 ( 4.901 -2.680 -0.033) 5.586 5.938 ( 4.901 2.680 -0.033) 5.586 6.360 ( -4.915 -1.559 -1.358) 5.332 6.360 ( -4.915 1.559 -1.358) 5.332 6.483 ( -1.720 -2.370 -0.002) 2.928 6.483 ( -1.720 2.370 -0.002) 2.928 6.715 ( 12.842 -5.016 2.934) 14.095 6.715 ( 12.842 5.016 2.934) 14.095 7.033 ( 4.012 -6.196 3.641) 8.231 7.033 ( 4.012 6.196 3.641) 8.231 7.217 ( 7.200 -4.687 -0.206) 8.594 7.217 ( 7.200 4.687 -0.206) 8.594 7.606 ( -0.234 -1.652 -5.396) 5.648 7.606 ( -0.234 1.652 -5.396) 5.648 8.110 ( 4.086 -7.597 0.426) 8.636 8.110 ( 4.086 7.597 0.426) 8.636 8.435 ( -1.475 -6.340 5.079) 8.257 8.435 ( -1.475 6.340 5.079) 8.257 8.698 ( 2.223 -3.369 -2.757) 4.888 8.698 ( 2.223 3.369 -2.757) 4.888 9.043 ( -7.044 -7.290 4.716) 11.180 9.043 ( -7.044 7.290 4.716) 11.180 9.143 ( -3.323 -2.334 -2.396) 4.715 9.143 ( -3.323 2.334 -2.396) 4.715 9.508 ( -6.445 -2.278 -0.912) 6.896 9.508 ( -6.445 2.278 -0.912) 6.896 9.830 ( -2.833 -1.930 -0.913) 3.547 9.830 ( -2.833 1.930 -0.913) 3.547 10.476 ( -1.865 -7.056 0.938) 7.358 10.476 ( -1.865 7.056 0.938) 7.358 10.679 ( -1.941 -7.655 -2.180) 8.193 10.679 ( -1.941 7.655 -2.180) 8.193 20.595 ( 1.781 -1.930 -0.178) 2.632 20.595 ( 1.781 1.930 -0.178) 2.632 20.903 ( 1.966 -0.558 0.043) 2.044 20.903 ( 1.966 0.558 0.043) 2.044 22.827 ( -0.993 -1.499 -0.962) 2.040 22.827 ( -0.993 1.499 -0.962) 2.040 23.086 ( 1.154 -1.095 0.644) 1.717 23.086 ( 1.154 1.095 0.644) 1.717 24.602 ( 1.326 -0.393 0.379) 1.434 24.602 ( 1.326 0.393 0.379) 1.434 24.941 ( -1.751 -0.451 0.058) 1.809 24.941 ( -1.751 0.451 0.058) 1.809 25.786 ( 4.355 -1.382 -0.253) 4.577 25.786 ( 4.355 1.382 -0.253) 4.577 26.117 ( 4.993 -1.013 0.209) 5.099 26.117 ( 4.993 1.013 0.209) 5.099 28.315 ( -1.983 -0.320 1.191) 2.336 28.315 ( -1.983 0.320 1.191) 2.336 28.583 ( -0.491 -0.888 0.928) 1.375 28.583 ( -0.491 0.888 0.928) 1.375 28.609 ( 0.790 -1.436 -1.527) 2.240 28.609 ( 0.790 1.436 -1.527) 2.240 28.772 ( -0.903 -0.694 -0.682) 1.327 28.772 ( -0.903 0.694 -0.682) 1.327 32.348 ( -0.837 -0.993 0.151) 1.308 32.348 ( -0.837 0.993 0.151) 1.308 32.512 ( -0.018 -1.521 -0.308) 1.552 32.512 ( -0.018 1.521 -0.308) 1.552 35.398 ( -0.181 -1.400 0.229) 1.430 35.398 ( -0.181 1.400 0.229) 1.430 35.543 ( 1.083 -0.698 0.011) 1.288 35.543 ( 1.083 0.698 0.011) 1.288 88.783 ( -2.763 -1.359 2.918) 4.242 88.783 ( -2.763 1.359 2.918) 4.242 89.077 ( -4.377 -1.819 -1.207) 4.891 89.077 ( -4.377 1.819 -1.207) 4.891 97.659 ( -1.728 -0.301 0.077) 1.756 97.659 ( -1.728 0.301 0.077) 1.756 97.705 ( -1.970 -0.945 0.114) 2.188 97.705 ( -1.970 0.945 0.114) 2.188 98.698 ( -0.762 -0.197 0.002) 0.787 98.698 ( -0.762 0.197 0.002) 0.787 99.038 ( 5.933 -3.059 0.471) 6.691 99.038 ( 5.933 3.059 0.471) 6.691 99.724 ( 0.005 -1.865 -1.052) 2.141 99.724 ( 0.005 1.865 -1.052) 2.141 99.915 ( -1.871 -0.481 -0.319) 1.958 99.915 ( -1.871 0.481 -0.319) 1.958 ======================= Grid point 106 (56/92) ======================= q-point: (-0.11 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.262 ( -0.709 -8.963 6.662) 11.190 1.262 ( -0.709 8.963 6.662) 11.191 1.517 ( -4.012 -15.393 4.102) 16.428 1.517 ( -4.012 15.393 4.102) 16.428 1.980 ( 0.624 -4.626 -2.936) 5.515 1.980 ( 0.624 4.626 -2.936) 5.515 2.087 ( 0.128 -1.773 -3.703) 4.108 2.087 ( 0.128 1.773 -3.703) 4.108 2.294 ( -7.406 -7.019 3.841) 10.903 2.294 ( -7.406 7.019 3.841) 10.903 2.461 ( -1.025 -5.735 2.808) 6.467 2.461 ( -1.025 5.735 2.808) 6.467 2.576 ( -0.061 -5.905 2.731) 6.506 2.576 ( -0.061 5.905 2.731) 6.506 2.710 ( 3.577 -4.706 -0.257) 5.917 2.710 ( 3.577 4.706 -0.257) 5.917 3.004 ( 3.498 -4.738 -0.123) 5.890 3.004 ( 3.498 4.738 -0.123) 5.890 3.255 ( -0.543 -1.662 -3.867) 4.243 3.255 ( -0.543 1.662 -3.867) 4.243 3.417 ( 4.632 -4.505 -1.504) 6.634 3.417 ( 4.632 4.505 -1.504) 6.634 3.605 ( -4.617 -1.105 -1.603) 5.011 3.605 ( -4.617 1.105 -1.603) 5.011 4.322 ( -0.628 -3.119 0.681) 3.254 4.322 ( -0.628 3.119 0.681) 3.254 4.643 ( 3.482 -2.264 -2.819) 5.020 4.643 ( 3.482 2.264 -2.819) 5.020 4.946 ( 3.531 -5.740 0.992) 6.812 4.946 ( 3.531 5.740 0.992) 6.812 5.193 ( 3.697 -2.428 2.475) 5.069 5.193 ( 3.697 2.428 2.475) 5.069 5.315 ( 1.832 -0.800 2.814) 3.452 5.315 ( 1.832 0.800 2.814) 3.452 5.444 ( -0.862 -1.669 -5.786) 6.084 5.444 ( -0.862 1.669 -5.786) 6.084 5.513 ( -2.706 -2.348 2.671) 4.468 5.513 ( -2.706 2.348 2.671) 4.468 5.819 ( 2.257 -1.305 -0.689) 2.697 5.819 ( 2.257 1.305 -0.689) 2.697 6.014 ( 2.839 -3.919 2.358) 5.383 6.014 ( 2.839 3.919 2.358) 5.383 6.270 ( -2.068 -2.461 -3.736) 4.928 6.270 ( -2.068 2.461 -3.736) 4.928 6.429 ( -3.844 -0.459 1.008) 4.000 6.429 ( -3.844 0.459 1.008) 4.000 6.894 ( 8.144 -4.657 -2.816) 9.795 6.894 ( 8.144 4.657 -2.816) 9.795 7.135 ( 2.349 -4.575 -0.951) 5.230 7.135 ( 2.349 4.575 -0.951) 5.230 7.349 ( 4.049 -9.262 1.474) 10.215 7.349 ( 4.049 9.262 1.474) 10.215 7.612 ( 6.677 -3.728 2.650) 8.093 7.612 ( 6.677 3.728 2.650) 8.093 8.183 ( 4.585 -9.127 0.929) 10.256 8.183 ( 4.585 9.127 0.929) 10.256 8.423 ( -4.933 -0.800 0.805) 5.062 8.423 ( -4.933 0.800 0.805) 5.062 8.698 ( 0.163 -3.218 0.254) 3.232 8.698 ( 0.163 3.218 0.254) 3.232 8.960 ( -8.060 -5.302 4.282) 10.555 8.960 ( -8.060 5.302 4.282) 10.555 9.121 ( 0.863 -1.044 0.492) 1.441 9.121 ( 0.863 1.044 0.492) 1.441 9.389 ( -5.769 -2.798 -0.983) 6.486 9.389 ( -5.769 2.798 -0.983) 6.486 9.778 ( -1.045 -2.168 -2.513) 3.479 9.778 ( -1.045 2.168 -2.513) 3.479 10.437 ( -2.193 -3.549 -1.309) 4.372 10.437 ( -2.193 3.549 -1.309) 4.372 10.643 ( -0.339 -5.546 -0.868) 5.624 10.643 ( -0.339 5.546 -0.868) 5.624 20.618 ( 1.429 -3.058 -0.830) 3.476 20.618 ( 1.429 3.058 -0.830) 3.476 20.931 ( 1.312 -0.430 -0.119) 1.386 20.931 ( 1.312 0.430 -0.119) 1.386 22.808 ( -0.091 -1.916 -0.512) 1.986 22.808 ( -0.091 1.916 -0.512) 1.986 23.104 ( 0.293 -1.211 0.113) 1.251 23.104 ( 0.293 1.211 0.113) 1.251 24.625 ( 0.836 -0.070 0.367) 0.916 24.625 ( 0.836 0.070 0.367) 0.916 24.921 ( -1.166 -0.234 0.820) 1.445 24.921 ( -1.166 0.234 0.820) 1.445 25.848 ( 3.166 -1.050 -0.338) 3.353 25.848 ( 3.166 1.050 -0.338) 3.353 26.187 ( 3.200 -2.369 -0.417) 4.003 26.187 ( 3.200 2.369 -0.417) 4.003 28.303 ( -1.107 -0.481 1.596) 2.001 28.303 ( -1.107 0.481 1.596) 2.001 28.575 ( -1.455 -0.469 1.183) 1.933 28.575 ( -1.455 0.469 1.183) 1.933 28.615 ( 1.233 -0.244 -0.696) 1.436 28.615 ( 1.233 0.244 -0.696) 1.436 28.750 ( -0.603 -1.844 -1.059) 2.210 28.750 ( -0.603 1.844 -1.059) 2.210 32.341 ( -0.581 -0.943 0.847) 1.395 32.341 ( -0.581 0.943 0.847) 1.395 32.508 ( 0.068 -1.769 -0.612) 1.874 32.508 ( 0.068 1.769 -0.612) 1.874 35.401 ( 0.081 -1.901 0.422) 1.948 35.401 ( 0.081 1.901 0.422) 1.948 35.555 ( 0.578 -1.005 -0.429) 1.237 35.555 ( 0.578 1.005 -0.429) 1.237 88.768 ( -2.852 -1.438 3.044) 4.412 88.768 ( -2.852 1.438 3.044) 4.412 89.000 ( -2.844 -1.952 -1.211) 3.656 89.000 ( -2.844 1.952 -1.211) 3.656 97.637 ( -0.866 -0.057 -0.019) 0.868 97.637 ( -0.866 0.057 -0.019) 0.868 97.674 ( -1.661 -0.665 -0.050) 1.790 97.674 ( -1.661 0.665 -0.050) 1.790 98.692 ( -0.258 -0.240 0.383) 0.520 98.692 ( -0.258 0.240 0.383) 0.520 99.118 ( 3.833 -4.963 -1.812) 6.528 99.118 ( 3.833 4.963 -1.812) 6.528 99.712 ( 0.573 -1.424 -0.563) 1.635 99.712 ( 0.573 1.424 -0.563) 1.635 99.889 ( -1.716 -3.558 0.542) 3.987 99.889 ( -1.716 3.558 0.542) 3.987 ======================= Grid point 126 (57/92) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.874 ( 0.148 0.000 21.623) 21.623 0.935 ( -6.454 0.000 20.678) 21.662 1.322 ( -1.016 0.000 -16.730) 16.761 1.363 ( 5.896 0.000 -18.061) 18.999 1.708 ( -3.630 0.000 22.646) 22.935 1.979 ( 1.987 0.000 -3.447) 3.979 2.218 ( -0.914 0.000 6.886) 6.946 2.272 ( 0.604 0.000 5.594) 5.627 2.413 ( 3.455 0.000 10.106) 10.680 2.465 ( -1.972 0.000 0.079) 1.974 2.562 ( 4.768 0.000 -0.700) 4.819 2.600 ( -6.426 0.000 -0.110) 6.427 2.663 ( 5.447 0.000 1.715) 5.711 2.745 ( -2.920 0.000 -0.477) 2.959 2.766 ( 4.172 0.000 -0.710) 4.232 2.829 ( -3.270 0.000 -0.196) 3.276 2.918 ( 4.020 0.000 -3.436) 5.288 2.919 ( -2.301 0.000 -9.451) 9.727 3.088 ( 0.303 0.000 -2.742) 2.759 3.183 ( -0.533 0.000 0.711) 0.888 3.184 ( -1.523 0.000 -3.284) 3.620 3.265 ( -0.800 0.000 -7.729) 7.770 3.348 ( -1.360 0.000 3.134) 3.416 3.432 ( -0.103 0.000 -4.641) 4.642 4.384 ( -1.359 0.000 1.815) 2.268 4.421 ( 1.486 0.000 -1.664) 2.231 4.844 ( -7.176 0.000 8.337) 11.000 4.868 ( 3.028 0.000 1.360) 3.319 4.883 ( -2.905 0.000 -0.201) 2.912 5.007 ( 3.602 0.000 -4.672) 5.900 5.185 ( 5.202 0.000 0.573) 5.234 5.226 ( -4.027 0.000 -4.841) 6.297 5.291 ( -2.099 0.000 6.419) 6.753 5.426 ( 0.571 0.000 -5.545) 5.575 5.434 ( -0.884 0.000 7.756) 7.806 5.585 ( 1.573 0.000 -5.775) 5.985 5.656 ( 0.847 0.000 7.896) 7.941 5.799 ( -1.869 0.000 -2.709) 3.291 5.879 ( 2.785 0.000 -0.397) 2.813 5.891 ( 0.768 0.000 -2.391) 2.511 5.977 ( -1.629 0.000 4.604) 4.884 6.017 ( -0.473 0.000 1.459) 1.534 6.082 ( 2.219 0.000 -4.756) 5.248 6.107 ( -2.286 0.000 -6.876) 7.247 6.364 ( -4.209 0.000 2.216) 4.756 6.426 ( -1.094 0.000 0.026) 1.094 6.469 ( 5.092 0.000 0.213) 5.096 6.622 ( 0.873 0.000 -10.296) 10.333 7.078 ( -0.157 0.000 1.618) 1.625 7.112 ( 1.171 0.000 -1.534) 1.930 7.221 ( -4.635 0.000 0.303) 4.645 7.231 ( 4.371 0.000 -0.341) 4.384 7.903 ( 11.463 0.000 7.814) 13.873 8.010 ( -13.147 0.000 -3.131) 13.514 8.191 ( 1.446 0.000 5.690) 5.871 8.274 ( -6.914 0.000 0.297) 6.921 8.595 ( 11.695 0.000 2.722) 12.008 8.658 ( -2.953 0.000 -2.971) 4.189 8.712 ( 0.822 0.000 2.491) 2.623 8.749 ( -6.270 0.000 0.120) 6.271 8.876 ( -1.889 0.000 4.232) 4.635 8.959 ( 0.565 0.000 -1.794) 1.881 9.081 ( -2.873 0.000 7.848) 8.358 9.213 ( -3.762 0.000 3.052) 4.844 9.292 ( 10.731 0.000 -9.751) 14.499 9.370 ( 4.619 0.000 -10.709) 11.662 9.581 ( -8.356 0.000 8.857) 12.177 9.770 ( 7.684 0.000 -8.307) 11.316 10.299 ( -10.293 0.000 1.254) 10.369 10.314 ( 8.348 0.000 -0.404) 8.358 10.812 ( -10.293 0.000 4.698) 11.314 10.901 ( 6.681 0.000 -3.237) 7.424 20.477 ( -0.752 0.000 0.048) 0.754 20.482 ( 0.939 0.000 -0.465) 1.048 20.876 ( -0.997 0.000 1.302) 1.640 20.902 ( 0.873 0.000 -1.056) 1.370 22.787 ( 3.204 0.000 1.839) 3.694 22.829 ( -3.259 0.000 -1.931) 3.788 23.061 ( 2.656 0.000 1.028) 2.849 23.088 ( -2.475 0.000 -1.367) 2.827 24.744 ( 1.874 0.000 1.704) 2.532 24.781 ( -2.146 0.000 -1.701) 2.739 24.889 ( -0.856 0.000 0.541) 1.013 24.896 ( 1.253 0.000 -0.079) 1.256 25.860 ( 1.102 0.000 0.743) 1.329 25.879 ( -0.790 0.000 -0.905) 1.201 26.113 ( 0.426 0.000 4.908) 4.927 26.221 ( -2.864 0.000 -4.735) 5.533 28.365 ( -0.719 0.000 3.535) 3.608 28.441 ( -0.768 0.000 -3.078) 3.173 28.537 ( -2.462 0.000 0.753) 2.574 28.564 ( 2.779 0.000 -1.494) 3.155 28.673 ( 0.056 0.000 3.132) 3.133 28.711 ( -3.917 0.000 0.079) 3.918 28.760 ( 4.289 0.000 0.219) 4.295 28.789 ( 2.310 0.000 -2.764) 3.602 32.330 ( -0.737 0.000 2.001) 2.132 32.375 ( 0.788 0.000 -2.069) 2.214 32.524 ( 0.320 0.000 0.842) 0.900 32.543 ( 0.147 0.000 -0.883) 0.895 35.391 ( 0.020 0.000 3.023) 3.023 35.462 ( -0.330 0.000 -3.369) 3.386 35.465 ( -0.524 0.000 2.930) 2.977 35.526 ( 0.106 0.000 -2.492) 2.495 88.789 ( -3.288 0.000 1.543) 3.632 88.833 ( 2.366 0.000 -2.404) 3.373 89.083 ( -20.019 0.000 1.348) 20.064 89.104 ( 11.063 0.000 -0.581) 11.078 97.612 ( 1.076 0.000 -0.132) 1.084 97.614 ( -1.735 0.000 -0.321) 1.764 97.675 ( -2.412 0.000 0.522) 2.468 97.683 ( 1.600 0.000 -0.194) 1.612 98.704 ( -0.697 0.000 1.196) 1.385 98.718 ( 0.562 0.000 -0.072) 0.567 98.796 ( 1.207 0.000 0.428) 1.281 98.820 ( -0.805 0.000 -1.669) 1.853 99.645 ( -0.328 0.000 1.748) 1.778 99.685 ( 0.788 0.000 -1.929) 2.084 100.041 ( -10.356 0.000 0.961) 10.400 100.058 ( 15.585 0.000 -0.567) 15.596 ======================= Grid point 127 (58/92) ======================= q-point: ( 0.11 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.090 ( 1.426 0.000 8.092) 8.217 1.123 ( 4.748 0.000 11.806) 12.725 1.196 ( 9.141 0.000 -9.377) 13.095 1.334 ( 10.330 0.000 -10.852) 14.983 1.868 ( -1.192 0.000 10.591) 10.658 1.966 ( 3.932 0.000 -6.095) 7.253 2.272 ( -0.706 0.000 2.736) 2.826 2.335 ( 1.655 0.000 1.727) 2.392 2.435 ( -1.119 0.000 0.720) 1.330 2.463 ( -5.809 0.000 -3.065) 6.568 2.513 ( 5.445 0.000 -4.838) 7.284 2.601 ( -2.880 0.000 -5.517) 6.224 2.661 ( -5.728 0.000 -1.118) 5.836 2.708 ( 1.202 0.000 -1.333) 1.795 2.759 ( -1.180 0.000 2.989) 3.214 2.804 ( -3.623 0.000 -0.480) 3.655 2.862 ( 4.595 0.000 4.134) 6.181 2.934 ( 1.710 0.000 -1.708) 2.417 3.095 ( -0.815 0.000 -5.311) 5.374 3.169 ( 2.199 0.000 4.737) 5.223 3.188 ( -1.186 0.000 5.156) 5.291 3.211 ( 0.323 0.000 -2.811) 2.830 3.361 ( -2.487 0.000 5.899) 6.402 3.400 ( 0.890 0.000 -3.438) 3.552 4.402 ( 1.266 0.000 1.343) 1.846 4.445 ( 3.290 0.000 -1.266) 3.525 4.803 ( -5.532 0.000 -0.845) 5.596 4.817 ( -6.567 0.000 8.152) 10.468 4.905 ( -0.745 0.000 1.081) 1.312 4.997 ( -0.823 0.000 -1.364) 1.593 5.132 ( 0.879 0.000 -5.537) 5.607 5.216 ( -8.324 0.000 4.054) 9.259 5.285 ( -0.774 0.000 4.614) 4.679 5.302 ( -5.836 0.000 -5.488) 8.011 5.522 ( 1.142 0.000 7.166) 7.256 5.556 ( 1.136 0.000 -6.903) 6.996 5.721 ( -1.561 0.000 -5.772) 5.980 5.756 ( -1.401 0.000 6.831) 6.973 5.849 ( -1.293 0.000 -1.127) 1.715 5.873 ( 0.115 0.000 -3.779) 3.781 6.030 ( 0.419 0.000 1.449) 1.508 6.039 ( -0.995 0.000 -1.906) 2.150 6.081 ( 4.985 0.000 -2.003) 5.372 6.092 ( 3.822 0.000 5.690) 6.855 6.286 ( -6.758 0.000 4.789) 8.282 6.360 ( -6.742 0.000 -1.321) 6.870 6.521 ( -1.741 0.000 -7.477) 7.677 6.563 ( 3.572 0.000 2.500) 4.360 7.053 ( -5.679 0.000 -0.028) 5.679 7.109 ( 1.573 0.000 -1.655) 2.283 7.170 ( -0.639 0.000 1.820) 1.929 7.265 ( -0.535 0.000 -1.675) 1.758 7.728 ( -15.011 0.000 -2.036) 15.148 8.148 ( 8.759 0.000 6.055) 10.648 8.173 ( -4.895 0.000 -0.850) 4.968 8.222 ( -7.775 0.000 6.819) 10.342 8.438 ( -9.046 0.000 -8.844) 12.651 8.608 ( -3.293 0.000 1.285) 3.534 8.776 ( 2.199 0.000 1.378) 2.595 8.865 ( -20.599 0.000 10.740) 23.231 8.932 ( 6.868 0.000 -0.628) 6.897 8.943 ( 4.835 0.000 3.546) 5.995 8.998 ( 5.737 0.000 -5.208) 7.749 9.261 ( 5.364 0.000 -15.209) 16.127 9.301 ( 6.987 0.000 4.676) 8.407 9.318 ( -1.167 0.000 -6.166) 6.275 9.606 ( -0.007 0.000 9.102) 9.102 9.804 ( 5.475 0.000 -6.403) 8.425 10.266 ( 5.056 0.000 0.175) 5.059 10.482 ( 8.988 0.000 0.468) 9.000 10.742 ( -6.179 0.000 6.153) 8.720 11.024 ( 10.957 0.000 -1.366) 11.042 20.465 ( -0.713 0.000 0.079) 0.717 20.494 ( 1.041 0.000 -0.357) 1.101 20.865 ( -1.879 0.000 1.320) 2.296 20.898 ( 0.053 0.000 -1.116) 1.118 22.757 ( -2.699 0.000 -1.736) 3.209 22.865 ( 3.346 0.000 1.879) 3.838 23.034 ( -2.058 0.000 -1.316) 2.443 23.122 ( 3.126 0.000 1.002) 3.283 24.722 ( -2.809 0.000 -1.184) 3.048 24.792 ( 1.487 0.000 1.590) 2.177 24.869 ( -1.790 0.000 0.247) 1.807 24.909 ( 0.807 0.000 -0.641) 1.030 25.822 ( -4.629 0.000 -1.172) 4.775 25.856 ( -2.441 0.000 0.835) 2.580 26.126 ( -3.206 0.000 -2.791) 4.251 26.155 ( -2.752 0.000 5.561) 6.204 28.377 ( -1.965 0.000 2.687) 3.329 28.380 ( -2.968 0.000 -0.845) 3.086 28.522 ( -0.429 0.000 -0.051) 0.432 28.599 ( 2.620 0.000 -0.448) 2.658 28.653 ( -2.252 0.000 -1.045) 2.483 28.691 ( -2.158 0.000 3.878) 4.438 28.795 ( 1.999 0.000 -2.930) 3.547 28.829 ( 5.278 0.000 -3.122) 6.132 32.345 ( -0.093 0.000 1.952) 1.954 32.372 ( 1.519 0.000 -1.992) 2.505 32.522 ( -1.242 0.000 0.940) 1.558 32.524 ( -0.947 0.000 -1.508) 1.780 35.421 ( -0.509 0.000 -2.789) 2.835 35.424 ( -0.152 0.000 3.266) 3.270 35.486 ( -0.850 0.000 2.876) 2.999 35.503 ( 0.449 0.000 -2.453) 2.494 88.773 ( -1.250 0.000 3.315) 3.543 88.870 ( 4.341 0.000 -1.653) 4.645 88.900 ( -7.962 0.000 4.699) 9.245 89.338 ( 13.023 0.000 5.292) 14.057 97.605 ( 0.784 0.000 -0.076) 0.787 97.639 ( 1.620 0.000 0.318) 1.651 97.670 ( 0.361 0.000 0.489) 0.608 97.743 ( 5.395 0.000 1.267) 5.542 98.705 ( -0.425 0.000 0.622) 0.753 98.725 ( 0.397 0.000 -0.223) 0.455 98.779 ( -1.719 0.000 -1.824) 2.506 98.809 ( -0.425 0.000 1.027) 1.112 99.654 ( -0.652 0.000 1.472) 1.610 99.672 ( 0.305 0.000 -2.133) 2.155 99.855 ( -10.236 0.000 -2.210) 10.472 100.248 ( 10.422 0.000 -4.045) 11.180 ======================= Grid point 128 (59/92) ======================= q-point: ( 0.22 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.129 ( 13.258 0.000 -12.524) 18.238 1.199 ( 9.350 0.000 -14.080) 16.901 1.445 ( 11.686 0.000 10.742) 15.873 1.500 ( 6.093 0.000 9.979) 11.692 1.882 ( -3.603 0.000 1.059) 3.756 1.994 ( 3.424 0.000 -2.328) 4.140 2.226 ( -2.700 0.000 -4.049) 4.867 2.339 ( -1.521 0.000 -16.468) 16.538 2.354 ( -5.693 0.000 4.816) 7.457 2.362 ( 8.546 0.000 -13.454) 15.939 2.481 ( -4.179 0.000 -0.661) 4.231 2.538 ( 4.278 0.000 -6.423) 7.717 2.592 ( -3.884 0.000 5.208) 6.497 2.711 ( -4.255 0.000 -0.088) 4.256 2.761 ( -2.751 0.000 1.303) 3.044 2.779 ( 1.573 0.000 -0.167) 1.582 2.901 ( 1.420 0.000 -7.327) 7.463 2.993 ( 2.935 0.000 8.598) 9.085 3.115 ( -0.133 0.000 7.489) 7.490 3.159 ( -2.863 0.000 1.025) 3.041 3.213 ( 1.462 0.000 0.151) 1.470 3.265 ( -1.904 0.000 5.844) 6.146 3.396 ( 3.275 0.000 -2.135) 3.910 3.410 ( -2.688 0.000 11.610) 11.917 4.442 ( 2.487 0.000 -0.024) 2.487 4.500 ( 3.430 0.000 0.650) 3.491 4.707 ( -4.860 0.000 -0.387) 4.875 4.773 ( -7.568 0.000 4.431) 8.770 4.886 ( -2.165 0.000 1.655) 2.725 4.974 ( -0.986 0.000 1.478) 1.776 5.102 ( -9.535 0.000 4.726) 10.642 5.143 ( 4.870 0.000 -3.370) 5.922 5.167 ( -3.996 0.000 -2.867) 4.918 5.285 ( -4.557 0.000 2.976) 5.443 5.488 ( 0.764 0.000 -6.744) 6.787 5.618 ( -0.255 0.000 7.605) 7.609 5.618 ( -3.945 0.000 -5.821) 7.031 5.723 ( -5.159 0.000 2.821) 5.880 5.796 ( -4.061 0.000 -2.186) 4.612 5.846 ( -0.871 0.000 -1.648) 1.864 5.994 ( -3.494 0.000 0.508) 3.531 6.012 ( -4.744 0.000 -2.124) 5.198 6.155 ( 4.737 0.000 -1.012) 4.843 6.187 ( -2.162 0.000 -5.379) 5.797 6.229 ( -0.938 0.000 6.673) 6.739 6.334 ( 4.166 0.000 9.071) 9.982 6.425 ( -3.060 0.000 -1.682) 3.492 6.619 ( -0.515 0.000 3.250) 3.291 6.950 ( -6.125 0.000 1.372) 6.277 7.149 ( 3.903 0.000 -0.188) 3.907 7.167 ( -7.831 0.000 -0.747) 7.867 7.197 ( 1.548 0.000 0.098) 1.551 7.527 ( -7.571 0.000 -0.407) 7.582 8.020 ( -15.157 0.000 -5.331) 16.067 8.092 ( -3.288 0.000 -1.700) 3.701 8.233 ( -1.137 0.000 -7.828) 7.910 8.361 ( 2.599 0.000 9.271) 9.628 8.458 ( -23.144 0.000 3.830) 23.459 8.641 ( -3.469 0.000 1.575) 3.810 8.776 ( -4.037 0.000 -4.241) 5.855 8.979 ( 0.729 0.000 -4.695) 4.751 9.000 ( 2.451 0.000 1.223) 2.739 9.100 ( 6.481 0.000 -2.193) 6.842 9.223 ( 2.558 0.000 -2.623) 3.664 9.341 ( 13.363 0.000 -4.704) 14.167 9.493 ( 9.813 0.000 3.020) 10.267 9.743 ( 3.883 0.000 8.607) 9.442 9.838 ( 6.039 0.000 -5.364) 8.077 10.383 ( 7.314 0.000 -0.617) 7.340 10.578 ( 3.614 0.000 -1.669) 3.981 10.724 ( -4.757 0.000 7.763) 9.105 11.192 ( 8.901 0.000 -1.143) 8.974 20.457 ( -0.368 0.000 0.313) 0.483 20.509 ( 1.207 0.000 -0.461) 1.292 20.845 ( -2.306 0.000 1.463) 2.731 20.882 ( -0.370 0.000 -1.244) 1.297 22.712 ( -1.347 0.000 -0.170) 1.357 22.925 ( 2.080 0.000 0.572) 2.157 23.000 ( -0.944 0.000 -0.259) 0.979 23.177 ( 2.672 0.000 -0.072) 2.673 24.671 ( -2.508 0.000 0.023) 2.508 24.812 ( 0.035 0.000 -0.638) 0.639 24.844 ( -1.652 0.000 0.614) 1.763 24.915 ( 1.202 0.000 -1.083) 1.618 25.715 ( -6.184 0.000 -1.047) 6.272 25.804 ( -4.744 0.000 0.809) 4.813 26.058 ( -2.126 0.000 -1.860) 2.825 26.127 ( -6.269 0.000 3.561) 7.210 28.337 ( -1.668 0.000 0.170) 1.676 28.370 ( -0.630 0.000 0.803) 1.021 28.518 ( 0.098 0.000 -0.032) 0.103 28.615 ( -1.022 0.000 -1.234) 1.602 28.636 ( 1.544 0.000 0.821) 1.749 28.687 ( -2.738 0.000 3.198) 4.210 28.793 ( 1.367 0.000 -2.682) 3.010 28.866 ( 3.485 0.000 -3.356) 4.838 32.365 ( 0.211 0.000 1.650) 1.663 32.385 ( 2.363 0.000 -1.598) 2.853 32.483 ( -1.166 0.000 -2.543) 2.798 32.509 ( -1.718 0.000 1.141) 2.062 35.391 ( 0.109 0.000 -1.995) 1.998 35.452 ( -0.627 0.000 2.893) 2.960 35.490 ( 1.015 0.000 -2.234) 2.454 35.492 ( -1.614 0.000 2.040) 2.601 88.822 ( 1.639 0.000 4.863) 5.131 88.863 ( -3.067 0.000 4.203) 5.203 88.930 ( 4.919 0.000 -2.175) 5.379 89.572 ( 4.509 0.000 7.313) 8.592 97.629 ( 1.857 0.000 -0.100) 1.860 97.666 ( 1.520 0.000 -0.034) 1.520 97.691 ( 1.395 0.000 0.860) 1.639 97.876 ( 5.582 0.000 4.361) 7.084 98.704 ( -0.186 0.000 0.121) 0.222 98.717 ( -1.462 0.000 -0.539) 1.558 98.739 ( 0.130 0.000 -2.022) 2.026 98.805 ( -1.576 0.000 1.240) 2.005 99.649 ( -0.543 0.000 -2.658) 2.713 99.653 ( -0.942 0.000 0.898) 1.301 99.713 ( -3.253 0.000 0.055) 3.254 100.330 ( 6.009 0.000 -5.560) 8.187 ======================= Grid point 129 (60/92) ======================= q-point: ( 0.33 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.225 ( 13.341 0.000 -15.279) 20.284 1.285 ( 17.202 0.000 -7.251) 18.668 1.646 ( -1.258 0.000 7.782) 7.883 1.676 ( 1.080 0.000 -0.239) 1.106 1.834 ( 4.162 0.000 -0.784) 4.235 1.979 ( -3.361 0.000 0.314) 3.375 2.101 ( -2.072 0.000 -7.785) 8.056 2.218 ( 0.511 0.000 -3.695) 3.730 2.341 ( -1.245 0.000 4.683) 4.846 2.387 ( -3.219 0.000 -4.015) 5.146 2.405 ( 6.037 0.000 -5.457) 8.138 2.496 ( 0.439 0.000 -10.588) 10.598 2.608 ( -1.916 0.000 4.726) 5.100 2.633 ( -2.481 0.000 -3.531) 4.316 2.709 ( -2.003 0.000 -2.944) 3.561 2.755 ( -0.815 0.000 -3.277) 3.377 2.882 ( 7.392 0.000 -6.092) 9.579 3.115 ( -4.219 0.000 2.398) 4.853 3.157 ( 2.179 0.000 10.377) 10.604 3.165 ( -1.045 0.000 3.796) 3.937 3.231 ( -0.335 0.000 1.786) 1.818 3.242 ( -6.634 0.000 3.836) 7.663 3.479 ( 6.381 0.000 0.492) 6.400 3.487 ( -3.630 0.000 11.480) 12.041 4.487 ( 4.055 0.000 -1.210) 4.232 4.551 ( -2.052 0.000 5.096) 5.493 4.637 ( -3.732 0.000 0.557) 3.774 4.687 ( -2.821 0.000 -1.660) 3.273 4.881 ( -2.164 0.000 3.840) 4.408 4.992 ( 0.477 0.000 0.916) 1.033 5.014 ( -5.486 0.000 2.398) 5.987 5.074 ( -3.534 0.000 -1.840) 3.984 5.223 ( -6.333 0.000 4.087) 7.537 5.237 ( 5.199 0.000 3.022) 6.014 5.424 ( -2.742 0.000 -6.955) 7.475 5.533 ( 4.242 0.000 -2.569) 4.959 5.598 ( -6.407 0.000 1.008) 6.486 5.703 ( -4.285 0.000 -0.047) 4.285 5.708 ( -2.531 0.000 2.664) 3.674 5.835 ( -8.220 0.000 5.096) 9.672 5.872 ( -0.672 0.000 -2.385) 2.478 5.873 ( -6.580 0.000 -5.235) 8.409 6.156 ( 4.225 0.000 -1.856) 4.615 6.200 ( 3.613 0.000 -4.394) 5.689 6.306 ( -0.476 0.000 5.653) 5.673 6.397 ( -2.106 0.000 4.549) 5.013 6.536 ( 7.922 0.000 6.584) 10.301 6.634 ( -2.761 0.000 5.837) 6.457 6.889 ( -5.623 0.000 4.882) 7.447 7.025 ( -5.926 0.000 -1.395) 6.088 7.206 ( 1.390 0.000 -3.156) 3.448 7.239 ( 3.497 0.000 2.431) 4.259 7.438 ( -3.506 0.000 -0.340) 3.523 7.707 ( -9.597 0.000 -12.223) 15.540 8.022 ( -6.743 0.000 2.277) 7.117 8.106 ( -16.458 0.000 -1.990) 16.578 8.112 ( -4.611 0.000 -4.737) 6.611 8.516 ( 3.126 0.000 7.934) 8.528 8.554 ( -5.605 0.000 -13.992) 15.073 8.656 ( 0.362 0.000 3.746) 3.764 8.988 ( 2.725 0.000 -2.105) 3.444 9.060 ( 3.590 0.000 -0.303) 3.602 9.151 ( 1.618 0.000 -0.020) 1.618 9.247 ( 2.213 0.000 -0.202) 2.222 9.570 ( 14.819 0.000 -0.976) 14.851 9.656 ( 6.268 0.000 1.991) 6.577 9.877 ( 1.759 0.000 6.314) 6.554 9.883 ( 6.205 0.000 -5.432) 8.247 10.462 ( 2.761 0.000 -0.533) 2.812 10.586 ( 1.275 0.000 -3.497) 3.722 10.754 ( -3.424 0.000 10.617) 11.156 11.254 ( 3.083 0.000 -5.864) 6.625 20.462 ( 0.183 0.000 0.961) 0.978 20.522 ( 1.120 0.000 -0.813) 1.384 20.823 ( -2.213 0.000 1.649) 2.760 20.863 ( -0.234 0.000 -1.371) 1.390 22.710 ( 0.003 0.000 1.801) 1.801 22.939 ( 0.119 0.000 -1.524) 1.528 23.002 ( 0.545 0.000 1.372) 1.476 23.201 ( 1.228 0.000 -1.782) 2.165 24.642 ( -1.838 0.000 1.350) 2.280 24.783 ( -0.559 0.000 -3.302) 3.349 24.832 ( -0.889 0.000 1.402) 1.660 24.925 ( 1.248 0.000 -1.280) 1.788 25.617 ( -4.282 0.000 -0.341) 4.295 25.721 ( -5.610 0.000 0.272) 5.616 26.013 ( -1.192 0.000 -1.337) 1.791 26.048 ( -5.459 0.000 1.239) 5.598 28.326 ( -0.540 0.000 0.939) 1.084 28.377 ( 0.851 0.000 -0.173) 0.868 28.525 ( 0.583 0.000 0.174) 0.609 28.587 ( -1.124 0.000 -0.804) 1.382 28.669 ( 1.344 0.000 0.872) 1.602 28.671 ( -2.806 0.000 2.535) 3.782 28.784 ( 0.518 0.000 -1.661) 1.740 28.878 ( 2.143 0.000 -3.182) 3.836 32.384 ( 0.116 0.000 1.158) 1.163 32.413 ( 2.710 0.000 -1.413) 3.057 32.444 ( -0.149 0.000 -2.251) 2.256 32.490 ( -2.040 0.000 1.136) 2.335 35.384 ( 0.928 0.000 -1.110) 1.447 35.457 ( -1.770 0.000 1.422) 2.270 35.483 ( -1.421 0.000 1.705) 2.220 35.489 ( 1.496 0.000 -1.820) 2.356 88.868 ( -1.120 0.000 3.457) 3.634 88.925 ( 2.434 0.000 7.386) 7.776 88.978 ( 4.214 0.000 -3.275) 5.337 89.603 ( -4.864 0.000 -0.104) 4.865 97.657 ( 1.524 0.000 -0.082) 1.526 97.687 ( 1.151 0.000 -0.419) 1.225 97.737 ( 2.335 0.000 1.954) 3.045 97.968 ( 0.190 0.000 2.614) 2.621 98.693 ( -0.240 0.000 -0.373) 0.444 98.701 ( -0.005 0.000 -0.196) 0.196 98.728 ( 0.593 0.000 -1.506) 1.618 98.785 ( -2.203 0.000 0.980) 2.411 99.614 ( -0.354 0.000 -1.403) 1.447 99.642 ( -1.087 0.000 0.226) 1.110 99.757 ( 2.583 0.000 7.015) 7.475 100.338 ( 3.280 0.000 -7.334) 8.034 ======================= Grid point 130 (61/92) ======================= q-point: ( 0.44 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( 12.966 0.000 -11.599) 17.396 1.489 ( -9.895 0.000 -9.281) 13.566 1.508 ( 14.776 0.000 -3.435) 15.170 1.617 ( -9.104 0.000 4.243) 10.044 1.933 ( -2.954 0.000 1.819) 3.469 1.950 ( 6.930 0.000 -3.479) 7.754 2.083 ( 4.122 0.000 -0.112) 4.124 2.249 ( 2.574 0.000 2.647) 3.692 2.303 ( -7.746 0.000 -7.015) 10.450 2.313 ( -0.923 0.000 -1.201) 1.515 2.393 ( 0.667 0.000 -5.234) 5.276 2.412 ( 0.132 0.000 0.923) 0.932 2.543 ( -4.644 0.000 0.242) 4.650 2.619 ( -1.460 0.000 2.753) 3.116 2.695 ( 3.317 0.000 -3.230) 4.630 2.700 ( -1.258 0.000 -3.894) 4.092 3.012 ( 14.323 0.000 -5.483) 15.337 3.072 ( -7.495 0.000 6.049) 9.632 3.123 ( -9.594 0.000 2.231) 9.850 3.165 ( -0.664 0.000 -0.525) 0.847 3.263 ( 1.203 0.000 2.707) 2.963 3.266 ( 0.302 0.000 5.236) 5.244 3.526 ( -3.794 0.000 7.887) 8.752 3.581 ( 6.270 0.000 -1.222) 6.388 4.530 ( -6.788 0.000 6.573) 9.449 4.554 ( 4.428 0.000 -0.955) 4.530 4.603 ( -0.592 0.000 1.216) 1.353 4.656 ( 0.412 0.000 -2.349) 2.385 4.889 ( -2.991 0.000 5.813) 6.537 4.984 ( 1.525 0.000 -1.755) 2.326 4.988 ( -0.372 0.000 -1.100) 1.161 5.005 ( -2.774 0.000 -1.174) 3.012 5.187 ( -4.232 0.000 5.972) 7.320 5.335 ( 2.443 0.000 -3.786) 4.505 5.376 ( 4.523 0.000 3.041) 5.450 5.494 ( -5.284 0.000 -0.374) 5.298 5.586 ( 1.986 0.000 -3.177) 3.747 5.641 ( -4.694 0.000 -2.848) 5.491 5.661 ( -3.654 0.000 0.982) 3.784 5.721 ( -5.127 0.000 2.274) 5.608 5.805 ( 6.858 0.000 0.852) 6.910 5.923 ( -1.443 0.000 4.533) 4.757 6.180 ( 0.778 0.000 -5.087) 5.146 6.209 ( 2.711 0.000 -3.061) 4.089 6.348 ( 0.582 0.000 4.991) 5.025 6.422 ( -1.857 0.000 4.567) 4.931 6.662 ( -3.160 0.000 8.376) 8.953 6.704 ( 6.229 0.000 2.038) 6.554 6.863 ( -4.580 0.000 7.047) 8.405 6.955 ( 0.440 0.000 -3.426) 3.454 7.193 ( 2.571 0.000 -3.685) 4.494 7.279 ( -1.272 0.000 0.892) 1.554 7.380 ( -2.177 0.000 -2.857) 3.592 7.479 ( -3.056 0.000 -10.779) 11.204 7.841 ( -12.816 0.000 8.083) 15.152 7.995 ( -3.020 0.000 -4.294) 5.250 8.016 ( 0.474 0.000 -0.616) 0.777 8.328 ( -0.084 0.000 -16.363) 16.363 8.665 ( 2.618 0.000 8.246) 8.651 8.715 ( 0.869 0.000 4.640) 4.721 8.990 ( 0.238 0.000 -2.278) 2.290 9.074 ( 2.156 0.000 -6.992) 7.317 9.182 ( -1.081 0.000 5.786) 5.886 9.283 ( 2.788 0.000 -1.524) 3.177 9.742 ( 1.800 0.000 1.855) 2.585 9.757 ( 7.268 0.000 -0.306) 7.274 9.910 ( -4.541 0.000 3.739) 5.883 9.934 ( 7.552 0.000 -5.675) 9.447 10.475 ( -1.198 0.000 1.478) 1.903 10.562 ( 0.807 0.000 -3.914) 3.997 10.829 ( -2.551 0.000 12.497) 12.754 11.194 ( 0.726 0.000 -9.927) 9.953 20.480 ( 0.209 0.000 1.474) 1.489 20.526 ( 0.652 0.000 -1.274) 1.431 20.809 ( -1.559 0.000 1.798) 2.379 20.848 ( 0.404 0.000 -1.493) 1.547 22.749 ( 1.254 0.000 3.416) 3.639 22.900 ( -1.515 0.000 -3.305) 3.635 23.043 ( 1.540 0.000 2.845) 3.235 23.178 ( -0.650 0.000 -3.311) 3.374 24.638 ( -1.164 0.000 2.441) 2.704 24.738 ( -0.023 0.000 -3.936) 3.936 24.844 ( -0.164 0.000 2.261) 2.267 24.921 ( 0.333 0.000 -2.035) 2.062 25.579 ( -0.155 0.000 0.528) 0.550 25.637 ( -3.878 0.000 -0.512) 3.912 25.990 ( -2.693 0.000 0.707) 2.785 25.992 ( 0.191 0.000 -0.957) 0.976 28.335 ( -0.147 0.000 1.563) 1.570 28.382 ( 0.291 0.000 -0.995) 1.037 28.541 ( 1.003 0.000 0.292) 1.045 28.561 ( -1.272 0.000 -0.326) 1.313 28.651 ( -2.595 0.000 2.405) 3.538 28.698 ( 1.928 0.000 -0.810) 2.091 28.783 ( 0.112 0.000 0.694) 0.703 28.872 ( 1.433 0.000 -3.491) 3.774 32.391 ( -0.512 0.000 0.779) 0.932 32.419 ( 0.736 0.000 -1.974) 2.106 32.454 ( 2.418 0.000 -0.653) 2.504 32.466 ( -2.157 0.000 1.002) 2.379 35.398 ( 1.596 0.000 -0.293) 1.623 35.429 ( -2.224 0.000 0.183) 2.232 35.478 ( -1.542 0.000 1.685) 2.284 35.499 ( 1.751 0.000 -1.469) 2.286 88.889 ( -1.261 0.000 3.916) 4.114 88.995 ( 2.541 0.000 -4.101) 4.824 89.061 ( 2.985 0.000 9.804) 10.249 89.458 ( -6.634 0.000 -6.803) 9.502 97.676 ( 0.681 0.000 0.139) 0.695 97.694 ( 0.330 0.000 -0.620) 0.703 97.807 ( 2.777 0.000 3.115) 4.173 97.946 ( -3.012 0.000 -1.005) 3.176 98.694 ( -0.002 0.000 0.226) 0.226 98.700 ( 0.112 0.000 -0.301) 0.321 98.733 ( 1.693 0.000 -0.811) 1.877 98.755 ( -2.236 0.000 0.489) 2.289 99.606 ( 0.450 0.000 -0.336) 0.562 99.624 ( -0.999 0.000 -0.263) 1.033 99.905 ( 2.456 0.000 11.244) 11.509 100.287 ( 1.596 0.000 -9.811) 9.940 ======================= Grid point 131 (62/92) ======================= q-point: (-0.44 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.209 ( -13.750 0.000 -4.216) 14.382 1.390 ( 0.653 0.000 -0.615) 0.897 1.474 ( -5.053 0.000 -1.114) 5.174 1.697 ( 11.128 0.000 -2.985) 11.521 1.917 ( -1.029 0.000 0.208) 1.050 2.002 ( 5.282 0.000 -4.603) 7.006 2.105 ( -7.472 0.000 -3.413) 8.214 2.194 ( 6.469 0.000 2.676) 7.001 2.241 ( -5.966 0.000 6.056) 8.502 2.323 ( -1.040 0.000 -4.288) 4.413 2.350 ( -4.445 0.000 -3.781) 5.835 2.398 ( 5.809 0.000 1.938) 6.123 2.572 ( 0.918 0.000 6.831) 6.892 2.606 ( -4.033 0.000 -1.670) 4.366 2.632 ( -2.363 0.000 1.184) 2.643 2.714 ( 3.653 0.000 -4.390) 5.712 2.910 ( -12.716 0.000 2.769) 13.014 3.093 ( -1.158 0.000 4.946) 5.080 3.144 ( 0.806 0.000 -1.240) 1.479 3.197 ( 11.109 0.000 -3.133) 11.543 3.294 ( -0.712 0.000 1.314) 1.494 3.312 ( 2.077 0.000 0.506) 2.137 3.534 ( -2.650 0.000 3.615) 4.483 3.658 ( 6.037 0.000 -4.016) 7.251 4.482 ( -6.610 0.000 5.295) 8.469 4.582 ( -0.234 0.000 2.328) 2.340 4.643 ( 1.420 0.000 -2.202) 2.620 4.649 ( 3.675 0.000 -1.783) 4.085 4.922 ( -0.039 0.000 5.490) 5.490 4.923 ( -4.544 0.000 0.182) 4.548 5.003 ( 2.252 0.000 -1.354) 2.627 5.026 ( 7.131 0.000 -3.232) 7.829 5.192 ( -3.731 0.000 6.480) 7.477 5.344 ( 5.390 0.000 -7.531) 9.261 5.439 ( -1.400 0.000 -0.118) 1.405 5.495 ( 6.131 0.000 1.572) 6.330 5.558 ( -0.157 0.000 1.259) 1.269 5.570 ( -0.933 0.000 -2.423) 2.597 5.678 ( -0.716 0.000 0.283) 0.770 5.692 ( 3.100 0.000 4.559) 5.513 5.847 ( -8.138 0.000 -2.038) 8.389 5.982 ( 7.997 0.000 1.793) 8.195 6.157 ( -3.052 0.000 -3.987) 5.021 6.161 ( -0.218 0.000 0.240) 0.324 6.409 ( -2.225 0.000 0.008) 2.225 6.436 ( 2.983 0.000 3.144) 4.334 6.694 ( -2.627 0.000 5.592) 6.178 6.793 ( 3.892 0.000 -0.154) 3.895 6.891 ( 1.872 0.000 1.545) 2.427 6.961 ( 6.414 0.000 -5.593) 8.510 7.211 ( -4.114 0.000 -4.049) 5.772 7.246 ( 3.588 0.000 3.758) 5.196 7.345 ( 1.215 0.000 1.257) 1.748 7.364 ( -0.552 0.000 -5.666) 5.693 7.845 ( -1.285 0.000 13.071) 13.134 7.945 ( 1.960 0.000 -2.695) 3.332 8.052 ( 1.497 0.000 4.252) 4.508 8.204 ( 5.301 0.000 -15.205) 16.103 8.759 ( 0.721 0.000 3.100) 3.183 8.760 ( -0.200 0.000 1.410) 1.424 8.959 ( -2.389 0.000 0.861) 2.540 9.007 ( -1.012 0.000 -5.742) 5.831 9.220 ( -1.580 0.000 4.676) 4.936 9.295 ( 2.062 0.000 -4.016) 4.514 9.752 ( -3.445 0.000 0.461) 3.476 9.793 ( -0.101 0.000 -2.601) 2.603 9.817 ( -9.745 0.000 3.990) 10.530 10.003 ( 5.808 0.000 -4.432) 7.306 10.470 ( -2.607 0.000 4.135) 4.888 10.530 ( -0.207 0.000 -3.234) 3.241 10.932 ( -1.699 0.000 13.469) 13.575 11.089 ( 0.328 0.000 -10.931) 10.936 20.496 ( -0.224 0.000 1.434) 1.451 20.515 ( -0.071 0.000 -1.646) 1.648 20.811 ( -0.530 0.000 1.836) 1.911 20.846 ( 1.283 0.000 -1.517) 1.986 22.817 ( 1.822 0.000 4.100) 4.487 22.830 ( -2.001 0.000 -3.818) 4.311 23.103 ( 1.352 0.000 3.419) 3.677 23.118 ( -1.744 0.000 -3.833) 4.211 24.654 ( -0.526 0.000 3.355) 3.396 24.702 ( 0.484 0.000 -3.405) 3.439 24.869 ( -0.207 0.000 2.614) 2.622 24.896 ( -0.298 0.000 -2.373) 2.392 25.595 ( -0.067 0.000 -0.896) 0.899 25.621 ( 3.966 0.000 0.967) 4.082 25.972 ( -0.538 0.000 0.828) 0.987 26.002 ( 2.019 0.000 -0.480) 2.075 28.349 ( -0.386 0.000 1.808) 1.849 28.366 ( -0.686 0.000 -1.148) 1.337 28.540 ( -0.831 0.000 -0.218) 0.859 28.562 ( 1.212 0.000 0.209) 1.229 28.638 ( -2.368 0.000 2.818) 3.681 28.715 ( 2.403 0.000 -2.402) 3.398 28.800 ( -0.295 0.000 2.394) 2.412 28.852 ( 1.211 0.000 -4.247) 4.416 32.384 ( -1.445 0.000 1.103) 1.818 32.413 ( 0.589 0.000 -1.236) 1.369 32.440 ( -1.982 0.000 0.582) 2.066 32.486 ( 2.315 0.000 -0.815) 2.454 35.394 ( -2.068 0.000 0.037) 2.069 35.428 ( 1.981 0.000 0.277) 2.001 35.466 ( -1.865 0.000 1.478) 2.380 35.513 ( 1.682 0.000 -1.419) 2.200 88.904 ( -2.223 0.000 4.111) 4.674 88.978 ( 0.799 0.000 -4.105) 4.182 89.237 ( 4.171 0.000 12.711) 13.377 89.272 ( -5.233 0.000 -8.923) 10.345 97.682 ( -0.215 0.000 0.372) 0.430 97.685 ( -0.608 0.000 -0.608) 0.860 97.869 ( -3.778 0.000 -2.321) 4.434 97.891 ( 2.792 0.000 3.858) 4.762 98.694 ( -0.038 0.000 0.149) 0.154 98.699 ( 0.122 0.000 -0.160) 0.202 98.723 ( -1.846 0.000 -0.010) 1.846 98.764 ( 2.449 0.000 -0.294) 2.467 99.607 ( -0.635 0.000 -0.313) 0.708 99.620 ( 1.230 0.000 0.100) 1.234 100.052 ( 0.585 0.000 11.168) 11.183 100.181 ( 0.081 0.000 -13.010) 13.010 ======================= Grid point 132 (63/92) ======================= q-point: (-0.33 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.961 ( -16.487 0.000 5.573) 17.404 1.175 ( -19.683 0.000 3.408) 19.976 1.584 ( 8.729 0.000 2.874) 9.190 1.800 ( 6.115 0.000 -5.283) 8.081 1.873 ( -2.449 0.000 -2.962) 3.844 2.003 ( -3.694 0.000 0.203) 3.700 2.016 ( -2.422 0.000 -1.876) 3.064 2.144 ( -14.676 0.000 10.408) 17.992 2.257 ( -0.852 0.000 -4.135) 4.222 2.302 ( 0.521 0.000 2.436) 2.491 2.328 ( 1.339 0.000 5.396) 5.559 2.474 ( 4.102 0.000 -2.652) 4.885 2.531 ( -1.712 0.000 5.051) 5.333 2.653 ( 3.024 0.000 1.048) 3.201 2.654 ( 0.560 0.000 5.618) 5.645 2.722 ( 3.591 0.000 -5.372) 6.462 2.801 ( -2.830 0.000 0.854) 2.956 3.148 ( 1.242 0.000 -0.561) 1.363 3.152 ( 1.698 0.000 4.262) 4.588 3.284 ( -0.239 0.000 -1.416) 1.436 3.297 ( 2.007 0.000 -2.693) 3.359 3.342 ( 5.542 0.000 -4.176) 6.940 3.508 ( -2.710 0.000 -0.714) 2.802 3.685 ( 3.419 0.000 -6.198) 7.079 4.438 ( -3.620 0.000 3.266) 4.876 4.573 ( -5.987 0.000 2.996) 6.695 4.661 ( 3.059 0.000 -1.690) 3.495 4.691 ( 6.695 0.000 -2.323) 7.087 4.889 ( -0.920 0.000 1.729) 1.959 4.967 ( -0.793 0.000 2.324) 2.456 5.046 ( 3.295 0.000 0.653) 3.359 5.141 ( 12.228 0.000 -7.187) 14.183 5.232 ( -0.318 0.000 9.977) 9.982 5.346 ( 4.918 0.000 -7.033) 8.582 5.379 ( -3.358 0.000 -7.162) 7.910 5.498 ( -5.049 0.000 0.450) 5.069 5.603 ( 5.444 0.000 1.287) 5.594 5.646 ( 5.347 0.000 4.438) 6.949 5.726 ( -1.258 0.000 -1.449) 1.919 5.757 ( 6.615 0.000 3.148) 7.326 5.823 ( 6.171 0.000 4.181) 7.454 6.003 ( -1.366 0.000 -7.965) 8.081 6.100 ( -2.681 0.000 3.693) 4.564 6.136 ( -3.409 0.000 0.498) 3.445 6.373 ( -1.206 0.000 -1.012) 1.574 6.481 ( 0.616 0.000 -0.321) 0.695 6.650 ( -3.767 0.000 -4.208) 5.648 6.816 ( 4.047 0.000 -8.005) 8.970 6.974 ( 5.936 0.000 2.513) 6.446 7.048 ( 7.512 0.000 -6.899) 10.200 7.125 ( -0.678 0.000 0.495) 0.840 7.289 ( -1.012 0.000 -1.976) 2.220 7.383 ( 2.270 0.000 5.126) 5.607 7.470 ( 9.346 0.000 7.010) 11.683 7.993 ( 2.880 0.000 1.443) 3.221 8.022 ( 6.295 0.000 7.996) 10.177 8.173 ( 3.093 0.000 14.200) 14.533 8.211 ( 14.436 0.000 -10.510) 17.856 8.712 ( -1.954 0.000 -6.797) 7.073 8.748 ( -0.729 0.000 -3.800) 3.870 8.941 ( -4.837 0.000 6.210) 7.872 8.952 ( -2.104 0.000 0.281) 2.123 9.226 ( -1.856 0.000 2.274) 2.935 9.265 ( 0.993 0.000 -6.356) 6.433 9.575 ( -14.241 0.000 -1.171) 14.289 9.722 ( -3.808 0.000 -4.215) 5.680 9.756 ( -6.243 0.000 5.696) 8.451 10.003 ( -0.013 0.000 -4.791) 4.791 10.479 ( -2.730 0.000 -2.150) 3.476 10.482 ( -2.547 0.000 5.850) 6.380 10.981 ( 0.114 0.000 -9.895) 9.896 11.052 ( -0.852 0.000 12.496) 12.525 20.492 ( -0.504 0.000 -1.641) 1.717 20.502 ( -0.619 0.000 1.022) 1.195 20.828 ( 0.239 0.000 1.706) 1.723 20.857 ( 1.886 0.000 -1.439) 2.372 22.764 ( -1.311 0.000 -2.980) 3.256 22.884 ( 1.100 0.000 3.379) 3.554 23.052 ( -1.344 0.000 -3.145) 3.420 23.151 ( 0.154 0.000 2.767) 2.771 24.682 ( 0.724 0.000 -2.314) 2.425 24.692 ( 0.129 0.000 4.437) 4.439 24.870 ( 0.096 0.000 -1.952) 1.955 24.886 ( -0.854 0.000 2.217) 2.376 25.619 ( 3.836 0.000 -0.599) 3.883 25.717 ( 5.975 0.000 0.716) 6.018 25.985 ( 0.682 0.000 1.145) 1.333 26.054 ( 4.530 0.000 0.540) 4.562 28.342 ( -1.067 0.000 -0.440) 1.154 28.357 ( -0.788 0.000 1.565) 1.752 28.529 ( 0.025 0.000 -0.550) 0.550 28.583 ( 1.051 0.000 -0.020) 1.051 28.633 ( -2.137 0.000 3.289) 3.922 28.732 ( 2.722 0.000 -2.396) 3.626 28.814 ( -1.169 0.000 2.240) 2.526 28.822 ( 0.808 0.000 -4.715) 4.784 32.371 ( -2.083 0.000 2.042) 2.917 32.409 ( 0.344 0.000 -1.134) 1.185 32.414 ( -1.584 0.000 0.495) 1.659 32.513 ( 1.967 0.000 -0.928) 2.175 35.366 ( -1.595 0.000 0.483) 1.667 35.451 ( -1.857 0.000 1.601) 2.452 35.467 ( 2.213 0.000 0.435) 2.256 35.522 ( 1.356 0.000 -1.690) 2.167 88.899 ( -3.370 0.000 3.766) 5.053 88.943 ( -0.078 0.000 -3.316) 3.317 89.105 ( -3.422 0.000 -8.685) 9.335 89.470 ( 7.001 0.000 13.005) 14.770 97.663 ( -1.245 0.000 -0.502) 1.343 97.677 ( -0.931 0.000 0.433) 1.027 97.783 ( -3.503 0.000 -2.122) 4.096 97.976 ( 2.687 0.000 2.718) 3.822 98.695 ( -1.043 0.000 -0.532) 1.170 98.697 ( 0.150 0.000 0.148) 0.211 98.700 ( -0.370 0.000 0.672) 0.768 98.802 ( 2.467 0.000 -0.482) 2.514 99.599 ( -0.126 0.000 0.119) 0.173 99.645 ( 1.711 0.000 -0.078) 1.713 100.007 ( -2.739 0.000 -15.667) 15.905 100.154 ( -1.474 0.000 9.289) 9.406 ======================= Grid point 133 (64/92) ======================= q-point: (-0.22 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.817 ( -13.954 0.000 16.778) 21.822 0.892 ( -20.022 0.000 7.901) 21.524 1.684 ( -1.213 0.000 -7.467) 7.565 1.744 ( -14.202 0.000 1.943) 14.334 1.807 ( -15.073 0.000 4.725) 15.796 1.822 ( 2.885 0.000 3.039) 4.191 2.023 ( 1.380 0.000 8.955) 9.060 2.116 ( 1.007 0.000 1.838) 2.096 2.223 ( 0.995 0.000 -3.043) 3.201 2.379 ( 0.950 0.000 3.670) 3.791 2.395 ( 4.543 0.000 5.713) 7.299 2.524 ( 3.468 0.000 -2.582) 4.324 2.615 ( 2.532 0.000 7.124) 7.560 2.699 ( -1.446 0.000 3.373) 3.670 2.722 ( 2.812 0.000 -4.078) 4.954 2.740 ( 4.483 0.000 2.107) 4.954 2.803 ( 0.947 0.000 1.468) 1.747 3.172 ( 1.801 0.000 0.030) 1.802 3.211 ( 1.595 0.000 -0.225) 1.611 3.229 ( -1.300 0.000 -9.141) 9.233 3.263 ( 0.558 0.000 -1.991) 2.068 3.379 ( 3.413 0.000 -4.529) 5.672 3.422 ( -4.174 0.000 -4.275) 5.975 3.635 ( -0.270 0.000 -8.020) 8.024 4.432 ( -0.255 0.000 0.820) 0.859 4.484 ( -6.665 0.000 1.969) 6.950 4.703 ( 3.237 0.000 -0.279) 3.249 4.820 ( 9.516 0.000 -0.514) 9.530 4.903 ( 0.595 0.000 0.660) 0.889 4.955 ( -3.181 0.000 2.360) 3.961 5.104 ( 1.430 0.000 1.871) 2.355 5.198 ( -4.139 0.000 -5.480) 6.867 5.248 ( 10.381 0.000 -8.410) 13.361 5.364 ( -0.614 0.000 3.999) 4.046 5.367 ( 4.914 0.000 -4.699) 6.799 5.479 ( 1.932 0.000 5.664) 5.985 5.699 ( 2.884 0.000 2.860) 4.062 5.770 ( 4.436 0.000 1.092) 4.568 5.787 ( 8.362 0.000 -1.043) 8.427 5.837 ( -4.501 0.000 -5.041) 6.758 5.934 ( 8.276 0.000 6.488) 10.516 5.997 ( 6.234 0.000 0.857) 6.292 6.082 ( -4.391 0.000 3.910) 5.879 6.091 ( -1.355 0.000 1.563) 2.069 6.335 ( -2.112 0.000 -1.712) 2.719 6.459 ( -0.811 0.000 -2.816) 2.931 6.520 ( -3.003 0.000 -7.277) 7.872 6.779 ( 3.848 0.000 -10.615) 11.291 7.030 ( 3.575 0.000 -6.135) 7.101 7.107 ( 4.496 0.000 1.940) 4.896 7.175 ( 1.048 0.000 1.574) 1.891 7.236 ( -0.005 0.000 -4.177) 4.177 7.468 ( 2.825 0.000 5.071) 5.805 7.795 ( 16.657 0.000 10.434) 19.655 8.039 ( 1.658 0.000 1.568) 2.282 8.160 ( 5.036 0.000 1.475) 5.248 8.453 ( 4.309 0.000 17.867) 18.379 8.484 ( 22.118 0.000 1.142) 22.147 8.596 ( 0.953 0.000 -7.860) 7.918 8.691 ( -0.418 0.000 -3.745) 3.768 8.916 ( -6.001 0.000 6.258) 8.670 8.921 ( -2.838 0.000 1.228) 3.092 9.195 ( -0.342 0.000 -7.874) 7.881 9.210 ( -3.086 0.000 0.720) 3.169 9.315 ( -13.372 0.000 -1.077) 13.416 9.587 ( -5.690 0.000 -5.618) 7.996 9.706 ( -7.511 0.000 6.418) 9.880 9.913 ( -2.981 0.000 -6.496) 7.148 10.389 ( -5.750 0.000 -1.559) 5.958 10.496 ( -3.712 0.000 5.829) 6.910 10.894 ( 0.979 0.000 -7.508) 7.572 11.128 ( -3.716 0.000 5.721) 6.822 20.471 ( -0.082 0.000 -0.963) 0.966 20.498 ( -0.786 0.000 0.533) 0.950 20.851 ( 0.353 0.000 1.522) 1.562 20.875 ( 1.975 0.000 -1.304) 2.366 22.728 ( -0.089 0.000 -1.486) 1.489 22.915 ( -0.645 0.000 1.481) 1.615 23.015 ( 0.076 0.000 -1.665) 1.666 23.163 ( -1.245 0.000 1.235) 1.754 24.679 ( 1.068 0.000 -0.835) 1.356 24.755 ( 1.477 0.000 4.710) 4.936 24.862 ( 0.926 0.000 -1.101) 1.438 24.887 ( -1.404 0.000 1.484) 2.043 25.701 ( 5.938 0.000 0.158) 5.940 25.815 ( 4.944 0.000 -0.131) 4.946 26.015 ( 0.998 0.000 1.834) 2.088 26.169 ( 8.043 0.000 0.566) 8.063 28.328 ( -0.702 0.000 0.854) 1.106 28.366 ( 0.609 0.000 1.320) 1.453 28.529 ( 0.988 0.000 -1.067) 1.454 28.597 ( 0.715 0.000 0.229) 0.750 28.634 ( -1.695 0.000 2.447) 2.977 28.754 ( 2.666 0.000 -1.973) 3.317 28.774 ( -1.714 0.000 -3.038) 3.488 28.806 ( -2.264 0.000 1.499) 2.715 32.351 ( -2.615 0.000 1.554) 3.042 32.400 ( 0.236 0.000 -1.453) 1.472 32.420 ( 0.522 0.000 2.952) 2.998 32.531 ( 1.500 0.000 -0.939) 1.770 35.354 ( -0.894 0.000 1.311) 1.587 35.442 ( -1.478 0.000 2.033) 2.513 35.504 ( 1.998 0.000 -1.133) 2.297 35.525 ( 1.454 0.000 -1.361) 1.992 88.873 ( -3.988 0.000 2.906) 4.935 88.905 ( -0.998 0.000 -2.837) 3.007 88.989 ( 0.464 0.000 -7.027) 7.042 89.678 ( 4.786 0.000 1.015) 4.892 97.635 ( -1.334 0.000 -0.541) 1.439 97.662 ( -1.205 0.000 0.295) 1.241 97.715 ( -2.357 0.000 -1.254) 2.670 97.992 ( -1.913 0.000 -4.832) 5.197 98.690 ( 0.567 0.000 1.591) 1.689 98.702 ( 0.312 0.000 0.127) 0.337 98.702 ( -0.485 0.000 1.166) 1.263 98.831 ( 1.822 0.000 -0.970) 2.064 99.606 ( 0.370 0.000 1.044) 1.108 99.670 ( 1.727 0.000 -0.684) 1.857 99.790 ( -4.384 0.000 -9.449) 10.417 100.195 ( -4.029 0.000 6.851) 7.948 ======================= Grid point 134 (65/92) ======================= q-point: (-0.11 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.748 ( -11.719 0.000 17.382) 20.964 0.849 ( -8.311 0.000 20.632) 22.244 1.508 ( -0.836 0.000 -16.106) 16.127 1.510 ( -16.851 0.000 8.826) 19.023 1.654 ( -8.031 0.000 2.816) 8.511 1.936 ( 3.668 0.000 3.147) 4.833 2.165 ( 0.532 0.000 4.168) 4.202 2.202 ( 2.850 0.000 13.700) 13.993 2.227 ( 1.537 0.000 2.199) 2.683 2.448 ( 1.690 0.000 4.003) 4.345 2.529 ( 2.076 0.000 -3.973) 4.483 2.539 ( 5.399 0.000 4.400) 6.965 2.683 ( -2.566 0.000 0.422) 2.600 2.726 ( 2.053 0.000 5.367) 5.746 2.729 ( 1.578 0.000 -1.486) 2.168 2.811 ( -0.789 0.000 4.830) 4.894 2.859 ( 5.224 0.000 -1.061) 5.331 3.079 ( -1.529 0.000 -13.508) 13.594 3.193 ( -0.259 0.000 -3.792) 3.801 3.199 ( 1.048 0.000 -0.256) 1.078 3.216 ( -1.985 0.000 -8.172) 8.410 3.340 ( -1.639 0.000 1.498) 2.221 3.355 ( 0.571 0.000 -6.364) 6.389 3.521 ( -2.158 0.000 -8.068) 8.351 4.411 ( -4.334 0.000 1.874) 4.722 4.427 ( -0.074 0.000 -1.157) 1.159 4.772 ( 4.026 0.000 2.252) 4.613 4.906 ( -0.240 0.000 0.354) 0.428 4.907 ( -6.943 0.000 4.433) 8.237 4.960 ( 7.516 0.000 -3.013) 8.097 5.109 ( 2.992 0.000 -1.056) 3.172 5.203 ( 3.267 0.000 3.057) 4.474 5.299 ( 3.593 0.000 -5.620) 6.670 5.390 ( -2.191 0.000 7.051) 7.384 5.402 ( 5.813 0.000 -5.065) 7.710 5.576 ( 0.489 0.000 6.525) 6.543 5.672 ( -3.164 0.000 -6.375) 7.117 5.789 ( 0.838 0.000 3.655) 3.750 5.835 ( 2.711 0.000 -0.104) 2.713 5.883 ( 4.675 0.000 -4.112) 6.227 6.014 ( -0.283 0.000 0.228) 0.363 6.031 ( -6.354 0.000 3.198) 7.114 6.073 ( 3.739 0.000 -2.542) 4.521 6.210 ( 1.344 0.000 -1.859) 2.293 6.301 ( 4.814 0.000 2.571) 5.457 6.418 ( 2.937 0.000 -5.602) 6.325 6.443 ( -0.907 0.000 -1.061) 1.395 6.716 ( 1.910 0.000 -10.846) 11.013 7.069 ( 5.424 0.000 -1.850) 5.731 7.092 ( -3.022 0.000 -0.222) 3.030 7.189 ( 0.615 0.000 -0.073) 0.619 7.252 ( 1.553 0.000 -0.714) 1.710 7.636 ( 9.548 0.000 7.402) 12.081 8.101 ( 2.472 0.000 3.819) 4.549 8.125 ( 1.797 0.000 8.046) 8.245 8.269 ( 12.719 0.000 1.526) 12.810 8.415 ( -3.664 0.000 -6.131) 7.142 8.657 ( 1.865 0.000 -3.031) 3.559 8.737 ( -1.146 0.000 7.446) 7.534 8.839 ( 5.709 0.000 5.734) 8.092 8.885 ( -4.955 0.000 5.333) 7.280 8.927 ( 1.990 0.000 6.313) 6.619 9.058 ( -7.114 0.000 -2.167) 7.437 9.129 ( 11.004 0.000 -11.380) 15.830 9.240 ( -1.714 0.000 2.198) 2.788 9.447 ( -1.765 0.000 -7.693) 7.893 9.646 ( -8.845 0.000 7.718) 11.739 9.796 ( -0.615 0.000 -7.897) 7.921 10.283 ( -3.080 0.000 -1.640) 3.490 10.455 ( -8.135 0.000 3.276) 8.770 10.863 ( 3.270 0.000 -4.890) 5.883 11.003 ( -13.451 0.000 -0.136) 13.452 20.471 ( 0.864 0.000 -0.453) 0.975 20.488 ( -0.793 0.000 0.174) 0.812 20.870 ( -0.073 0.000 1.415) 1.417 20.893 ( 1.605 0.000 -1.144) 1.971 22.733 ( 1.546 0.000 0.416) 1.601 22.893 ( -2.434 0.000 -0.645) 2.518 23.020 ( 1.533 0.000 -0.029) 1.533 23.138 ( -2.187 0.000 -0.384) 2.220 24.701 ( 1.590 0.000 0.690) 1.734 24.811 ( 0.554 0.000 0.264) 0.614 24.875 ( 1.393 0.000 -0.326) 1.430 24.883 ( -0.493 0.000 1.710) 1.780 25.801 ( 4.906 0.000 0.688) 4.954 25.872 ( 2.434 0.000 -0.616) 2.511 26.057 ( 0.929 0.000 3.154) 3.288 26.271 ( 4.575 0.000 -4.546) 6.449 28.338 ( -0.194 0.000 2.413) 2.421 28.421 ( 4.914 0.000 -0.841) 4.986 28.540 ( 1.986 0.000 -1.492) 2.484 28.599 ( -3.135 0.000 -0.482) 3.171 28.628 ( 1.224 0.000 1.048) 1.612 28.724 ( -2.878 0.000 3.193) 4.299 28.769 ( -3.849 0.000 2.461) 4.568 28.777 ( 2.807 0.000 -3.715) 4.657 32.330 ( -1.801 0.000 1.767) 2.523 32.387 ( 0.375 0.000 -1.845) 1.883 32.482 ( 2.406 0.000 2.592) 3.537 32.542 ( 0.955 0.000 -0.869) 1.291 35.364 ( -0.245 0.000 2.264) 2.278 35.447 ( -0.909 0.000 2.553) 2.710 35.496 ( 0.540 0.000 -3.159) 3.205 35.541 ( 1.386 0.000 -1.964) 2.404 88.832 ( -3.843 0.000 1.856) 4.267 88.850 ( -0.484 0.000 -3.576) 3.608 88.989 ( 5.859 0.000 -3.654) 6.906 89.505 ( -18.324 0.000 -10.998) 21.372 97.612 ( -0.522 0.000 -0.577) 0.778 97.644 ( -1.163 0.000 -0.118) 1.169 97.680 ( -0.672 0.000 -0.470) 0.820 97.801 ( -10.241 0.000 -5.019) 11.405 98.703 ( -0.862 0.000 1.534) 1.759 98.710 ( 0.456 0.000 0.058) 0.460 98.753 ( 3.238 0.000 1.158) 3.439 98.838 ( 0.603 0.000 -1.441) 1.562 99.629 ( 0.007 0.000 1.691) 1.691 99.685 ( 1.358 0.000 -1.390) 1.943 99.795 ( 10.016 0.000 3.411) 10.581 100.161 ( -7.268 0.000 4.146) 8.367 ======================= Grid point 135 (66/92) ======================= q-point: ( 0.00 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.995 ( -5.034 10.947 17.089) 20.910 1.071 ( -1.350 10.901 17.368) 20.550 1.378 ( 2.475 6.412 -16.347) 17.733 1.441 ( 2.764 6.215 -15.233) 16.682 1.785 ( -3.353 5.685 20.238) 21.287 2.008 ( 2.059 1.171 -2.939) 3.775 2.153 ( 0.170 -4.557 8.125) 9.318 2.241 ( -0.567 -2.988 2.293) 3.809 2.335 ( 1.323 -5.573 4.888) 7.530 2.425 ( 0.329 -4.480 1.418) 4.711 2.546 ( 2.772 1.268 4.617) 5.533 2.608 ( -0.007 -0.376 3.521) 3.541 2.622 ( -3.110 -1.152 -1.744) 3.747 2.734 ( -1.793 -0.751 0.094) 1.946 2.830 ( 2.488 3.879 -0.779) 4.674 2.889 ( -0.931 -1.102 -1.770) 2.283 2.921 ( 1.230 4.251 -4.741) 6.486 2.952 ( 1.943 1.635 -6.732) 7.195 3.089 ( 1.384 -0.832 -1.421) 2.151 3.171 ( -1.364 -1.911 -2.526) 3.449 3.174 ( -1.473 1.373 -1.386) 2.444 3.280 ( -0.506 1.235 -5.375) 5.538 3.378 ( -2.359 2.189 0.846) 3.327 3.444 ( 0.440 1.217 -3.630) 3.854 4.395 ( 2.307 -1.076 -0.665) 2.631 4.399 ( -1.680 0.525 -1.164) 2.110 4.743 ( -2.799 -7.883 6.277) 10.458 4.814 ( -0.072 -5.854 0.140) 5.856 4.926 ( -0.855 2.352 0.778) 2.621 4.973 ( 0.772 1.098 -3.396) 3.652 5.150 ( 3.943 -1.799 1.544) 4.601 5.218 ( -2.413 -0.459 -5.523) 6.045 5.356 ( -0.970 3.513 6.514) 7.464 5.437 ( -5.773 1.185 7.105) 9.232 5.480 ( 0.553 1.317 -3.484) 3.766 5.570 ( 4.833 -2.232 -4.217) 6.791 5.584 ( 1.762 -4.486 5.298) 7.162 5.712 ( -2.736 -6.606 -4.421) 8.406 5.739 ( 2.902 -4.209 5.280) 7.349 5.848 ( -0.775 -1.936 -4.802) 5.235 6.043 ( -2.046 3.747 0.927) 4.368 6.074 ( 3.509 1.459 0.357) 3.817 6.120 ( 0.086 4.278 -3.500) 5.527 6.159 ( -2.362 2.454 -4.662) 5.773 6.383 ( -1.403 1.087 0.743) 1.924 6.405 ( -0.880 -1.476 -1.217) 2.106 6.600 ( 5.402 8.339 3.001) 10.379 6.732 ( -2.349 7.765 -8.627) 11.842 7.094 ( -1.295 0.478 1.792) 2.262 7.131 ( 2.138 1.321 -1.615) 2.987 7.183 ( 2.996 -1.392 3.904) 5.114 7.255 ( -2.846 1.045 -2.746) 4.091 7.875 ( 9.895 -1.615 6.770) 12.098 7.979 ( -12.305 -1.544 -3.219) 12.813 8.190 ( 0.470 0.342 7.445) 7.468 8.294 ( -5.104 1.204 0.147) 5.246 8.517 ( 10.189 -6.635 1.665) 12.272 8.582 ( -4.285 -3.258 -2.965) 6.145 8.717 ( 8.324 -1.391 2.755) 8.878 8.761 ( -9.745 0.946 -0.016) 9.790 8.894 ( -3.582 0.820 6.431) 7.407 9.017 ( 1.205 3.786 -2.323) 4.602 9.093 ( -3.782 1.033 6.037) 7.198 9.218 ( -1.152 0.708 1.105) 1.746 9.262 ( 8.187 -2.923 -7.158) 11.260 9.361 ( 1.898 -0.106 -8.264) 8.480 9.606 ( -5.869 1.497 7.070) 9.310 9.787 ( 4.903 0.073 -8.347) 9.681 10.263 ( -5.408 -1.335 1.827) 5.862 10.298 ( 5.927 -0.691 -1.498) 6.152 10.767 ( -8.091 -3.732 4.746) 10.095 10.855 ( 5.899 -4.102 -3.203) 7.867 20.501 ( 0.466 2.186 0.636) 2.324 20.534 ( -0.249 3.510 -2.700) 4.435 20.889 ( -0.910 1.103 1.305) 1.936 20.916 ( 0.802 1.067 -1.127) 1.747 22.792 ( 2.957 0.439 1.674) 3.426 22.829 ( -2.761 -0.022 -1.660) 3.222 23.066 ( 2.245 0.371 0.796) 2.411 23.089 ( -2.256 0.038 -1.265) 2.586 24.709 ( 1.141 -2.462 1.068) 2.916 24.728 ( -1.179 -3.580 -0.505) 3.803 24.903 ( -0.317 1.461 1.507) 2.123 24.928 ( 0.299 1.391 -0.621) 1.552 25.860 ( 1.061 0.024 0.604) 1.221 25.875 ( -0.650 -0.233 -0.680) 0.969 26.131 ( 0.155 1.340 3.498) 3.749 26.220 ( -1.888 -0.229 -4.270) 4.675 28.358 ( -0.778 -0.596 3.208) 3.354 28.420 ( -0.319 -1.747 -2.084) 2.738 28.546 ( -2.514 0.812 0.948) 2.807 28.578 ( 2.819 1.179 -1.743) 3.518 28.667 ( 0.040 -0.535 2.950) 2.999 28.698 ( -3.836 -1.174 0.220) 4.018 28.715 ( 3.303 -3.140 1.655) 4.849 28.770 ( 2.303 -1.611 -3.273) 4.314 32.337 ( -0.704 0.672 1.968) 2.196 32.381 ( 0.752 0.459 -1.895) 2.090 32.500 ( 0.311 -1.625 1.855) 2.486 32.535 ( 0.000 -0.905 -1.437) 1.698 35.396 ( 0.020 0.422 2.761) 2.793 35.457 ( -0.275 -0.406 -2.137) 2.192 35.481 ( -0.199 1.208 1.425) 1.878 35.531 ( -0.076 0.377 -2.334) 2.365 88.785 ( -3.142 -0.273 1.986) 3.727 88.834 ( 2.072 0.105 -2.467) 3.223 89.018 ( -12.841 -4.377 3.866) 14.107 89.077 ( 7.289 -2.680 -1.712) 7.952 97.612 ( -0.203 0.122 -0.039) 0.240 97.616 ( -0.025 0.162 -0.433) 0.463 97.671 ( -1.852 -0.378 0.455) 1.944 97.678 ( 1.203 -0.447 -0.186) 1.297 98.695 ( -0.520 -0.047 0.854) 1.001 98.704 ( 0.489 -0.241 0.121) 0.559 98.879 ( -0.737 4.858 -0.174) 4.917 98.912 ( 0.398 7.023 -3.489) 7.852 99.658 ( 0.037 1.311 1.821) 2.244 99.699 ( 0.238 1.312 -1.916) 2.334 100.006 ( -1.257 -3.306 1.058) 3.692 100.017 ( 5.171 -3.154 0.026) 6.057 ======================= Grid point 136 (67/92) ======================= q-point: ( 0.11 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.107 ( -0.166 4.911 11.951) 12.922 1.255 ( 4.541 9.553 -0.208) 10.579 1.334 ( 7.958 11.311 -0.382) 13.835 1.386 ( 9.920 4.897 -11.221) 15.758 1.907 ( -1.847 1.898 6.958) 7.445 2.009 ( 3.585 2.512 -4.024) 5.946 2.222 ( 0.040 -3.906 2.167) 4.467 2.245 ( -1.132 -5.983 0.413) 6.103 2.352 ( -1.206 -5.020 -2.556) 5.761 2.453 ( 3.602 -3.009 -2.057) 5.125 2.524 ( -2.758 2.319 -0.678) 3.667 2.591 ( -0.521 -1.549 4.569) 4.852 2.658 ( -2.556 -0.631 -7.384) 7.839 2.709 ( -0.694 2.941 4.584) 5.491 2.828 ( -1.053 2.168 -0.805) 2.541 2.857 ( 0.692 0.335 0.979) 1.245 2.887 ( -0.865 5.520 -1.658) 5.829 2.926 ( 1.007 -0.878 -2.428) 2.772 3.065 ( -0.426 -3.296 -1.073) 3.492 3.166 ( -1.227 0.371 0.485) 1.370 3.204 ( -0.173 0.017 -4.849) 4.852 3.221 ( 2.107 2.743 8.179) 8.880 3.379 ( -1.966 1.215 4.495) 5.054 3.424 ( 0.787 1.940 -2.369) 3.162 4.380 ( 0.339 -1.593 -0.321) 1.661 4.436 ( 2.943 -0.462 -0.250) 2.990 4.740 ( -4.147 -6.159 2.122) 7.722 4.789 ( -3.955 -5.646 3.399) 7.685 4.882 ( -2.417 1.320 -1.283) 3.038 4.966 ( -0.631 0.219 0.155) 0.686 5.136 ( 0.170 0.092 -4.394) 4.398 5.209 ( -2.234 -1.440 2.804) 3.863 5.271 ( -10.451 1.159 1.688) 10.650 5.381 ( -4.157 2.862 -0.230) 5.052 5.480 ( -1.080 -3.701 5.245) 6.509 5.595 ( 0.999 2.458 -5.964) 6.527 5.652 ( 1.925 -4.398 -4.639) 6.676 5.694 ( 0.223 -4.187 4.667) 6.274 5.752 ( -0.953 -3.810 -2.993) 4.938 5.828 ( 1.796 -3.307 0.843) 3.856 6.032 ( 0.010 0.381 1.333) 1.386 6.079 ( -0.864 3.502 -1.907) 4.080 6.117 ( 0.890 3.412 -0.289) 3.538 6.168 ( 4.244 3.146 3.510) 6.343 6.338 ( -6.783 0.393 -0.290) 6.801 6.349 ( -4.292 1.699 2.317) 5.164 6.579 ( -4.281 4.586 -6.082) 8.738 6.709 ( 2.484 9.848 2.238) 10.400 7.028 ( -9.117 -2.191 -0.227) 9.379 7.138 ( 1.631 1.711 -1.532) 2.817 7.153 ( -0.612 -0.504 -0.026) 0.793 7.301 ( 2.271 2.341 -0.071) 3.262 7.713 ( -13.347 -0.765 -1.723) 13.480 8.092 ( 5.344 -3.607 5.960) 8.780 8.198 ( -3.733 2.082 -0.591) 4.315 8.218 ( -8.312 -0.376 6.698) 10.681 8.400 ( -7.508 -3.252 -10.268) 13.129 8.576 ( -0.918 -3.054 -0.542) 3.235 8.654 ( -5.680 -5.612 6.226) 10.126 8.877 ( -4.179 0.477 1.616) 4.506 8.983 ( 10.204 1.721 3.867) 11.047 9.013 ( -4.261 3.814 -0.700) 5.762 9.070 ( 6.185 4.408 1.768) 7.798 9.246 ( -0.489 -1.868 -3.674) 4.151 9.281 ( 5.866 1.388 -10.159) 11.813 9.337 ( 5.668 1.313 1.348) 5.972 9.629 ( -0.624 1.605 7.588) 7.781 9.782 ( 4.221 -2.197 -5.959) 7.626 10.280 ( 5.247 1.388 0.096) 5.428 10.426 ( 9.011 -3.888 -1.029) 9.868 10.710 ( -5.598 -2.845 5.408) 8.287 10.953 ( 9.302 -5.970 -2.382) 11.307 20.500 ( -0.831 2.771 -0.904) 3.031 20.521 ( 0.505 2.130 0.565) 2.261 20.879 ( -1.903 1.135 1.295) 2.567 20.909 ( -0.153 0.841 -1.119) 1.408 22.764 ( -2.545 0.644 -1.686) 3.120 22.859 ( 2.715 -0.531 1.409) 3.104 23.041 ( -1.683 0.649 -0.897) 2.015 23.121 ( 2.891 -0.194 0.919) 3.039 24.690 ( -2.274 -2.336 -0.537) 3.304 24.732 ( 0.115 -3.741 0.665) 3.802 24.908 ( -0.397 2.099 0.675) 2.240 24.931 ( 0.796 1.459 -0.604) 1.768 25.820 ( -4.424 0.020 -0.864) 4.507 25.857 ( -2.196 0.053 0.395) 2.232 26.134 ( -3.222 0.666 -1.556) 3.640 26.159 ( -2.789 0.219 3.596) 4.556 28.369 ( -1.563 -0.658 2.271) 2.834 28.375 ( -2.346 -0.417 -0.643) 2.468 28.526 ( -0.842 0.482 0.188) 0.988 28.610 ( 2.337 0.853 -0.720) 2.590 28.643 ( -2.355 -0.848 -0.575) 2.569 28.684 ( -1.506 -0.537 3.146) 3.530 28.768 ( 2.103 -2.235 -2.957) 4.261 28.796 ( 5.071 -2.554 -1.963) 6.008 32.347 ( -0.315 0.363 1.369) 1.451 32.383 ( 1.722 0.820 -1.404) 2.368 32.501 ( -1.428 -1.409 -0.286) 2.026 32.521 ( -0.194 -0.623 -0.126) 0.665 35.421 ( -0.545 0.094 -1.611) 1.703 35.427 ( -0.065 0.166 2.096) 2.104 35.493 ( -0.897 0.605 1.105) 1.547 35.511 ( 0.356 0.609 -0.902) 1.145 88.770 ( -1.306 -0.178 3.096) 3.365 88.860 ( 0.053 -1.114 0.802) 1.374 88.902 ( -2.308 0.528 1.968) 3.079 89.264 ( 11.817 -6.017 2.443) 13.483 97.608 ( 0.634 0.219 -0.037) 0.672 97.637 ( 1.570 -0.087 0.032) 1.573 97.666 ( 0.366 -0.328 0.482) 0.688 97.730 ( 4.529 -1.149 0.762) 4.734 98.686 ( -0.734 -0.209 0.199) 0.789 98.721 ( 1.056 -0.201 -0.096) 1.079 98.861 ( -2.225 5.751 1.279) 6.298 98.882 ( -1.144 4.974 -1.093) 5.220 99.665 ( -0.723 0.956 0.042) 1.199 99.690 ( 0.489 1.779 -0.429) 1.894 99.843 ( -8.925 -1.008 -2.111) 9.227 100.191 ( 9.525 -4.956 -2.757) 11.086 ======================= Grid point 137 (68/92) ======================= q-point: ( 0.22 0.17 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.217 ( 11.328 7.601 -7.626) 15.629 1.275 ( 8.133 6.774 -11.959) 15.970 1.474 ( 8.527 4.337 5.190) 10.883 1.589 ( 7.728 6.275 9.134) 13.510 1.897 ( -2.808 0.831 0.634) 2.996 2.034 ( 1.024 2.504 -1.244) 2.977 2.184 ( 0.656 -8.184 -8.393) 11.741 2.220 ( -0.269 -0.916 -2.892) 3.045 2.292 ( 0.220 -3.528 -2.929) 4.591 2.424 ( -2.954 -1.409 -5.220) 6.161 2.488 ( 3.020 4.545 -10.065) 11.449 2.551 ( -0.429 -0.181 -0.022) 0.467 2.629 ( -1.240 -0.655 0.765) 1.597 2.706 ( -3.851 3.115 2.239) 5.435 2.783 ( -4.699 4.933 -1.305) 6.937 2.843 ( 2.126 -3.552 -4.260) 5.940 2.888 ( 0.072 2.395 -0.951) 2.578 2.980 ( 2.941 -0.798 8.317) 8.858 3.105 ( -3.193 -0.430 0.633) 3.283 3.137 ( 2.775 -2.922 5.017) 6.435 3.180 ( -1.278 -0.765 1.250) 1.945 3.320 ( -1.862 4.067 5.990) 7.475 3.419 ( 3.231 1.084 -0.318) 3.423 3.427 ( -2.069 1.637 8.704) 9.095 4.399 ( 2.345 -3.073 -0.418) 3.888 4.482 ( 2.092 -1.379 0.835) 2.641 4.666 ( -3.862 -4.392 -0.984) 5.931 4.749 ( -6.761 -2.917 4.112) 8.434 4.850 ( -0.520 -1.818 -0.294) 1.914 4.958 ( -0.691 0.132 1.464) 1.624 5.065 ( -11.197 -1.803 2.372) 11.587 5.136 ( 2.175 -0.797 -1.521) 2.771 5.205 ( -2.376 2.321 0.525) 3.363 5.328 ( -3.525 2.396 1.140) 4.412 5.479 ( -3.819 -4.507 -1.020) 5.995 5.519 ( -1.975 -4.083 -3.851) 5.950 5.573 ( -3.206 -3.366 -4.067) 6.177 5.707 ( -4.762 -1.751 2.612) 5.707 5.747 ( 2.832 -0.364 1.603) 3.274 5.870 ( 1.728 0.108 0.351) 1.767 6.015 ( -5.591 -0.497 -1.916) 5.931 6.033 ( -4.917 2.309 -0.160) 5.434 6.146 ( 1.954 0.597 -1.530) 2.552 6.187 ( -5.911 1.462 -0.386) 6.101 6.286 ( 3.968 1.985 4.819) 6.550 6.353 ( -0.093 2.238 6.905) 7.259 6.464 ( -3.679 3.395 -1.812) 5.324 6.734 ( -1.665 7.103 2.318) 7.655 6.896 ( -6.506 -2.727 1.944) 7.318 7.096 ( -5.365 -2.618 -2.548) 6.491 7.185 ( 4.196 1.961 -0.456) 4.654 7.291 ( -1.487 5.142 0.047) 5.353 7.556 ( -4.501 2.044 -0.145) 4.945 7.977 ( -13.290 -3.800 -7.431) 15.693 8.108 ( -2.896 0.167 -2.567) 3.873 8.224 ( -4.755 -1.852 -5.165) 7.260 8.261 ( -3.126 -1.163 8.743) 9.357 8.526 ( -11.431 0.850 5.264) 12.613 8.585 ( 0.265 -2.704 1.156) 2.952 8.849 ( -3.397 1.843 -1.651) 4.203 8.917 ( -2.677 1.005 -3.694) 4.671 9.092 ( 3.844 -0.478 -3.100) 4.961 9.166 ( 2.278 7.261 -3.049) 8.198 9.222 ( 5.640 2.659 1.422) 6.395 9.359 ( 11.647 1.561 -2.882) 12.099 9.527 ( 10.880 2.695 2.896) 11.577 9.723 ( 2.904 -1.799 5.120) 6.155 9.813 ( 5.206 -2.298 -3.152) 6.505 10.383 ( 5.960 -0.266 -0.275) 5.972 10.527 ( 4.465 -3.292 -1.827) 5.841 10.695 ( -3.858 -2.949 6.870) 8.413 11.087 ( 8.895 -8.670 -2.866) 12.748 20.483 ( -0.491 2.152 -0.129) 2.211 20.534 ( 0.252 1.915 0.546) 2.007 20.856 ( -2.396 0.985 1.299) 2.898 20.890 ( -0.591 0.616 -1.127) 1.414 22.720 ( -1.286 0.774 -0.306) 1.532 22.901 ( 1.306 -1.922 0.238) 2.336 23.020 ( -0.420 1.629 0.043) 1.683 23.171 ( 2.369 -0.622 -0.051) 2.450 24.649 ( -2.309 -1.688 0.185) 2.866 24.725 ( -1.033 -4.479 -0.266) 4.605 24.911 ( 0.057 2.882 0.093) 2.884 24.936 ( 1.064 1.671 -1.081) 2.256 25.723 ( -5.694 0.753 -0.839) 5.805 25.805 ( -4.397 0.084 0.447) 4.420 26.067 ( -2.798 0.693 -1.376) 3.194 26.124 ( -5.937 -0.385 3.121) 6.718 28.341 ( -1.370 0.288 0.211) 1.416 28.367 ( -0.285 -0.223 0.803) 0.881 28.520 ( -0.095 0.165 0.026) 0.192 28.605 ( -1.403 -0.942 -0.739) 1.844 28.635 ( 0.465 -0.061 0.690) 0.835 28.692 ( -0.801 0.489 2.211) 2.401 28.764 ( 1.370 -2.303 -3.061) 4.068 28.845 ( 3.508 -1.889 -2.349) 4.625 32.357 ( 0.373 -0.228 0.453) 0.630 32.406 ( 2.120 1.152 -0.523) 2.469 32.465 ( -1.358 -1.062 -1.685) 2.411 32.515 ( -0.926 0.148 0.571) 1.097 35.395 ( 0.024 0.350 -1.737) 1.773 35.452 ( -0.242 -0.203 2.335) 2.357 35.479 ( -0.680 0.139 -0.493) 0.851 35.514 ( -0.416 0.929 0.610) 1.187 88.809 ( 1.236 -1.034 3.862) 4.185 88.848 ( -2.472 -1.243 3.586) 4.529 88.949 ( 4.892 1.767 -1.202) 5.339 89.459 ( 6.072 -8.998 3.393) 11.373 97.629 ( 1.686 0.045 0.027) 1.687 97.663 ( 1.564 -0.258 -0.087) 1.588 97.688 ( 1.426 -0.274 0.739) 1.629 97.832 ( 4.990 -3.246 2.227) 6.356 98.680 ( -0.069 -0.140 0.042) 0.162 98.732 ( 0.737 -0.014 -0.767) 1.064 98.830 ( -3.370 6.264 1.562) 7.282 98.851 ( -2.152 3.737 0.509) 4.342 99.642 ( -1.522 0.233 -1.499) 2.149 99.686 ( -1.161 1.227 0.108) 1.693 99.728 ( -1.492 2.243 0.045) 2.694 100.276 ( 5.732 -4.833 -4.656) 8.826 ======================= Grid point 138 (69/92) ======================= q-point: ( 0.33 0.17 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.272 ( 12.093 4.837 -15.117) 19.954 1.383 ( 14.807 7.582 -6.430) 17.835 1.647 ( 1.586 0.943 5.263) 5.577 1.730 ( -0.438 4.296 0.591) 4.358 1.870 ( 2.508 2.684 -0.172) 3.677 1.997 ( -2.428 0.804 -0.654) 2.640 2.078 ( -0.952 -2.356 -7.615) 8.028 2.198 ( 0.818 -2.057 -1.557) 2.707 2.309 ( -0.060 -0.155 -0.168) 0.236 2.347 ( -0.359 -1.402 1.002) 1.760 2.448 ( 3.969 2.284 -8.790) 9.912 2.552 ( -5.257 0.144 -4.914) 7.197 2.567 ( 1.846 0.123 -2.499) 3.110 2.640 ( -4.578 -1.107 1.170) 4.853 2.710 ( -2.161 3.276 -1.272) 4.126 2.794 ( -0.608 -0.967 -6.787) 6.882 2.891 ( 4.786 2.142 -3.149) 6.116 3.059 ( -2.752 -3.463 2.900) 5.289 3.146 ( 0.065 0.926 4.752) 4.842 3.155 ( 0.932 -1.203 5.066) 5.290 3.251 ( 0.580 0.511 5.010) 5.069 3.304 ( -5.117 3.166 4.876) 7.744 3.465 ( 1.242 1.007 4.384) 4.667 3.526 ( 1.079 1.772 6.815) 7.124 4.447 ( 4.290 -3.038 -0.819) 5.320 4.508 ( -1.685 -4.030 2.543) 5.055 4.617 ( -3.176 -1.583 2.099) 4.123 4.662 ( -3.930 -2.485 -1.208) 4.804 4.850 ( 0.393 -2.238 0.399) 2.307 4.944 ( -5.055 -3.610 1.874) 6.488 4.977 ( -1.737 -0.209 2.965) 3.443 5.106 ( -4.733 1.077 -0.221) 4.859 5.239 ( 3.966 0.154 2.650) 4.772 5.275 ( -4.391 2.734 1.810) 5.481 5.356 ( -4.401 -5.117 -4.763) 8.260 5.478 ( 3.076 -3.623 -2.728) 5.480 5.534 ( -1.592 -6.822 0.006) 7.005 5.624 ( -5.574 -0.465 1.425) 5.772 5.813 ( -5.033 -0.560 0.995) 5.161 5.827 ( -6.785 2.118 0.634) 7.136 5.884 ( -9.895 0.450 -0.614) 9.924 5.905 ( 2.435 3.154 -0.368) 4.001 6.148 ( 1.593 -0.994 -1.128) 2.190 6.168 ( 2.871 0.846 -1.459) 3.330 6.390 ( 1.430 6.118 3.911) 7.401 6.404 ( -3.229 -0.392 4.967) 5.938 6.505 ( 6.156 -2.191 4.642) 8.015 6.741 ( -2.191 7.151 5.295) 9.164 6.819 ( -7.189 -3.351 3.770) 8.782 6.965 ( -4.950 -3.479 -2.790) 6.663 7.247 ( 3.088 -0.033 -0.145) 3.091 7.272 ( -0.134 3.835 -2.113) 4.381 7.514 ( -1.041 5.244 -1.363) 5.518 7.684 ( -7.213 -1.376 -12.113) 14.165 8.042 ( -3.313 -3.180 -4.451) 6.396 8.083 ( -9.020 1.696 2.559) 9.529 8.149 ( -11.079 5.090 1.938) 12.345 8.545 ( 1.403 1.358 5.103) 5.464 8.569 ( -2.180 1.053 -4.762) 5.342 8.692 ( -1.661 2.422 -3.253) 4.383 8.930 ( 1.358 -2.009 0.686) 2.520 9.123 ( 4.064 1.314 -3.817) 5.728 9.191 ( 0.892 4.369 1.774) 4.799 9.289 ( 3.101 4.473 -1.142) 5.561 9.568 ( 12.640 0.257 0.439) 12.650 9.694 ( 6.064 2.806 1.624) 6.876 9.808 ( 4.244 -4.472 -0.779) 6.214 9.881 ( 3.696 -2.021 0.877) 4.303 10.449 ( 2.434 -1.463 -0.470) 2.878 10.542 ( 0.611 -2.136 -2.156) 3.096 10.732 ( -2.029 -2.510 8.953) 9.517 11.153 ( 4.564 -8.609 -6.197) 11.548 20.482 ( 0.069 1.711 0.678) 1.841 20.540 ( 0.202 1.354 -0.179) 1.381 20.831 ( -2.197 0.751 1.405) 2.714 20.868 ( -0.464 0.440 -1.202) 1.362 22.718 ( 0.145 0.783 1.654) 1.836 22.915 ( 0.571 -1.988 -0.430) 2.113 23.018 ( -0.066 1.400 0.296) 1.433 23.190 ( 0.904 -1.045 -1.734) 2.217 24.621 ( -1.826 -1.635 1.131) 2.700 24.700 ( -0.975 -4.441 -1.059) 4.668 24.907 ( -0.015 3.722 -0.603) 3.771 24.945 ( 1.241 1.613 -1.166) 2.345 25.633 ( -3.879 1.474 -0.290) 4.160 25.728 ( -5.142 0.471 0.207) 5.167 26.014 ( -2.042 0.113 -0.813) 2.201 26.048 ( -5.187 -0.154 1.145) 5.314 28.333 ( -0.426 0.645 1.004) 1.267 28.379 ( 1.002 0.154 -0.006) 1.014 28.524 ( 0.485 -0.070 0.118) 0.504 28.576 ( -1.380 -0.961 -0.349) 1.718 28.642 ( -0.730 -1.002 1.252) 1.762 28.701 ( -0.370 1.379 0.839) 1.656 28.756 ( 1.115 -2.272 -1.796) 3.103 28.864 ( 1.895 -1.350 -2.474) 3.396 32.370 ( 0.690 -0.623 0.235) 0.959 32.426 ( -0.448 -1.257 -1.452) 1.972 32.440 ( 1.851 1.758 -0.497) 2.601 32.502 ( -1.281 0.747 0.515) 1.570 35.388 ( 0.780 0.390 -0.934) 1.277 35.459 ( -0.974 -0.416 -0.463) 1.156 35.469 ( -0.567 0.165 1.924) 2.013 35.509 ( -0.214 0.865 -0.241) 0.923 88.855 ( -0.894 -1.121 3.184) 3.492 88.882 ( 1.869 -2.664 3.992) 5.150 89.018 ( 4.282 2.578 -0.291) 5.006 89.504 ( -1.567 -7.979 -1.668) 8.301 97.657 ( 1.479 0.023 0.075) 1.481 97.685 ( 1.296 -0.068 -0.310) 1.334 97.729 ( 2.072 -0.648 1.624) 2.711 97.908 ( 1.462 -4.434 1.045) 4.784 98.687 ( 0.568 0.191 0.301) 0.671 98.732 ( 0.683 0.343 -1.172) 1.399 98.787 ( -2.878 5.411 0.580) 6.156 98.820 ( -2.693 2.988 1.032) 4.153 99.605 ( -0.706 0.099 -0.460) 0.849 99.677 ( -0.634 1.828 -0.205) 1.946 99.770 ( 2.228 1.679 5.692) 6.339 100.288 ( 3.074 -4.445 -6.608) 8.536 ======================= Grid point 139 (70/92) ======================= q-point: ( 0.44 0.17 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.339 ( 11.771 3.146 -10.255) 15.926 1.539 ( -8.556 4.445 -8.303) 12.725 1.570 ( 12.915 4.789 -4.165) 14.390 1.646 ( -8.597 2.740 2.243) 9.297 1.949 ( 5.811 -0.075 -3.606) 6.839 1.963 ( -3.111 2.355 0.919) 4.009 2.069 ( 5.495 -1.458 -0.420) 5.701 2.213 ( -0.474 -2.400 0.600) 2.519 2.285 ( -1.009 -0.253 -2.465) 2.675 2.363 ( -3.285 -1.417 -4.357) 5.638 2.393 ( 1.418 2.989 0.763) 3.395 2.434 ( -2.159 2.321 -0.822) 3.275 2.532 ( -2.832 -0.056 -0.956) 2.989 2.617 ( 0.408 -1.473 -0.075) 1.530 2.663 ( -3.797 1.442 0.602) 4.106 2.733 ( 1.632 -1.037 -5.522) 5.851 2.972 ( 4.982 -1.209 -0.547) 5.155 3.037 ( -2.344 -2.996 0.708) 3.869 3.133 ( -0.174 1.226 0.937) 1.553 3.209 ( -5.696 1.321 1.312) 5.993 3.280 ( 3.965 2.348 4.373) 6.353 3.321 ( -2.355 3.718 5.462) 7.014 3.532 ( -1.128 0.916 6.527) 6.687 3.599 ( 4.042 1.383 -0.108) 4.273 4.484 ( -4.141 -4.109 3.786) 6.954 4.519 ( 4.071 -3.481 -1.292) 5.510 4.582 ( -3.401 -1.157 3.774) 5.210 4.629 ( 0.860 -2.328 -1.886) 3.117 4.859 ( -4.172 -2.176 4.512) 6.519 4.907 ( 2.676 -4.870 -3.465) 6.548 4.977 ( -0.299 -0.410 1.665) 1.741 5.034 ( -2.374 1.293 -1.069) 2.907 5.224 ( -3.254 0.951 2.734) 4.356 5.288 ( 1.065 -2.217 -2.922) 3.819 5.364 ( 4.219 -1.291 4.347) 6.194 5.475 ( -2.118 -1.921 -1.121) 3.071 5.522 ( 1.337 -7.351 -1.002) 7.538 5.578 ( -1.962 -1.035 -1.760) 2.832 5.651 ( -6.594 -1.285 1.382) 6.858 5.744 ( -4.655 0.091 -0.335) 4.668 5.839 ( 2.211 3.618 2.520) 4.932 5.969 ( 1.224 2.746 1.703) 3.455 6.149 ( 0.978 -1.181 -1.636) 2.242 6.228 ( 2.597 0.889 -1.124) 2.966 6.355 ( -4.692 -0.724 5.454) 7.231 6.461 ( 0.707 3.719 1.221) 3.978 6.640 ( 5.148 -2.426 3.144) 6.501 6.720 ( -5.997 1.568 5.214) 8.100 6.806 ( -0.968 -1.811 5.533) 5.902 6.884 ( -0.516 -3.557 -4.313) 5.614 7.252 ( 2.581 1.238 -3.297) 4.366 7.279 ( 1.074 -2.479 -0.161) 2.706 7.454 ( -3.169 7.988 -3.705) 9.359 7.505 ( -2.240 3.061 -8.649) 9.444 7.901 ( -7.446 2.860 3.188) 8.590 7.989 ( -4.345 -0.046 -2.181) 4.862 8.083 ( -1.381 6.861 3.597) 7.868 8.397 ( 0.181 5.483 -13.754) 14.808 8.663 ( 2.021 -0.443 5.306) 5.696 8.719 ( 1.076 0.008 3.585) 3.743 8.947 ( -0.416 -1.213 1.597) 2.048 9.125 ( 2.379 2.314 -6.572) 7.362 9.226 ( -0.705 3.331 4.154) 5.371 9.315 ( 2.231 3.168 -2.044) 4.380 9.731 ( 4.686 -0.107 1.032) 4.799 9.768 ( 1.328 -0.012 1.219) 1.803 9.868 ( 4.083 -3.594 -0.774) 5.494 9.916 ( 1.057 -2.094 -1.735) 2.917 10.463 ( -1.044 -0.765 1.204) 1.768 10.523 ( 0.472 -2.219 -2.410) 3.310 10.804 ( -1.947 -2.595 10.460) 10.952 11.118 ( 1.690 -6.731 -9.147) 11.482 20.497 ( 0.327 1.411 1.185) 1.871 20.537 ( 0.124 0.880 -0.881) 1.251 20.816 ( -1.422 0.638 1.564) 2.208 20.852 ( 0.217 0.290 -1.343) 1.391 22.758 ( 1.364 0.840 3.302) 3.669 22.898 ( -1.062 -0.317 -2.558) 2.788 23.037 ( 1.063 -0.360 2.149) 2.424 23.163 ( -0.808 -1.337 -3.251) 3.607 24.613 ( -1.082 -1.880 1.906) 2.888 24.675 ( -0.235 -3.925 -1.698) 4.283 24.905 ( 0.041 3.703 0.226) 3.710 24.945 ( 0.417 1.861 -1.606) 2.493 25.600 ( -0.046 1.760 0.419) 1.810 25.651 ( -3.612 1.108 -0.357) 3.795 25.984 ( -1.425 -0.306 0.264) 1.481 25.995 ( -1.322 -0.045 -0.270) 1.350 28.343 ( -0.216 0.770 1.661) 1.843 28.388 ( 0.357 0.505 -0.777) 0.993 28.538 ( 0.947 -0.268 0.195) 1.003 28.552 ( -1.152 -0.721 -0.094) 1.362 28.639 ( -1.689 -0.899 1.957) 2.737 28.697 ( 0.917 -0.423 -1.974) 2.218 28.770 ( 0.797 -0.787 1.247) 1.676 28.858 ( 0.924 -1.250 -2.954) 3.338 32.381 ( 0.197 -0.622 0.343) 0.737 32.403 ( -0.330 -1.008 -1.003) 1.460 32.470 ( 2.005 1.248 -0.448) 2.404 32.484 ( -1.375 1.219 0.340) 1.868 35.400 ( 1.260 0.237 -0.116) 1.287 35.432 ( -1.759 0.134 -0.241) 1.780 35.478 ( -0.743 0.106 1.555) 1.726 35.506 ( 0.756 0.399 -1.046) 1.350 88.875 ( -1.185 -1.155 3.623) 3.983 88.941 ( 1.900 -3.549 0.372) 4.042 89.095 ( 2.800 2.040 4.566) 5.731 89.403 ( -4.314 -4.561 -6.402) 8.966 97.677 ( 0.669 0.125 0.261) 0.729 97.695 ( 0.414 0.191 -0.566) 0.727 97.789 ( 2.218 -1.545 2.676) 3.804 97.902 ( -1.659 -3.492 -1.202) 4.048 98.700 ( 0.395 0.641 0.456) 0.881 98.728 ( -0.163 1.285 -0.912) 1.585 98.765 ( 0.465 3.267 0.088) 3.301 98.786 ( -2.297 2.531 0.616) 3.473 99.607 ( 0.596 0.642 0.644) 1.088 99.655 ( -1.010 2.308 -0.984) 2.705 99.896 ( 2.230 -0.641 9.716) 9.989 100.241 ( 1.237 -4.109 -8.974) 9.947 ======================= Grid point 140 (71/92) ======================= q-point: (-0.44 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.259 ( -13.514 4.533 -3.538) 14.686 1.447 ( 0.240 4.911 -1.086) 5.036 1.498 ( -4.139 2.258 0.408) 4.732 1.732 ( 10.378 2.539 -4.493) 11.590 1.922 ( -1.486 0.598 -0.780) 1.782 1.991 ( 3.719 -0.791 -2.700) 4.663 2.108 ( -5.108 -0.101 -3.759) 6.343 2.186 ( 6.103 -1.525 1.602) 6.491 2.243 ( -5.338 -1.213 4.280) 6.949 2.331 ( -0.445 1.942 -3.450) 3.983 2.388 ( -2.554 3.332 -1.206) 4.368 2.421 ( 3.810 2.218 1.401) 4.626 2.559 ( 0.701 -0.895 3.224) 3.418 2.576 ( -3.721 -1.029 -0.177) 3.865 2.625 ( -1.956 -0.549 2.486) 3.210 2.730 ( 3.763 0.181 -3.892) 5.416 2.909 ( -9.914 0.119 2.202) 10.156 3.058 ( 2.314 -2.497 1.064) 3.567 3.148 ( -1.693 0.110 0.474) 1.761 3.199 ( 5.318 0.523 0.240) 5.349 3.314 ( -2.342 2.179 1.465) 3.519 3.377 ( 3.302 4.019 1.204) 5.339 3.556 ( -1.461 1.995 2.521) 3.531 3.664 ( 5.645 0.614 -3.630) 6.740 4.450 ( -5.007 -2.856 4.068) 7.055 4.554 ( -2.437 -2.222 3.421) 4.752 4.559 ( 2.250 -4.761 -2.276) 5.737 4.660 ( 3.047 -1.467 -1.356) 3.643 4.815 ( -4.134 -4.744 3.671) 7.285 4.950 ( 4.154 -4.279 -2.735) 6.561 5.000 ( -0.205 2.228 0.151) 2.242 5.032 ( 6.843 0.597 -1.478) 7.026 5.202 ( -3.598 0.948 3.520) 5.122 5.318 ( 6.248 -1.957 -4.094) 7.722 5.428 ( -1.848 -1.536 -0.488) 2.452 5.469 ( 3.690 -2.677 1.828) 4.912 5.504 ( -2.899 -3.152 -2.761) 5.095 5.538 ( 3.194 -2.903 0.403) 4.335 5.678 ( 2.403 -0.641 4.722) 5.337 5.692 ( 0.323 0.080 -0.019) 0.333 5.865 ( -6.599 1.934 0.596) 6.902 5.994 ( 5.751 1.772 -1.813) 6.285 6.143 ( -4.486 -0.988 1.058) 4.714 6.223 ( 3.076 3.279 -1.727) 4.816 6.400 ( -0.051 0.977 4.659) 4.760 6.457 ( 1.919 -0.117 -1.666) 2.544 6.684 ( -3.910 -2.614 2.004) 5.113 6.759 ( 2.885 2.261 5.318) 6.459 6.844 ( 3.994 -3.704 -1.982) 5.796 6.871 ( 5.273 -5.039 -4.149) 8.391 7.259 ( -2.293 -2.584 -3.192) 4.703 7.297 ( 2.955 -3.081 -1.444) 4.507 7.369 ( -2.613 8.272 1.801) 8.860 7.423 ( 0.645 8.648 -2.166) 8.938 7.888 ( -1.044 1.431 5.528) 5.805 7.954 ( 2.621 2.183 0.303) 3.425 8.127 ( -0.152 6.603 6.399) 9.196 8.305 ( 5.982 7.813 -12.953) 16.267 8.724 ( -0.074 -2.501 2.701) 3.682 8.742 ( -0.405 -1.919 -1.057) 2.227 8.967 ( -2.372 1.825 6.148) 6.837 9.064 ( 0.067 3.574 -7.711) 8.499 9.246 ( -2.167 1.827 3.730) 4.685 9.320 ( 1.703 2.197 -3.100) 4.164 9.731 ( -4.513 -1.841 1.197) 5.019 9.782 ( -3.979 -1.186 1.624) 4.459 9.827 ( -3.491 1.002 -1.767) 4.039 9.963 ( 5.117 -3.789 -3.376) 7.207 10.447 ( -3.416 -1.399 3.271) 4.932 10.513 ( 1.017 -0.783 -2.208) 2.554 10.886 ( -2.312 -4.173 11.434) 12.389 11.032 ( 0.516 -5.154 -9.855) 11.133 20.513 ( 0.012 1.346 0.890) 1.614 20.527 ( 0.194 1.003 -1.080) 1.487 20.819 ( -0.330 0.664 1.616) 1.778 20.849 ( 1.203 0.247 -1.363) 1.835 22.824 ( 1.362 0.609 3.449) 3.758 22.836 ( -1.618 0.595 -3.215) 3.648 23.089 ( 0.824 -1.224 2.641) 3.025 23.105 ( -0.971 -1.098 -3.064) 3.397 24.625 ( -0.253 -2.171 2.425) 3.265 24.658 ( 0.532 -3.146 -1.930) 3.729 24.910 ( -0.562 2.847 1.187) 3.136 24.927 ( -0.269 2.350 -1.508) 2.805 25.611 ( -0.153 1.427 -0.485) 1.515 25.640 ( 3.780 1.519 0.517) 4.107 25.976 ( 0.132 0.267 0.682) 0.744 25.999 ( 1.947 -0.317 -0.374) 2.007 28.355 ( -0.741 0.579 1.818) 2.047 28.375 ( -0.694 0.723 -0.865) 1.324 28.536 ( -0.565 -0.347 -0.158) 0.682 28.559 ( 1.328 -0.337 -0.023) 1.371 28.629 ( -2.186 -0.670 2.461) 3.359 28.699 ( 2.103 -1.481 -2.302) 3.452 28.796 ( -0.160 -0.366 1.862) 1.904 28.835 ( 0.649 -1.387 -3.427) 3.754 32.376 ( -1.385 -0.546 0.696) 1.643 32.398 ( 0.473 -0.901 -0.505) 1.136 32.463 ( -1.442 1.523 0.132) 2.102 32.497 ( 1.845 0.812 -0.657) 2.120 35.398 ( -1.884 0.347 0.053) 1.916 35.424 ( 1.099 -0.166 0.386) 1.176 35.478 ( -0.746 0.803 1.164) 1.599 35.513 ( 1.465 -0.025 -1.271) 1.940 88.887 ( -2.171 -1.399 3.562) 4.400 88.950 ( 0.880 -2.430 -2.550) 3.631 89.212 ( 1.471 -1.802 9.077) 9.370 89.255 ( -3.488 -1.516 -7.030) 7.993 97.683 ( -0.323 0.167 0.393) 0.535 97.687 ( -0.550 0.266 -0.583) 0.844 97.842 ( -2.791 -2.321 -1.559) 3.951 97.854 ( 1.326 -2.867 2.635) 4.114 98.707 ( -0.513 1.015 0.882) 1.439 98.712 ( -0.543 0.874 -0.620) 1.201 98.766 ( -0.071 3.351 0.068) 3.352 98.796 ( 2.863 2.741 -0.272) 3.972 99.625 ( -0.704 1.695 -0.458) 1.892 99.636 ( 1.194 1.536 0.289) 1.967 100.028 ( 0.623 -2.129 10.028) 10.271 100.139 ( -0.416 -3.662 -11.604) 12.176 ======================= Grid point 141 (72/92) ======================= q-point: (-0.33 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.020 ( -15.166 5.813 5.129) 17.032 1.248 ( -17.719 6.143 5.448) 19.529 1.628 ( 7.779 3.673 2.741) 9.029 1.783 ( 1.768 -1.631 -3.855) 4.544 1.907 ( 1.823 1.983 -3.392) 4.331 1.988 ( -2.955 -0.992 -0.621) 3.178 2.051 ( 2.282 2.424 -2.935) 4.438 2.189 ( -6.461 -0.603 5.272) 8.361 2.241 ( -10.538 3.429 1.252) 11.152 2.276 ( 1.278 -1.257 2.161) 2.808 2.366 ( -1.954 3.281 2.349) 4.483 2.488 ( -1.895 -3.205 4.572) 5.896 2.490 ( 4.066 1.747 -0.761) 4.490 2.636 ( 2.597 -0.941 1.650) 3.217 2.664 ( 2.243 -0.395 3.756) 4.392 2.748 ( 1.819 2.455 -1.863) 3.579 2.830 ( 0.333 1.488 -0.192) 1.537 3.094 ( 1.320 -3.122 0.140) 3.393 3.165 ( 1.823 -0.691 1.299) 2.343 3.258 ( -0.431 0.509 -1.085) 1.273 3.295 ( 2.260 0.047 -1.302) 2.609 3.398 ( -0.479 1.976 -2.093) 2.918 3.543 ( -0.135 3.070 -2.658) 4.063 3.690 ( 2.989 0.470 -5.646) 6.406 4.406 ( -4.050 -2.514 2.627) 5.443 4.527 ( -2.893 -2.885 1.778) 4.456 4.612 ( 2.534 -4.740 -0.424) 5.391 4.686 ( 4.838 -0.961 -1.286) 5.097 4.817 ( -0.163 -4.719 1.668) 5.007 4.993 ( 2.024 -1.684 -1.026) 2.826 5.004 ( 1.578 -0.181 1.346) 2.082 5.154 ( 9.431 0.255 -3.653) 10.117 5.231 ( 2.867 0.650 4.777) 5.609 5.350 ( -0.198 -2.332 -5.696) 6.158 5.357 ( 0.456 0.371 -6.353) 6.380 5.445 ( -2.445 -3.274 0.655) 4.139 5.523 ( 0.953 -5.602 1.058) 5.780 5.636 ( 7.118 -0.963 0.501) 7.201 5.733 ( 3.321 -0.660 3.090) 4.584 5.804 ( 2.439 1.103 4.537) 5.268 5.841 ( 6.985 2.371 2.726) 7.864 5.990 ( -2.235 -0.164 -4.495) 5.023 6.102 ( -1.275 1.326 1.958) 2.686 6.191 ( -3.357 4.833 -2.938) 6.577 6.426 ( -1.572 4.288 1.348) 4.762 6.497 ( 1.618 0.060 -0.504) 1.695 6.618 ( -0.202 -2.835 -7.137) 7.682 6.850 ( 3.338 0.506 1.349) 3.636 6.902 ( 6.852 -1.156 -3.258) 7.674 6.950 ( 6.233 -6.262 -4.189) 9.778 7.218 ( 2.611 4.927 -0.247) 5.581 7.274 ( -0.587 -2.465 -3.091) 3.997 7.422 ( 2.720 -2.124 8.045) 8.754 7.472 ( 1.136 6.831 4.473) 8.244 7.957 ( 2.939 -2.155 2.813) 4.604 8.066 ( 6.527 2.965 3.478) 7.968 8.220 ( 3.309 5.580 7.909) 10.229 8.349 ( 11.354 8.818 -4.118) 14.954 8.684 ( -1.633 -2.296 -4.388) 5.215 8.723 ( -1.779 -2.150 -1.543) 3.189 8.958 ( -3.318 1.624 0.267) 3.704 9.009 ( -2.468 4.266 2.320) 5.447 9.231 ( -2.522 0.321 1.052) 2.751 9.306 ( 1.042 3.150 -3.806) 5.049 9.591 ( -12.085 1.339 -1.359) 12.234 9.682 ( -8.311 -4.148 3.853) 10.056 9.785 ( -1.237 3.098 -2.719) 4.303 9.965 ( -0.067 -3.488 -3.988) 5.298 10.424 ( -3.839 -3.262 3.423) 6.090 10.500 ( -1.121 1.155 -0.265) 1.631 10.931 ( -0.616 -5.074 -7.337) 8.942 10.965 ( -2.643 -6.649 9.164) 11.627 20.503 ( -0.357 1.198 -1.053) 1.634 20.536 ( 0.959 2.305 0.166) 2.502 20.838 ( 0.543 0.809 1.450) 1.747 20.861 ( 1.860 0.361 -1.220) 2.253 22.769 ( -1.468 0.578 -2.913) 3.313 22.883 ( 0.644 -0.231 2.663) 2.750 23.047 ( -0.739 -0.267 -2.466) 2.588 23.141 ( 0.459 -0.910 2.643) 2.832 24.650 ( 0.780 -2.376 -0.513) 2.553 24.657 ( 0.659 -2.551 1.728) 3.151 24.902 ( -0.736 2.376 0.046) 2.488 24.917 ( -0.813 2.224 0.841) 2.513 25.635 ( 3.577 1.416 -0.427) 3.871 25.726 ( 5.337 0.616 0.403) 5.388 26.001 ( 1.961 1.150 0.417) 2.312 26.054 ( 4.746 -0.122 0.568) 4.782 28.345 ( -1.383 0.363 0.114) 1.435 28.363 ( -1.068 0.446 1.232) 1.691 28.530 ( 0.369 0.069 -0.690) 0.786 28.579 ( 1.250 -0.349 -0.280) 1.327 28.623 ( -1.858 -0.743 2.828) 3.464 28.715 ( 1.945 -1.806 -1.277) 2.945 28.784 ( -0.612 -1.382 -2.597) 3.005 28.822 ( -0.461 -0.668 0.261) 0.852 32.360 ( -1.599 -0.563 1.082) 2.011 32.400 ( -0.284 -0.701 0.437) 0.873 32.440 ( -1.032 1.801 -0.378) 2.110 32.518 ( 1.602 0.365 -0.762) 1.811 35.372 ( -1.470 0.557 0.455) 1.637 35.438 ( -0.441 -0.514 1.129) 1.317 35.489 ( 1.217 1.151 0.317) 1.705 35.523 ( 1.313 0.088 -1.315) 1.861 88.877 ( -3.007 -1.739 2.622) 4.352 88.929 ( 0.123 -1.495 -2.635) 3.032 89.106 ( -3.692 0.108 -6.863) 7.794 89.368 ( 2.017 -7.682 10.984) 13.555 97.664 ( -1.265 0.187 -0.530) 1.384 97.677 ( -1.054 0.078 0.385) 1.125 97.768 ( -3.107 -1.222 -1.859) 3.822 97.898 ( -0.200 -5.360 2.302) 5.836 98.695 ( -0.886 0.266 -0.276) 0.966 98.705 ( -0.698 0.559 0.922) 1.284 98.794 ( 3.259 5.664 0.020) 6.535 98.845 ( 3.660 4.037 -0.965) 5.534 99.607 ( -0.286 1.009 -0.500) 1.162 99.668 ( 1.560 1.866 0.489) 2.481 99.980 ( -2.805 -2.285 -13.145) 13.634 100.121 ( -1.353 -2.953 8.464) 9.066 ======================= Grid point 142 (73/92) ======================= q-point: (-0.22 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.903 ( -11.268 8.751 15.316) 20.932 1.034 ( -16.191 10.853 9.176) 21.544 1.662 ( -3.900 -0.875 -4.700) 6.170 1.771 ( -2.217 2.650 -4.019) 5.300 1.887 ( 0.505 3.785 -3.635) 5.272 1.940 ( -18.444 10.009 12.110) 24.229 1.979 ( 0.945 -2.187 5.208) 5.727 2.118 ( 0.574 -1.103 1.732) 2.132 2.200 ( 1.093 -2.414 0.774) 2.760 2.325 ( 2.414 -2.677 1.996) 4.120 2.371 ( -0.599 0.060 3.158) 3.215 2.556 ( 2.175 -0.465 3.320) 3.996 2.580 ( 4.042 0.396 3.883) 5.619 2.682 ( 1.838 -2.850 1.557) 3.732 2.737 ( 2.619 2.467 -0.091) 3.599 2.786 ( 1.116 2.520 5.062) 5.763 2.864 ( 4.157 3.103 -2.442) 5.733 3.123 ( 2.360 -2.469 -0.379) 3.437 3.188 ( -0.778 -1.418 -4.972) 5.229 3.197 ( 0.267 -2.101 -2.712) 3.441 3.301 ( -1.088 0.797 -6.093) 6.240 3.362 ( 0.944 0.002 0.521) 1.078 3.487 ( -1.239 4.229 -5.966) 7.417 3.637 ( -0.720 0.122 -7.600) 7.635 4.381 ( -1.479 -3.493 1.016) 3.927 4.492 ( -2.195 0.436 0.126) 2.241 4.641 ( 2.142 -5.694 0.618) 6.115 4.797 ( 5.587 -3.691 -0.671) 6.730 4.828 ( 1.468 -3.253 1.289) 3.795 4.984 ( -0.028 1.820 -0.134) 1.825 5.093 ( 4.645 -0.827 0.793) 4.784 5.183 ( -2.646 -0.675 -4.797) 5.520 5.264 ( 6.250 0.473 -5.050) 8.049 5.339 ( 1.755 0.068 0.731) 1.902 5.412 ( 2.870 1.452 0.199) 3.223 5.428 ( 4.791 -5.322 3.588) 8.010 5.542 ( 0.002 -5.768 0.827) 5.827 5.754 ( 7.784 -2.574 -1.970) 8.432 5.829 ( -2.208 -1.689 4.614) 5.386 5.844 ( -4.447 0.797 -4.500) 6.377 5.926 ( 8.423 -0.180 4.518) 9.560 6.042 ( 5.996 1.179 0.783) 6.161 6.115 ( -1.462 3.026 -0.480) 3.395 6.140 ( 3.794 7.048 3.949) 8.926 6.372 ( -3.742 3.139 -2.343) 5.417 6.475 ( -1.548 -0.797 -1.227) 2.130 6.536 ( 0.810 1.467 -8.971) 9.126 6.849 ( 2.658 3.686 -7.448) 8.725 6.973 ( 3.660 -2.010 -4.267) 5.970 7.030 ( 6.777 -2.853 2.318) 7.710 7.203 ( -2.777 1.049 -1.970) 3.563 7.308 ( 4.372 4.463 -1.348) 6.391 7.507 ( 1.060 2.384 4.104) 4.863 7.705 ( 13.709 -5.779 14.068) 20.475 8.019 ( 1.259 -1.406 3.291) 3.794 8.186 ( 5.294 1.940 0.105) 5.639 8.404 ( 7.118 0.176 2.846) 7.668 8.567 ( 7.821 2.840 7.070) 10.919 8.631 ( 5.794 0.825 -4.936) 7.656 8.663 ( -1.578 -1.666 0.102) 2.297 8.903 ( -3.548 -0.015 0.061) 3.548 8.992 ( -4.263 4.913 4.957) 8.178 9.191 ( -1.727 -0.886 -1.853) 2.684 9.275 ( 0.090 5.057 -4.550) 6.803 9.361 ( -12.023 3.480 -1.401) 12.595 9.575 ( -8.259 -2.544 1.285) 8.736 9.718 ( -3.769 2.238 -1.496) 4.632 9.894 ( -1.692 -1.631 -5.582) 6.057 10.378 ( -4.843 -2.058 0.975) 5.352 10.464 ( -5.193 -0.836 2.861) 5.988 10.849 ( 0.568 -4.392 -6.767) 8.087 10.985 ( -6.437 -10.363 6.678) 13.907 20.490 ( 0.055 1.710 -0.754) 1.870 20.555 ( 1.830 3.568 -1.263) 4.204 20.863 ( 0.640 1.048 1.230) 1.738 20.883 ( 2.080 0.598 -1.037) 2.399 22.732 ( -0.155 0.544 -1.328) 1.443 22.898 ( -0.736 -1.506 0.705) 1.818 23.029 ( 0.385 1.208 -0.916) 1.565 23.157 ( -0.975 -0.565 1.199) 1.646 24.657 ( 1.209 -1.722 -0.611) 2.191 24.697 ( 1.022 -3.537 2.493) 4.446 24.901 ( -0.147 2.075 0.904) 2.268 24.910 ( -1.026 1.885 1.025) 2.379 25.712 ( 5.600 1.033 0.032) 5.695 25.810 ( 4.334 -0.235 0.015) 4.341 26.043 ( 2.356 1.910 0.562) 3.085 26.165 ( 7.591 -0.484 0.003) 7.607 28.330 ( -0.944 0.219 0.979) 1.378 28.363 ( -0.057 -0.256 1.293) 1.320 28.533 ( 1.278 0.386 -1.236) 1.820 28.595 ( 0.927 -0.269 0.001) 0.965 28.626 ( -1.345 -0.579 2.433) 2.840 28.716 ( -2.221 -3.388 0.025) 4.051 28.752 ( 1.548 -0.401 -2.721) 3.156 28.805 ( -2.310 -0.713 0.714) 2.521 32.345 ( -1.637 -0.237 1.177) 2.030 32.401 ( -0.756 -0.591 1.191) 1.529 32.429 ( 0.332 1.372 0.144) 1.419 32.534 ( 1.312 -0.014 -0.890) 1.585 35.361 ( -0.792 0.665 1.210) 1.592 35.442 ( -0.500 -0.027 1.441) 1.526 35.507 ( 1.164 0.147 -1.648) 2.023 35.535 ( 1.691 0.744 -0.720) 1.983 88.847 ( -2.953 -1.737 1.279) 3.657 88.904 ( -0.345 -0.840 -1.832) 2.044 88.992 ( -1.483 0.514 -5.484) 5.704 89.462 ( -3.521 -15.061 5.200) 16.318 97.636 ( -1.319 0.147 -0.566) 1.443 97.659 ( -1.339 -0.176 0.209) 1.367 97.707 ( -2.197 -0.600 -1.064) 2.513 97.873 ( -4.358 -6.780 -0.778) 8.097 98.682 ( -0.319 0.040 -0.138) 0.350 98.705 ( -0.711 0.331 1.279) 1.501 98.857 ( 3.623 4.692 -0.566) 5.955 98.899 ( 5.822 8.719 -3.282) 10.985 99.611 ( 0.834 0.815 0.855) 1.446 99.692 ( 1.248 1.474 -0.330) 1.960 99.797 ( -3.647 0.786 -7.868) 8.708 100.158 ( -3.805 -3.416 6.181) 8.022 ======================= Grid point 143 (74/92) ======================= q-point: (-0.11 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.919 ( -7.544 13.964 13.865) 21.075 0.975 ( -7.239 10.860 17.364) 21.722 1.534 ( -0.326 2.436 -10.749) 11.027 1.575 ( -11.591 5.343 -1.278) 12.827 1.746 ( -10.505 8.061 6.022) 14.547 1.973 ( 2.413 1.651 3.112) 4.270 2.065 ( 1.309 -4.228 5.317) 6.918 2.215 ( 3.402 -2.215 6.335) 7.524 2.229 ( -0.073 -3.394 3.914) 5.181 2.399 ( -0.541 -2.475 4.076) 4.799 2.414 ( 4.171 -0.384 4.370) 6.054 2.591 ( 0.693 -2.264 -0.646) 2.454 2.669 ( 1.276 -0.760 2.548) 2.949 2.737 ( -1.141 6.105 0.286) 6.217 2.772 ( 2.035 -2.159 6.409) 7.062 2.861 ( 2.783 1.228 1.982) 3.631 2.894 ( 3.147 4.269 -3.065) 6.126 3.061 ( -1.088 -1.223 -12.260) 12.369 3.151 ( 1.774 -2.448 -2.282) 3.788 3.177 ( -1.325 -2.314 -5.908) 6.482 3.217 ( 0.838 0.123 -2.134) 2.296 3.364 ( -3.782 2.317 -2.470) 5.077 3.407 ( 1.393 3.632 -3.858) 5.479 3.522 ( -2.530 0.030 -7.542) 7.955 4.376 ( 0.371 -2.883 -0.023) 2.907 4.451 ( -1.857 2.070 -2.062) 3.462 4.701 ( 1.859 -7.392 3.332) 8.318 4.803 ( -1.245 -4.820 1.789) 5.290 4.903 ( 3.050 -2.180 -0.206) 3.755 4.990 ( 1.624 2.692 -2.292) 3.890 5.099 ( 0.561 0.034 -0.818) 0.992 5.232 ( 6.201 2.631 3.078) 7.406 5.288 ( 2.518 -1.085 -5.388) 6.045 5.384 ( 1.865 0.375 4.733) 5.101 5.465 ( 2.089 2.097 1.315) 3.239 5.539 ( -0.966 -3.165 3.197) 4.601 5.569 ( 3.707 -7.751 0.912) 8.640 5.698 ( -4.262 -1.792 -1.894) 4.996 5.800 ( -3.083 -5.236 -1.227) 6.198 5.855 ( 4.998 -1.242 -2.669) 5.800 6.035 ( 0.203 3.322 0.079) 3.329 6.078 ( 0.121 2.818 -1.393) 3.146 6.122 ( 2.139 1.548 1.445) 3.010 6.263 ( -3.277 2.764 -4.626) 6.307 6.317 ( 7.538 2.373 2.406) 8.261 6.446 ( 0.456 1.198 -6.026) 6.161 6.497 ( 2.342 4.076 1.506) 4.937 6.819 ( 2.201 6.285 -7.190) 9.800 7.025 ( 6.397 -3.037 0.053) 7.082 7.115 ( -0.713 0.631 1.036) 1.407 7.138 ( -0.486 0.376 -0.570) 0.838 7.324 ( -0.364 4.247 -2.266) 4.828 7.639 ( 8.547 0.343 6.061) 10.483 8.066 ( 5.979 -4.389 11.306) 13.522 8.091 ( 1.874 0.012 6.107) 6.388 8.250 ( 6.337 -1.247 -1.250) 6.579 8.395 ( 0.779 -1.358 -6.727) 6.907 8.599 ( 0.571 -3.746 -2.238) 4.401 8.709 ( -1.696 -2.672 3.789) 4.937 8.829 ( 2.018 -0.650 5.857) 6.229 8.869 ( -1.604 0.186 5.920) 6.136 9.012 ( 0.652 5.659 7.346) 9.296 9.098 ( -6.419 1.734 -3.693) 7.606 9.192 ( 2.890 2.464 -6.011) 7.111 9.271 ( 0.464 2.953 -3.422) 4.544 9.443 ( -4.490 -0.631 -4.449) 6.352 9.648 ( -5.136 0.109 2.797) 5.849 9.815 ( 1.174 1.406 -7.350) 7.574 10.297 ( -3.246 0.957 -1.327) 3.635 10.378 ( -9.418 -4.957 3.521) 11.210 10.817 ( 2.530 -4.323 -4.046) 6.439 10.889 ( -10.083 -7.735 3.148) 13.092 20.490 ( 0.416 1.975 -0.061) 2.019 20.560 ( 1.266 4.145 -3.083) 5.319 20.882 ( 0.040 1.085 1.239) 1.648 20.905 ( 1.816 0.994 -1.043) 2.318 22.739 ( 1.619 0.678 0.513) 1.829 22.879 ( -1.726 -1.200 -0.461) 2.152 23.034 ( 1.077 1.224 -0.191) 1.641 23.136 ( -2.033 -0.264 -0.385) 2.086 24.678 ( 1.397 -1.719 0.457) 2.262 24.732 ( 0.562 -4.360 0.923) 4.492 24.898 ( -0.981 1.580 1.242) 2.236 24.922 ( 0.634 1.632 0.554) 1.836 25.804 ( 4.653 0.395 0.459) 4.692 25.865 ( 2.287 -0.352 -0.244) 2.327 26.088 ( 1.641 2.147 1.636) 3.159 26.255 ( 4.205 -1.490 -3.906) 5.929 28.336 ( -0.473 -0.147 2.312) 2.364 28.401 ( 3.335 -1.621 -0.084) 3.709 28.547 ( 2.157 0.642 -1.486) 2.697 28.601 ( -2.423 0.157 -0.034) 2.428 28.624 ( 0.908 -0.252 0.861) 1.276 28.681 ( -2.856 -2.694 4.083) 5.664 28.753 ( -2.684 -1.373 1.451) 3.346 28.769 ( 0.988 -0.788 -3.066) 3.316 32.334 ( -1.305 0.404 1.602) 2.105 32.392 ( -0.077 0.302 -1.151) 1.192 32.461 ( 1.271 -1.023 2.412) 2.912 32.541 ( 0.827 -0.449 -1.123) 1.465 35.371 ( -0.208 0.621 2.073) 2.174 35.454 ( -0.034 0.285 1.507) 1.534 35.495 ( 0.252 0.143 -2.474) 2.491 35.548 ( 1.030 0.439 -1.834) 2.149 88.813 ( -2.170 -1.139 0.669) 2.540 88.862 ( -1.866 0.502 -2.045) 2.814 88.971 ( 4.591 -1.439 -3.189) 5.772 89.308 ( -16.553 -13.177 -0.774) 21.172 97.614 ( -0.481 0.214 -0.539) 0.754 97.639 ( -1.224 -0.312 -0.108) 1.268 97.675 ( -0.712 -0.429 -0.392) 0.920 97.753 ( -6.872 -2.849 -1.379) 7.566 98.684 ( 0.429 -0.256 0.274) 0.570 98.705 ( -0.880 0.285 1.177) 1.497 98.885 ( 1.049 3.793 -1.007) 4.062 98.936 ( 3.814 9.859 -6.377) 12.345 99.638 ( 0.219 0.975 1.343) 1.674 99.711 ( 0.719 2.173 -1.343) 2.654 99.788 ( 8.281 -0.500 2.907) 8.790 100.123 ( -6.714 -3.447 3.543) 8.337 ======================= Grid point 144 (75/92) ======================= q-point: ( 0.00 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.284 ( -7.788 14.533 10.725) 19.669 1.351 ( 2.863 14.284 8.674) 16.955 1.585 ( 3.465 9.219 -8.190) 12.809 1.609 ( 1.976 10.379 -7.451) 12.928 1.865 ( -4.188 -1.470 5.928) 7.406 1.924 ( 1.174 -7.100 -0.992) 7.264 2.049 ( 0.532 -5.118 7.382) 8.998 2.152 ( -0.066 -5.281 1.770) 5.570 2.235 ( 4.902 -2.917 7.196) 9.183 2.408 ( -3.500 2.250 -1.459) 4.409 2.552 ( -2.559 -2.398 3.883) 5.232 2.568 ( -0.244 -0.753 0.545) 0.961 2.661 ( 2.438 3.246 5.897) 7.159 2.710 ( -3.304 -1.084 0.090) 3.479 2.826 ( -0.110 -2.487 -1.823) 3.085 2.896 ( 0.967 -3.119 -4.800) 5.805 2.929 ( -0.849 2.299 -1.844) 3.067 3.029 ( 5.439 3.850 -5.505) 8.644 3.056 ( 0.057 -2.686 5.027) 5.700 3.138 ( 3.623 0.025 -0.992) 3.756 3.236 ( -3.930 3.191 -6.105) 7.931 3.306 ( -0.981 0.674 -6.983) 7.084 3.423 ( -3.028 2.152 1.152) 3.889 3.477 ( 1.030 1.143 -2.560) 2.987 4.367 ( 1.651 -0.291 1.949) 2.571 4.431 ( -1.057 1.309 -4.021) 4.359 4.566 ( 0.072 -6.951 4.655) 8.366 4.660 ( -0.760 -7.043 -3.170) 7.761 5.002 ( 2.639 4.559 1.430) 5.458 5.042 ( -0.645 3.637 -2.167) 4.282 5.135 ( 1.108 0.540 2.057) 2.398 5.207 ( -1.786 -0.610 -4.597) 4.969 5.369 ( -5.337 -2.040 5.968) 8.262 5.447 ( -4.222 0.421 4.208) 5.976 5.453 ( 1.658 -1.714 1.707) 2.933 5.507 ( 1.654 -3.713 0.283) 4.075 5.555 ( 3.874 -0.397 2.398) 4.573 5.628 ( -1.341 -2.232 -2.793) 3.819 5.691 ( 3.079 0.563 1.608) 3.519 5.806 ( -0.044 -2.243 -6.854) 7.212 6.077 ( 2.284 0.852 0.803) 2.566 6.117 ( -1.294 1.642 -0.967) 2.303 6.194 ( 1.026 0.685 -0.819) 1.481 6.199 ( -0.699 0.727 -1.742) 2.013 6.397 ( -1.520 2.818 1.868) 3.707 6.480 ( -1.353 8.643 -5.934) 10.571 6.675 ( 5.831 -2.352 8.838) 10.847 6.858 ( -6.501 2.145 -8.505) 10.918 7.077 ( 1.464 -0.938 2.143) 2.760 7.108 ( 3.372 -3.199 0.232) 4.654 7.210 ( 2.041 3.097 0.898) 3.816 7.280 ( -6.073 0.824 -4.480) 7.592 7.889 ( 8.557 3.391 5.625) 10.787 7.985 ( -8.992 2.114 -2.837) 9.663 8.187 ( -1.198 -2.324 4.119) 4.880 8.290 ( -3.577 -3.707 -3.913) 6.469 8.382 ( 8.186 -1.000 10.338) 13.224 8.592 ( -6.974 3.791 -6.396) 10.194 8.651 ( 11.822 -4.458 5.622) 13.829 8.771 ( -10.408 -0.190 -2.051) 10.610 8.890 ( -2.864 -0.756 7.615) 8.171 9.025 ( 5.178 -4.673 -3.526) 7.815 9.121 ( -2.695 1.333 1.149) 3.218 9.173 ( -2.439 -2.257 -1.875) 3.815 9.287 ( 2.488 4.284 2.913) 5.747 9.386 ( 1.294 1.822 -3.147) 3.860 9.615 ( -0.843 -0.364 2.253) 2.433 9.734 ( 0.740 -4.346 -6.329) 7.714 10.296 ( 0.414 3.812 -0.002) 3.835 10.322 ( 1.835 2.821 -2.114) 3.974 10.675 ( -4.452 -4.167 3.260) 6.914 10.740 ( 4.074 -6.038 -2.574) 7.725 20.554 ( 0.269 2.407 0.675) 2.514 20.591 ( -0.088 1.381 -2.794) 3.117 20.916 ( -0.574 1.218 0.810) 1.571 20.936 ( 0.505 0.537 -0.897) 1.161 22.805 ( 2.040 0.680 1.093) 2.412 22.827 ( -1.380 -0.243 -0.860) 1.644 23.075 ( 1.124 0.479 0.207) 1.239 23.089 ( -1.522 -0.094 -0.948) 1.796 24.661 ( 0.401 -1.726 0.454) 1.829 24.665 ( -0.592 -2.023 0.169) 2.115 24.932 ( -0.258 1.072 1.244) 1.663 24.946 ( 0.200 0.391 0.131) 0.458 25.863 ( 0.723 0.239 0.288) 0.814 25.872 ( -0.372 -0.091 -0.499) 0.629 26.159 ( -0.070 1.193 1.398) 1.839 26.207 ( -0.598 -0.956 -2.688) 2.915 28.347 ( -0.714 -0.296 2.350) 2.474 28.379 ( -0.046 -1.810 -0.228) 1.825 28.570 ( -2.406 1.316 1.311) 3.039 28.606 ( 2.307 1.001 -1.532) 2.945 28.652 ( -0.656 -0.903 2.940) 3.144 28.658 ( 2.200 -1.445 1.405) 2.983 28.676 ( -2.097 -0.722 -0.451) 2.263 28.729 ( 1.718 -2.075 -3.394) 4.333 32.357 ( -0.525 1.138 1.827) 2.215 32.390 ( 0.534 0.198 -0.790) 0.974 32.472 ( 0.084 -0.645 1.297) 1.451 32.508 ( 0.093 -1.476 -1.655) 2.220 35.408 ( -0.003 0.729 2.007) 2.135 35.444 ( -0.157 -0.769 -0.814) 1.130 35.508 ( 0.043 1.180 0.220) 1.201 35.536 ( -0.171 -0.022 -1.779) 1.787 88.787 ( -2.915 0.672 2.608) 3.969 88.835 ( 0.459 -0.278 -1.143) 1.263 88.942 ( -5.584 -2.041 3.064) 6.688 89.007 ( 5.287 -3.424 -2.345) 6.721 97.619 ( -0.569 0.448 -0.017) 0.724 97.622 ( 0.559 0.372 -0.334) 0.750 97.660 ( -0.963 -0.558 0.251) 1.141 97.666 ( 0.671 -0.681 -0.198) 0.977 98.704 ( 0.168 0.636 0.707) 0.966 98.709 ( -0.205 0.451 0.299) 0.579 98.981 ( -0.277 4.105 -0.019) 4.114 99.028 ( -0.201 3.011 -4.537) 5.449 99.704 ( 1.050 2.951 1.724) 3.575 99.741 ( -1.021 2.441 -1.590) 3.087 99.917 ( 5.692 -4.292 1.731) 7.336 99.939 ( -3.741 -3.971 -0.446) 5.474 ======================= Grid point 145 (76/92) ======================= q-point: ( 0.11 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.296 ( -2.061 11.786 9.213) 15.101 1.521 ( 3.868 14.061 4.607) 15.293 1.537 ( 7.110 8.797 -10.105) 15.167 1.603 ( 4.891 11.478 -4.634) 13.310 1.863 ( -2.069 -5.741 3.599) 7.085 1.966 ( 3.316 -6.800 -0.223) 7.569 2.119 ( 0.057 -6.534 3.279) 7.311 2.127 ( 0.400 -5.086 -4.874) 7.056 2.321 ( 0.417 2.834 -7.745) 8.258 2.428 ( 4.212 1.006 6.993) 8.226 2.542 ( -1.678 -0.282 1.680) 2.391 2.574 ( 0.337 -1.579 3.356) 3.725 2.658 ( -2.803 0.339 -0.745) 2.920 2.708 ( -1.581 -2.743 0.478) 3.202 2.832 ( 0.743 -1.372 3.870) 4.173 2.855 ( 1.125 -2.119 -2.375) 3.376 2.911 ( -2.501 2.187 0.957) 3.458 3.001 ( -5.789 -0.416 -1.836) 6.087 3.026 ( 2.920 5.757 -8.209) 10.443 3.196 ( 1.134 -1.035 -8.623) 8.758 3.200 ( -1.373 1.845 4.482) 5.038 3.264 ( 4.232 0.702 7.943) 9.027 3.410 ( -3.070 1.883 2.975) 4.671 3.463 ( 0.408 1.113 -0.996) 1.548 4.360 ( -0.946 0.395 -1.617) 1.915 4.443 ( 2.601 1.330 0.816) 3.033 4.571 ( -2.915 -8.084 -0.559) 8.611 4.640 ( 0.100 -6.802 1.787) 7.034 4.960 ( -4.812 4.972 -2.259) 7.279 5.014 ( -1.562 3.504 0.150) 3.839 5.122 ( -1.397 -1.408 -2.315) 3.048 5.179 ( -4.772 -1.811 3.300) 6.078 5.294 ( -8.318 0.956 4.721) 9.612 5.379 ( -5.563 -2.158 0.189) 5.970 5.427 ( -2.635 -0.462 0.729) 2.773 5.519 ( -0.530 -5.473 -1.555) 5.714 5.656 ( 1.268 0.800 1.019) 1.813 5.679 ( 5.007 1.828 -2.005) 5.695 5.695 ( 0.851 -1.476 -5.513) 5.771 5.757 ( 2.023 -3.578 2.321) 4.720 6.059 ( -0.949 2.144 -1.912) 3.025 6.133 ( -0.444 1.102 -0.043) 1.189 6.175 ( -0.800 0.644 -1.122) 1.521 6.208 ( 1.573 0.593 1.265) 2.104 6.368 ( -6.394 5.235 3.812) 9.101 6.444 ( 0.361 7.050 -0.076) 7.060 6.633 ( -8.352 -0.879 -5.514) 10.046 6.836 ( 1.262 -2.439 7.498) 7.985 6.981 ( -9.908 1.268 -4.130) 10.809 7.132 ( 2.206 -2.998 -1.738) 4.108 7.181 ( -1.391 3.428 0.625) 3.752 7.326 ( 4.349 -0.577 3.271) 5.473 7.754 ( -11.070 5.577 -2.902) 12.730 8.046 ( 0.644 -0.868 2.521) 2.743 8.164 ( -6.796 -5.144 -0.482) 8.537 8.212 ( -4.245 -2.719 4.538) 6.782 8.388 ( -3.913 4.539 -9.429) 11.172 8.523 ( -1.391 0.145 3.288) 3.573 8.575 ( -7.079 -2.471 3.968) 8.483 8.850 ( -2.146 -6.391 5.184) 8.504 8.963 ( 6.398 0.408 -2.386) 6.840 9.049 ( 3.531 -1.190 -6.923) 7.863 9.141 ( 3.814 3.710 7.710) 9.368 9.231 ( 7.852 -0.593 2.715) 8.329 9.374 ( 6.237 5.311 -6.097) 10.212 9.391 ( 4.917 4.591 0.291) 6.733 9.641 ( -0.115 -1.033 3.031) 3.204 9.700 ( 2.015 -5.415 -3.155) 6.583 10.319 ( 3.075 2.318 -0.800) 3.933 10.389 ( 7.373 0.819 -1.539) 7.576 10.638 ( -3.893 -2.888 3.048) 5.725 10.799 ( 6.049 -7.755 -2.643) 10.184 20.558 ( -0.860 2.131 -1.333) 2.657 20.565 ( -0.288 1.643 1.032) 1.962 20.906 ( -1.699 1.194 0.912) 2.268 20.925 ( -0.612 0.457 -0.804) 1.109 22.784 ( -1.907 1.224 -1.349) 2.637 22.841 ( 1.127 -1.107 0.369) 1.622 23.062 ( -0.596 1.202 -0.114) 1.346 23.111 ( 2.100 -0.746 0.714) 2.340 24.646 ( -1.703 -1.500 0.043) 2.270 24.663 ( -0.730 -2.428 0.283) 2.551 24.943 ( 0.453 1.201 0.438) 1.357 24.956 ( 1.051 0.719 -0.336) 1.317 25.828 ( -3.713 0.648 -0.507) 3.803 25.855 ( -2.149 -0.296 0.051) 2.170 26.147 ( -3.110 0.453 -0.136) 3.146 26.160 ( -2.837 -0.150 0.965) 3.000 28.355 ( -0.787 -0.454 1.606) 1.845 28.363 ( -1.119 -0.636 -0.237) 1.309 28.544 ( -1.701 1.197 0.600) 2.165 28.609 ( -1.615 -1.357 0.205) 2.119 28.641 ( 0.293 1.072 -0.979) 1.481 28.674 ( 0.626 -0.181 1.067) 1.251 28.715 ( 2.066 -2.229 -1.027) 3.208 28.743 ( 4.053 -2.187 -1.615) 4.880 32.362 ( -0.527 1.022 0.776) 1.387 32.398 ( 1.400 0.311 -0.733) 1.611 32.474 ( -0.897 -0.776 -0.023) 1.186 32.501 ( 0.618 -1.109 -0.274) 1.299 35.425 ( -0.462 0.177 -0.799) 0.939 35.429 ( -0.093 0.025 1.190) 1.194 35.508 ( -0.743 0.717 -0.086) 1.036 35.522 ( 0.096 0.238 0.100) 0.276 88.771 ( -1.747 0.405 2.610) 3.167 88.826 ( -2.747 -1.817 2.420) 4.087 88.933 ( 3.371 2.404 -0.463) 4.167 89.124 ( 9.126 -6.337 -0.754) 11.136 97.616 ( 0.444 0.556 0.068) 0.715 97.636 ( 1.115 -0.054 -0.088) 1.119 97.660 ( 0.838 -0.016 0.250) 0.875 97.700 ( 3.097 -1.447 0.213) 3.425 98.697 ( -0.596 0.933 -0.033) 1.107 98.722 ( 0.656 0.059 0.126) 0.671 98.969 ( -2.399 3.670 1.282) 4.568 98.977 ( -1.956 3.304 -0.816) 3.925 99.693 ( -1.668 1.668 -1.025) 2.572 99.741 ( -0.724 1.924 0.690) 2.169 99.828 ( -3.594 0.724 -1.499) 3.960 100.058 ( 7.233 -6.919 -0.812) 10.042 ======================= Grid point 146 (77/92) ======================= q-point: ( 0.22 0.33 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.408 ( 6.581 9.221 2.583) 11.619 1.469 ( 5.028 10.486 -12.559) 17.116 1.619 ( 4.825 6.677 -3.415) 8.918 1.737 ( 6.830 7.437 5.851) 11.670 1.883 ( -0.464 -2.123 3.788) 4.367 1.995 ( 2.677 -8.564 -5.112) 10.326 2.041 ( 0.334 -2.201 -5.989) 6.389 2.173 ( 1.521 -4.214 -1.114) 4.617 2.293 ( 3.372 4.046 -1.631) 5.514 2.430 ( -3.105 2.507 -2.676) 4.805 2.527 ( -1.638 0.079 0.943) 1.892 2.583 ( -1.175 3.101 -6.193) 7.025 2.639 ( -0.404 -1.421 0.053) 1.478 2.666 ( -1.670 -5.388 -2.115) 6.025 2.816 ( -4.259 -2.988 -0.647) 5.242 2.843 ( -3.001 1.133 -2.754) 4.228 2.910 ( 2.626 3.078 1.754) 4.410 3.000 ( 2.205 2.714 4.399) 5.620 3.048 ( 3.993 -2.739 7.150) 8.635 3.120 ( -1.454 -0.756 -3.520) 3.882 3.204 ( -2.518 3.135 0.943) 4.130 3.373 ( -4.486 -1.580 3.810) 6.094 3.432 ( 3.792 2.749 7.659) 8.978 3.480 ( 0.382 2.010 2.875) 3.529 4.349 ( 1.667 -0.890 -1.482) 2.401 4.460 ( -2.569 -1.076 0.818) 2.903 4.535 ( 1.239 -5.620 -1.223) 5.883 4.644 ( -3.016 -5.886 2.544) 7.087 4.873 ( -2.684 3.624 -1.965) 4.919 4.990 ( -1.283 2.313 1.016) 2.834 5.037 ( -11.464 -0.973 2.382) 11.749 5.105 ( -0.091 -2.017 -0.322) 2.044 5.250 ( -2.789 0.528 1.797) 3.359 5.310 ( -3.915 -4.543 1.743) 6.246 5.370 ( -3.669 -0.501 -1.184) 3.888 5.448 ( -5.802 -4.371 -1.773) 7.477 5.551 ( -3.634 1.496 -4.563) 6.022 5.666 ( -2.930 -1.718 -1.321) 3.644 5.779 ( 4.831 2.283 2.496) 5.898 5.858 ( 5.303 -1.084 0.653) 5.451 5.991 ( -7.938 -1.104 -2.416) 8.371 6.050 ( -9.346 -1.275 -1.780) 9.600 6.151 ( 1.333 0.751 -0.681) 1.674 6.235 ( 1.455 -1.758 3.360) 4.061 6.324 ( -5.297 7.009 7.062) 11.272 6.470 ( 1.739 5.619 1.711) 6.126 6.498 ( -4.943 0.344 -1.037) 5.062 6.773 ( -8.000 -3.924 0.534) 8.926 6.919 ( -0.467 4.240 3.809) 5.719 7.127 ( -6.210 4.717 -1.157) 7.884 7.173 ( 3.157 -2.459 -0.768) 4.075 7.370 ( -0.480 0.997 -0.487) 1.209 7.618 ( -2.271 4.341 -1.357) 5.083 7.884 ( -8.391 -4.577 -10.019) 13.847 8.062 ( -5.123 -2.547 -1.903) 6.029 8.160 ( -6.089 -3.500 2.266) 7.380 8.372 ( 1.003 8.022 4.188) 9.105 8.501 ( -7.897 -0.777 5.954) 9.921 8.547 ( 2.216 -1.025 1.162) 2.704 8.810 ( -4.984 -6.156 -0.633) 7.946 8.963 ( 0.179 2.725 -3.668) 4.573 9.062 ( 4.651 -0.756 -3.289) 5.746 9.294 ( 3.958 5.291 1.828) 6.855 9.375 ( 5.002 8.571 -4.654) 10.961 9.397 ( 9.487 1.525 0.078) 9.609 9.583 ( 11.868 2.031 2.749) 12.351 9.662 ( 2.938 -4.068 -2.355) 5.542 9.741 ( 1.434 -4.363 3.560) 5.811 10.369 ( 3.542 0.331 -0.684) 3.623 10.505 ( 7.084 0.361 -0.329) 7.101 10.613 ( -3.420 -2.922 3.837) 5.912 10.875 ( 6.866 -10.079 -3.716) 12.749 20.534 ( -0.769 2.259 -0.387) 2.417 20.568 ( -0.790 0.930 1.075) 1.626 20.881 ( -2.312 1.162 0.832) 2.718 20.902 ( -1.129 0.327 -0.669) 1.353 22.748 ( -1.070 1.828 -0.397) 2.155 22.852 ( 0.309 -2.565 -0.071) 2.585 23.062 ( 0.124 2.165 0.208) 2.179 23.149 ( 1.628 -1.495 0.013) 2.211 24.615 ( -2.095 -1.179 0.318) 2.425 24.645 ( -1.470 -2.832 -0.023) 3.190 24.958 ( 1.169 1.578 -0.310) 1.988 24.969 ( 1.292 1.135 -0.870) 1.928 25.749 ( -4.782 1.557 -0.473) 5.051 25.803 ( -3.983 -0.480 0.046) 4.012 26.082 ( -3.821 0.637 -0.489) 3.905 26.111 ( -5.260 -0.755 1.963) 5.665 28.348 ( -0.591 0.361 0.336) 0.770 28.361 ( 0.247 -0.276 0.746) 0.833 28.528 ( -0.722 0.680 0.171) 1.006 28.578 ( -1.847 -1.405 0.051) 2.321 28.638 ( -0.212 0.479 -0.138) 0.542 28.698 ( 1.860 -1.196 -1.158) 2.496 28.722 ( 0.625 -0.099 -0.657) 0.913 28.796 ( 3.271 -2.412 -1.070) 4.203 32.361 ( 0.071 0.661 -0.048) 0.667 32.409 ( 0.521 -0.970 -0.829) 1.378 32.463 ( 0.304 1.025 -0.339) 1.121 32.510 ( 0.143 -0.638 0.344) 0.739 35.406 ( -0.079 0.683 -1.137) 1.329 35.440 ( -0.124 -0.743 0.761) 1.070 35.494 ( -0.787 1.049 0.249) 1.335 35.525 ( -0.536 0.027 0.747) 0.920 88.789 ( 0.319 -0.592 2.699) 2.782 88.816 ( -1.653 -1.555 2.851) 3.644 89.005 ( 5.468 3.481 -0.876) 6.541 89.258 ( 7.106 -8.674 -0.811) 11.243 97.634 ( 1.376 0.449 0.221) 1.464 97.657 ( 1.390 -0.365 0.115) 1.442 97.687 ( 1.761 0.408 0.272) 1.828 97.763 ( 3.626 -2.917 0.457) 4.676 98.691 ( 0.087 0.986 -0.088) 0.994 98.729 ( 0.562 -0.338 -0.503) 0.826 98.924 ( -3.247 3.235 0.449) 4.606 98.946 ( -4.105 3.243 2.824) 5.945 99.656 ( -1.960 0.971 -0.896) 2.363 99.691 ( -2.464 -0.353 0.089) 2.491 99.822 ( 1.627 5.968 -0.118) 6.187 100.139 ( 4.831 -7.528 -2.823) 9.380 ======================= Grid point 147 (78/92) ======================= q-point: ( 0.33 0.33 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.420 ( 7.684 8.161 -13.991) 17.928 1.541 ( 9.237 5.434 -4.311) 11.552 1.691 ( 2.831 3.059 1.051) 4.299 1.848 ( 2.709 3.927 1.005) 4.875 1.910 ( -0.074 2.031 -1.603) 2.588 1.963 ( 2.617 -2.423 -4.591) 5.814 2.019 ( 1.284 -3.035 -3.721) 4.970 2.167 ( 2.026 -1.222 -1.178) 2.643 2.325 ( -3.163 1.533 -1.910) 4.000 2.364 ( -0.229 2.383 2.584) 3.523 2.478 ( -4.909 -0.257 -4.989) 7.004 2.520 ( 0.939 -0.121 -0.285) 0.988 2.584 ( -1.875 -0.059 -2.664) 3.258 2.646 ( 2.279 0.353 -2.312) 3.265 2.697 ( -6.234 -3.227 -3.100) 7.674 2.792 ( -2.870 0.104 -0.496) 2.914 2.936 ( 4.377 2.581 -4.675) 6.905 3.028 ( -2.311 -0.812 -1.369) 2.806 3.146 ( -0.561 1.296 4.751) 4.957 3.179 ( 2.221 2.166 5.664) 6.458 3.235 ( 2.008 -1.612 8.187) 8.582 3.327 ( -3.317 -1.318 3.522) 5.014 3.521 ( 0.441 3.316 3.735) 5.013 3.560 ( 1.398 1.402 6.830) 7.111 4.381 ( 3.210 -2.578 -0.551) 4.154 4.416 ( -2.953 -3.703 1.092) 4.861 4.556 ( 1.562 -2.932 -0.366) 3.342 4.598 ( -4.778 -3.605 1.901) 6.280 4.824 ( 0.428 0.502 -3.840) 3.896 4.899 ( -7.739 -0.990 2.378) 8.156 4.995 ( -0.481 1.767 1.997) 2.709 5.106 ( -2.009 -1.137 0.366) 2.337 5.222 ( -1.967 -2.309 0.395) 3.059 5.238 ( -4.207 -3.309 0.249) 5.358 5.326 ( -2.994 0.502 2.269) 3.790 5.363 ( -0.319 -4.615 -0.725) 4.683 5.476 ( -1.747 0.324 -1.314) 2.210 5.590 ( -4.501 -2.442 0.116) 5.122 5.763 ( -8.998 -1.598 -1.516) 9.264 5.827 ( -9.010 -2.578 0.028) 9.371 5.921 ( -0.364 2.124 3.509) 4.118 5.949 ( 5.415 0.638 -2.657) 6.066 6.170 ( -3.683 2.907 0.708) 4.745 6.255 ( -0.108 6.912 3.154) 7.598 6.359 ( -3.197 -3.601 5.786) 7.528 6.457 ( 2.531 -1.597 2.489) 3.893 6.527 ( 1.986 4.667 1.878) 5.408 6.697 ( -4.617 -4.721 2.751) 7.154 6.924 ( -2.562 2.275 0.744) 3.506 6.975 ( -7.644 8.388 -1.261) 11.418 7.198 ( 0.784 -3.803 -1.571) 4.188 7.319 ( -2.125 -1.265 -5.216) 5.772 7.592 ( 2.301 3.087 -5.293) 6.545 7.710 ( -0.562 2.805 -6.424) 7.032 7.965 ( -4.043 -2.458 -1.567) 4.985 8.081 ( -5.790 -2.101 0.782) 6.209 8.322 ( -9.726 8.850 6.563) 14.697 8.559 ( 3.755 0.071 4.835) 6.122 8.575 ( -1.170 -0.216 -0.935) 1.514 8.703 ( -1.560 -2.187 -3.637) 4.522 8.954 ( 1.506 4.018 -1.150) 4.443 9.109 ( 3.639 -1.528 -1.202) 4.125 9.314 ( 0.174 6.307 -0.736) 6.352 9.408 ( 3.976 5.149 -5.094) 8.263 9.578 ( 9.026 0.108 2.974) 9.504 9.696 ( 6.301 -4.982 -4.476) 9.195 9.750 ( 1.369 1.056 3.903) 4.269 9.808 ( 4.015 -3.687 1.492) 5.652 10.418 ( 2.915 0.426 -0.092) 2.947 10.565 ( 0.017 4.029 -1.037) 4.161 10.640 ( 0.612 -5.750 6.533) 8.724 10.931 ( 5.309 -11.052 -5.497) 13.437 20.525 ( -0.274 1.972 0.307) 2.015 20.563 ( -0.755 0.514 0.418) 1.004 20.852 ( -2.055 1.063 0.801) 2.449 20.876 ( -1.016 0.153 -0.700) 1.243 22.747 ( 0.345 1.948 1.399) 2.423 22.862 ( 0.692 -2.859 0.564) 2.996 23.058 ( -0.459 2.183 -0.668) 2.329 23.157 ( 0.247 -1.996 -1.565) 2.548 24.588 ( -1.769 -1.170 0.766) 2.254 24.620 ( -1.281 -2.870 -0.202) 3.150 24.970 ( 0.965 2.085 -0.920) 2.475 24.980 ( 1.259 1.371 -1.068) 2.146 25.674 ( -3.337 2.167 -0.173) 3.983 25.734 ( -4.147 -0.138 0.067) 4.150 26.018 ( -3.308 0.233 -0.034) 3.317 26.039 ( -4.754 -0.625 0.961) 4.891 28.351 ( -0.036 0.970 1.110) 1.474 28.381 ( 1.094 -0.140 0.489) 1.207 28.524 ( 0.119 0.176 0.002) 0.213 28.552 ( -1.322 -1.095 0.037) 1.717 28.631 ( -0.583 0.068 0.115) 0.598 28.694 ( 0.345 -2.402 -2.539) 3.512 28.739 ( 1.139 1.438 0.748) 1.982 28.824 ( 1.672 -2.184 -1.390) 3.082 32.365 ( 0.461 0.193 -0.151) 0.522 32.399 ( -0.394 -1.188 -0.844) 1.509 32.477 ( 1.337 1.537 -0.126) 2.041 32.512 ( -0.253 0.039 0.208) 0.330 35.401 ( 0.487 0.801 -0.589) 1.107 35.442 ( -0.119 -0.954 -0.154) 0.973 35.487 ( -0.944 1.076 0.974) 1.732 35.519 ( -0.659 -0.038 0.140) 0.675 88.827 ( -0.011 -1.302 2.495) 2.814 88.833 ( 0.391 -1.736 3.021) 3.506 89.082 ( 4.413 3.510 -0.473) 5.658 89.321 ( 2.682 -8.056 -2.886) 8.968 97.661 ( 1.378 0.404 0.374) 1.484 97.684 ( 1.556 -0.182 0.261) 1.588 97.719 ( 1.608 0.152 0.559) 1.709 97.815 ( 2.051 -3.894 -0.185) 4.405 98.700 ( 0.860 0.953 0.178) 1.296 98.734 ( 0.998 -0.198 -0.721) 1.247 98.874 ( -3.557 2.941 0.713) 4.671 98.897 ( -4.660 2.841 1.982) 5.807 99.624 ( -0.832 1.544 0.475) 1.817 99.689 ( -0.038 -0.605 1.895) 1.990 99.850 ( 1.461 5.633 0.789) 5.872 100.159 ( 2.537 -7.229 -4.805) 9.043 ======================= Grid point 148 (79/92) ======================= q-point: ( 0.44 0.33 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.437 ( 7.932 5.680 -7.333) 12.204 1.618 ( -1.648 -0.171 -1.251) 2.076 1.669 ( 2.046 6.069 -7.268) 9.687 1.753 ( -3.285 6.063 -7.687) 10.327 1.942 ( 4.457 -0.617 -1.909) 4.887 2.007 ( -0.075 -0.367 2.012) 2.047 2.024 ( 3.679 -0.403 -2.257) 4.335 2.160 ( -0.102 -3.682 -4.600) 5.893 2.291 ( 1.201 1.537 -0.774) 2.099 2.341 ( -5.058 1.246 0.342) 5.220 2.398 ( -0.645 -1.686 2.975) 3.480 2.512 ( -1.024 2.344 -1.345) 2.890 2.552 ( -3.311 0.336 0.033) 3.328 2.595 ( 0.746 -1.119 -1.199) 1.801 2.673 ( 2.722 -1.063 -2.091) 3.593 2.713 ( -5.085 2.131 -0.950) 5.595 2.970 ( 1.879 0.346 -1.125) 2.217 2.994 ( -0.305 -0.786 -0.467) 0.964 3.141 ( -0.197 0.068 1.681) 1.694 3.208 ( -5.438 -1.459 1.592) 5.851 3.339 ( 4.706 2.751 6.033) 8.131 3.388 ( -1.536 1.863 6.671) 7.095 3.575 ( 1.106 2.801 3.825) 4.868 3.628 ( 2.166 0.931 1.229) 2.659 4.387 ( -2.536 -3.696 2.732) 5.250 4.430 ( 2.737 -4.131 -1.269) 5.115 4.553 ( -4.136 -1.594 3.815) 5.848 4.571 ( 1.618 -2.644 -1.277) 3.353 4.811 ( -1.299 -2.991 -1.783) 3.716 4.814 ( -1.447 -2.055 -0.725) 2.615 4.992 ( -1.140 1.700 1.121) 2.334 5.053 ( -0.931 0.340 -1.993) 2.226 5.187 ( 0.978 -1.710 1.993) 2.802 5.288 ( -1.045 -0.457 0.580) 1.279 5.301 ( 1.785 -3.666 2.985) 5.053 5.379 ( -0.043 -4.754 0.873) 4.833 5.450 ( -0.077 -0.161 0.214) 0.278 5.533 ( -2.995 -2.761 -0.352) 4.088 5.642 ( -3.906 0.690 1.013) 4.094 5.718 ( -2.675 -1.988 -0.624) 3.391 5.946 ( -0.746 5.805 2.007) 6.188 6.013 ( 2.639 1.430 0.108) 3.004 6.112 ( -0.059 -2.128 -0.033) 2.129 6.231 ( -9.329 -3.267 0.748) 9.913 6.367 ( 2.962 4.858 5.475) 7.896 6.542 ( -1.225 2.915 -1.152) 3.365 6.597 ( 5.055 -1.868 3.976) 6.697 6.673 ( -0.897 -4.581 3.621) 5.908 6.848 ( -2.702 3.396 -2.180) 4.856 6.897 ( -3.212 4.898 -0.468) 5.876 7.168 ( -0.949 -5.108 -2.507) 5.769 7.230 ( -0.014 -4.532 -6.342) 7.795 7.596 ( 3.668 6.878 -3.396) 8.502 7.664 ( -1.216 7.923 -3.312) 8.673 7.912 ( -0.952 -1.020 0.359) 1.441 7.986 ( -4.374 -1.038 -1.090) 4.625 8.271 ( -5.133 8.845 7.229) 12.524 8.492 ( -0.481 1.553 -6.997) 7.183 8.648 ( 1.559 -0.298 2.785) 3.206 8.706 ( 1.428 -1.096 -0.423) 1.849 8.984 ( 0.655 4.307 3.467) 5.568 9.144 ( 2.528 -0.562 -2.723) 3.758 9.305 ( -1.615 4.079 1.364) 4.594 9.393 ( 1.088 2.693 -5.031) 5.809 9.732 ( 3.049 -2.090 2.694) 4.574 9.747 ( -0.502 -1.055 2.342) 2.617 9.776 ( 6.179 -2.977 -3.020) 7.494 9.853 ( 0.329 -3.015 -1.304) 3.301 10.464 ( 1.402 1.872 1.452) 2.753 10.536 ( -1.342 3.652 -1.031) 4.025 10.716 ( -0.501 -5.084 6.905) 8.589 10.930 ( 2.682 -10.100 -6.978) 12.566 20.530 ( 0.269 1.495 0.643) 1.649 20.554 ( -0.403 0.495 -0.229) 0.678 20.834 ( -1.095 0.921 0.892) 1.685 20.857 ( -0.220 0.050 -0.842) 0.871 22.786 ( 1.437 1.816 2.912) 3.721 22.878 ( 0.253 -1.654 -0.095) 1.676 23.041 ( -0.263 0.961 -0.187) 1.014 23.125 ( -1.057 -2.174 -2.959) 3.821 24.575 ( -0.884 -1.308 1.135) 1.945 24.601 ( -0.456 -2.652 -0.404) 2.721 24.971 ( 0.207 2.283 -0.593) 2.367 24.984 ( 0.512 1.467 -1.162) 1.941 25.644 ( -0.209 2.073 0.225) 2.096 25.675 ( -2.644 0.841 -0.111) 2.777 25.978 ( -1.530 -0.151 0.393) 1.587 25.989 ( -1.644 -0.486 0.046) 1.715 28.365 ( -0.321 1.208 1.817) 2.205 28.398 ( 0.274 0.172 0.170) 0.366 28.531 ( 0.621 -0.266 -0.097) 0.683 28.536 ( -0.269 -0.582 -0.263) 0.693 28.623 ( -0.935 -0.341 0.844) 1.305 28.669 ( 0.225 -1.907 -2.502) 3.154 28.767 ( 0.971 0.551 1.039) 1.525 28.824 ( 0.475 -1.740 -1.819) 2.561 32.372 ( 0.341 -0.211 0.016) 0.402 32.384 ( -0.461 -0.735 -0.447) 0.976 32.497 ( 1.135 1.047 -0.201) 1.557 32.506 ( -0.473 0.683 -0.003) 0.831 35.408 ( 0.693 0.563 0.069) 0.896 35.431 ( -0.862 -0.243 -0.295) 0.943 35.486 ( -0.359 0.621 0.985) 1.219 35.510 ( -0.043 -0.127 -0.546) 0.562 88.848 ( -0.846 -1.145 2.925) 3.253 88.872 ( 0.792 -2.607 1.721) 3.223 89.140 ( 2.233 2.282 1.196) 3.409 89.294 ( -0.652 -5.035 -4.726) 6.936 97.684 ( 0.676 0.578 0.568) 1.056 97.704 ( 0.619 0.575 -0.305) 0.898 97.754 ( 1.213 -1.314 1.545) 2.363 97.822 ( -0.189 -3.551 -1.175) 3.745 98.720 ( 0.960 1.122 0.488) 1.555 98.746 ( 0.757 0.343 -0.623) 1.039 98.832 ( -1.424 2.475 0.393) 2.882 98.845 ( -2.939 2.309 0.802) 3.823 99.638 ( 0.743 2.159 1.842) 2.934 99.702 ( -0.434 1.212 0.335) 1.331 99.898 ( 1.304 1.615 4.181) 4.667 100.123 ( 0.601 -6.462 -6.689) 9.320 ======================= Grid point 149 (80/92) ======================= q-point: (-0.44 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.391 ( -11.527 7.216 -2.204) 13.777 1.552 ( -8.428 2.023 3.594) 9.383 1.574 ( 5.774 5.937 -3.290) 8.911 1.756 ( 4.646 -1.219 -6.901) 8.409 1.949 ( -2.117 1.351 -1.857) 3.123 1.984 ( 3.435 1.123 0.628) 3.668 2.090 ( -0.678 -2.224 -4.667) 5.214 2.110 ( 3.340 -4.139 -0.711) 5.365 2.255 ( -4.796 3.062 3.221) 6.538 2.352 ( 2.846 0.481 -1.131) 3.100 2.436 ( 0.382 0.490 3.747) 3.798 2.466 ( 0.559 -0.763 -1.492) 1.767 2.561 ( -0.300 0.920 1.358) 1.668 2.588 ( 0.563 -0.877 -0.913) 1.386 2.626 ( -4.476 3.652 0.904) 5.847 2.724 ( 5.371 0.037 -1.152) 5.493 2.922 ( -6.715 1.369 1.571) 7.030 3.011 ( 1.523 -1.677 -0.662) 2.360 3.148 ( -2.264 -0.218 1.791) 2.895 3.195 ( 3.187 -1.179 1.502) 3.715 3.375 ( -4.256 3.117 2.493) 5.835 3.440 ( 0.226 1.396 2.625) 2.982 3.613 ( 1.035 3.039 0.137) 3.213 3.680 ( 4.605 0.534 -2.556) 5.294 4.383 ( -1.871 -2.419 2.568) 3.993 4.452 ( 2.904 -4.856 -2.440) 6.161 4.513 ( -4.698 -1.061 3.422) 5.908 4.599 ( 1.576 -3.750 0.054) 4.068 4.740 ( -3.772 -1.788 2.398) 4.814 4.838 ( 2.894 -5.339 -1.359) 6.223 5.031 ( 4.063 1.218 -0.865) 4.329 5.055 ( 5.968 1.023 -3.464) 6.976 5.226 ( -2.870 1.043 -0.068) 3.054 5.282 ( 5.469 -0.799 0.782) 5.582 5.353 ( -1.556 -5.176 -1.268) 5.552 5.378 ( 1.426 -3.824 0.878) 4.174 5.477 ( -0.761 -0.189 -1.434) 1.634 5.494 ( 2.883 -1.063 1.486) 3.413 5.665 ( 2.108 -0.148 3.520) 4.106 5.685 ( 1.023 -0.599 -1.747) 2.112 5.921 ( -6.053 3.013 2.075) 7.072 6.062 ( 6.796 4.124 -2.173) 8.241 6.084 ( -6.088 -4.069 2.397) 7.705 6.241 ( 10.823 -2.338 0.499) 11.084 6.470 ( 1.957 4.963 4.976) 7.295 6.471 ( -3.267 2.664 -3.272) 5.337 6.630 ( -4.720 -2.440 2.698) 5.959 6.726 ( 2.186 -5.380 -1.968) 6.131 6.849 ( 0.898 1.892 -2.455) 3.227 6.859 ( 5.219 4.815 2.257) 7.451 7.143 ( -0.613 -6.026 0.494) 6.078 7.190 ( 1.942 -5.862 -4.020) 7.368 7.580 ( -4.375 8.972 -1.950) 10.170 7.622 ( 0.457 8.537 -0.167) 8.551 7.896 ( -1.485 0.318 1.944) 2.467 7.997 ( 6.815 -0.008 -1.893) 7.073 8.293 ( -2.703 7.762 8.670) 11.946 8.449 ( 4.608 3.703 -7.150) 9.277 8.677 ( -0.774 -1.231 1.452) 2.055 8.700 ( -0.280 -1.671 -2.145) 2.734 9.034 ( -1.721 4.051 5.882) 7.346 9.124 ( 1.084 1.530 -6.225) 6.502 9.287 ( -3.663 2.023 3.023) 5.162 9.358 ( -0.177 0.541 -1.902) 1.985 9.680 ( -6.839 -2.083 2.687) 7.638 9.763 ( -5.745 -1.278 0.439) 5.902 9.837 ( 4.082 -0.689 -4.259) 5.939 9.858 ( 3.957 -4.141 -1.066) 5.826 10.458 ( -4.398 3.153 2.237) 5.855 10.535 ( 2.452 3.230 -1.227) 4.237 10.764 ( -2.995 -6.618 7.231) 10.250 10.881 ( 0.901 -8.435 -7.193) 11.122 20.541 ( -0.062 1.106 0.024) 1.108 20.550 ( 0.783 0.853 -0.126) 1.165 20.836 ( 0.175 0.855 0.947) 1.288 20.854 ( 0.992 0.106 -0.845) 1.307 22.841 ( 0.512 0.961 2.105) 2.370 22.852 ( -0.922 0.695 -1.831) 2.164 23.060 ( 0.476 -1.133 1.481) 1.925 23.075 ( -0.113 -1.513 -2.029) 2.533 24.582 ( 0.154 -1.520 1.240) 1.968 24.596 ( 0.508 -2.246 -0.641) 2.390 24.965 ( -0.819 2.010 0.269) 2.187 24.974 ( -0.408 1.620 -0.708) 1.814 25.649 ( 0.139 1.861 -0.166) 1.873 25.672 ( 2.840 1.103 0.125) 3.049 25.980 ( 1.261 0.086 0.395) 1.324 25.990 ( 1.850 -0.459 -0.168) 1.913 28.373 ( -1.367 0.938 1.884) 2.509 28.391 ( -1.151 0.513 0.092) 1.264 28.530 ( 0.388 -0.035 -0.559) 0.681 28.549 ( 1.585 -0.508 -0.661) 1.791 28.616 ( -1.534 -0.406 1.545) 2.214 28.657 ( 1.028 -2.133 -1.631) 2.875 28.788 ( 0.016 -0.251 0.834) 0.871 28.805 ( 0.015 -1.163 -1.878) 2.209 32.367 ( -0.962 -0.154 0.322) 1.026 32.381 ( 0.281 -0.701 -0.155) 0.771 32.494 ( -0.811 1.242 -0.011) 1.483 32.512 ( 0.978 0.439 -0.438) 1.158 35.408 ( -1.390 0.541 0.139) 1.498 35.422 ( 0.239 -0.070 0.394) 0.466 35.494 ( 0.262 0.612 0.560) 0.870 35.511 ( 1.111 -0.214 -0.828) 1.402 88.856 ( -1.759 -1.158 2.491) 3.262 88.889 ( 0.181 -2.738 0.054) 2.745 89.183 ( -0.703 -0.667 3.664) 3.790 89.216 ( -1.952 -1.838 -4.383) 5.138 97.692 ( -0.481 0.713 0.558) 1.025 97.698 ( -0.567 0.792 -0.597) 1.142 97.783 ( -0.880 -2.627 0.977) 2.937 97.793 ( -0.670 -2.608 -0.529) 2.744 98.730 ( -0.975 0.923 0.591) 1.466 98.732 ( -1.197 0.833 -0.383) 1.508 98.834 ( 1.421 2.650 0.223) 3.015 98.855 ( 3.495 2.032 0.007) 4.043 99.675 ( 0.295 2.699 0.944) 2.875 99.683 ( 0.098 2.642 -0.697) 2.734 99.973 ( 0.476 -2.479 6.450) 6.927 100.041 ( -1.011 -4.947 -7.920) 9.392 ======================= Grid point 150 (81/92) ======================= q-point: (-0.33 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.201 ( -10.783 10.163 4.248) 15.414 1.399 ( -12.870 6.574 6.373) 15.795 1.664 ( -0.660 -2.127 1.248) 2.553 1.780 ( 5.070 1.391 3.779) 6.475 1.894 ( -2.684 -1.347 -1.956) 3.584 1.992 ( 0.472 1.086 -5.456) 5.582 2.067 ( -1.410 -1.765 -3.902) 4.509 2.135 ( 2.468 -2.763 2.071) 4.244 2.266 ( 2.069 3.369 2.607) 4.736 2.383 ( 0.644 1.008 1.833) 2.189 2.424 ( -1.075 1.899 -1.036) 2.416 2.479 ( -10.718 5.613 4.062) 12.762 2.536 ( 3.937 1.936 1.129) 4.531 2.620 ( -0.208 -0.521 1.019) 1.163 2.627 ( 3.885 -2.300 2.432) 5.128 2.810 ( 5.951 -0.371 -1.098) 6.063 2.835 ( -4.144 2.354 2.167) 5.235 3.024 ( 0.541 -4.000 -0.237) 4.043 3.155 ( 1.107 1.301 1.156) 2.063 3.278 ( 3.620 -0.480 1.870) 4.103 3.312 ( -2.525 1.993 -2.607) 4.140 3.404 ( -4.372 -1.124 -2.095) 4.976 3.618 ( 1.508 3.496 -3.723) 5.325 3.699 ( 1.723 0.092 -4.579) 4.893 4.357 ( -3.545 -1.466 1.353) 4.068 4.469 ( 2.570 -5.372 -3.191) 6.756 4.501 ( -1.886 -1.320 3.571) 4.248 4.632 ( 3.394 -4.438 -0.376) 5.600 4.749 ( 1.208 -0.240 2.532) 2.816 4.905 ( 5.686 -4.823 1.808) 7.672 5.042 ( -0.254 2.344 -1.864) 3.006 5.150 ( 5.449 -0.743 -1.957) 5.837 5.243 ( 5.952 -0.549 -1.262) 6.109 5.269 ( -1.174 -3.655 -2.897) 4.809 5.373 ( 2.887 -0.805 -2.106) 3.663 5.377 ( -0.259 -0.975 -2.541) 2.733 5.465 ( 1.529 0.241 -0.460) 1.615 5.578 ( 4.014 -3.277 1.798) 5.485 5.729 ( 5.213 0.020 0.471) 5.234 5.777 ( 5.535 -1.892 4.959) 7.669 5.896 ( 0.376 1.989 2.094) 2.912 5.977 ( -5.149 -1.682 -1.014) 5.511 6.187 ( 7.425 6.382 -0.825) 9.825 6.327 ( -3.561 7.113 -3.103) 8.539 6.462 ( 5.365 -2.502 -0.951) 5.996 6.524 ( -5.457 -0.917 -1.799) 5.818 6.549 ( 4.511 0.991 -2.067) 5.060 6.742 ( 3.619 -6.567 -0.370) 7.507 6.892 ( 4.254 1.723 0.902) 4.678 6.993 ( 7.590 4.729 0.081) 8.943 7.191 ( 2.375 -6.066 4.131) 7.714 7.195 ( 4.123 -4.065 -1.229) 5.919 7.497 ( -4.093 7.065 0.957) 8.221 7.613 ( -2.470 4.769 2.652) 5.990 7.936 ( 3.378 1.221 0.965) 3.720 8.105 ( 7.208 -0.646 -1.106) 7.321 8.368 ( 1.438 7.271 8.097) 10.977 8.502 ( 7.005 3.938 -1.233) 8.130 8.641 ( -1.443 -1.043 -3.374) 3.815 8.670 ( -1.985 -2.114 -0.867) 3.027 9.008 ( -3.022 3.059 -2.587) 5.018 9.089 ( -1.010 2.152 0.049) 2.378 9.244 ( -5.482 1.225 3.426) 6.580 9.351 ( -1.008 -0.015 1.846) 2.104 9.586 ( -7.813 -2.716 3.030) 8.809 9.624 ( -9.253 0.597 -1.469) 9.388 9.840 ( -0.447 0.661 -3.052) 3.155 9.873 ( 1.486 -3.876 -3.526) 5.446 10.402 ( -4.483 2.647 1.706) 5.479 10.554 ( 0.240 4.024 -0.509) 4.063 10.753 ( -4.551 -9.817 2.013) 11.006 10.828 ( -0.936 -6.732 -1.892) 7.055 20.536 ( 0.180 1.660 -0.619) 1.781 20.572 ( 1.802 0.695 -0.250) 1.948 20.858 ( 1.269 0.926 0.769) 1.749 20.870 ( 1.798 0.325 -0.669) 1.945 22.792 ( -1.509 1.561 -2.578) 3.370 22.868 ( -0.474 -1.239 0.511) 1.422 23.050 ( 0.592 0.676 -0.457) 1.008 23.113 ( 1.031 -1.628 2.261) 2.971 24.603 ( 1.064 -1.696 0.049) 2.003 24.606 ( 1.092 -1.876 0.439) 2.214 24.950 ( -1.401 1.839 0.753) 2.431 24.960 ( -1.151 1.463 0.449) 1.914 25.675 ( 3.246 2.173 -0.248) 3.914 25.734 ( 4.192 -0.067 0.043) 4.193 26.022 ( 3.471 0.743 -0.331) 3.565 26.047 ( 4.918 -0.475 0.284) 4.949 28.357 ( -2.022 0.626 0.842) 2.278 28.371 ( -1.849 0.209 1.095) 2.159 28.535 ( 1.239 0.469 -1.149) 1.754 28.568 ( 1.694 -0.690 -1.062) 2.115 28.610 ( -1.270 -0.231 2.052) 2.424 28.662 ( 0.277 -2.553 -0.043) 2.568 28.770 ( -0.470 -0.038 -1.963) 2.019 28.800 ( -0.776 -1.191 0.609) 1.547 32.355 ( -1.059 0.158 0.636) 1.245 32.382 ( -0.287 -0.870 0.426) 1.010 32.479 ( -0.765 1.678 -0.271) 1.864 32.521 ( 0.753 -0.181 -0.550) 0.950 35.388 ( -1.145 0.973 0.426) 1.561 35.428 ( -0.260 -0.587 0.776) 1.007 35.507 ( 1.147 0.634 -0.404) 1.371 35.525 ( 1.390 -0.007 -0.517) 1.483 88.842 ( -2.290 -1.095 1.471) 2.934 88.881 ( -0.287 -2.519 -1.095) 2.762 89.113 ( -3.895 0.701 -3.262) 5.129 89.219 ( -2.769 -5.290 5.601) 8.186 97.672 ( -1.378 0.573 -0.565) 1.596 97.683 ( -1.389 0.524 0.257) 1.506 97.739 ( -2.239 -1.204 -1.099) 2.770 97.797 ( -1.554 -3.764 1.454) 4.324 98.705 ( -1.149 0.628 -0.316) 1.347 98.717 ( -1.249 0.384 0.754) 1.509 98.885 ( 3.975 3.416 -0.160) 5.243 98.933 ( 6.211 2.547 -0.877) 6.770 99.649 ( -0.382 2.804 -1.601) 3.251 99.711 ( 0.860 1.650 0.386) 1.901 99.930 ( -2.288 -1.582 -7.032) 7.562 100.037 ( -1.106 -4.592 6.091) 7.708 ======================= Grid point 151 (82/92) ======================= q-point: (-0.22 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.155 ( -5.521 13.137 12.714) 19.098 1.286 ( -10.485 11.268 9.500) 18.087 1.638 ( -3.965 -2.036 2.154) 4.951 1.832 ( -1.191 -0.960 -1.587) 2.204 1.901 ( 0.437 -2.501 0.892) 2.691 1.939 ( -0.026 1.996 -2.742) 3.392 2.005 ( -0.267 -4.050 -3.477) 5.344 2.142 ( -0.850 -1.943 0.577) 2.198 2.253 ( -14.917 12.357 4.291) 19.840 2.365 ( 4.124 5.509 3.385) 7.669 2.407 ( -1.576 3.576 3.863) 5.495 2.494 ( 2.503 -3.214 6.065) 7.306 2.612 ( 0.084 -1.822 -1.112) 2.136 2.631 ( 4.896 0.560 2.008) 5.321 2.738 ( 2.893 -3.962 5.171) 7.128 2.823 ( 0.799 0.432 0.533) 1.054 2.887 ( 2.878 -0.307 -0.266) 2.907 3.032 ( 1.105 -5.285 0.598) 5.433 3.193 ( -1.503 1.647 -3.708) 4.327 3.215 ( 2.219 4.057 -3.105) 5.570 3.276 ( -4.007 -1.971 -7.723) 8.921 3.376 ( 4.108 -0.295 1.381) 4.344 3.571 ( -1.327 3.356 -5.635) 6.691 3.637 ( -1.639 -0.087 -6.615) 6.815 4.321 ( -1.745 -1.389 0.899) 2.405 4.479 ( 1.097 -7.643 -0.033) 7.721 4.512 ( 0.847 1.118 -0.261) 1.427 4.675 ( 2.023 -6.023 -0.887) 6.415 4.825 ( 3.899 2.212 2.422) 5.095 5.026 ( 0.876 -0.137 -1.072) 1.391 5.047 ( 7.651 -1.739 0.816) 7.888 5.161 ( 3.035 -1.625 -3.071) 4.613 5.280 ( 3.398 -0.133 1.026) 3.552 5.321 ( 0.642 0.173 -2.080) 2.184 5.338 ( 1.502 -1.334 -1.115) 2.298 5.430 ( 5.854 -0.943 0.187) 5.932 5.493 ( 1.551 0.743 0.678) 1.848 5.653 ( 2.929 -5.506 0.627) 6.268 5.820 ( -2.752 0.621 3.099) 4.191 5.855 ( -4.693 0.242 -2.730) 5.435 5.903 ( 8.414 -0.661 4.222) 9.437 6.021 ( 8.348 -3.209 1.602) 9.086 6.201 ( -2.511 4.157 -3.947) 6.258 6.284 ( -0.981 3.336 -1.141) 3.659 6.433 ( 0.360 2.913 -2.702) 3.990 6.480 ( -0.553 1.290 1.414) 1.992 6.568 ( 3.837 3.047 -7.756) 9.174 6.821 ( 6.119 -4.184 -3.163) 8.060 6.982 ( 3.898 2.346 0.563) 4.584 7.103 ( 6.929 7.129 -0.774) 9.972 7.184 ( -0.655 -3.034 -1.791) 3.583 7.370 ( 7.500 -1.012 -0.746) 7.604 7.520 ( 2.872 0.633 8.177) 8.690 7.647 ( 3.210 -0.240 8.561) 9.146 8.004 ( 3.115 1.223 1.985) 3.891 8.202 ( 6.391 -1.836 -1.552) 6.828 8.463 ( -1.543 4.166 -0.345) 4.456 8.580 ( 2.305 -0.204 4.172) 4.771 8.602 ( -3.062 -1.801 -3.292) 4.843 8.671 ( 7.718 0.805 2.531) 8.163 8.932 ( -2.779 2.735 -1.768) 4.281 9.071 ( -0.446 0.297 -0.937) 1.080 9.182 ( -7.535 1.825 5.437) 9.469 9.350 ( -2.157 0.243 1.885) 2.875 9.442 ( -10.097 3.690 -1.749) 10.891 9.494 ( -7.566 -2.743 3.893) 8.940 9.752 ( -3.604 -0.164 -5.756) 6.794 9.847 ( 0.447 -3.254 -4.512) 5.581 10.349 ( -3.778 2.252 1.244) 4.571 10.505 ( -5.750 3.623 -0.777) 6.840 10.698 ( -0.853 -8.613 -1.604) 8.803 10.792 ( -3.798 -7.298 1.747) 8.411 20.537 ( 0.563 2.359 -0.497) 2.476 20.599 ( 2.481 0.409 -1.562) 2.960 20.889 ( 1.320 1.069 0.476) 1.764 20.896 ( 2.191 0.574 -0.542) 2.329 22.757 ( -0.141 1.761 -1.187) 2.129 22.856 ( -0.619 -2.312 -0.302) 2.413 23.062 ( 0.604 1.815 0.055) 1.913 23.137 ( -0.339 -1.321 1.036) 1.713 24.621 ( 1.458 -1.330 -0.271) 1.992 24.635 ( 1.199 -2.130 0.923) 2.613 24.938 ( -1.345 1.425 1.242) 2.319 24.946 ( -1.313 1.190 1.046) 2.058 25.744 ( 4.856 1.791 -0.099) 5.176 25.804 ( 4.023 -0.562 -0.058) 4.062 26.080 ( 3.720 1.496 -0.352) 4.025 26.144 ( 6.248 -1.413 -0.654) 6.439 28.337 ( -1.461 0.371 1.195) 1.924 28.355 ( -1.238 -0.404 1.275) 1.823 28.546 ( 1.836 0.811 -1.481) 2.494 28.585 ( 1.548 -0.692 -0.642) 1.814 28.616 ( -0.936 -0.173 2.245) 2.439 28.655 ( -1.921 -2.119 1.176) 3.092 28.746 ( 0.012 -0.025 -1.736) 1.736 28.780 ( -2.022 -1.366 0.131) 2.443 32.347 ( -0.886 0.464 0.995) 1.410 32.383 ( -0.601 -0.950 1.303) 1.721 32.465 ( -0.364 1.777 -0.509) 1.884 32.525 ( 0.541 -0.814 -0.816) 1.273 35.381 ( -0.582 1.171 0.983) 1.636 35.434 ( 0.058 -0.838 0.766) 1.137 35.516 ( 0.832 0.720 -1.201) 1.629 35.544 ( 1.423 -0.046 -0.655) 1.568 88.817 ( -1.961 -0.752 0.659) 2.201 88.865 ( 0.084 -2.379 -1.257) 2.691 89.016 ( -3.985 1.728 -2.308) 4.919 89.196 ( -7.187 -8.682 4.850) 12.270 97.643 ( -1.289 0.489 -0.570) 1.491 97.658 ( -1.581 0.040 0.025) 1.582 97.695 ( -1.904 -0.257 -0.552) 1.999 97.765 ( -3.467 -3.552 0.472) 4.987 98.690 ( -0.480 0.629 0.001) 0.792 98.710 ( -0.699 0.019 0.996) 1.217 98.944 ( 3.564 3.987 -1.023) 5.445 99.027 ( 7.222 2.219 -3.646) 8.389 99.646 ( 1.320 2.166 -0.035) 2.537 99.710 ( 0.222 -0.094 -1.495) 1.515 99.838 ( -2.121 3.324 -2.581) 4.713 100.058 ( -3.138 -5.510 4.398) 7.717 ======================= Grid point 152 (83/92) ======================= q-point: (-0.11 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.246 ( -2.234 15.084 12.644) 19.809 1.266 ( -4.883 14.456 10.883) 18.742 1.592 ( -1.680 2.210 0.717) 2.867 1.726 ( -4.267 7.902 -9.947) 13.401 1.896 ( -1.312 -6.552 3.774) 7.674 1.928 ( -2.485 2.952 1.664) 4.202 1.979 ( 0.077 -5.071 0.327) 5.082 2.122 ( -4.496 0.109 5.375) 7.008 2.167 ( 0.279 -2.808 1.569) 3.229 2.436 ( 0.154 5.217 1.782) 5.515 2.479 ( 0.473 4.044 11.001) 11.730 2.570 ( 1.221 0.544 0.605) 1.467 2.600 ( -1.377 -4.886 1.827) 5.395 2.724 ( 1.998 -1.882 2.095) 3.454 2.804 ( 0.872 -3.498 2.813) 4.573 2.876 ( 3.442 -2.069 1.554) 4.306 2.915 ( 1.332 2.014 1.545) 2.866 3.055 ( -0.839 0.334 -10.657) 10.695 3.083 ( 3.120 -1.490 -0.684) 3.525 3.128 ( -2.487 -2.410 -8.414) 9.099 3.276 ( 3.626 4.747 -0.795) 6.026 3.410 ( -2.208 0.892 -3.489) 4.224 3.480 ( 0.442 2.699 -4.400) 5.181 3.522 ( -3.464 0.167 -6.336) 7.223 4.324 ( 0.858 -1.053 1.190) 1.806 4.493 ( -1.644 -2.423 -0.786) 3.032 4.517 ( 2.227 -3.869 -0.212) 4.469 4.686 ( 0.550 -5.896 -1.141) 6.031 4.913 ( 4.207 2.894 2.341) 5.618 5.037 ( 2.084 0.945 -1.382) 2.674 5.112 ( 1.961 1.098 -1.743) 2.844 5.256 ( 6.206 -0.936 -2.923) 6.924 5.311 ( 2.876 3.068 -0.045) 4.206 5.356 ( 0.146 -3.835 5.815) 6.967 5.396 ( 6.110 -1.486 1.461) 6.456 5.489 ( 0.341 -2.657 1.244) 2.954 5.548 ( -1.754 1.878 5.443) 6.019 5.641 ( -2.406 -2.691 -1.200) 3.804 5.743 ( -4.267 -0.524 -2.529) 4.988 5.820 ( 3.301 -2.139 -3.230) 5.090 6.056 ( 2.521 -0.355 0.168) 2.552 6.122 ( 1.567 0.853 0.677) 1.909 6.150 ( 1.641 0.232 -0.187) 1.668 6.245 ( -1.017 -2.132 -1.069) 2.593 6.412 ( -0.368 2.589 -0.711) 2.710 6.513 ( 1.974 -0.300 3.802) 4.295 6.554 ( 2.616 9.178 -6.929) 11.793 6.919 ( 7.740 1.577 0.573) 7.920 6.996 ( 2.240 0.739 -5.826) 6.285 7.123 ( -3.024 -2.109 -1.950) 4.171 7.191 ( 2.280 5.647 0.108) 6.091 7.390 ( -1.036 0.908 -3.247) 3.527 7.676 ( 8.244 3.276 5.451) 10.412 7.933 ( 10.692 -7.247 10.509) 16.652 8.112 ( 6.728 1.232 6.446) 9.398 8.273 ( -1.435 3.227 -1.058) 3.687 8.343 ( 0.110 -3.211 -6.686) 7.417 8.519 ( -2.281 -4.143 -0.354) 4.742 8.689 ( 1.523 2.324 0.724) 2.871 8.813 ( 1.900 -0.867 6.887) 7.196 8.885 ( -4.014 0.936 4.233) 5.908 9.045 ( 1.238 -4.985 -7.890) 9.415 9.134 ( -5.692 4.559 8.474) 11.180 9.276 ( -5.641 3.486 -1.656) 6.834 9.298 ( -5.507 0.257 -1.226) 5.648 9.421 ( -4.724 -0.878 1.941) 5.182 9.642 ( -1.700 -0.151 -4.422) 4.740 9.795 ( -0.140 -4.270 -5.518) 6.978 10.306 ( -2.191 2.872 0.474) 3.643 10.382 ( -6.076 3.166 -1.162) 6.949 10.691 ( 0.365 -6.025 0.042) 6.036 10.743 ( -3.040 -6.093 0.496) 6.827 20.544 ( 0.596 2.681 -0.047) 2.747 20.611 ( 1.576 0.534 -2.940) 3.379 20.909 ( 0.511 1.189 0.514) 1.392 20.925 ( 1.784 0.618 -0.723) 2.022 22.764 ( 1.440 1.588 0.406) 2.182 22.846 ( -0.481 -1.839 -0.130) 1.906 23.066 ( 0.290 1.639 -0.397) 1.711 23.124 ( -1.483 -0.835 -0.393) 1.747 24.644 ( 1.186 -1.246 0.187) 1.731 24.660 ( 0.664 -2.293 0.619) 2.466 24.930 ( -1.099 1.226 1.243) 2.063 24.943 ( -0.527 0.524 1.043) 1.281 25.820 ( 3.889 1.010 0.108) 4.020 25.858 ( 2.440 -0.441 -0.204) 2.488 26.131 ( 2.363 1.814 0.222) 2.987 26.214 ( 3.539 -2.146 -2.459) 4.814 28.335 ( -0.850 0.064 1.982) 2.158 28.365 ( 0.751 -1.481 0.954) 1.915 28.566 ( 2.273 1.097 -1.152) 2.774 28.603 ( 0.142 -0.097 0.198) 0.262 28.621 ( -0.288 0.007 0.883) 0.929 28.637 ( -2.030 -1.325 3.315) 4.107 28.724 ( -2.258 -1.013 -0.095) 2.476 28.745 ( -0.137 -1.323 -2.328) 2.681 32.348 ( -0.608 0.868 1.467) 1.809 32.389 ( -0.313 -0.679 0.933) 1.196 32.460 ( 0.200 0.891 0.111) 0.920 32.521 ( 0.251 -1.347 -1.230) 1.841 35.390 ( -0.134 1.103 1.594) 1.943 35.444 ( 0.297 -1.076 0.358) 1.173 35.511 ( 0.285 1.197 -1.150) 1.684 35.551 ( 0.635 -0.279 -1.464) 1.620 88.798 ( -1.177 -0.014 0.867) 1.462 88.856 ( -0.487 -1.425 -0.850) 1.729 88.950 ( -0.471 0.164 -1.653) 1.727 89.086 ( -10.037 -6.995 2.655) 12.519 97.623 ( -0.412 0.554 -0.471) 0.835 97.636 ( -1.109 0.018 -0.036) 1.110 97.666 ( -0.945 -0.266 -0.284) 1.022 97.704 ( -3.584 -1.813 -0.033) 4.017 98.690 ( 0.263 0.690 0.432) 0.856 98.711 ( -0.563 0.091 0.956) 1.113 98.977 ( 1.812 4.286 -1.293) 4.829 99.065 ( 3.525 2.122 -6.447) 7.648 99.672 ( 0.964 2.002 0.614) 2.305 99.744 ( 3.892 -0.400 0.791) 3.991 99.804 ( 0.468 3.272 0.269) 3.316 100.024 ( -5.179 -5.411 2.157) 7.795 ======================= Grid point 153 (84/92) ======================= q-point: ( 0.00 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.588 ( -2.606 -9.955 5.211) 11.535 1.588 ( -2.606 9.955 5.211) 11.535 1.622 ( 0.492 -5.772 4.788) 7.516 1.622 ( 0.492 5.772 4.788) 7.516 1.872 ( 2.164 -3.544 -4.956) 6.466 1.872 ( 2.164 3.544 -4.956) 6.466 1.989 ( 0.791 -5.470 -0.549) 5.554 1.989 ( 0.791 5.470 -0.549) 5.554 2.312 ( -1.029 -8.267 8.101) 11.620 2.312 ( -1.029 8.267 8.101) 11.620 2.564 ( -1.520 -1.528 -1.367) 2.552 2.564 ( -1.520 1.528 -1.367) 2.552 2.693 ( -0.484 -0.171 0.728) 0.891 2.693 ( -0.484 0.171 0.728) 0.891 2.827 ( 0.885 -2.706 -1.039) 3.030 2.827 ( 0.885 2.706 -1.039) 3.030 2.981 ( -1.410 -3.374 3.228) 4.878 2.981 ( -1.410 3.374 3.228) 4.878 3.115 ( 5.453 -2.994 -1.529) 6.406 3.115 ( 5.453 2.994 -1.529) 6.406 3.293 ( -2.999 -1.843 -8.181) 8.906 3.293 ( -2.999 1.843 -8.181) 8.906 3.470 ( -0.642 -1.722 -0.560) 1.921 3.470 ( -0.642 1.722 -0.560) 1.921 4.399 ( 0.650 -3.120 3.001) 4.377 4.399 ( 0.650 3.120 3.001) 4.377 4.539 ( -0.396 -3.758 -3.561) 5.192 4.539 ( -0.396 3.758 -3.561) 5.192 5.074 ( 2.431 -1.241 0.700) 2.818 5.074 ( 2.431 1.241 0.700) 2.818 5.176 ( -1.372 -2.593 -1.843) 3.465 5.176 ( -1.372 2.593 -1.843) 3.465 5.381 ( -3.137 -3.928 4.907) 7.025 5.381 ( -3.137 3.928 4.907) 7.025 5.456 ( -1.365 -1.096 -0.484) 1.816 5.456 ( -1.365 1.096 -0.484) 1.816 5.571 ( 2.003 -2.349 3.946) 5.010 5.571 ( 2.003 2.349 3.946) 5.010 5.748 ( 1.475 -3.152 -6.098) 7.021 5.748 ( 1.475 3.152 -6.098) 7.021 6.114 ( 1.716 -1.908 1.182) 2.825 6.114 ( 1.716 1.908 1.182) 2.825 6.190 ( -0.014 -0.458 -1.408) 1.481 6.190 ( -0.014 0.458 -1.408) 1.481 6.523 ( 1.375 -7.060 7.305) 10.252 6.523 ( 1.375 7.060 7.305) 10.252 6.742 ( -4.167 -10.700 -8.623) 14.361 6.742 ( -4.167 10.700 -8.623) 14.361 7.076 ( 2.244 -0.904 1.505) 2.849 7.076 ( 2.244 0.904 1.505) 2.849 7.269 ( -2.636 -1.869 -2.995) 4.406 7.269 ( -2.636 1.869 -2.995) 4.406 7.990 ( 4.678 -4.240 4.896) 7.990 7.990 ( 4.678 4.240 4.896) 7.990 8.164 ( -5.083 -4.104 -4.695) 8.045 8.164 ( -5.083 4.104 -4.695) 8.045 8.496 ( 6.258 -7.701 11.096) 14.886 8.496 ( 6.258 7.701 11.096) 14.886 8.726 ( -9.603 -4.994 -8.319) 13.651 8.726 ( -9.603 4.994 -8.319) 13.651 8.904 ( 4.647 -3.433 3.903) 6.972 8.904 ( 4.647 3.433 3.903) 6.972 9.146 ( -2.784 -1.043 -0.032) 2.974 9.146 ( -2.784 1.043 -0.032) 2.974 9.378 ( 1.468 -3.145 2.769) 4.440 9.378 ( 1.468 3.145 2.769) 4.440 9.642 ( 0.641 -3.417 -4.218) 5.466 9.642 ( 0.641 3.417 -4.218) 5.466 10.363 ( 0.366 -0.781 -1.156) 1.442 10.363 ( 0.366 0.781 -1.156) 1.442 10.637 ( 0.515 -1.983 -0.176) 2.056 10.637 ( 0.515 1.983 -0.176) 2.056 20.593 ( 0.064 -1.016 -0.759) 1.270 20.593 ( 0.064 1.016 -0.759) 1.270 20.935 ( -0.018 -0.530 -0.117) 0.543 20.935 ( -0.018 0.530 -0.117) 0.543 22.818 ( 0.441 -0.545 0.173) 0.722 22.818 ( 0.441 0.545 0.173) 0.722 23.084 ( -0.299 -0.319 -0.442) 0.621 23.084 ( -0.299 0.319 -0.442) 0.621 24.643 ( -0.124 -0.072 0.232) 0.273 24.643 ( -0.124 0.072 0.232) 0.273 24.947 ( -0.029 -0.312 0.739) 0.803 24.947 ( -0.029 0.312 0.739) 0.803 25.869 ( 0.141 -0.226 -0.137) 0.300 25.869 ( 0.141 0.226 -0.137) 0.300 26.184 ( -0.140 -1.121 -0.641) 1.299 26.184 ( -0.140 1.121 -0.641) 1.299 28.351 ( -0.367 -0.750 1.209) 1.469 28.351 ( -0.367 0.750 1.209) 1.469 28.599 ( -1.665 -1.261 1.210) 2.414 28.599 ( -1.665 1.261 1.210) 2.414 28.644 ( 1.952 -0.212 1.065) 2.233 28.644 ( 1.952 0.212 1.065) 2.233 28.687 ( 0.119 -1.638 -2.407) 2.914 28.687 ( 0.119 1.638 -2.407) 2.914 32.381 ( -0.086 -0.951 1.200) 1.533 32.381 ( -0.086 0.951 1.200) 1.533 32.478 ( 0.156 -1.062 -0.910) 1.407 32.478 ( 0.156 1.062 -0.910) 1.407 35.426 ( -0.062 -0.883 0.755) 1.163 35.426 ( -0.062 0.883 0.755) 1.163 35.528 ( -0.045 -0.671 -0.897) 1.121 35.528 ( -0.045 0.671 -0.897) 1.121 88.813 ( -2.554 -1.510 2.208) 3.699 88.813 ( -2.554 1.510 2.208) 3.699 88.945 ( 1.766 -1.970 -1.270) 2.934 88.945 ( 1.766 1.970 -1.270) 2.934 97.627 ( -0.138 -0.142 -0.041) 0.202 97.627 ( -0.138 0.142 -0.041) 0.202 97.654 ( 0.060 -0.183 -0.117) 0.226 97.654 ( 0.060 0.183 -0.117) 0.226 98.714 ( 0.012 -0.159 0.582) 0.603 98.714 ( 0.012 0.159 0.582) 0.603 99.042 ( -0.193 -1.362 -2.118) 2.525 99.042 ( -0.193 1.362 -2.118) 2.525 99.767 ( 0.828 -1.699 0.706) 2.018 99.767 ( 0.828 1.699 0.706) 2.018 99.868 ( -0.249 -1.387 -0.059) 1.410 99.868 ( -0.249 1.387 -0.059) 1.410 ======================= Grid point 155 (85/92) ======================= q-point: ( 0.11 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.565 ( -2.519 -11.786 3.734) 12.617 1.565 ( -2.519 11.786 3.734) 12.617 1.719 ( 4.461 -4.197 -0.566) 6.151 1.719 ( 4.461 4.197 -0.566) 6.151 1.852 ( 2.222 -0.683 -3.106) 3.880 1.852 ( 2.222 0.683 -3.106) 3.880 2.007 ( 2.323 -2.584 -1.333) 3.722 2.007 ( 2.323 2.584 -1.333) 3.722 2.420 ( 4.745 -4.757 0.072) 6.719 2.420 ( 4.745 4.757 0.072) 6.719 2.521 ( -2.551 -2.075 3.194) 4.584 2.521 ( -2.551 2.075 3.194) 4.584 2.671 ( -2.767 -0.945 0.476) 2.963 2.671 ( -2.767 0.945 0.476) 2.963 2.816 ( 1.275 -0.525 0.255) 1.402 2.816 ( 1.275 0.525 0.255) 1.402 2.977 ( -4.444 -2.694 0.871) 5.269 2.977 ( -4.444 2.694 0.871) 5.269 3.140 ( 1.854 -4.314 -9.259) 10.382 3.140 ( 1.854 4.314 -9.259) 10.382 3.245 ( 1.623 -2.134 5.935) 6.512 3.245 ( 1.623 2.134 5.935) 6.512 3.455 ( -1.274 -1.734 1.147) 2.439 3.455 ( -1.274 1.734 1.147) 2.439 4.413 ( -0.567 -4.471 -1.210) 4.667 4.413 ( -0.567 4.471 -1.210) 4.667 4.519 ( 0.135 -4.092 0.877) 4.187 4.519 ( 0.135 4.092 0.877) 4.187 5.053 ( -2.628 -2.598 -2.944) 4.725 5.053 ( -2.628 2.598 -2.944) 4.725 5.122 ( -5.000 -3.241 2.001) 6.286 5.122 ( -5.000 3.241 2.001) 6.286 5.321 ( -7.552 -2.799 3.169) 8.655 5.321 ( -7.552 2.799 3.169) 8.655 5.445 ( -1.079 -2.451 0.017) 2.678 5.445 ( -1.079 2.451 0.017) 2.678 5.683 ( 1.402 -1.602 -2.106) 2.994 5.683 ( 1.402 1.602 -2.106) 2.994 5.694 ( 4.245 -1.184 -0.028) 4.407 5.694 ( 4.245 1.184 -0.028) 4.407 6.113 ( -1.059 -2.429 -2.305) 3.512 6.113 ( -1.059 2.429 -2.305) 3.512 6.192 ( -0.006 -1.281 -0.791) 1.505 6.192 ( -0.006 1.281 -0.791) 1.505 6.534 ( -6.334 -7.639 -1.764) 10.079 6.534 ( -6.334 7.639 -1.764) 10.079 6.646 ( -2.343 -11.228 5.817) 12.861 6.646 ( -2.343 11.228 5.817) 12.861 7.057 ( -2.171 -3.694 -2.104) 4.774 7.057 ( -2.171 3.694 -2.104) 4.774 7.270 ( 1.583 -4.119 3.062) 5.371 7.270 ( 1.583 4.119 3.062) 5.371 7.929 ( -7.670 -9.360 -5.175) 13.162 7.929 ( -7.670 9.360 -5.175) 13.162 8.138 ( -2.587 -3.160 4.225) 5.876 8.138 ( -2.587 3.160 4.225) 5.876 8.493 ( -3.917 -3.927 -5.659) 7.924 8.493 ( -3.917 3.927 -5.659) 7.924 8.656 ( -3.634 -9.360 8.983) 13.472 8.656 ( -3.634 9.360 8.983) 13.472 9.005 ( 6.084 -2.475 -5.076) 8.301 9.005 ( 6.084 2.475 -5.076) 8.301 9.204 ( 7.829 -2.010 5.123) 9.570 9.204 ( 7.829 2.010 5.123) 9.570 9.462 ( 7.207 -1.548 -1.443) 7.511 9.462 ( 7.207 1.548 -1.443) 7.511 9.609 ( -0.765 -0.537 -1.326) 1.622 9.609 ( -0.765 0.537 -1.326) 1.622 10.382 ( 2.609 -2.565 -0.354) 3.676 10.382 ( 2.609 2.565 -0.354) 3.676 10.651 ( 1.879 -4.821 -0.853) 5.244 10.651 ( 1.879 4.821 -0.853) 5.244 20.583 ( -0.714 -0.140 -0.110) 0.736 20.583 ( -0.714 0.140 -0.110) 0.736 20.925 ( -1.165 -0.479 0.026) 1.260 20.925 ( -1.165 0.479 0.026) 1.260 22.814 ( -0.619 -1.408 -0.632) 1.663 22.814 ( -0.619 1.408 -0.632) 1.663 23.089 ( 0.824 -1.237 0.423) 1.545 23.089 ( 0.824 1.237 0.423) 1.545 24.633 ( -1.298 -0.365 0.197) 1.363 24.633 ( -1.298 0.365 0.197) 1.363 24.960 ( 0.995 -0.321 0.054) 1.047 24.960 ( 0.995 0.321 0.054) 1.047 25.844 ( -2.764 -0.724 -0.195) 2.864 25.844 ( -2.764 0.724 -0.195) 2.864 26.155 ( -2.933 -0.298 0.174) 2.953 26.155 ( -2.933 0.298 0.174) 2.953 28.353 ( -0.480 -0.239 0.662) 0.852 28.353 ( -0.480 0.239 0.662) 0.852 28.575 ( -2.197 -1.600 0.758) 2.822 28.575 ( -2.197 1.600 0.758) 2.822 28.664 ( 0.368 -1.026 -0.929) 1.432 28.664 ( 0.368 1.026 -0.929) 1.432 28.704 ( 3.340 -1.301 -0.532) 3.624 28.704 ( 3.340 1.301 -0.532) 3.624 32.387 ( -0.129 -1.115 0.183) 1.137 32.387 ( -0.129 1.115 0.183) 1.137 32.478 ( 0.580 -0.911 -0.282) 1.116 32.478 ( 0.580 0.911 -0.282) 1.116 35.428 ( -0.271 -0.127 0.153) 0.336 35.428 ( -0.271 0.127 0.153) 0.336 35.520 ( -0.323 -0.355 0.002) 0.480 35.520 ( -0.323 0.355 0.002) 0.480 88.790 ( -2.485 -1.376 2.438) 3.743 88.790 ( -2.485 1.376 2.438) 3.743 89.007 ( 6.356 -4.487 -1.287) 7.886 89.007 ( 6.356 4.487 -1.287) 7.886 97.629 ( 0.473 -0.577 0.116) 0.755 97.629 ( 0.473 0.577 0.116) 0.755 97.672 ( 1.957 -1.062 -0.001) 2.226 97.672 ( 1.957 1.062 -0.001) 2.226 98.716 ( -0.079 -0.640 -0.002) 0.645 98.716 ( -0.079 0.640 -0.002) 0.645 99.011 ( -2.272 -0.224 0.218) 2.293 99.011 ( -2.272 0.224 0.218) 2.293 99.733 ( -3.275 -1.755 -0.784) 3.797 99.733 ( -3.275 1.755 -0.784) 3.797 99.913 ( 4.072 -6.139 -0.028) 7.366 99.913 ( 4.072 6.139 -0.028) 7.366 ======================= Grid point 157 (86/92) ======================= q-point: ( 0.22 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.582 ( 2.351 -5.142 -2.458) 6.165 1.582 ( 2.351 5.142 -2.458) 6.165 1.730 ( 1.698 -8.550 -2.372) 9.034 1.730 ( 1.698 8.550 -2.372) 9.034 1.906 ( 5.950 -1.534 -3.304) 6.977 1.906 ( 5.950 1.534 -3.304) 6.977 2.038 ( 3.391 -5.792 -0.762) 6.755 2.038 ( 3.391 5.792 -0.762) 6.755 2.434 ( -2.700 -7.115 1.384) 7.735 2.434 ( -2.700 7.115 1.384) 7.735 2.533 ( 2.255 -0.742 -3.588) 4.302 2.533 ( 2.255 0.742 -3.588) 4.302 2.625 ( -3.794 -1.370 1.556) 4.324 2.625 ( -3.794 1.370 1.556) 4.324 2.801 ( -2.128 -2.636 -4.620) 5.729 2.801 ( -2.128 2.636 -4.620) 5.729 2.999 ( 3.295 -2.785 8.387) 9.431 2.999 ( 3.295 2.785 8.387) 9.431 3.069 ( -0.434 -3.702 -4.713) 6.009 3.069 ( -0.434 3.702 -4.713) 6.009 3.296 ( -2.958 -4.627 2.914) 6.217 3.296 ( -2.958 4.627 2.914) 6.217 3.488 ( 1.495 -1.441 5.201) 5.600 3.488 ( 1.495 1.441 5.201) 5.600 4.380 ( -0.408 -3.817 -2.191) 4.420 4.380 ( -0.408 3.817 -2.191) 4.420 4.534 ( -0.718 -3.717 1.880) 4.227 4.534 ( -0.718 3.717 1.880) 4.227 4.968 ( -4.647 -4.223 -1.590) 6.477 4.968 ( -4.647 4.223 -1.590) 6.477 5.061 ( -3.625 -2.357 1.265) 4.505 5.061 ( -3.625 2.357 1.265) 4.505 5.243 ( -4.382 -1.760 2.109) 5.172 5.243 ( -4.382 1.760 2.109) 5.172 5.386 ( -5.034 -1.781 -0.361) 5.352 5.386 ( -5.034 1.781 -0.361) 5.352 5.611 ( -3.188 -3.379 -3.222) 5.654 5.611 ( -3.188 3.379 -3.222) 5.654 5.826 ( 5.749 -1.861 1.377) 6.197 5.826 ( 5.749 1.861 1.377) 6.197 6.000 ( -9.727 -2.171 -3.236) 10.478 6.000 ( -9.727 2.171 -3.236) 10.478 6.185 ( 2.000 -2.233 2.260) 3.754 6.185 ( 2.000 2.233 2.260) 3.754 6.457 ( -4.620 -3.422 2.580) 6.302 6.457 ( -4.620 3.422 2.580) 6.302 6.627 ( -4.236 -8.196 2.259) 9.498 6.627 ( -4.236 8.196 2.259) 9.498 7.040 ( -0.352 -6.515 1.272) 6.647 7.040 ( -0.352 6.515 1.272) 6.647 7.297 ( -1.868 -6.932 0.217) 7.183 7.297 ( -1.868 6.932 0.217) 7.183 7.754 ( -3.420 -7.369 -7.723) 11.209 7.754 ( -3.420 7.369 -7.723) 11.209 8.074 ( -6.323 -3.482 1.451) 7.363 8.074 ( -6.323 3.482 1.451) 7.363 8.486 ( 1.970 -2.254 2.425) 3.853 8.486 ( 1.970 2.254 2.425) 3.853 8.629 ( -6.022 -8.969 3.980) 11.513 8.629 ( -6.022 8.969 3.980) 11.513 9.027 ( 4.162 -2.650 -4.811) 6.892 9.027 ( 4.162 2.650 -4.811) 6.892 9.393 ( 6.766 -2.682 2.253) 7.619 9.393 ( 6.766 2.682 2.253) 7.619 9.536 ( 6.083 -6.397 -7.413) 11.527 9.536 ( 6.083 6.397 -7.413) 11.527 9.645 ( 3.914 -3.616 5.449) 7.621 9.645 ( 3.914 3.616 5.449) 7.621 10.434 ( 2.702 -4.982 1.505) 5.864 10.434 ( 2.702 4.982 1.505) 5.864 10.681 ( 3.276 -7.487 -1.930) 8.397 10.681 ( 3.276 7.487 -1.930) 8.397 20.569 ( -0.987 -0.868 0.294) 1.347 20.569 ( -0.987 0.868 0.294) 1.347 20.900 ( -1.784 -0.524 0.085) 1.861 20.900 ( -1.784 0.524 0.085) 1.861 22.796 ( -0.539 -2.532 -0.281) 2.604 22.796 ( -0.539 2.532 -0.281) 2.604 23.109 ( 0.793 -2.117 0.139) 2.265 23.109 ( 0.793 2.117 0.139) 2.265 24.608 ( -1.867 -0.631 0.233) 1.985 24.608 ( -1.867 0.631 0.233) 1.985 24.979 ( 1.541 -0.299 -0.608) 1.683 24.979 ( 1.541 0.299 -0.608) 1.683 25.782 ( -4.097 -1.387 -0.185) 4.329 25.782 ( -4.097 1.387 -0.185) 4.329 26.095 ( -4.584 -0.653 0.619) 4.671 26.095 ( -4.584 0.653 0.619) 4.671 28.355 ( 0.162 -0.303 0.555) 0.653 28.355 ( 0.162 0.303 0.555) 0.653 28.549 ( -1.503 -1.232 0.272) 1.962 28.549 ( -1.503 1.232 0.272) 1.962 28.659 ( 0.401 -1.536 -1.253) 2.022 28.659 ( 0.401 1.536 -1.253) 2.022 28.749 ( 2.450 -1.854 -0.279) 3.085 28.749 ( 2.450 1.854 -0.279) 3.085 32.383 ( -0.111 -1.237 -0.480) 1.331 32.383 ( -0.111 1.237 -0.480) 1.331 32.489 ( 0.800 -1.196 0.115) 1.444 32.489 ( 0.800 1.196 0.115) 1.444 35.423 ( -0.124 -0.832 -0.300) 0.893 35.423 ( -0.124 0.832 -0.300) 0.893 35.516 ( -0.662 -0.803 0.570) 1.187 35.516 ( -0.662 0.803 0.570) 1.187 88.790 ( -0.731 -0.722 2.425) 2.634 88.790 ( -0.731 0.722 2.425) 2.634 89.103 ( 6.435 -5.777 -1.401) 8.760 89.103 ( 6.435 5.777 -1.401) 8.760 97.646 ( 1.222 -0.607 0.298) 1.397 97.646 ( 1.222 0.607 0.298) 1.397 97.711 ( 2.492 -1.857 0.028) 3.108 97.711 ( 2.492 1.857 0.028) 3.108 98.714 ( 0.264 -0.999 -0.345) 1.089 98.714 ( 0.264 0.999 -0.345) 1.089 98.970 ( -3.845 -0.777 1.608) 4.239 98.970 ( -3.845 0.777 1.608) 4.239 99.677 ( -2.269 -0.879 -0.195) 2.441 99.677 ( -2.269 0.879 -0.195) 2.441 99.971 ( 3.387 -7.705 -1.181) 8.499 99.971 ( 3.387 7.705 -1.181) 8.499 ======================= Grid point 159 (87/92) ======================= q-point: ( 0.33 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.566 ( 4.269 -3.632 -9.298) 10.857 1.566 ( 4.269 3.632 -9.298) 10.857 1.776 ( 3.784 -4.992 0.543) 6.287 1.776 ( 3.784 4.992 0.543) 6.287 1.955 ( 5.184 -2.033 -4.503) 7.161 1.955 ( 5.184 2.033 -4.503) 7.161 2.074 ( 1.165 -7.601 -2.143) 7.983 2.074 ( 1.165 7.601 -2.143) 7.983 2.373 ( -4.955 -2.021 1.342) 5.517 2.373 ( -4.955 2.021 1.342) 5.517 2.516 ( 0.299 -3.061 -3.654) 4.776 2.516 ( 0.299 3.061 -3.654) 4.776 2.571 ( -4.224 -2.099 1.110) 4.846 2.571 ( -4.224 2.099 1.110) 4.846 2.748 ( 0.155 -4.331 -2.110) 4.820 2.748 ( 0.155 4.331 -2.110) 4.820 2.991 ( 0.352 -2.271 -4.385) 4.951 2.991 ( 0.352 2.271 -4.385) 4.951 3.192 ( 0.618 -2.143 8.891) 9.166 3.192 ( 0.618 2.143 8.891) 9.166 3.257 ( -0.467 -4.413 2.884) 5.292 3.257 ( -0.467 4.413 2.884) 5.292 3.571 ( 0.957 -0.855 5.155) 5.312 3.571 ( 0.957 0.855 5.155) 5.312 4.362 ( -0.282 -1.062 -0.255) 1.128 4.362 ( -0.282 1.062 -0.255) 1.128 4.535 ( -0.655 -1.282 0.888) 1.692 4.535 ( -0.655 1.282 0.888) 1.692 4.864 ( -4.709 -2.392 -2.182) 5.715 4.864 ( -4.709 2.392 -2.182) 5.715 5.054 ( 0.807 -3.328 0.761) 3.508 5.054 ( 0.807 3.328 0.761) 3.508 5.194 ( -5.158 -0.872 1.555) 5.458 5.194 ( -5.158 0.872 1.555) 5.458 5.320 ( -2.382 -0.408 2.194) 3.264 5.320 ( -2.382 0.408 2.194) 3.264 5.524 ( -3.573 -3.358 -1.676) 5.182 5.524 ( -3.573 3.358 -1.676) 5.182 5.770 ( -9.400 -2.011 -0.306) 9.618 5.770 ( -9.400 2.011 -0.306) 9.618 5.948 ( 4.625 -0.558 -0.122) 4.660 5.948 ( 4.625 0.558 -0.122) 4.660 6.259 ( -3.222 -4.824 3.712) 6.887 6.259 ( -3.222 4.824 3.712) 6.887 6.400 ( -1.516 -4.628 3.660) 6.092 6.400 ( -1.516 4.628 3.660) 6.092 6.601 ( -1.280 -3.624 0.971) 3.964 6.601 ( -1.280 3.624 0.971) 3.964 7.020 ( -3.688 -5.360 0.412) 6.520 7.020 ( -3.688 5.360 0.412) 6.520 7.217 ( -2.783 -6.495 -5.580) 9.004 7.217 ( -2.783 6.495 -5.580) 9.004 7.689 ( 3.647 -4.556 -5.337) 7.908 7.689 ( 3.647 4.556 -5.337) 7.908 7.996 ( -5.234 -4.606 1.491) 7.129 7.996 ( -5.234 4.606 1.491) 7.129 8.489 ( -5.989 -6.119 3.640) 9.304 8.489 ( -5.989 6.119 3.640) 9.304 8.625 ( 2.655 -3.913 1.067) 4.848 8.625 ( 2.655 3.913 1.067) 4.848 9.053 ( 3.558 -4.014 -2.467) 5.904 9.053 ( 3.558 4.014 -2.467) 5.904 9.437 ( 0.913 -3.715 -3.903) 5.466 9.437 ( 0.913 3.715 -3.903) 5.466 9.595 ( 5.908 -3.376 0.242) 6.808 9.595 ( 5.908 3.376 0.242) 6.808 9.762 ( 3.732 -1.032 1.815) 4.277 9.762 ( 3.732 1.032 1.815) 4.277 10.498 ( 1.687 -6.177 3.276) 7.192 10.498 ( 1.687 6.177 3.276) 7.192 10.711 ( 3.273 -8.848 -2.986) 9.896 10.711 ( 3.273 8.848 -2.986) 9.896 20.558 ( -0.712 -0.964 0.340) 1.246 20.558 ( -0.712 0.964 0.340) 1.246 20.871 ( -1.622 -0.614 0.032) 1.735 20.871 ( -1.622 0.614 0.032) 1.735 22.799 ( 0.519 -2.814 1.095) 3.064 22.799 ( 0.519 2.814 1.095) 3.064 23.108 ( -0.296 -2.424 -1.224) 2.731 23.108 ( -0.296 2.424 -1.224) 2.731 24.581 ( -1.581 -0.690 0.372) 1.765 24.581 ( -1.581 0.690 0.372) 1.765 24.994 ( 1.321 -0.192 -1.022) 1.681 24.994 ( 1.321 0.192 -1.022) 1.681 25.716 ( -3.386 -1.502 -0.049) 3.705 25.716 ( -3.386 1.502 -0.049) 3.705 26.026 ( -4.189 -0.505 0.558) 4.256 26.026 ( -4.189 0.505 0.558) 4.256 28.371 ( 0.617 -0.760 0.997) 1.397 28.371 ( 0.617 0.760 0.997) 1.397 28.533 ( -0.578 -0.661 -0.030) 0.878 28.533 ( -0.578 0.661 -0.030) 0.878 28.649 ( -0.100 -1.571 -1.252) 2.012 28.649 ( -0.100 1.571 -1.252) 2.012 28.777 ( 1.408 -2.023 -0.396) 2.497 28.777 ( 1.408 2.023 -0.396) 2.497 32.376 ( -0.012 -0.828 -0.444) 0.940 32.376 ( -0.012 0.828 -0.444) 0.940 32.503 ( 0.667 -0.835 0.048) 1.070 32.503 ( 0.667 0.835 0.048) 1.070 35.420 ( 0.180 -0.999 -0.267) 1.049 35.420 ( 0.180 0.999 -0.267) 1.049 35.509 ( -0.835 -0.848 0.456) 1.275 35.509 ( -0.835 0.848 0.456) 1.275 88.812 ( 0.078 -0.132 2.477) 2.482 88.812 ( 0.078 0.132 2.477) 2.482 89.176 ( 4.212 -5.450 -1.913) 7.149 89.176 ( 4.212 5.450 -1.913) 7.149 97.673 ( 1.407 -0.681 0.615) 1.680 97.673 ( 1.407 0.681 0.615) 1.680 97.747 ( 1.777 -2.335 -0.276) 2.947 97.747 ( 1.777 2.335 -0.276) 2.947 98.722 ( 1.033 -0.924 -0.220) 1.403 98.722 ( 1.033 0.924 -0.220) 1.403 98.917 ( -4.379 -0.825 1.383) 4.665 98.917 ( -4.379 0.825 1.383) 4.665 99.662 ( -0.475 -1.709 1.628) 2.408 99.662 ( -0.475 1.709 1.628) 2.408 99.996 ( 1.852 -7.583 -2.437) 8.177 99.996 ( 1.852 7.583 -2.437) 8.177 ======================= Grid point 161 (88/92) ======================= q-point: ( 0.44 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.558 ( 3.244 -4.833 -3.858) 6.983 1.558 ( 3.244 4.833 -3.858) 6.983 1.787 ( 0.218 -3.739 -9.087) 9.829 1.787 ( 0.218 3.739 -9.087) 9.829 1.962 ( 0.357 -2.679 0.485) 2.745 1.962 ( 0.357 2.679 0.485) 2.745 2.065 ( 2.423 -3.515 -3.928) 5.802 2.065 ( 2.423 3.515 -3.928) 5.802 2.339 ( -0.377 -2.597 1.701) 3.128 2.339 ( -0.377 2.597 1.701) 3.128 2.450 ( -5.137 -6.675 -0.541) 8.440 2.450 ( -5.137 6.675 -0.541) 8.440 2.557 ( 1.490 -1.782 0.175) 2.330 2.557 ( 1.490 1.782 0.175) 2.330 2.722 ( -1.262 -1.897 -1.266) 2.606 2.722 ( -1.262 1.897 -1.266) 2.606 2.982 ( 0.881 -0.780 -0.607) 1.323 2.982 ( 0.881 0.780 -0.607) 1.323 3.162 ( -3.605 -2.076 1.592) 4.454 3.162 ( -3.605 2.076 1.592) 4.454 3.389 ( 2.379 -1.577 7.105) 7.657 3.389 ( 2.379 1.577 7.105) 7.657 3.626 ( 1.399 -1.361 2.022) 2.810 3.626 ( 1.399 1.361 2.022) 2.810 4.362 ( -0.195 -1.526 1.039) 1.856 4.362 ( -0.195 1.526 1.039) 1.856 4.534 ( -0.716 -0.394 0.784) 1.133 4.534 ( -0.716 0.394 0.784) 1.133 4.785 ( -2.074 -0.496 -2.140) 3.021 4.785 ( -2.074 0.496 -2.140) 3.021 5.035 ( -1.365 -1.871 -1.257) 2.635 5.035 ( -1.365 1.871 -1.257) 2.635 5.204 ( 3.612 -3.205 3.250) 5.821 5.204 ( 3.612 3.205 3.250) 5.821 5.310 ( -2.752 -1.807 1.577) 3.651 5.310 ( -2.752 1.807 1.577) 3.651 5.476 ( -1.489 -2.253 0.635) 2.774 5.476 ( -1.489 2.253 0.635) 2.774 5.673 ( -1.891 -1.966 -0.118) 2.731 5.673 ( -1.891 1.966 -0.118) 2.731 6.032 ( 5.272 -0.608 0.580) 5.339 6.032 ( 5.272 0.608 0.580) 5.339 6.122 ( -10.747 -4.861 0.842) 11.825 6.122 ( -10.747 4.861 0.842) 11.825 6.511 ( 4.371 -6.716 3.997) 8.955 6.511 ( 4.371 6.716 3.997) 8.955 6.590 ( -1.038 -2.229 1.549) 2.906 6.590 ( -1.038 2.229 1.549) 2.906 6.942 ( -3.691 -3.169 -1.956) 5.243 6.942 ( -3.691 3.169 -1.956) 5.243 7.126 ( -0.662 -3.247 -5.678) 6.575 7.126 ( -0.662 3.247 -5.678) 6.575 7.726 ( 4.025 -3.448 -2.216) 5.745 7.726 ( 4.025 3.448 -2.216) 5.745 7.927 ( -3.515 -3.444 0.407) 4.937 7.927 ( -3.515 3.444 0.407) 4.937 8.434 ( -3.404 -6.020 2.228) 7.266 8.434 ( -3.404 6.020 2.228) 7.266 8.672 ( 1.571 -1.926 0.006) 2.486 8.672 ( 1.571 1.926 0.006) 2.486 9.091 ( 2.300 -4.429 0.098) 4.992 9.091 ( 2.300 4.429 0.098) 4.992 9.391 ( -1.375 -2.929 -3.215) 4.561 9.391 ( -1.375 2.929 -3.215) 4.561 9.694 ( 2.858 -0.522 2.382) 3.757 9.694 ( 2.858 0.522 2.382) 3.757 9.799 ( 1.631 -2.158 -1.669) 3.179 9.799 ( 1.631 2.158 -1.669) 3.179 10.550 ( -0.196 -4.882 3.803) 6.192 10.550 ( -0.196 4.882 3.803) 6.192 10.720 ( 1.978 -8.091 -3.456) 9.018 10.720 ( 1.978 8.091 -3.456) 9.018 20.554 ( -0.169 -0.575 0.216) 0.637 20.554 ( -0.169 0.575 0.216) 0.637 20.851 ( -0.683 -0.574 -0.020) 0.892 20.851 ( -0.683 0.574 -0.020) 0.892 22.832 ( 1.160 -2.335 1.972) 3.269 22.832 ( 1.160 2.335 1.972) 3.269 23.076 ( -1.030 -2.127 -2.120) 3.175 23.076 ( -1.030 2.127 -2.120) 3.175 24.566 ( -0.664 -0.578 0.440) 0.985 24.566 ( -0.664 0.578 0.440) 0.985 24.998 ( 0.399 -0.246 -0.927) 1.039 24.998 ( 0.399 0.246 -0.927) 1.039 25.677 ( -1.213 -0.767 0.062) 1.436 25.677 ( -1.213 0.767 0.062) 1.436 25.979 ( -1.688 -0.267 0.321) 1.739 25.979 ( -1.688 0.267 0.321) 1.739 28.390 ( -0.175 -0.898 1.476) 1.737 28.390 ( -0.175 0.898 1.476) 1.737 28.529 ( 0.518 -0.124 -0.571) 0.781 28.529 ( 0.518 0.124 -0.571) 0.781 28.632 ( -0.408 -1.225 -0.862) 1.552 28.632 ( -0.408 1.225 -0.862) 1.552 28.789 ( 0.604 -1.395 -0.454) 1.586 28.789 ( 0.604 1.395 -0.454) 1.586 32.373 ( -0.059 -0.297 -0.182) 0.353 32.373 ( -0.059 0.297 -0.182) 0.353 32.511 ( 0.346 -0.239 -0.107) 0.434 32.511 ( 0.346 0.239 -0.107) 0.434 35.422 ( 0.019 -0.594 0.022) 0.595 35.422 ( 0.019 0.594 0.022) 0.595 35.501 ( -0.315 -0.645 0.094) 0.724 35.501 ( -0.315 0.645 0.094) 0.724 88.838 ( -0.164 -0.463 2.263) 2.316 88.838 ( -0.164 0.463 2.263) 2.316 89.201 ( 1.347 -3.532 -1.912) 4.236 89.201 ( 1.347 3.532 -1.912) 4.236 97.701 ( 0.814 -0.894 0.839) 1.471 97.701 ( 0.814 0.894 0.839) 1.471 97.760 ( 0.388 -2.012 -0.599) 2.135 97.760 ( 0.388 2.012 -0.599) 2.135 98.741 ( 1.112 -0.705 0.055) 1.318 98.741 ( 1.112 0.705 0.055) 1.318 98.865 ( -2.523 -0.451 0.597) 2.631 98.865 ( -2.523 0.451 0.597) 2.631 99.688 ( 0.527 -2.050 2.584) 3.341 99.688 ( 0.527 2.050 2.584) 3.341 99.984 ( 0.381 -5.939 -2.902) 6.621 99.984 ( 0.381 5.939 -2.902) 6.621 ======================= Grid point 163 (89/92) ======================= q-point: (-0.44 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.530 ( -7.559 -4.500 0.696) 8.824 1.530 ( -7.559 4.500 0.696) 8.824 1.689 ( 1.952 -4.468 -4.682) 6.760 1.689 ( 1.952 4.468 -4.682) 6.760 1.987 ( -0.285 -2.871 0.561) 2.940 1.987 ( -0.285 2.871 0.561) 2.940 2.054 ( 2.683 -2.066 -4.254) 5.437 2.054 ( 2.683 2.066 -4.254) 5.437 2.351 ( -3.171 -3.783 1.109) 5.059 2.351 ( -3.171 3.783 1.109) 5.059 2.418 ( 3.469 -1.097 2.070) 4.186 2.418 ( 3.469 1.097 2.070) 4.186 2.571 ( -0.303 -0.350 -0.786) 0.912 2.571 ( -0.303 0.350 -0.786) 0.912 2.708 ( 0.972 -2.491 -0.069) 2.674 2.708 ( 0.972 2.491 -0.069) 2.674 2.971 ( -2.547 -2.529 0.557) 3.632 2.971 ( -2.547 2.529 0.557) 3.632 3.158 ( 1.203 -1.599 1.603) 2.564 3.158 ( 1.203 1.599 1.603) 2.564 3.433 ( -3.511 -1.864 3.135) 5.063 3.433 ( -3.511 1.864 3.135) 5.063 3.669 ( 3.178 -1.755 -1.466) 3.915 3.669 ( 3.178 1.755 -1.466) 3.915 4.375 ( 0.432 -1.826 0.300) 1.900 4.375 ( 0.432 1.826 0.300) 1.900 4.526 ( -1.233 -2.334 1.173) 2.888 4.526 ( -1.233 2.334 1.173) 2.888 4.749 ( -0.781 -2.552 0.832) 2.796 4.749 ( -0.781 2.552 0.832) 2.796 5.057 ( 6.177 -0.859 -2.887) 6.872 5.057 ( 6.177 0.859 -2.887) 6.872 5.257 ( -3.300 -2.492 -0.901) 4.232 5.257 ( -3.300 2.492 -0.901) 4.232 5.309 ( 4.260 -2.315 1.490) 5.072 5.309 ( 4.260 2.315 1.490) 5.072 5.480 ( 1.303 -0.396 0.509) 1.454 5.480 ( 1.303 0.396 0.509) 1.454 5.672 ( 1.292 -0.607 -0.379) 1.477 5.672 ( 1.292 0.607 -0.379) 1.477 5.994 ( -6.401 -3.895 2.858) 8.019 5.994 ( -6.401 3.895 2.858) 8.019 6.158 ( 10.392 -4.557 -0.736) 11.371 6.158 ( 10.392 4.557 -0.736) 11.371 6.535 ( -2.574 -1.748 0.830) 3.220 6.535 ( -2.574 1.748 0.830) 3.220 6.620 ( -0.086 -3.856 0.670) 3.915 6.620 ( -0.086 3.856 0.670) 3.915 6.907 ( 2.213 -1.935 0.147) 2.943 6.907 ( 2.213 1.935 0.147) 2.943 7.083 ( 0.889 -2.425 -2.277) 3.443 7.083 ( 0.889 2.425 -2.277) 3.443 7.710 ( -4.102 -1.880 -0.778) 4.579 7.710 ( -4.102 1.880 -0.778) 4.579 7.939 ( 4.875 -4.045 -0.602) 6.364 7.939 ( 4.875 4.045 -0.602) 6.364 8.433 ( 0.218 -4.581 2.594) 5.269 8.433 ( 0.218 4.581 2.594) 5.269 8.675 ( -0.329 -0.681 -1.127) 1.357 8.675 ( -0.329 0.681 -1.127) 1.357 9.114 ( 0.045 -2.565 -0.348) 2.589 9.114 ( 0.045 2.565 -0.348) 2.589 9.335 ( -3.287 -2.277 0.577) 4.040 9.335 ( -3.287 2.277 0.577) 4.040 9.689 ( -5.287 -3.315 1.547) 6.429 9.689 ( -5.287 3.315 1.547) 6.429 9.828 ( 4.103 -0.815 -2.914) 5.098 9.828 ( 4.103 0.815 -2.914) 5.098 10.564 ( -2.499 -4.853 3.084) 6.269 10.564 ( -2.499 4.853 3.084) 6.269 10.707 ( 0.623 -5.795 -2.881) 6.502 10.707 ( 0.623 5.795 -2.881) 6.502 20.557 ( 0.399 -0.240 -0.020) 0.466 20.557 ( 0.399 0.240 -0.020) 0.466 20.851 ( 0.664 -0.427 0.009) 0.790 20.851 ( 0.664 0.427 0.009) 0.790 22.857 ( -0.253 -0.316 0.236) 0.468 22.857 ( -0.253 0.316 0.236) 0.468 23.051 ( 0.321 -0.447 -0.386) 0.672 23.051 ( 0.321 0.447 -0.386) 0.672 24.568 ( 0.400 -0.309 0.297) 0.586 24.568 ( 0.400 0.309 0.297) 0.586 24.989 ( -0.687 -0.222 -0.218) 0.754 24.989 ( -0.687 0.222 -0.218) 0.754 25.678 ( 1.307 -0.607 -0.036) 1.441 25.678 ( 1.307 0.607 -0.036) 1.441 25.982 ( 1.782 -0.194 0.093) 1.795 25.982 ( 1.782 0.194 0.093) 1.795 28.390 ( -1.671 -0.545 1.447) 2.277 28.390 ( -1.671 0.545 1.447) 2.277 28.537 ( 1.508 -0.574 -1.246) 2.039 28.537 ( 1.508 0.574 -1.246) 2.039 28.621 ( -0.438 -1.009 0.110) 1.105 28.621 ( -0.438 1.009 0.110) 1.105 28.789 ( -0.040 -0.360 -0.442) 0.572 28.789 ( -0.040 0.360 -0.442) 0.572 32.369 ( -0.304 -0.330 0.082) 0.456 32.369 ( -0.304 0.330 0.082) 0.456 32.512 ( 0.040 -0.438 -0.212) 0.488 32.512 ( 0.040 0.438 -0.212) 0.488 35.418 ( -0.627 -0.362 0.289) 0.780 35.418 ( -0.627 0.362 0.289) 0.780 35.504 ( 0.787 -0.407 -0.171) 0.902 35.504 ( 0.787 0.407 -0.171) 0.902 88.850 ( -0.916 -0.772 1.488) 1.910 88.850 ( -0.916 0.772 1.488) 1.910 89.185 ( -1.301 -0.877 -0.833) 1.776 89.185 ( -1.301 0.877 -0.833) 1.776 97.710 ( -0.665 -0.411 0.266) 0.826 97.710 ( -0.665 0.411 0.266) 0.826 97.752 ( -0.607 -0.551 -0.132) 0.830 97.752 ( -0.607 0.551 -0.132) 0.830 98.741 ( -1.289 -0.064 0.073) 1.293 98.741 ( -1.289 0.064 0.073) 1.293 98.870 ( 2.760 -0.578 0.187) 2.827 98.870 ( 2.760 0.578 0.187) 2.827 99.717 ( 0.305 -0.390 0.739) 0.890 99.717 ( 0.305 0.390 0.739) 0.890 99.958 ( -0.523 -1.881 -1.237) 2.312 99.958 ( -0.523 1.881 -1.237) 2.312 ======================= Grid point 165 (90/92) ======================= q-point: (-0.33 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.405 ( -7.502 -7.115 3.586) 10.944 1.405 ( -7.502 7.115 3.586) 10.944 1.691 ( -3.833 -6.169 4.545) 8.568 1.691 ( -3.833 6.169 4.545) 8.568 1.971 ( -0.500 -4.623 -2.115) 5.108 1.971 ( -0.500 4.623 -2.115) 5.108 2.058 ( 1.999 -2.586 -2.267) 3.977 2.058 ( 1.999 2.586 -2.267) 3.977 2.355 ( 1.487 -3.239 2.675) 4.457 2.355 ( 1.487 3.239 2.675) 4.457 2.489 ( 1.277 -4.640 0.374) 4.827 2.489 ( 1.277 4.640 0.374) 4.827 2.570 ( 2.659 -1.546 0.497) 3.116 2.570 ( 2.659 1.546 0.497) 3.116 2.717 ( -2.260 -6.499 1.044) 6.960 2.717 ( -2.260 6.499 1.044) 6.960 2.928 ( -2.121 -4.481 0.884) 5.036 2.928 ( -2.121 4.481 0.884) 5.036 3.224 ( 4.101 -3.962 1.780) 5.974 3.224 ( 4.101 3.962 1.780) 5.974 3.363 ( -4.582 -2.390 -2.635) 5.801 3.363 ( -4.582 2.390 -2.635) 5.801 3.681 ( 1.194 -1.998 -3.804) 4.460 3.681 ( 1.194 1.998 -3.804) 4.460 4.366 ( -1.384 -2.739 -0.212) 3.076 4.366 ( -1.384 2.739 -0.212) 3.076 4.534 ( 1.361 -3.572 0.303) 3.834 4.534 ( 1.361 3.572 0.303) 3.834 4.801 ( 4.326 -4.316 3.138) 6.869 4.801 ( 4.326 4.316 3.138) 6.869 5.104 ( 0.932 -3.163 -3.129) 4.546 5.104 ( 0.932 3.163 -3.129) 4.546 5.228 ( 3.914 -0.680 -0.952) 4.085 5.228 ( 3.914 0.680 -0.952) 4.085 5.367 ( 2.577 -0.600 -2.203) 3.443 5.367 ( 2.577 0.600 -2.203) 3.443 5.509 ( 1.884 -3.085 -0.317) 3.629 5.509 ( 1.884 3.085 -0.317) 3.629 5.742 ( 6.768 -1.221 2.100) 7.191 5.742 ( 6.768 1.221 2.100) 7.191 5.935 ( -4.150 -1.900 1.150) 4.707 5.935 ( -4.150 1.900 1.150) 4.707 6.341 ( 9.796 -7.233 -2.932) 12.525 6.341 ( 9.796 7.233 -2.932) 12.525 6.462 ( -3.613 -4.174 -1.440) 5.705 6.462 ( -3.613 4.174 -1.440) 5.705 6.619 ( 1.602 -4.303 -0.181) 4.595 6.619 ( 1.602 4.303 -0.181) 4.595 6.998 ( 5.063 -6.213 2.817) 8.496 6.998 ( 5.063 6.213 2.817) 8.496 7.118 ( 4.112 -2.468 1.634) 5.067 7.118 ( 4.112 2.468 1.634) 5.067 7.623 ( -4.714 -3.597 0.170) 5.932 7.623 ( -4.714 3.597 0.170) 5.932 8.024 ( 5.554 -5.698 -1.049) 8.025 8.024 ( 5.554 5.698 -1.049) 8.025 8.497 ( 2.981 -3.867 4.216) 6.451 8.497 ( 2.981 3.867 4.216) 6.451 8.642 ( -1.277 -0.702 -2.570) 2.954 8.642 ( -1.277 0.702 -2.570) 2.954 9.078 ( -1.673 -2.753 -3.212) 4.549 9.078 ( -1.673 2.753 -3.212) 4.549 9.299 ( -5.880 -3.582 6.656) 9.576 9.299 ( -5.880 3.582 6.656) 9.576 9.596 ( -6.086 -2.606 -0.231) 6.625 9.596 ( -6.086 2.606 -0.231) 6.625 9.833 ( 0.069 -0.881 -3.319) 3.435 9.833 ( 0.069 0.881 -3.319) 3.435 10.537 ( -3.345 -8.670 0.975) 9.344 10.537 ( -3.345 8.670 0.975) 9.344 10.680 ( -1.106 -6.409 -1.347) 6.642 10.680 ( -1.106 6.409 -1.347) 6.642 20.567 ( 1.059 -0.998 -0.357) 1.498 20.567 ( 1.059 0.998 -0.357) 1.498 20.871 ( 1.689 -0.255 0.014) 1.708 20.871 ( 1.689 0.255 0.014) 1.708 22.832 ( -1.240 -1.952 -1.556) 2.787 22.832 ( -1.240 1.952 -1.556) 2.787 23.076 ( 1.264 -1.623 1.380) 2.477 23.076 ( 1.264 1.623 1.380) 2.477 24.584 ( 1.207 -0.072 0.126) 1.216 24.584 ( 1.207 0.072 0.126) 1.216 24.973 ( -1.456 -0.228 0.646) 1.609 24.973 ( -1.456 0.228 0.646) 1.609 25.717 ( 3.398 -1.492 -0.137) 3.714 25.717 ( 3.398 1.492 -0.137) 3.714 26.035 ( 4.416 -0.578 -0.211) 4.458 26.035 ( 4.416 0.578 -0.211) 4.458 28.369 ( -2.349 -0.420 1.165) 2.655 28.369 ( -2.349 0.420 1.165) 2.655 28.550 ( 1.849 -0.867 -1.587) 2.586 28.550 ( 1.849 0.867 -1.587) 2.586 28.620 ( -0.546 -1.212 1.197) 1.789 28.620 ( -0.546 1.212 1.197) 1.789 28.778 ( -0.699 -0.734 -0.461) 1.114 28.778 ( -0.699 0.734 -0.461) 1.114 32.365 ( -0.573 -0.686 0.473) 1.011 32.365 ( -0.573 0.686 0.473) 1.011 32.508 ( -0.135 -1.015 -0.379) 1.091 32.508 ( -0.135 1.015 -0.379) 1.091 35.411 ( -0.671 -0.999 0.500) 1.303 35.411 ( -0.671 0.999 0.500) 1.303 35.520 ( 1.293 -0.482 -0.407) 1.439 35.520 ( 1.293 0.482 -0.407) 1.439 88.840 ( -1.362 -1.004 0.491) 1.762 88.840 ( -1.362 1.004 0.491) 1.762 89.142 ( -3.747 -2.192 0.537) 4.374 89.142 ( -3.747 2.192 0.537) 4.374 97.687 ( -1.692 -0.529 -0.445) 1.828 97.687 ( -1.692 0.529 -0.445) 1.828 97.738 ( -1.495 -1.548 0.425) 2.194 97.738 ( -1.495 1.548 0.425) 2.194 98.717 ( -1.368 -0.341 0.147) 1.418 98.717 ( -1.368 0.341 0.147) 1.418 98.941 ( 5.316 -1.468 -0.512) 5.539 98.941 ( 5.316 1.468 -0.512) 5.539 99.709 ( -0.192 -2.065 -1.985) 2.870 99.709 ( -0.192 2.065 -1.985) 2.870 99.946 ( -1.186 -3.152 1.399) 3.647 99.946 ( -1.186 3.152 1.399) 3.647 ======================= Grid point 167 (91/92) ======================= q-point: (-0.22 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( -3.242 -5.748 9.801) 11.816 1.387 ( -3.242 5.748 9.801) 11.816 1.663 ( -5.643 -8.283 6.197) 11.784 1.663 ( -5.643 8.283 6.197) 11.784 1.921 ( -0.065 -3.285 -4.993) 5.977 1.921 ( -0.065 3.285 -4.993) 5.977 2.060 ( -0.674 -5.889 -1.720) 6.172 2.060 ( -0.674 5.889 -1.720) 6.172 2.414 ( -1.028 -3.684 3.548) 5.217 2.414 ( -1.028 3.684 3.548) 5.217 2.497 ( 1.372 -2.804 -0.052) 3.122 2.497 ( 1.372 2.804 -0.052) 3.122 2.643 ( 2.622 -2.161 -0.060) 3.399 2.643 ( 2.622 2.161 -0.060) 3.399 2.662 ( -3.994 -5.948 5.808) 9.223 2.662 ( -3.994 5.948 5.808) 9.223 2.952 ( 2.507 -3.599 2.096) 4.861 2.952 ( 2.507 3.599 2.096) 4.861 3.232 ( -3.787 -1.929 -7.061) 8.241 3.232 ( -3.787 1.929 -7.061) 8.241 3.321 ( 5.117 -4.481 -0.396) 6.813 3.321 ( 5.117 4.481 -0.396) 6.813 3.625 ( -1.873 -1.471 -5.462) 5.959 3.625 ( -1.873 1.471 -5.462) 5.959 4.345 ( -1.045 -3.901 0.889) 4.135 4.345 ( -1.045 3.901 0.889) 4.135 4.565 ( 2.492 -3.824 -1.232) 4.727 4.565 ( 2.492 3.824 -1.232) 4.727 4.914 ( 3.699 -5.660 2.850) 7.338 4.914 ( 3.699 5.660 2.850) 7.338 5.105 ( 5.105 -3.313 -1.713) 6.322 5.105 ( 5.105 3.313 -1.713) 6.322 5.295 ( 2.617 -2.040 -1.751) 3.752 5.295 ( 2.617 2.040 -1.751) 3.752 5.379 ( 3.293 -3.162 -0.959) 4.665 5.379 ( 3.293 3.162 -0.959) 4.665 5.549 ( 1.958 -3.915 1.943) 4.789 5.549 ( 1.958 3.915 1.943) 4.789 5.841 ( -4.229 -1.186 1.178) 4.547 5.841 ( -4.229 1.186 1.178) 4.547 5.937 ( 8.556 -3.571 1.409) 9.378 5.937 ( 8.556 3.571 1.409) 9.378 6.277 ( -4.509 -2.584 -5.211) 7.359 6.277 ( -4.509 2.584 -5.211) 7.359 6.481 ( 0.241 -1.178 -0.176) 1.215 6.481 ( 0.241 1.178 -0.176) 1.215 6.696 ( 9.207 -7.172 -3.205) 12.103 6.696 ( 9.207 7.172 -3.205) 12.103 7.081 ( 2.493 -5.750 -1.187) 6.378 7.081 ( 2.493 5.750 -1.187) 6.378 7.259 ( 7.916 -7.018 3.327) 11.090 7.259 ( 7.916 7.018 3.327) 11.090 7.596 ( 0.176 -4.353 4.890) 6.549 7.596 ( 0.176 4.353 4.890) 6.549 8.098 ( 5.129 -6.415 -0.992) 8.273 8.098 ( 5.129 6.415 -0.992) 8.273 8.538 ( -5.865 -2.914 0.847) 6.603 8.538 ( -5.865 2.914 0.847) 6.603 8.642 ( 6.796 -3.265 0.194) 7.542 8.642 ( 6.796 3.265 0.194) 7.542 9.011 ( -1.737 -4.157 -3.502) 5.706 9.011 ( -1.737 4.157 -3.502) 5.706 9.272 ( -8.200 -5.280 9.899) 13.897 9.272 ( -8.200 5.280 9.899) 13.897 9.489 ( -6.313 -0.128 -0.790) 6.364 9.489 ( -6.313 0.128 -0.790) 6.364 9.765 ( -2.327 -2.746 -4.804) 6.002 9.765 ( -2.327 2.746 -4.804) 6.002 10.475 ( -3.715 -7.601 -1.429) 8.580 10.475 ( -3.715 7.601 -1.429) 8.580 10.650 ( -1.530 -5.514 0.202) 5.725 10.650 ( -1.530 5.514 0.202) 5.725 20.582 ( 1.462 -1.705 -0.784) 2.379 20.582 ( 1.462 1.705 -0.784) 2.379 20.902 ( 1.880 -0.153 -0.087) 1.889 20.902 ( 1.880 0.153 -0.087) 1.889 22.803 ( -0.309 -2.431 -0.912) 2.615 22.803 ( -0.309 2.431 -0.912) 2.615 23.103 ( 0.314 -1.827 0.673) 1.972 23.103 ( 0.314 1.827 0.673) 1.972 24.609 ( 1.479 -0.268 0.138) 1.510 24.609 ( 1.479 0.268 0.138) 1.510 24.957 ( -1.632 -0.194 1.147) 2.004 24.957 ( -1.632 0.194 1.147) 2.004 25.781 ( 4.209 -1.513 -0.129) 4.474 25.781 ( 4.209 1.513 -0.129) 4.474 26.111 ( 4.876 -1.500 -0.668) 5.145 26.111 ( 4.876 1.500 -0.668) 5.145 28.346 ( -1.740 -0.459 1.283) 2.210 28.346 ( -1.740 0.459 1.283) 2.210 28.566 ( 1.977 -0.965 -1.277) 2.544 28.566 ( 1.977 0.965 -1.277) 2.544 28.624 ( -1.031 -0.896 1.776) 2.240 28.624 ( -1.031 0.896 1.776) 2.240 28.755 ( -1.317 -0.859 -0.720) 1.729 28.755 ( -1.317 0.859 -0.720) 1.729 32.363 ( -0.584 -0.896 1.060) 1.506 32.363 ( -0.584 0.896 1.060) 1.506 32.500 ( -0.177 -1.454 -0.691) 1.620 32.500 ( -0.177 1.454 -0.691) 1.620 35.409 ( -0.248 -1.338 0.726) 1.543 35.409 ( -0.248 1.338 0.726) 1.543 35.534 ( 1.084 -0.795 -0.800) 1.564 35.534 ( 1.084 0.795 -0.800) 1.564 88.822 ( -0.919 -1.283 0.048) 1.579 88.822 ( -0.919 1.283 0.048) 1.579 89.072 ( -5.654 -3.689 0.954) 6.818 89.072 ( -5.654 3.689 0.954) 6.818 97.654 ( -1.453 -0.451 -0.406) 1.574 97.654 ( -1.453 0.451 -0.406) 1.574 97.709 ( -2.281 -1.657 0.182) 2.825 97.709 ( -2.281 1.657 0.182) 2.825 98.704 ( -0.605 -0.569 0.477) 0.957 98.704 ( -0.605 0.569 0.477) 0.957 99.018 ( 5.110 -2.449 -2.127) 6.052 99.018 ( 5.110 2.449 -2.127) 6.052 99.690 ( 0.733 -1.661 -1.380) 2.281 99.690 ( 0.733 1.661 -1.380) 2.281 99.936 ( -2.276 -5.486 1.743) 6.190 99.936 ( -2.276 5.486 1.743) 6.190 ======================= Grid point 169 (92/92) ======================= q-point: (-0.11 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.482 ( 0.689 -1.425 10.382) 10.502 1.482 ( 0.689 1.425 10.382) 10.502 1.642 ( -5.187 -8.421 6.111) 11.626 1.642 ( -5.187 8.421 6.111) 11.626 1.885 ( 2.174 -3.370 -5.084) 6.475 1.885 ( 2.174 3.370 -5.084) 6.475 2.006 ( -1.812 -8.323 -2.068) 8.766 2.006 ( -1.812 8.323 -2.068) 8.766 2.340 ( -7.739 -11.803 2.438) 14.323 2.340 ( -7.739 11.803 2.438) 14.323 2.560 ( 2.364 -1.982 1.312) 3.353 2.560 ( 2.364 1.982 1.312) 3.353 2.668 ( 0.897 -6.163 2.972) 6.900 2.668 ( 0.897 6.163 2.972) 6.900 2.741 ( 1.887 -1.635 7.248) 7.666 2.741 ( 1.887 1.635 7.248) 7.666 3.025 ( 2.849 -3.974 0.908) 4.973 3.025 ( 2.849 3.974 0.908) 4.973 3.085 ( -1.611 -1.191 -9.383) 9.594 3.085 ( -1.611 1.191 -9.383) 9.594 3.375 ( 2.392 -3.759 -3.307) 5.549 3.375 ( 2.392 3.759 -3.307) 5.549 3.520 ( -2.806 -0.953 -5.032) 5.839 3.520 ( -2.806 0.953 -5.032) 5.839 4.357 ( 0.257 -4.354 2.517) 5.036 4.357 ( 0.257 4.354 2.517) 5.036 4.575 ( 1.054 -4.190 -3.086) 5.309 4.575 ( 1.054 4.190 -3.086) 5.309 4.993 ( 3.583 -3.857 2.642) 5.890 4.993 ( 3.583 3.857 2.642) 5.890 5.185 ( 4.329 -4.814 -3.435) 7.329 5.185 ( 4.329 4.814 -3.435) 7.329 5.335 ( 4.562 -1.908 1.154) 5.078 5.335 ( 4.562 1.908 1.154) 5.078 5.420 ( 0.683 -3.622 1.775) 4.091 5.420 ( 0.683 3.622 1.775) 4.091 5.592 ( -3.128 -2.386 3.895) 5.536 5.592 ( -3.128 2.386 3.895) 5.536 5.766 ( -0.168 -2.432 -3.501) 4.266 5.766 ( -0.168 2.432 -3.501) 4.266 6.075 ( 2.966 -2.552 1.811) 4.311 6.075 ( 2.966 2.552 1.811) 4.311 6.193 ( 0.154 -2.813 -1.753) 3.318 6.193 ( 0.154 2.813 -1.753) 3.318 6.466 ( -1.660 -2.698 2.632) 4.118 6.466 ( -1.660 2.698 2.632) 4.118 6.802 ( 7.497 -10.661 -5.985) 14.342 6.802 ( 7.497 10.661 -5.985) 14.342 7.058 ( -0.700 -3.413 -2.992) 4.593 7.058 ( -0.700 3.413 -2.992) 4.593 7.334 ( 0.104 -5.930 -2.155) 6.311 7.334 ( 0.104 5.930 -2.155) 6.311 7.778 ( 10.013 -6.418 8.784) 14.786 7.778 ( 10.013 6.418 8.784) 14.786 8.194 ( 7.157 -6.106 -0.578) 9.425 8.194 ( 7.157 6.106 -0.578) 9.425 8.414 ( -7.093 -5.566 0.290) 9.021 8.414 ( -7.093 5.566 0.290) 9.021 8.775 ( 5.653 -3.516 3.347) 7.451 8.775 ( 5.653 3.516 3.347) 7.451 8.928 ( -5.211 -4.143 -3.316) 7.437 8.928 ( -5.211 4.143 -3.316) 7.437 9.225 ( -7.839 -3.940 5.160) 10.178 9.225 ( -7.839 3.940 5.160) 10.178 9.382 ( -5.366 -3.464 1.444) 6.548 9.382 ( -5.366 3.464 1.444) 6.548 9.685 ( -0.173 -4.414 -5.418) 6.990 9.685 ( -0.173 4.414 -5.418) 6.990 10.399 ( -2.738 -3.233 -1.692) 4.562 10.399 ( -2.738 3.233 -1.692) 4.562 10.637 ( -0.523 -2.387 0.325) 2.466 10.637 ( -0.523 2.387 0.325) 2.466 20.594 ( 1.029 -1.811 -1.057) 2.335 20.594 ( 1.029 1.811 -1.057) 2.335 20.927 ( 1.191 -0.433 -0.179) 1.280 20.927 ( 1.191 0.433 -0.179) 1.280 22.804 ( 0.675 -1.984 0.159) 2.102 22.804 ( 0.675 1.984 0.159) 2.102 23.100 ( -0.612 -1.402 -0.438) 1.592 23.100 ( -0.612 1.402 -0.438) 1.592 24.632 ( 1.002 -0.311 0.224) 1.072 24.632 ( 1.002 0.311 0.224) 1.072 24.946 ( -1.076 -0.268 1.164) 1.608 24.946 ( -1.076 0.268 1.164) 1.608 25.843 ( 2.995 -0.982 -0.115) 3.154 25.843 ( 2.995 0.982 -0.115) 3.154 26.170 ( 2.944 -1.886 -1.000) 3.636 26.170 ( 2.944 1.886 -1.000) 3.636 28.342 ( -0.597 -0.681 1.519) 1.769 28.342 ( -0.597 0.681 1.519) 1.769 28.590 ( 1.952 -1.015 -0.417) 2.239 28.590 ( 1.952 1.015 -0.417) 2.239 28.623 ( -1.279 -0.194 1.903) 2.301 28.623 ( -1.279 0.194 1.903) 2.301 28.720 ( -1.370 -0.703 -1.422) 2.096 28.720 ( -1.370 0.703 -1.422) 2.096 32.369 ( -0.303 -1.038 1.485) 1.837 32.369 ( -0.303 1.038 1.485) 1.837 32.489 ( -0.098 -1.549 -0.988) 1.840 32.489 ( -0.098 1.549 -0.988) 1.840 35.417 ( 0.037 -1.363 0.885) 1.625 35.417 ( 0.037 1.363 0.885) 1.625 35.537 ( 0.481 -1.006 -1.138) 1.594 35.537 ( 0.481 1.006 -1.138) 1.594 88.816 ( -0.237 -1.655 0.614) 1.781 88.816 ( -0.237 1.655 0.614) 1.781 88.985 ( -4.953 -2.973 0.214) 5.781 88.985 ( -4.953 2.973 0.214) 5.781 97.634 ( -0.612 -0.366 -0.243) 0.753 97.634 ( -0.612 0.366 -0.243) 0.753 97.673 ( -1.934 -0.980 -0.063) 2.169 97.673 ( -1.934 0.980 -0.063) 2.169 98.706 ( -0.060 -0.581 0.760) 0.958 98.706 ( -0.060 0.581 0.760) 0.958 99.053 ( 2.613 -2.524 -3.276) 4.892 99.053 ( 2.613 2.524 -3.276) 4.892 99.715 ( 2.707 -1.856 0.671) 3.350 99.715 ( 2.707 1.856 0.671) 3.350 99.904 ( -3.052 -5.452 0.694) 6.287 99.904 ( -3.052 5.452 0.694) 6.287 =================== End of collection of collisions =================== ----------- Thermal conductivity (W/m-k) with tetrahedron method ----------- # T(K) xx yy zz yz xz xy #ipm 0.0 0.000 0.000 0.000 0.000 0.000 0.000 3/32400 10.0 263.791 254.579 231.582 0.000 3.114 0.000 3/32400 20.0 53.938 41.564 46.136 0.000 -4.515 0.000 3/32400 30.0 24.181 17.897 20.938 0.000 -2.362 0.000 3/32400 40.0 13.985 10.197 12.312 0.000 -1.378 0.000 3/32400 50.0 9.232 6.680 8.217 0.000 -0.901 0.000 3/32400 60.0 6.655 4.794 5.965 0.000 -0.644 0.000 3/32400 70.0 5.110 3.671 4.600 0.000 -0.491 0.000 3/32400 80.0 4.110 2.948 3.711 0.000 -0.393 0.000 3/32400 90.0 3.424 2.453 3.098 0.000 -0.326 0.000 3/32400 100.0 2.930 2.097 2.655 0.000 -0.277 0.000 3/32400 110.0 2.559 1.832 2.321 0.000 -0.241 0.000 3/32400 120.0 2.273 1.626 2.063 0.000 -0.213 0.000 3/32400 130.0 2.045 1.463 1.857 0.000 -0.191 0.000 3/32400 140.0 1.859 1.330 1.690 0.000 -0.173 0.000 3/32400 150.0 1.706 1.220 1.551 0.000 -0.158 0.000 3/32400 160.0 1.576 1.128 1.433 0.000 -0.146 0.000 3/32400 170.0 1.466 1.049 1.333 0.000 -0.135 0.000 3/32400 180.0 1.370 0.980 1.246 0.000 -0.126 0.000 3/32400 190.0 1.287 0.921 1.170 0.000 -0.118 0.000 3/32400 200.0 1.213 0.868 1.103 0.000 -0.111 0.000 3/32400 210.0 1.148 0.821 1.044 0.000 -0.105 0.000 3/32400 220.0 1.089 0.780 0.991 0.000 -0.100 0.000 3/32400 230.0 1.037 0.742 0.943 0.000 -0.095 0.000 3/32400 240.0 0.989 0.708 0.899 0.000 -0.090 0.000 3/32400 250.0 0.946 0.677 0.860 0.000 -0.086 0.000 3/32400 260.0 0.906 0.648 0.824 0.000 -0.083 0.000 3/32400 270.0 0.869 0.622 0.790 0.000 -0.079 0.000 3/32400 280.0 0.836 0.598 0.760 0.000 -0.076 0.000 3/32400 290.0 0.805 0.576 0.732 0.000 -0.073 0.000 3/32400 300.0 0.776 0.556 0.705 0.000 -0.071 0.000 3/32400 310.0 0.750 0.537 0.681 0.000 -0.068 0.000 3/32400 320.0 0.725 0.519 0.658 0.000 -0.066 0.000 3/32400 330.0 0.701 0.502 0.637 0.000 -0.064 0.000 3/32400 340.0 0.680 0.487 0.617 0.000 -0.062 0.000 3/32400 350.0 0.659 0.472 0.599 0.000 -0.060 0.000 3/32400 360.0 0.640 0.458 0.581 0.000 -0.058 0.000 3/32400 370.0 0.622 0.445 0.565 0.000 -0.056 0.000 3/32400 380.0 0.605 0.433 0.549 0.000 -0.055 0.000 3/32400 390.0 0.588 0.421 0.534 0.000 -0.053 0.000 3/32400 400.0 0.573 0.410 0.520 0.000 -0.052 0.000 3/32400 410.0 0.559 0.400 0.507 0.000 -0.051 0.000 3/32400 420.0 0.545 0.390 0.495 0.000 -0.049 0.000 3/32400 430.0 0.532 0.381 0.483 0.000 -0.048 0.000 3/32400 440.0 0.519 0.372 0.471 0.000 -0.047 0.000 3/32400 450.0 0.507 0.363 0.460 0.000 -0.046 0.000 3/32400 460.0 0.496 0.355 0.450 0.000 -0.045 0.000 3/32400 470.0 0.485 0.347 0.440 0.000 -0.044 0.000 3/32400 480.0 0.474 0.340 0.431 0.000 -0.043 0.000 3/32400 490.0 0.464 0.333 0.421 0.000 -0.042 0.000 3/32400 500.0 0.455 0.326 0.413 0.000 -0.041 0.000 3/32400 510.0 0.446 0.319 0.404 0.000 -0.040 0.000 3/32400 520.0 0.437 0.313 0.396 0.000 -0.040 0.000 3/32400 530.0 0.429 0.307 0.389 0.000 -0.039 0.000 3/32400 540.0 0.420 0.301 0.381 0.000 -0.038 0.000 3/32400 550.0 0.413 0.296 0.374 0.000 -0.037 0.000 3/32400 560.0 0.405 0.290 0.367 0.000 -0.037 0.000 3/32400 570.0 0.398 0.285 0.361 0.000 -0.036 0.000 3/32400 580.0 0.391 0.280 0.354 0.000 -0.035 0.000 3/32400 590.0 0.384 0.275 0.348 0.000 -0.035 0.000 3/32400 600.0 0.377 0.270 0.342 0.000 -0.034 0.000 3/32400 610.0 0.371 0.266 0.337 0.000 -0.034 0.000 3/32400 620.0 0.365 0.262 0.331 0.000 -0.033 0.000 3/32400 630.0 0.359 0.257 0.326 0.000 -0.033 0.000 3/32400 640.0 0.353 0.253 0.321 0.000 -0.032 0.000 3/32400 650.0 0.348 0.249 0.316 0.000 -0.031 0.000 3/32400 660.0 0.343 0.245 0.311 0.000 -0.031 0.000 3/32400 670.0 0.337 0.242 0.306 0.000 -0.031 0.000 3/32400 680.0 0.332 0.238 0.301 0.000 -0.030 0.000 3/32400 690.0 0.327 0.235 0.297 0.000 -0.030 0.000 3/32400 700.0 0.323 0.231 0.293 0.000 -0.029 0.000 3/32400 710.0 0.318 0.228 0.288 0.000 -0.029 0.000 3/32400 720.0 0.314 0.225 0.284 0.000 -0.028 0.000 3/32400 730.0 0.309 0.222 0.280 0.000 -0.028 0.000 3/32400 740.0 0.305 0.219 0.277 0.000 -0.028 0.000 3/32400 750.0 0.301 0.216 0.273 0.000 -0.027 0.000 3/32400 760.0 0.297 0.213 0.269 0.000 -0.027 0.000 3/32400 770.0 0.293 0.210 0.266 0.000 -0.027 0.000 3/32400 780.0 0.289 0.207 0.262 0.000 -0.026 0.000 3/32400 790.0 0.286 0.205 0.259 0.000 -0.026 0.000 3/32400 800.0 0.282 0.202 0.256 0.000 -0.026 0.000 3/32400 810.0 0.278 0.200 0.252 0.000 -0.025 0.000 3/32400 820.0 0.275 0.197 0.249 0.000 -0.025 0.000 3/32400 830.0 0.272 0.195 0.246 0.000 -0.025 0.000 3/32400 840.0 0.268 0.192 0.243 0.000 -0.024 0.000 3/32400 850.0 0.265 0.190 0.240 0.000 -0.024 0.000 3/32400 860.0 0.262 0.188 0.238 0.000 -0.024 0.000 3/32400 870.0 0.259 0.186 0.235 0.000 -0.023 0.000 3/32400 880.0 0.256 0.184 0.232 0.000 -0.023 0.000 3/32400 890.0 0.253 0.181 0.230 0.000 -0.023 0.000 3/32400 900.0 0.250 0.179 0.227 0.000 -0.023 0.000 3/32400 910.0 0.248 0.177 0.224 0.000 -0.022 0.000 3/32400 920.0 0.245 0.175 0.222 0.000 -0.022 0.000 3/32400 930.0 0.242 0.174 0.220 0.000 -0.022 0.000 3/32400 940.0 0.240 0.172 0.217 0.000 -0.022 0.000 3/32400 950.0 0.237 0.170 0.215 0.000 -0.021 0.000 3/32400 960.0 0.235 0.168 0.213 0.000 -0.021 0.000 3/32400 970.0 0.232 0.166 0.210 0.000 -0.021 0.000 3/32400 980.0 0.230 0.165 0.208 0.000 -0.021 0.000 3/32400 990.0 0.228 0.163 0.206 0.000 -0.021 0.000 3/32400 1000.0 0.225 0.161 0.204 0.000 -0.020 0.000 3/32400 Thermal conductivity related properties were written into "kappa-m965.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 20:58:27]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|