----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 20:38:03]------------------------- 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 6.703355970028364 0.000000000000000 0.000000000000000 b 0.000000000000000 7.761523400000000 0.000000000000000 c -5.912613960294352 0.000000000000000 9.240410970300227 Atomic positions (fractional): *1 Ba 0.64130759155699 0.14774799784756 0.89473248300565 137.327 2 Ba 0.64130759155699 0.35225200215244 0.39473248300565 137.327 3 Ba 0.35869240844301 0.85225200215244 0.10526751699435 137.327 4 Ba 0.35869240844301 0.64774799784756 0.60526751699435 137.327 *5 Ba 0.03573928840541 0.05012192942349 0.31671169172184 137.327 6 Ba 0.03573928840541 0.44987807057651 0.81671169172184 137.327 7 Ba 0.96426071159460 0.94987807057651 0.68328830827816 137.327 8 Ba 0.96426071159460 0.55012192942349 0.18328830827816 137.327 *9 H 0.43279121045351 0.04845658476157 0.61917996541840 1.008 10 H 0.43279121045351 0.45154341523843 0.11917996541840 1.008 11 H 0.56720878954649 0.95154341523843 0.38082003458160 1.008 12 H 0.56720878954649 0.54845658476157 0.88082003458160 1.008 *13 H 0.80472024278835 0.85081659802316 0.01721596629460 1.008 14 H 0.80472024278835 0.64918340197684 0.51721596629460 1.008 15 H 0.19527975721165 0.14918340197684 0.98278403370540 1.008 16 H 0.19527975721165 0.35081659802316 0.48278403370540 1.008 *17 H 0.81654754854907 0.71809559138303 0.88241761481790 1.008 18 H 0.81654754854907 0.78190440861697 0.38241761481790 1.008 19 H 0.18345245145093 0.28190440861698 0.11758238518210 1.008 20 H 0.18345245145093 0.21809559138303 0.61758238518210 1.008 *21 H 0.47110645149343 0.73669396036486 0.41355157612012 1.008 22 H 0.47110645149343 0.76330603963514 0.91355157612012 1.008 23 H 0.52889354850657 0.26330603963514 0.58644842387988 1.008 24 H 0.52889354850657 0.23669396036485 0.08644842387988 1.008 *25 O 0.29534649095406 0.99942501614973 0.61907573204443 15.999 26 O 0.29534649095406 0.50057498385027 0.11907573204443 15.999 27 O 0.70465350904595 0.00057498385027 0.38092426795557 15.999 28 O 0.70465350904595 0.49942501614973 0.88092426795557 15.999 *29 O 0.73352472652017 0.86120067081074 0.07813263073822 15.999 30 O 0.73352472652017 0.63879932918926 0.57813263073822 15.999 31 O 0.26647527347983 0.13879932918926 0.92186736926178 15.999 32 O 0.26647527347983 0.36120067081074 0.42186736926178 15.999 *33 O 0.88561048576483 0.83557807327933 0.89573874204271 15.999 34 O 0.88561048576483 0.66442192672067 0.39573874204271 15.999 35 O 0.11438951423517 0.16442192672067 0.10426125795729 15.999 36 O 0.11438951423517 0.33557807327933 0.60426125795729 15.999 *37 O 0.32318888184286 0.79984993259063 0.34390734315137 15.999 38 O 0.32318888184286 0.70015006740937 0.84390734315137 15.999 39 O 0.67681111815714 0.20015006740937 0.65609265684863 15.999 40 O 0.67681111815714 0.29984993259063 0.15609265684863 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.703355970028364 0.000000000000000 0.000000000000000 b 0.000000000000000 7.761523400000000 0.000000000000000 c -5.912613960294352 0.000000000000000 9.240410970300227 Atomic positions (fractional): *1 Ba 0.64130759155699 0.14774799784756 0.89473248300565 137.327 > 1 2 Ba 0.64130759155699 0.35225200215244 0.39473248300565 137.327 > 2 3 Ba 0.35869240844301 0.85225200215244 0.10526751699435 137.327 > 3 4 Ba 0.35869240844301 0.64774799784756 0.60526751699435 137.327 > 4 *5 Ba 0.03573928840541 0.05012192942349 0.31671169172184 137.327 > 5 6 Ba 0.03573928840541 0.44987807057651 0.81671169172184 137.327 > 6 7 Ba 0.96426071159460 0.94987807057651 0.68328830827816 137.327 > 7 8 Ba 0.96426071159460 0.55012192942349 0.18328830827816 137.327 > 8 *9 H 0.43279121045351 0.04845658476157 0.61917996541840 1.008 > 9 10 H 0.43279121045351 0.45154341523843 0.11917996541840 1.008 > 10 11 H 0.56720878954649 0.95154341523843 0.38082003458160 1.008 > 11 12 H 0.56720878954649 0.54845658476157 0.88082003458160 1.008 > 12 *13 H 0.80472024278835 0.85081659802316 0.01721596629460 1.008 > 13 14 H 0.80472024278835 0.64918340197684 0.51721596629460 1.008 > 14 15 H 0.19527975721165 0.14918340197684 0.98278403370540 1.008 > 15 16 H 0.19527975721165 0.35081659802316 0.48278403370540 1.008 > 16 *17 H 0.81654754854907 0.71809559138303 0.88241761481790 1.008 > 17 18 H 0.81654754854907 0.78190440861697 0.38241761481790 1.008 > 18 19 H 0.18345245145093 0.28190440861698 0.11758238518210 1.008 > 19 20 H 0.18345245145093 0.21809559138303 0.61758238518210 1.008 > 20 *21 H 0.47110645149343 0.73669396036486 0.41355157612012 1.008 > 21 22 H 0.47110645149343 0.76330603963514 0.91355157612012 1.008 > 22 23 H 0.52889354850657 0.26330603963514 0.58644842387988 1.008 > 23 24 H 0.52889354850657 0.23669396036485 0.08644842387988 1.008 > 24 *25 O 0.29534649095406 0.99942501614973 0.61907573204443 15.999 > 25 26 O 0.29534649095406 0.50057498385027 0.11907573204443 15.999 > 26 27 O 0.70465350904595 0.00057498385027 0.38092426795557 15.999 > 27 28 O 0.70465350904595 0.49942501614973 0.88092426795557 15.999 > 28 *29 O 0.73352472652017 0.86120067081074 0.07813263073822 15.999 > 29 30 O 0.73352472652017 0.63879932918926 0.57813263073822 15.999 > 30 31 O 0.26647527347983 0.13879932918926 0.92186736926178 15.999 > 31 32 O 0.26647527347983 0.36120067081074 0.42186736926178 15.999 > 32 *33 O 0.88561048576483 0.83557807327933 0.89573874204271 15.999 > 33 34 O 0.88561048576483 0.66442192672067 0.39573874204271 15.999 > 34 35 O 0.11438951423517 0.16442192672067 0.10426125795729 15.999 > 35 36 O 0.11438951423517 0.33557807327933 0.60426125795729 15.999 > 36 *37 O 0.32318888184286 0.79984993259063 0.34390734315137 15.999 > 37 38 O 0.32318888184286 0.70015006740937 0.84390734315137 15.999 > 38 39 O 0.67681111815714 0.20015006740937 0.65609265684863 15.999 > 39 40 O 0.67681111815714 0.29984993259063 0.15609265684863 15.999 > 40 -------------------------------- super cell -------------------------------- Lattice vectors: a 13.406711940056727 0.000000000000000 0.000000000000000 b 0.000000000000000 7.761523400000000 0.000000000000000 c -5.912613960294352 0.000000000000000 9.240410970300227 Atomic positions (fractional): *1 Ba 0.32065379577849 0.14774799784756 0.89473248300565 137.327 > 1 2 Ba 0.82065379577849 0.14774799784756 0.89473248300565 137.327 > 1 3 Ba 0.32065379577849 0.35225200215244 0.39473248300565 137.327 > 2 4 Ba 0.82065379577849 0.35225200215244 0.39473248300565 137.327 > 2 5 Ba 0.17934620422151 0.85225200215244 0.10526751699435 137.327 > 3 6 Ba 0.67934620422151 0.85225200215244 0.10526751699435 137.327 > 3 7 Ba 0.17934620422151 0.64774799784756 0.60526751699435 137.327 > 4 8 Ba 0.67934620422151 0.64774799784756 0.60526751699435 137.327 > 4 *9 Ba 0.01786964420270 0.05012192942349 0.31671169172184 137.327 > 5 10 Ba 0.51786964420270 0.05012192942349 0.31671169172184 137.327 > 5 11 Ba 0.01786964420270 0.44987807057651 0.81671169172184 137.327 > 6 12 Ba 0.51786964420270 0.44987807057651 0.81671169172184 137.327 > 6 13 Ba 0.48213035579730 0.94987807057651 0.68328830827816 137.327 > 7 14 Ba 0.98213035579730 0.94987807057651 0.68328830827816 137.327 > 7 15 Ba 0.48213035579730 0.55012192942349 0.18328830827816 137.327 > 8 16 Ba 0.98213035579730 0.55012192942349 0.18328830827816 137.327 > 8 *17 H 0.21639560522676 0.04845658476157 0.61917996541840 1.008 > 9 18 H 0.71639560522676 0.04845658476157 0.61917996541840 1.008 > 9 19 H 0.21639560522676 0.45154341523843 0.11917996541840 1.008 > 10 20 H 0.71639560522676 0.45154341523843 0.11917996541840 1.008 > 10 21 H 0.28360439477324 0.95154341523843 0.38082003458160 1.008 > 11 22 H 0.78360439477324 0.95154341523843 0.38082003458160 1.008 > 11 23 H 0.28360439477324 0.54845658476157 0.88082003458160 1.008 > 12 24 H 0.78360439477324 0.54845658476157 0.88082003458160 1.008 > 12 *25 H 0.40236012139418 0.85081659802316 0.01721596629460 1.008 > 13 26 H 0.90236012139418 0.85081659802316 0.01721596629460 1.008 > 13 27 H 0.40236012139418 0.64918340197684 0.51721596629460 1.008 > 14 28 H 0.90236012139418 0.64918340197684 0.51721596629460 1.008 > 14 29 H 0.09763987860582 0.14918340197684 0.98278403370540 1.008 > 15 30 H 0.59763987860582 0.14918340197684 0.98278403370540 1.008 > 15 31 H 0.09763987860582 0.35081659802316 0.48278403370540 1.008 > 16 32 H 0.59763987860582 0.35081659802316 0.48278403370540 1.008 > 16 *33 H 0.40827377427454 0.71809559138303 0.88241761481790 1.008 > 17 34 H 0.90827377427454 0.71809559138303 0.88241761481790 1.008 > 17 35 H 0.40827377427454 0.78190440861697 0.38241761481790 1.008 > 18 36 H 0.90827377427454 0.78190440861697 0.38241761481790 1.008 > 18 37 H 0.09172622572546 0.28190440861698 0.11758238518210 1.008 > 19 38 H 0.59172622572546 0.28190440861698 0.11758238518210 1.008 > 19 39 H 0.09172622572546 0.21809559138303 0.61758238518210 1.008 > 20 40 H 0.59172622572546 0.21809559138303 0.61758238518210 1.008 > 20 *41 H 0.23555322574672 0.73669396036486 0.41355157612012 1.008 > 21 42 H 0.73555322574672 0.73669396036486 0.41355157612012 1.008 > 21 43 H 0.23555322574672 0.76330603963514 0.91355157612012 1.008 > 22 44 H 0.73555322574672 0.76330603963514 0.91355157612012 1.008 > 22 45 H 0.26444677425328 0.26330603963514 0.58644842387988 1.008 > 23 46 H 0.76444677425328 0.26330603963514 0.58644842387988 1.008 > 23 47 H 0.26444677425328 0.23669396036485 0.08644842387988 1.008 > 24 48 H 0.76444677425328 0.23669396036485 0.08644842387988 1.008 > 24 *49 O 0.14767324547703 0.99942501614973 0.61907573204443 15.999 > 25 50 O 0.64767324547703 0.99942501614973 0.61907573204443 15.999 > 25 51 O 0.14767324547703 0.50057498385027 0.11907573204443 15.999 > 26 52 O 0.64767324547703 0.50057498385027 0.11907573204443 15.999 > 26 53 O 0.35232675452297 0.00057498385027 0.38092426795557 15.999 > 27 54 O 0.85232675452297 0.00057498385027 0.38092426795557 15.999 > 27 55 O 0.35232675452297 0.49942501614973 0.88092426795557 15.999 > 28 56 O 0.85232675452297 0.49942501614973 0.88092426795557 15.999 > 28 *57 O 0.36676236326008 0.86120067081074 0.07813263073822 15.999 > 29 58 O 0.86676236326008 0.86120067081074 0.07813263073822 15.999 > 29 59 O 0.36676236326008 0.63879932918926 0.57813263073822 15.999 > 30 60 O 0.86676236326008 0.63879932918926 0.57813263073822 15.999 > 30 61 O 0.13323763673992 0.13879932918926 0.92186736926178 15.999 > 31 62 O 0.63323763673992 0.13879932918926 0.92186736926178 15.999 > 31 63 O 0.13323763673992 0.36120067081074 0.42186736926178 15.999 > 32 64 O 0.63323763673992 0.36120067081074 0.42186736926178 15.999 > 32 *65 O 0.44280524288241 0.83557807327933 0.89573874204271 15.999 > 33 66 O 0.94280524288241 0.83557807327933 0.89573874204271 15.999 > 33 67 O 0.44280524288241 0.66442192672067 0.39573874204271 15.999 > 34 68 O 0.94280524288241 0.66442192672067 0.39573874204271 15.999 > 34 69 O 0.05719475711759 0.16442192672067 0.10426125795729 15.999 > 35 70 O 0.55719475711759 0.16442192672067 0.10426125795729 15.999 > 35 71 O 0.05719475711759 0.33557807327933 0.60426125795729 15.999 > 36 72 O 0.55719475711759 0.33557807327933 0.60426125795729 15.999 > 36 *73 O 0.16159444092143 0.79984993259063 0.34390734315137 15.999 > 37 74 O 0.66159444092143 0.79984993259063 0.34390734315137 15.999 > 37 75 O 0.16159444092143 0.70015006740937 0.84390734315137 15.999 > 38 76 O 0.66159444092143 0.70015006740937 0.84390734315137 15.999 > 38 77 O 0.33840555907857 0.20015006740937 0.65609265684863 15.999 > 39 78 O 0.83840555907857 0.20015006740937 0.65609265684863 15.999 > 39 79 O 0.33840555907857 0.29984993259063 0.15609265684863 15.999 > 40 80 O 0.83840555907857 0.29984993259063 0.15609265684863 15.999 > 40 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.2917002 0.0000000 -0.0271968 0.0000000 3.3018653 0.0000000 -0.0271966 0.0000000 3.3508821 -------------------------- Born effective charges -------------------------- 1 Ba 2.6343522 0.0766453 -0.0262867 0.0650821 2.5470200 -0.0107434 -0.0554425 -0.0744543 2.6470096 2 Ba 2.6343522 -0.0766453 -0.0262867 -0.0650821 2.5470200 0.0107434 -0.0554425 0.0744543 2.6470096 3 Ba 2.6343522 0.0766453 -0.0262867 0.0650821 2.5470200 -0.0107434 -0.0554425 -0.0744543 2.6470096 4 Ba 2.6343522 -0.0766453 -0.0262867 -0.0650821 2.5470200 0.0107434 -0.0554425 0.0744543 2.6470096 5 Ba 2.6209666 -0.0288817 -0.0520847 0.0085016 2.6311634 0.0078200 -0.0377004 -0.0226216 2.6685757 6 Ba 2.6209666 0.0288817 -0.0520847 -0.0085016 2.6311634 -0.0078200 -0.0377004 0.0226216 2.6685757 7 Ba 2.6209666 -0.0288817 -0.0520847 0.0085016 2.6311634 0.0078200 -0.0377004 -0.0226216 2.6685757 8 Ba 2.6209666 0.0288817 -0.0520847 -0.0085016 2.6311634 -0.0078200 -0.0377004 0.0226216 2.6685757 9 H 0.7207072 0.3334085 0.1332856 0.3432167 0.5050128 0.0537902 0.1133082 0.0407695 0.3320484 10 H 0.7207072 -0.3334085 0.1332856 -0.3432167 0.5050128 -0.0537902 0.1133082 -0.0407695 0.3320484 11 H 0.7207072 0.3334085 0.1332856 0.3432167 0.5050128 0.0537902 0.1133082 0.0407695 0.3320484 12 H 0.7207072 -0.3334085 0.1332856 -0.3432167 0.5050128 -0.0537902 0.1133082 -0.0407695 0.3320484 13 H 0.9019830 -0.0581206 -0.5772550 -0.0839215 0.3120359 0.0545200 -0.5338382 0.0380313 0.6604379 14 H 0.9019830 0.0581206 -0.5772550 0.0839215 0.3120359 -0.0545200 -0.5338382 -0.0380313 0.6604379 15 H 0.9019830 -0.0581206 -0.5772550 -0.0839215 0.3120359 0.0545200 -0.5338382 0.0380313 0.6604379 16 H 0.9019830 0.0581206 -0.5772550 0.0839215 0.3120359 -0.0545200 -0.5338382 -0.0380313 0.6604379 17 H 0.3844232 0.2549780 -0.0140706 0.2618071 0.8526184 0.0601465 -0.0187425 0.0496472 0.2641510 18 H 0.3844232 -0.2549780 -0.0140706 -0.2618071 0.8526184 -0.0601465 -0.0187425 -0.0496472 0.2641510 19 H 0.3844232 0.2549780 -0.0140706 0.2618071 0.8526184 0.0601465 -0.0187425 0.0496472 0.2641510 20 H 0.3844232 -0.2549780 -0.0140706 -0.2618071 0.8526184 -0.0601465 -0.0187425 -0.0496472 0.2641510 21 H 0.4695268 -0.0839803 0.2594918 -0.0920834 0.3996495 -0.2959424 0.2441035 -0.2691165 0.7146039 22 H 0.4695268 0.0839803 0.2594918 0.0920834 0.3996495 0.2959424 0.2441035 0.2691165 0.7146039 23 H 0.4695268 -0.0839803 0.2594918 -0.0920834 0.3996495 -0.2959424 0.2441035 -0.2691165 0.7146039 24 H 0.4695268 0.0839803 0.2594918 0.0920834 0.3996495 0.2959424 0.2441035 0.2691165 0.7146039 25 O -1.7733824 -0.0588912 -0.0435490 -0.1132759 -1.9731871 -0.0700640 -0.0160525 -0.0448498 -1.7236869 26 O -1.7733824 0.0588912 -0.0435490 0.1132759 -1.9731871 0.0700640 -0.0160525 0.0448498 -1.7236869 27 O -1.7733824 -0.0588912 -0.0435490 -0.1132759 -1.9731871 -0.0700640 -0.0160525 -0.0448498 -1.7236869 28 O -1.7733824 0.0588912 -0.0435490 0.1132759 -1.9731871 0.0700640 -0.0160525 0.0448498 -1.7236869 29 O -2.0461398 0.0104467 0.1487136 0.0362087 -1.7967094 -0.1151413 0.1594335 -0.0459753 -2.0056185 30 O -2.0461398 -0.0104467 0.1487136 -0.0362087 -1.7967094 0.1151413 0.1594335 0.0459753 -2.0056185 31 O -2.0461398 0.0104467 0.1487136 0.0362087 -1.7967094 -0.1151413 0.1594335 -0.0459753 -2.0056185 32 O -2.0461398 -0.0104467 0.1487136 -0.0362087 -1.7967094 0.1151413 0.1594335 0.0459753 -2.0056185 33 O -1.9396364 -0.0636950 0.2370145 -0.0731444 -1.7303540 -0.0248024 0.2017093 0.0248788 -1.7280931 34 O -1.9396364 0.0636950 0.2370145 0.0731444 -1.7303540 0.0248024 0.2017093 -0.0248788 -1.7280931 35 O -1.9396364 -0.0636950 0.2370145 -0.0731444 -1.7303540 -0.0248024 0.2017093 0.0248788 -1.7280931 36 O -1.9396364 0.0636950 0.2370145 0.0731444 -1.7303540 0.0248024 0.2017093 -0.0248788 -1.7280931 37 O -1.9728005 -0.0943050 -0.0652596 -0.0459791 -1.7472493 0.1399955 -0.0567784 0.2037997 -1.8294280 38 O -1.9728005 0.0943050 -0.0652596 0.0459791 -1.7472493 -0.1399955 -0.0567784 -0.2037997 -1.8294280 39 O -1.9728005 -0.0943050 -0.0652596 -0.0459791 -1.7472493 0.1399955 -0.0567784 0.2037997 -1.8294280 40 O -1.9728005 0.0943050 -0.0652596 0.0459791 -1.7472493 -0.1399955 -0.0567784 -0.2037997 -1.8294280 ---------------------------------------------------------------------------- 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: 0.734 Solver_block: 200 / 1200 - Time: 0.632 Solver_block: 300 / 1200 - Time: 0.631 Solver_block: 400 / 1200 - Time: 0.628 Solver_block: 500 / 1200 - Time: 0.635 Solver_block: 600 / 1200 - Time: 0.631 Solver_block: 700 / 1200 - Time: 0.636 Solver_block: 800 / 1200 - Time: 0.631 Solver_block: 900 / 1200 - Time: 0.630 Solver_block: 1000 / 1200 - Time: 0.629 Solver_block: 1100 / 1200 - Time: 0.628 Solver_block: 1200 / 1200 - Time: 0.636 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 7.894 --------------------------------- 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 20:38:48]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 20:38:49]------------------------- 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 6.703355970028364 0.000000000000000 0.000000000000000 b 0.000000000000000 7.761523400000000 0.000000000000000 c -5.912613960294352 0.000000000000000 9.240410970300227 Atomic positions (fractional): 1 Ba 0.64130759155699 0.14774799784756 0.89473248300565 137.327 2 Ba 0.64130759155699 0.35225200215244 0.39473248300565 137.327 3 Ba 0.35869240844301 0.85225200215244 0.10526751699435 137.327 4 Ba 0.35869240844301 0.64774799784756 0.60526751699435 137.327 5 Ba 0.03573928840541 0.05012192942349 0.31671169172184 137.327 6 Ba 0.03573928840541 0.44987807057651 0.81671169172184 137.327 7 Ba 0.96426071159460 0.94987807057651 0.68328830827816 137.327 8 Ba 0.96426071159460 0.55012192942349 0.18328830827816 137.327 9 H 0.43279121045351 0.04845658476157 0.61917996541840 1.008 10 H 0.43279121045351 0.45154341523843 0.11917996541840 1.008 11 H 0.56720878954649 0.95154341523843 0.38082003458160 1.008 12 H 0.56720878954649 0.54845658476157 0.88082003458160 1.008 13 H 0.80472024278835 0.85081659802316 0.01721596629460 1.008 14 H 0.80472024278835 0.64918340197684 0.51721596629460 1.008 15 H 0.19527975721165 0.14918340197684 0.98278403370540 1.008 16 H 0.19527975721165 0.35081659802316 0.48278403370540 1.008 17 H 0.81654754854907 0.71809559138303 0.88241761481790 1.008 18 H 0.81654754854907 0.78190440861697 0.38241761481790 1.008 19 H 0.18345245145093 0.28190440861698 0.11758238518210 1.008 20 H 0.18345245145093 0.21809559138303 0.61758238518210 1.008 21 H 0.47110645149343 0.73669396036486 0.41355157612012 1.008 22 H 0.47110645149343 0.76330603963514 0.91355157612012 1.008 23 H 0.52889354850657 0.26330603963514 0.58644842387988 1.008 24 H 0.52889354850657 0.23669396036485 0.08644842387988 1.008 25 O 0.29534649095406 0.99942501614973 0.61907573204443 15.999 26 O 0.29534649095406 0.50057498385027 0.11907573204443 15.999 27 O 0.70465350904595 0.00057498385027 0.38092426795557 15.999 28 O 0.70465350904595 0.49942501614973 0.88092426795557 15.999 29 O 0.73352472652017 0.86120067081074 0.07813263073822 15.999 30 O 0.73352472652017 0.63879932918926 0.57813263073822 15.999 31 O 0.26647527347983 0.13879932918926 0.92186736926178 15.999 32 O 0.26647527347983 0.36120067081074 0.42186736926178 15.999 33 O 0.88561048576483 0.83557807327933 0.89573874204271 15.999 34 O 0.88561048576483 0.66442192672067 0.39573874204271 15.999 35 O 0.11438951423517 0.16442192672067 0.10426125795729 15.999 36 O 0.11438951423517 0.33557807327933 0.60426125795729 15.999 37 O 0.32318888184286 0.79984993259063 0.34390734315137 15.999 38 O 0.32318888184286 0.70015006740937 0.84390734315137 15.999 39 O 0.67681111815714 0.20015006740937 0.65609265684863 15.999 40 O 0.67681111815714 0.29984993259063 0.15609265684863 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.406711940056727 0.000000000000000 0.000000000000000 b 0.000000000000000 7.761523400000000 0.000000000000000 c -5.912613960294352 0.000000000000000 9.240410970300227 Atomic positions (fractional): 1 Ba 0.32065379577849 0.14774799784756 0.89473248300565 137.327 > 1 2 Ba 0.82065379577849 0.14774799784756 0.89473248300565 137.327 > 1 3 Ba 0.32065379577849 0.35225200215244 0.39473248300565 137.327 > 3 4 Ba 0.82065379577849 0.35225200215244 0.39473248300565 137.327 > 3 5 Ba 0.17934620422151 0.85225200215244 0.10526751699435 137.327 > 5 6 Ba 0.67934620422151 0.85225200215244 0.10526751699435 137.327 > 5 7 Ba 0.17934620422151 0.64774799784756 0.60526751699435 137.327 > 7 8 Ba 0.67934620422151 0.64774799784756 0.60526751699435 137.327 > 7 9 Ba 0.01786964420270 0.05012192942349 0.31671169172184 137.327 > 9 10 Ba 0.51786964420270 0.05012192942349 0.31671169172184 137.327 > 9 11 Ba 0.01786964420270 0.44987807057651 0.81671169172184 137.327 > 11 12 Ba 0.51786964420270 0.44987807057651 0.81671169172184 137.327 > 11 13 Ba 0.48213035579730 0.94987807057651 0.68328830827816 137.327 > 13 14 Ba 0.98213035579730 0.94987807057651 0.68328830827816 137.327 > 13 15 Ba 0.48213035579730 0.55012192942349 0.18328830827816 137.327 > 15 16 Ba 0.98213035579730 0.55012192942349 0.18328830827816 137.327 > 15 17 H 0.21639560522676 0.04845658476157 0.61917996541840 1.008 > 17 18 H 0.71639560522676 0.04845658476157 0.61917996541840 1.008 > 17 19 H 0.21639560522676 0.45154341523843 0.11917996541840 1.008 > 19 20 H 0.71639560522676 0.45154341523843 0.11917996541840 1.008 > 19 21 H 0.28360439477324 0.95154341523843 0.38082003458160 1.008 > 21 22 H 0.78360439477324 0.95154341523843 0.38082003458160 1.008 > 21 23 H 0.28360439477324 0.54845658476157 0.88082003458160 1.008 > 23 24 H 0.78360439477324 0.54845658476157 0.88082003458160 1.008 > 23 25 H 0.40236012139418 0.85081659802316 0.01721596629460 1.008 > 25 26 H 0.90236012139418 0.85081659802316 0.01721596629460 1.008 > 25 27 H 0.40236012139418 0.64918340197684 0.51721596629460 1.008 > 27 28 H 0.90236012139418 0.64918340197684 0.51721596629460 1.008 > 27 29 H 0.09763987860582 0.14918340197684 0.98278403370540 1.008 > 29 30 H 0.59763987860582 0.14918340197684 0.98278403370540 1.008 > 29 31 H 0.09763987860582 0.35081659802316 0.48278403370540 1.008 > 31 32 H 0.59763987860582 0.35081659802316 0.48278403370540 1.008 > 31 33 H 0.40827377427454 0.71809559138303 0.88241761481790 1.008 > 33 34 H 0.90827377427454 0.71809559138303 0.88241761481790 1.008 > 33 35 H 0.40827377427454 0.78190440861697 0.38241761481790 1.008 > 35 36 H 0.90827377427454 0.78190440861697 0.38241761481790 1.008 > 35 37 H 0.09172622572546 0.28190440861698 0.11758238518210 1.008 > 37 38 H 0.59172622572546 0.28190440861698 0.11758238518210 1.008 > 37 39 H 0.09172622572546 0.21809559138303 0.61758238518210 1.008 > 39 40 H 0.59172622572546 0.21809559138303 0.61758238518210 1.008 > 39 41 H 0.23555322574672 0.73669396036486 0.41355157612012 1.008 > 41 42 H 0.73555322574672 0.73669396036486 0.41355157612012 1.008 > 41 43 H 0.23555322574672 0.76330603963514 0.91355157612012 1.008 > 43 44 H 0.73555322574672 0.76330603963514 0.91355157612012 1.008 > 43 45 H 0.26444677425328 0.26330603963514 0.58644842387988 1.008 > 45 46 H 0.76444677425328 0.26330603963514 0.58644842387988 1.008 > 45 47 H 0.26444677425328 0.23669396036485 0.08644842387988 1.008 > 47 48 H 0.76444677425328 0.23669396036485 0.08644842387988 1.008 > 47 49 O 0.14767324547703 0.99942501614973 0.61907573204443 15.999 > 49 50 O 0.64767324547703 0.99942501614973 0.61907573204443 15.999 > 49 51 O 0.14767324547703 0.50057498385027 0.11907573204443 15.999 > 51 52 O 0.64767324547703 0.50057498385027 0.11907573204443 15.999 > 51 53 O 0.35232675452297 0.00057498385027 0.38092426795557 15.999 > 53 54 O 0.85232675452297 0.00057498385027 0.38092426795557 15.999 > 53 55 O 0.35232675452297 0.49942501614973 0.88092426795557 15.999 > 55 56 O 0.85232675452297 0.49942501614973 0.88092426795557 15.999 > 55 57 O 0.36676236326008 0.86120067081074 0.07813263073822 15.999 > 57 58 O 0.86676236326008 0.86120067081074 0.07813263073822 15.999 > 57 59 O 0.36676236326008 0.63879932918926 0.57813263073822 15.999 > 59 60 O 0.86676236326008 0.63879932918926 0.57813263073822 15.999 > 59 61 O 0.13323763673992 0.13879932918926 0.92186736926178 15.999 > 61 62 O 0.63323763673992 0.13879932918926 0.92186736926178 15.999 > 61 63 O 0.13323763673992 0.36120067081074 0.42186736926178 15.999 > 63 64 O 0.63323763673992 0.36120067081074 0.42186736926178 15.999 > 63 65 O 0.44280524288241 0.83557807327933 0.89573874204271 15.999 > 65 66 O 0.94280524288241 0.83557807327933 0.89573874204271 15.999 > 65 67 O 0.44280524288241 0.66442192672067 0.39573874204271 15.999 > 67 68 O 0.94280524288241 0.66442192672067 0.39573874204271 15.999 > 67 69 O 0.05719475711759 0.16442192672067 0.10426125795729 15.999 > 69 70 O 0.55719475711759 0.16442192672067 0.10426125795729 15.999 > 69 71 O 0.05719475711759 0.33557807327933 0.60426125795729 15.999 > 71 72 O 0.55719475711759 0.33557807327933 0.60426125795729 15.999 > 71 73 O 0.16159444092143 0.79984993259063 0.34390734315137 15.999 > 73 74 O 0.66159444092143 0.79984993259063 0.34390734315137 15.999 > 73 75 O 0.16159444092143 0.70015006740937 0.84390734315137 15.999 > 75 76 O 0.66159444092143 0.70015006740937 0.84390734315137 15.999 > 75 77 O 0.33840555907857 0.20015006740937 0.65609265684863 15.999 > 77 78 O 0.83840555907857 0.20015006740937 0.65609265684863 15.999 > 77 79 O 0.33840555907857 0.29984993259063 0.15609265684863 15.999 > 79 80 O 0.83840555907857 0.29984993259063 0.15609265684863 15.999 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.2917002 0.0000000 -0.0271968 0.0000000 3.3018653 0.0000000 -0.0271966 0.0000000 3.3508821 -------------------------- Born effective charges -------------------------- 1 Ba 2.6343522 0.0766453 -0.0262867 0.0650821 2.5470200 -0.0107434 -0.0554425 -0.0744543 2.6470096 2 Ba 2.6343522 -0.0766453 -0.0262867 -0.0650821 2.5470200 0.0107434 -0.0554425 0.0744543 2.6470096 3 Ba 2.6343522 0.0766453 -0.0262867 0.0650821 2.5470200 -0.0107434 -0.0554425 -0.0744543 2.6470096 4 Ba 2.6343522 -0.0766453 -0.0262867 -0.0650821 2.5470200 0.0107434 -0.0554425 0.0744543 2.6470096 5 Ba 2.6209666 -0.0288817 -0.0520847 0.0085016 2.6311634 0.0078200 -0.0377004 -0.0226216 2.6685757 6 Ba 2.6209666 0.0288817 -0.0520847 -0.0085016 2.6311634 -0.0078200 -0.0377004 0.0226216 2.6685757 7 Ba 2.6209666 -0.0288817 -0.0520847 0.0085016 2.6311634 0.0078200 -0.0377004 -0.0226216 2.6685757 8 Ba 2.6209666 0.0288817 -0.0520847 -0.0085016 2.6311634 -0.0078200 -0.0377004 0.0226216 2.6685757 9 H 0.7207072 0.3334085 0.1332856 0.3432167 0.5050128 0.0537902 0.1133082 0.0407695 0.3320484 10 H 0.7207072 -0.3334085 0.1332856 -0.3432167 0.5050128 -0.0537902 0.1133082 -0.0407695 0.3320484 11 H 0.7207072 0.3334085 0.1332856 0.3432167 0.5050128 0.0537902 0.1133082 0.0407695 0.3320484 12 H 0.7207072 -0.3334085 0.1332856 -0.3432167 0.5050128 -0.0537902 0.1133082 -0.0407695 0.3320484 13 H 0.9019830 -0.0581206 -0.5772550 -0.0839215 0.3120359 0.0545200 -0.5338382 0.0380313 0.6604379 14 H 0.9019830 0.0581206 -0.5772550 0.0839215 0.3120359 -0.0545200 -0.5338382 -0.0380313 0.6604379 15 H 0.9019830 -0.0581206 -0.5772550 -0.0839215 0.3120359 0.0545200 -0.5338382 0.0380313 0.6604379 16 H 0.9019830 0.0581206 -0.5772550 0.0839215 0.3120359 -0.0545200 -0.5338382 -0.0380313 0.6604379 17 H 0.3844232 0.2549780 -0.0140706 0.2618071 0.8526184 0.0601465 -0.0187425 0.0496472 0.2641510 18 H 0.3844232 -0.2549780 -0.0140706 -0.2618071 0.8526184 -0.0601465 -0.0187425 -0.0496472 0.2641510 19 H 0.3844232 0.2549780 -0.0140706 0.2618071 0.8526184 0.0601465 -0.0187425 0.0496472 0.2641510 20 H 0.3844232 -0.2549780 -0.0140706 -0.2618071 0.8526184 -0.0601465 -0.0187425 -0.0496472 0.2641510 21 H 0.4695268 -0.0839803 0.2594918 -0.0920834 0.3996495 -0.2959424 0.2441035 -0.2691165 0.7146039 22 H 0.4695268 0.0839803 0.2594918 0.0920834 0.3996495 0.2959424 0.2441035 0.2691165 0.7146039 23 H 0.4695268 -0.0839803 0.2594918 -0.0920834 0.3996495 -0.2959424 0.2441035 -0.2691165 0.7146039 24 H 0.4695268 0.0839803 0.2594918 0.0920834 0.3996495 0.2959424 0.2441035 0.2691165 0.7146039 25 O -1.7733824 -0.0588912 -0.0435490 -0.1132759 -1.9731871 -0.0700640 -0.0160525 -0.0448498 -1.7236869 26 O -1.7733824 0.0588912 -0.0435490 0.1132759 -1.9731871 0.0700640 -0.0160525 0.0448498 -1.7236869 27 O -1.7733824 -0.0588912 -0.0435490 -0.1132759 -1.9731871 -0.0700640 -0.0160525 -0.0448498 -1.7236869 28 O -1.7733824 0.0588912 -0.0435490 0.1132759 -1.9731871 0.0700640 -0.0160525 0.0448498 -1.7236869 29 O -2.0461398 0.0104467 0.1487136 0.0362087 -1.7967094 -0.1151413 0.1594335 -0.0459753 -2.0056185 30 O -2.0461398 -0.0104467 0.1487136 -0.0362087 -1.7967094 0.1151413 0.1594335 0.0459753 -2.0056185 31 O -2.0461398 0.0104467 0.1487136 0.0362087 -1.7967094 -0.1151413 0.1594335 -0.0459753 -2.0056185 32 O -2.0461398 -0.0104467 0.1487136 -0.0362087 -1.7967094 0.1151413 0.1594335 0.0459753 -2.0056185 33 O -1.9396364 -0.0636950 0.2370145 -0.0731444 -1.7303540 -0.0248024 0.2017093 0.0248788 -1.7280931 34 O -1.9396364 0.0636950 0.2370145 0.0731444 -1.7303540 0.0248024 0.2017093 -0.0248788 -1.7280931 35 O -1.9396364 -0.0636950 0.2370145 -0.0731444 -1.7303540 -0.0248024 0.2017093 0.0248788 -1.7280931 36 O -1.9396364 0.0636950 0.2370145 0.0731444 -1.7303540 0.0248024 0.2017093 -0.0248788 -1.7280931 37 O -1.9728005 -0.0943050 -0.0652596 -0.0459791 -1.7472493 0.1399955 -0.0567784 0.2037997 -1.8294280 38 O -1.9728005 0.0943050 -0.0652596 0.0459791 -1.7472493 -0.1399955 -0.0567784 -0.2037997 -1.8294280 39 O -1.9728005 -0.0943050 -0.0652596 -0.0459791 -1.7472493 0.1399955 -0.0567784 0.2037997 -1.8294280 40 O -1.9728005 0.0943050 -0.0652596 0.0459791 -1.7472493 -0.1399955 -0.0567784 -0.2037997 -1.8294280 ---------------------------------------------------------------------------- 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 (zx) 0.00000000 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 20:39:15]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 20:39:16]------------------------- 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 6.703355970028364 0.000000000000000 0.000000000000000 b 0.000000000000000 7.761523400000000 0.000000000000000 c -5.912613960294352 0.000000000000000 9.240410970300227 Atomic positions (fractional): 1 Ba 0.64130759155699 0.14774799784756 0.89473248300565 137.327 2 Ba 0.64130759155699 0.35225200215244 0.39473248300565 137.327 3 Ba 0.35869240844301 0.85225200215244 0.10526751699435 137.327 4 Ba 0.35869240844301 0.64774799784756 0.60526751699435 137.327 5 Ba 0.03573928840541 0.05012192942349 0.31671169172184 137.327 6 Ba 0.03573928840541 0.44987807057651 0.81671169172184 137.327 7 Ba 0.96426071159460 0.94987807057651 0.68328830827816 137.327 8 Ba 0.96426071159460 0.55012192942349 0.18328830827816 137.327 9 H 0.43279121045351 0.04845658476157 0.61917996541840 1.008 10 H 0.43279121045351 0.45154341523843 0.11917996541840 1.008 11 H 0.56720878954649 0.95154341523843 0.38082003458160 1.008 12 H 0.56720878954649 0.54845658476157 0.88082003458160 1.008 13 H 0.80472024278835 0.85081659802316 0.01721596629460 1.008 14 H 0.80472024278835 0.64918340197684 0.51721596629460 1.008 15 H 0.19527975721165 0.14918340197684 0.98278403370540 1.008 16 H 0.19527975721165 0.35081659802316 0.48278403370540 1.008 17 H 0.81654754854907 0.71809559138303 0.88241761481790 1.008 18 H 0.81654754854907 0.78190440861697 0.38241761481790 1.008 19 H 0.18345245145093 0.28190440861698 0.11758238518210 1.008 20 H 0.18345245145093 0.21809559138303 0.61758238518210 1.008 21 H 0.47110645149343 0.73669396036486 0.41355157612012 1.008 22 H 0.47110645149343 0.76330603963514 0.91355157612012 1.008 23 H 0.52889354850657 0.26330603963514 0.58644842387988 1.008 24 H 0.52889354850657 0.23669396036485 0.08644842387988 1.008 25 O 0.29534649095406 0.99942501614973 0.61907573204443 15.999 26 O 0.29534649095406 0.50057498385027 0.11907573204443 15.999 27 O 0.70465350904595 0.00057498385027 0.38092426795557 15.999 28 O 0.70465350904595 0.49942501614973 0.88092426795557 15.999 29 O 0.73352472652017 0.86120067081074 0.07813263073822 15.999 30 O 0.73352472652017 0.63879932918926 0.57813263073822 15.999 31 O 0.26647527347983 0.13879932918926 0.92186736926178 15.999 32 O 0.26647527347983 0.36120067081074 0.42186736926178 15.999 33 O 0.88561048576483 0.83557807327933 0.89573874204271 15.999 34 O 0.88561048576483 0.66442192672067 0.39573874204271 15.999 35 O 0.11438951423517 0.16442192672067 0.10426125795729 15.999 36 O 0.11438951423517 0.33557807327933 0.60426125795729 15.999 37 O 0.32318888184286 0.79984993259063 0.34390734315137 15.999 38 O 0.32318888184286 0.70015006740937 0.84390734315137 15.999 39 O 0.67681111815714 0.20015006740937 0.65609265684863 15.999 40 O 0.67681111815714 0.29984993259063 0.15609265684863 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.406711940056727 0.000000000000000 0.000000000000000 b 0.000000000000000 7.761523400000000 0.000000000000000 c -5.912613960294352 0.000000000000000 9.240410970300227 Atomic positions (fractional): 1 Ba 0.32065379577849 0.14774799784756 0.89473248300565 137.327 > 1 2 Ba 0.82065379577849 0.14774799784756 0.89473248300565 137.327 > 1 3 Ba 0.32065379577849 0.35225200215244 0.39473248300565 137.327 > 3 4 Ba 0.82065379577849 0.35225200215244 0.39473248300565 137.327 > 3 5 Ba 0.17934620422151 0.85225200215244 0.10526751699435 137.327 > 5 6 Ba 0.67934620422151 0.85225200215244 0.10526751699435 137.327 > 5 7 Ba 0.17934620422151 0.64774799784756 0.60526751699435 137.327 > 7 8 Ba 0.67934620422151 0.64774799784756 0.60526751699435 137.327 > 7 9 Ba 0.01786964420270 0.05012192942349 0.31671169172184 137.327 > 9 10 Ba 0.51786964420270 0.05012192942349 0.31671169172184 137.327 > 9 11 Ba 0.01786964420270 0.44987807057651 0.81671169172184 137.327 > 11 12 Ba 0.51786964420270 0.44987807057651 0.81671169172184 137.327 > 11 13 Ba 0.48213035579730 0.94987807057651 0.68328830827816 137.327 > 13 14 Ba 0.98213035579730 0.94987807057651 0.68328830827816 137.327 > 13 15 Ba 0.48213035579730 0.55012192942349 0.18328830827816 137.327 > 15 16 Ba 0.98213035579730 0.55012192942349 0.18328830827816 137.327 > 15 17 H 0.21639560522676 0.04845658476157 0.61917996541840 1.008 > 17 18 H 0.71639560522676 0.04845658476157 0.61917996541840 1.008 > 17 19 H 0.21639560522676 0.45154341523843 0.11917996541840 1.008 > 19 20 H 0.71639560522676 0.45154341523843 0.11917996541840 1.008 > 19 21 H 0.28360439477324 0.95154341523843 0.38082003458160 1.008 > 21 22 H 0.78360439477324 0.95154341523843 0.38082003458160 1.008 > 21 23 H 0.28360439477324 0.54845658476157 0.88082003458160 1.008 > 23 24 H 0.78360439477324 0.54845658476157 0.88082003458160 1.008 > 23 25 H 0.40236012139418 0.85081659802316 0.01721596629460 1.008 > 25 26 H 0.90236012139418 0.85081659802316 0.01721596629460 1.008 > 25 27 H 0.40236012139418 0.64918340197684 0.51721596629460 1.008 > 27 28 H 0.90236012139418 0.64918340197684 0.51721596629460 1.008 > 27 29 H 0.09763987860582 0.14918340197684 0.98278403370540 1.008 > 29 30 H 0.59763987860582 0.14918340197684 0.98278403370540 1.008 > 29 31 H 0.09763987860582 0.35081659802316 0.48278403370540 1.008 > 31 32 H 0.59763987860582 0.35081659802316 0.48278403370540 1.008 > 31 33 H 0.40827377427454 0.71809559138303 0.88241761481790 1.008 > 33 34 H 0.90827377427454 0.71809559138303 0.88241761481790 1.008 > 33 35 H 0.40827377427454 0.78190440861697 0.38241761481790 1.008 > 35 36 H 0.90827377427454 0.78190440861697 0.38241761481790 1.008 > 35 37 H 0.09172622572546 0.28190440861698 0.11758238518210 1.008 > 37 38 H 0.59172622572546 0.28190440861698 0.11758238518210 1.008 > 37 39 H 0.09172622572546 0.21809559138303 0.61758238518210 1.008 > 39 40 H 0.59172622572546 0.21809559138303 0.61758238518210 1.008 > 39 41 H 0.23555322574672 0.73669396036486 0.41355157612012 1.008 > 41 42 H 0.73555322574672 0.73669396036486 0.41355157612012 1.008 > 41 43 H 0.23555322574672 0.76330603963514 0.91355157612012 1.008 > 43 44 H 0.73555322574672 0.76330603963514 0.91355157612012 1.008 > 43 45 H 0.26444677425328 0.26330603963514 0.58644842387988 1.008 > 45 46 H 0.76444677425328 0.26330603963514 0.58644842387988 1.008 > 45 47 H 0.26444677425328 0.23669396036485 0.08644842387988 1.008 > 47 48 H 0.76444677425328 0.23669396036485 0.08644842387988 1.008 > 47 49 O 0.14767324547703 0.99942501614973 0.61907573204443 15.999 > 49 50 O 0.64767324547703 0.99942501614973 0.61907573204443 15.999 > 49 51 O 0.14767324547703 0.50057498385027 0.11907573204443 15.999 > 51 52 O 0.64767324547703 0.50057498385027 0.11907573204443 15.999 > 51 53 O 0.35232675452297 0.00057498385027 0.38092426795557 15.999 > 53 54 O 0.85232675452297 0.00057498385027 0.38092426795557 15.999 > 53 55 O 0.35232675452297 0.49942501614973 0.88092426795557 15.999 > 55 56 O 0.85232675452297 0.49942501614973 0.88092426795557 15.999 > 55 57 O 0.36676236326008 0.86120067081074 0.07813263073822 15.999 > 57 58 O 0.86676236326008 0.86120067081074 0.07813263073822 15.999 > 57 59 O 0.36676236326008 0.63879932918926 0.57813263073822 15.999 > 59 60 O 0.86676236326008 0.63879932918926 0.57813263073822 15.999 > 59 61 O 0.13323763673992 0.13879932918926 0.92186736926178 15.999 > 61 62 O 0.63323763673992 0.13879932918926 0.92186736926178 15.999 > 61 63 O 0.13323763673992 0.36120067081074 0.42186736926178 15.999 > 63 64 O 0.63323763673992 0.36120067081074 0.42186736926178 15.999 > 63 65 O 0.44280524288241 0.83557807327933 0.89573874204271 15.999 > 65 66 O 0.94280524288241 0.83557807327933 0.89573874204271 15.999 > 65 67 O 0.44280524288241 0.66442192672067 0.39573874204271 15.999 > 67 68 O 0.94280524288241 0.66442192672067 0.39573874204271 15.999 > 67 69 O 0.05719475711759 0.16442192672067 0.10426125795729 15.999 > 69 70 O 0.55719475711759 0.16442192672067 0.10426125795729 15.999 > 69 71 O 0.05719475711759 0.33557807327933 0.60426125795729 15.999 > 71 72 O 0.55719475711759 0.33557807327933 0.60426125795729 15.999 > 71 73 O 0.16159444092143 0.79984993259063 0.34390734315137 15.999 > 73 74 O 0.66159444092143 0.79984993259063 0.34390734315137 15.999 > 73 75 O 0.16159444092143 0.70015006740937 0.84390734315137 15.999 > 75 76 O 0.66159444092143 0.70015006740937 0.84390734315137 15.999 > 75 77 O 0.33840555907857 0.20015006740937 0.65609265684863 15.999 > 77 78 O 0.83840555907857 0.20015006740937 0.65609265684863 15.999 > 77 79 O 0.33840555907857 0.29984993259063 0.15609265684863 15.999 > 79 80 O 0.83840555907857 0.29984993259063 0.15609265684863 15.999 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.2917002 0.0000000 -0.0271968 0.0000000 3.3018653 0.0000000 -0.0271966 0.0000000 3.3508821 -------------------------- Born effective charges -------------------------- 1 Ba 2.6343522 0.0766453 -0.0262867 0.0650821 2.5470200 -0.0107434 -0.0554425 -0.0744543 2.6470096 2 Ba 2.6343522 -0.0766453 -0.0262867 -0.0650821 2.5470200 0.0107434 -0.0554425 0.0744543 2.6470096 3 Ba 2.6343522 0.0766453 -0.0262867 0.0650821 2.5470200 -0.0107434 -0.0554425 -0.0744543 2.6470096 4 Ba 2.6343522 -0.0766453 -0.0262867 -0.0650821 2.5470200 0.0107434 -0.0554425 0.0744543 2.6470096 5 Ba 2.6209666 -0.0288817 -0.0520847 0.0085016 2.6311634 0.0078200 -0.0377004 -0.0226216 2.6685757 6 Ba 2.6209666 0.0288817 -0.0520847 -0.0085016 2.6311634 -0.0078200 -0.0377004 0.0226216 2.6685757 7 Ba 2.6209666 -0.0288817 -0.0520847 0.0085016 2.6311634 0.0078200 -0.0377004 -0.0226216 2.6685757 8 Ba 2.6209666 0.0288817 -0.0520847 -0.0085016 2.6311634 -0.0078200 -0.0377004 0.0226216 2.6685757 9 H 0.7207072 0.3334085 0.1332856 0.3432167 0.5050128 0.0537902 0.1133082 0.0407695 0.3320484 10 H 0.7207072 -0.3334085 0.1332856 -0.3432167 0.5050128 -0.0537902 0.1133082 -0.0407695 0.3320484 11 H 0.7207072 0.3334085 0.1332856 0.3432167 0.5050128 0.0537902 0.1133082 0.0407695 0.3320484 12 H 0.7207072 -0.3334085 0.1332856 -0.3432167 0.5050128 -0.0537902 0.1133082 -0.0407695 0.3320484 13 H 0.9019830 -0.0581206 -0.5772550 -0.0839215 0.3120359 0.0545200 -0.5338382 0.0380313 0.6604379 14 H 0.9019830 0.0581206 -0.5772550 0.0839215 0.3120359 -0.0545200 -0.5338382 -0.0380313 0.6604379 15 H 0.9019830 -0.0581206 -0.5772550 -0.0839215 0.3120359 0.0545200 -0.5338382 0.0380313 0.6604379 16 H 0.9019830 0.0581206 -0.5772550 0.0839215 0.3120359 -0.0545200 -0.5338382 -0.0380313 0.6604379 17 H 0.3844232 0.2549780 -0.0140706 0.2618071 0.8526184 0.0601465 -0.0187425 0.0496472 0.2641510 18 H 0.3844232 -0.2549780 -0.0140706 -0.2618071 0.8526184 -0.0601465 -0.0187425 -0.0496472 0.2641510 19 H 0.3844232 0.2549780 -0.0140706 0.2618071 0.8526184 0.0601465 -0.0187425 0.0496472 0.2641510 20 H 0.3844232 -0.2549780 -0.0140706 -0.2618071 0.8526184 -0.0601465 -0.0187425 -0.0496472 0.2641510 21 H 0.4695268 -0.0839803 0.2594918 -0.0920834 0.3996495 -0.2959424 0.2441035 -0.2691165 0.7146039 22 H 0.4695268 0.0839803 0.2594918 0.0920834 0.3996495 0.2959424 0.2441035 0.2691165 0.7146039 23 H 0.4695268 -0.0839803 0.2594918 -0.0920834 0.3996495 -0.2959424 0.2441035 -0.2691165 0.7146039 24 H 0.4695268 0.0839803 0.2594918 0.0920834 0.3996495 0.2959424 0.2441035 0.2691165 0.7146039 25 O -1.7733824 -0.0588912 -0.0435490 -0.1132759 -1.9731871 -0.0700640 -0.0160525 -0.0448498 -1.7236869 26 O -1.7733824 0.0588912 -0.0435490 0.1132759 -1.9731871 0.0700640 -0.0160525 0.0448498 -1.7236869 27 O -1.7733824 -0.0588912 -0.0435490 -0.1132759 -1.9731871 -0.0700640 -0.0160525 -0.0448498 -1.7236869 28 O -1.7733824 0.0588912 -0.0435490 0.1132759 -1.9731871 0.0700640 -0.0160525 0.0448498 -1.7236869 29 O -2.0461398 0.0104467 0.1487136 0.0362087 -1.7967094 -0.1151413 0.1594335 -0.0459753 -2.0056185 30 O -2.0461398 -0.0104467 0.1487136 -0.0362087 -1.7967094 0.1151413 0.1594335 0.0459753 -2.0056185 31 O -2.0461398 0.0104467 0.1487136 0.0362087 -1.7967094 -0.1151413 0.1594335 -0.0459753 -2.0056185 32 O -2.0461398 -0.0104467 0.1487136 -0.0362087 -1.7967094 0.1151413 0.1594335 0.0459753 -2.0056185 33 O -1.9396364 -0.0636950 0.2370145 -0.0731444 -1.7303540 -0.0248024 0.2017093 0.0248788 -1.7280931 34 O -1.9396364 0.0636950 0.2370145 0.0731444 -1.7303540 0.0248024 0.2017093 -0.0248788 -1.7280931 35 O -1.9396364 -0.0636950 0.2370145 -0.0731444 -1.7303540 -0.0248024 0.2017093 0.0248788 -1.7280931 36 O -1.9396364 0.0636950 0.2370145 0.0731444 -1.7303540 0.0248024 0.2017093 -0.0248788 -1.7280931 37 O -1.9728005 -0.0943050 -0.0652596 -0.0459791 -1.7472493 0.1399955 -0.0567784 0.2037997 -1.8294280 38 O -1.9728005 0.0943050 -0.0652596 0.0459791 -1.7472493 -0.1399955 -0.0567784 -0.2037997 -1.8294280 39 O -1.9728005 -0.0943050 -0.0652596 -0.0459791 -1.7472493 0.1399955 -0.0567784 0.2037997 -1.8294280 40 O -1.9728005 0.0943050 -0.0652596 0.0459791 -1.7472493 -0.1399955 -0.0567784 -0.2037997 -1.8294280 ---------------------------------------------------------------------------- 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 1.825 ( 0.000 0.000 0.000) 0.000 1.833 ( 0.000 0.000 0.000) 0.000 2.002 ( 0.000 0.000 0.000) 0.000 2.017 ( 0.000 0.000 0.000) 0.000 2.161 ( 0.000 0.000 0.000) 0.000 2.223 ( 0.000 0.000 0.000) 0.000 2.338 ( 0.000 0.000 0.000) 0.000 2.454 ( 0.000 0.000 0.000) 0.000 2.484 ( 0.000 0.000 0.000) 0.000 2.584 ( 0.000 0.000 0.000) 0.000 2.627 ( 0.000 0.000 0.000) 0.000 2.773 ( 0.000 0.000 0.000) 0.000 2.872 ( 0.000 0.000 0.000) 0.000 2.884 ( 0.000 0.000 0.000) 0.000 3.184 ( 0.000 0.000 0.000) 0.000 3.252 ( 0.000 0.000 0.000) 0.000 3.282 ( 0.000 0.000 0.000) 0.000 3.369 ( 0.000 0.000 0.000) 0.000 3.390 ( 0.000 0.000 0.000) 0.000 3.479 ( 0.000 0.000 0.000) 0.000 3.612 ( 0.000 0.000 0.000) 0.000 4.316 ( 0.000 0.000 0.000) 0.000 4.498 ( 0.000 0.000 0.000) 0.000 4.575 ( 0.000 0.000 0.000) 0.000 4.806 ( 0.000 0.000 0.000) 0.000 4.865 ( 0.000 0.000 0.000) 0.000 4.991 ( 0.000 0.000 0.000) 0.000 5.125 ( 0.000 0.000 0.000) 0.000 5.164 ( 0.000 0.000 0.000) 0.000 5.206 ( 0.000 0.000 0.000) 0.000 5.329 ( 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 5.587 ( 0.000 0.000 0.000) 0.000 5.749 ( 0.000 0.000 0.000) 0.000 5.752 ( 0.000 0.000 0.000) 0.000 5.890 ( 0.000 0.000 0.000) 0.000 5.891 ( 0.000 0.000 0.000) 0.000 5.902 ( 0.000 0.000 0.000) 0.000 5.986 ( 0.000 0.000 0.000) 0.000 6.271 ( 0.000 0.000 0.000) 0.000 6.272 ( 0.000 0.000 0.000) 0.000 6.352 ( 0.000 0.000 0.000) 0.000 6.474 ( 0.000 0.000 0.000) 0.000 6.527 ( 0.000 0.000 0.000) 0.000 7.030 ( 0.000 0.000 0.000) 0.000 7.179 ( 0.000 0.000 0.000) 0.000 7.227 ( 0.000 0.000 0.000) 0.000 7.259 ( 0.000 0.000 0.000) 0.000 7.301 ( 0.000 0.000 0.000) 0.000 7.396 ( 0.000 0.000 0.000) 0.000 8.033 ( 0.000 0.000 0.000) 0.000 8.087 ( 0.000 0.000 0.000) 0.000 8.184 ( 0.000 0.000 0.000) 0.000 8.431 ( 0.000 0.000 0.000) 0.000 8.673 ( 0.000 0.000 0.000) 0.000 8.677 ( 0.000 0.000 0.000) 0.000 8.755 ( 0.000 0.000 0.000) 0.000 8.771 ( 0.000 0.000 0.000) 0.000 9.012 ( 0.000 0.000 0.000) 0.000 9.023 ( 0.000 0.000 0.000) 0.000 9.168 ( 0.000 0.000 0.000) 0.000 9.333 ( 0.000 0.000 0.000) 0.000 9.710 ( 0.000 0.000 0.000) 0.000 9.789 ( 0.000 0.000 0.000) 0.000 10.194 ( 0.000 0.000 0.000) 0.000 10.321 ( 0.000 0.000 0.000) 0.000 10.588 ( 0.000 0.000 0.000) 0.000 10.952 ( 0.000 0.000 0.000) 0.000 20.458 ( 0.000 0.000 0.000) 0.000 20.614 ( 0.000 0.000 0.000) 0.000 20.860 ( 0.000 0.000 0.000) 0.000 20.917 ( 0.000 0.000 0.000) 0.000 22.776 ( 0.000 0.000 0.000) 0.000 22.871 ( 0.000 0.000 0.000) 0.000 23.053 ( 0.000 0.000 0.000) 0.000 23.143 ( 0.000 0.000 0.000) 0.000 24.662 ( 0.000 0.000 0.000) 0.000 24.743 ( 0.000 0.000 0.000) 0.000 24.858 ( 0.000 0.000 0.000) 0.000 24.897 ( 0.000 0.000 0.000) 0.000 25.867 ( 0.000 0.000 0.000) 0.000 25.873 ( 0.000 0.000 0.000) 0.000 26.015 ( 0.000 0.000 0.000) 0.000 26.079 ( 0.000 0.000 0.000) 0.000 28.266 ( 0.000 0.000 0.000) 0.000 28.310 ( 0.000 0.000 0.000) 0.000 28.534 ( 0.000 0.000 0.000) 0.000 28.570 ( 0.000 0.000 0.000) 0.000 28.619 ( 0.000 0.000 0.000) 0.000 28.668 ( 0.000 0.000 0.000) 0.000 28.706 ( 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 32.349 ( 0.000 0.000 0.000) 0.000 32.417 ( 0.000 0.000 0.000) 0.000 32.616 ( 0.000 0.000 0.000) 0.000 35.345 ( 0.000 0.000 0.000) 0.000 35.405 ( 0.000 0.000 0.000) 0.000 35.514 ( 0.000 0.000 0.000) 0.000 35.541 ( 0.000 0.000 0.000) 0.000 88.686 ( 0.000 0.000 0.000) 0.000 88.763 ( 0.000 0.000 0.000) 0.000 88.926 ( 0.000 0.000 0.000) 0.000 89.127 ( 0.000 0.000 0.000) 0.000 97.619 ( 0.000 0.000 0.000) 0.000 97.630 ( 0.000 0.000 0.000) 0.000 97.638 ( 0.000 0.000 0.000) 0.000 97.692 ( 0.000 0.000 0.000) 0.000 98.669 ( 0.000 0.000 0.000) 0.000 98.678 ( 0.000 0.000 0.000) 0.000 98.731 ( 0.000 0.000 0.000) 0.000 98.863 ( 0.000 0.000 0.000) 0.000 99.587 ( 0.000 0.000 0.000) 0.000 99.730 ( 0.000 0.000 0.000) 0.000 99.766 ( 0.000 0.000 0.000) 0.000 99.984 ( 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| 0.442 ( 20.917 0.000 8.098) 22.430 0.476 ( 21.962 0.000 10.299) 24.257 0.746 ( 32.317 0.000 17.436) 36.721 1.815 ( 1.537 0.000 -2.136) 2.631 1.849 ( -1.308 0.000 5.321) 5.479 1.968 ( 1.188 0.000 -10.042) 10.112 2.095 ( 2.429 0.000 9.772) 10.069 2.121 ( -0.904 0.000 -2.996) 3.129 2.241 ( -3.283 0.000 -6.425) 7.215 2.267 ( -2.124 0.000 7.690) 7.978 2.415 ( -4.378 0.000 2.571) 5.077 2.564 ( 2.279 0.000 3.054) 3.811 2.584 ( -2.318 0.000 1.849) 2.965 2.635 ( 0.118 0.000 1.868) 1.872 2.750 ( -1.284 0.000 -1.239) 1.785 2.873 ( 0.110 0.000 -0.019) 0.111 2.890 ( -1.906 0.000 2.589) 3.215 3.165 ( -1.364 0.000 -0.901) 1.635 3.205 ( -5.033 0.000 -0.171) 5.036 3.256 ( -1.023 0.000 -3.291) 3.446 3.369 ( 1.150 0.000 -2.148) 2.436 3.399 ( 2.457 0.000 -4.632) 5.243 3.460 ( -0.995 0.000 -2.869) 3.037 3.599 ( 3.090 0.000 -6.062) 6.804 4.343 ( 3.113 0.000 0.142) 3.116 4.469 ( -3.500 0.000 0.718) 3.573 4.691 ( 6.047 0.000 -9.914) 11.612 4.834 ( 2.582 0.000 0.589) 2.649 4.837 ( -2.490 0.000 -1.419) 2.866 4.949 ( -4.734 0.000 0.719) 4.788 5.049 ( -5.607 0.000 -2.742) 6.241 5.163 ( -1.935 0.000 1.352) 2.360 5.285 ( 4.361 0.000 4.252) 6.091 5.441 ( -3.030 0.000 -3.947) 4.976 5.509 ( 0.414 0.000 2.183) 2.222 5.569 ( -1.901 0.000 -2.574) 3.200 5.676 ( -4.332 0.000 -1.229) 4.503 5.786 ( -1.559 0.000 1.461) 2.137 5.858 ( -4.634 0.000 10.175) 11.180 5.907 ( 3.303 0.000 -2.826) 4.347 5.941 ( 4.438 0.000 3.115) 5.422 5.981 ( -0.253 0.000 -1.013) 1.044 6.079 ( -8.548 0.000 9.434) 12.731 6.158 ( -11.315 0.000 -1.870) 11.469 6.276 ( 1.913 0.000 -2.400) 3.069 6.416 ( -0.318 0.000 -3.052) 3.068 6.625 ( 4.257 0.000 1.882) 4.654 7.030 ( -2.215 0.000 1.091) 2.469 7.065 ( -3.914 0.000 -14.554) 15.071 7.181 ( 0.622 0.000 -0.562) 0.838 7.207 ( -0.917 0.000 -7.601) 7.656 7.274 ( 1.791 0.000 5.036) 5.345 7.525 ( 1.183 0.000 16.062) 16.106 7.938 ( -15.028 0.000 -8.775) 17.402 7.986 ( -7.517 0.000 0.165) 7.519 8.086 ( -1.231 0.000 1.981) 2.333 8.408 ( -12.372 0.000 6.933) 14.182 8.605 ( -1.025 0.000 -1.528) 1.840 8.685 ( 2.614 0.000 -3.349) 4.248 8.760 ( -1.128 0.000 2.402) 2.654 8.803 ( 2.620 0.000 2.212) 3.429 9.028 ( -0.199 0.000 7.271) 7.274 9.076 ( 4.787 0.000 -4.018) 6.250 9.193 ( 6.043 0.000 0.636) 6.076 9.397 ( 7.351 0.000 -1.768) 7.560 9.560 ( -7.944 0.000 3.170) 8.553 9.788 ( -2.554 0.000 2.490) 3.567 9.815 ( 8.592 0.000 -0.717) 8.622 10.212 ( 1.556 0.000 0.640) 1.683 10.392 ( 5.527 0.000 2.700) 6.151 10.715 ( 8.479 0.000 -15.440) 17.615 11.005 ( 4.719 0.000 2.308) 5.253 20.462 ( 0.070 0.000 0.472) 0.478 20.613 ( -1.433 0.000 -0.311) 1.467 20.854 ( -0.751 0.000 0.124) 0.761 20.912 ( -0.569 0.000 0.129) 0.584 22.795 ( 1.138 0.000 1.612) 1.974 22.849 ( -1.439 0.000 -1.751) 2.266 23.080 ( 1.695 0.000 1.120) 2.032 23.132 ( -0.401 0.000 -1.401) 1.457 24.707 ( -6.545 0.000 6.740) 9.395 24.754 ( 0.451 0.000 1.273) 1.351 24.856 ( -0.365 0.000 -0.036) 0.366 24.906 ( 0.498 0.000 0.787) 0.931 25.833 ( -3.960 0.000 -0.889) 4.059 25.836 ( -3.917 0.000 1.009) 4.044 26.028 ( 0.384 0.000 1.142) 1.205 26.078 ( -1.246 0.000 1.280) 1.786 28.277 ( 0.800 0.000 0.767) 1.109 28.314 ( -1.494 0.000 1.752) 2.302 28.525 ( -0.801 0.000 -0.512) 0.951 28.601 ( -1.975 0.000 0.369) 2.009 28.663 ( -0.642 0.000 0.033) 0.642 28.716 ( 1.281 0.000 -0.712) 1.465 28.869 ( -0.669 0.000 0.223) 0.705 29.015 ( -0.446 0.000 0.028) 0.447 32.287 ( 0.771 0.000 0.113) 0.780 32.418 ( -3.155 0.000 6.034) 6.810 32.422 ( 0.541 0.000 0.034) 0.542 32.609 ( -0.549 0.000 -0.410) 0.685 35.352 ( 0.502 0.000 0.470) 0.688 35.410 ( 0.229 0.000 0.655) 0.694 35.503 ( -0.970 0.000 -0.334) 1.026 35.542 ( 0.004 0.000 0.127) 0.127 88.770 ( 1.108 0.000 -0.308) 1.150 88.836 ( 19.582 0.000 -30.010) 35.833 88.940 ( 2.144 0.000 -0.482) 2.197 89.181 ( 3.472 0.000 4.064) 5.345 97.630 ( 1.234 0.000 0.161) 1.245 97.635 ( 0.617 0.000 -0.083) 0.622 97.713 ( 2.062 0.000 0.750) 2.194 97.773 ( 8.251 0.000 -13.526) 15.844 98.674 ( 0.266 0.000 0.405) 0.484 98.729 ( -0.420 0.000 0.232) 0.480 98.760 ( -2.090 0.000 3.084) 3.725 98.850 ( -0.904 0.000 -0.984) 1.337 99.590 ( -0.008 0.000 0.514) 0.515 99.719 ( -1.461 0.000 0.189) 1.473 99.952 ( -1.216 0.000 -3.881) 4.067 100.430 ( -2.193 0.000 5.134) 5.583 ======================= 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| 0.856 ( 18.458 0.000 8.039) 20.132 0.941 ( 20.353 0.000 10.709) 22.999 1.406 ( 26.554 0.000 12.388) 29.302 1.834 ( 1.010 0.000 0.160) 1.022 1.877 ( 3.249 0.000 -12.843) 13.247 1.912 ( 1.854 0.000 5.792) 6.082 2.089 ( -5.494 0.000 0.448) 5.513 2.091 ( -0.692 0.000 1.333) 1.502 2.295 ( -3.094 0.000 5.753) 6.532 2.315 ( 5.557 0.000 10.868) 12.207 2.368 ( -2.683 0.000 0.526) 2.734 2.526 ( -5.207 0.000 -0.405) 5.223 2.583 ( -3.163 0.000 1.967) 3.724 2.648 ( -3.149 0.000 2.785) 4.204 2.736 ( -0.285 0.000 2.064) 2.084 2.869 ( -0.852 0.000 -0.275) 0.895 2.894 ( -2.348 0.000 5.742) 6.203 3.097 ( -6.677 0.000 -1.383) 6.818 3.138 ( 0.116 0.000 -1.687) 1.691 3.189 ( -1.211 0.000 -5.248) 5.386 3.346 ( -1.566 0.000 -3.255) 3.612 3.374 ( 2.149 0.000 -7.324) 7.633 3.379 ( -1.409 0.000 -6.628) 6.776 3.604 ( 6.113 0.000 -7.510) 9.684 4.416 ( -4.132 0.000 1.954) 4.571 4.417 ( 5.119 0.000 0.185) 5.122 4.684 ( 2.419 0.000 -4.859) 5.428 4.754 ( -4.504 0.000 -2.167) 4.998 4.871 ( -1.331 0.000 -0.893) 1.603 4.890 ( -2.909 0.000 1.602) 3.321 4.940 ( -1.663 0.000 -0.161) 1.671 5.140 ( -3.577 0.000 3.656) 5.115 5.343 ( -4.183 0.000 -4.511) 6.152 5.404 ( 4.422 0.000 1.425) 4.645 5.488 ( -0.546 0.000 -7.231) 7.251 5.539 ( -1.015 0.000 4.711) 4.819 5.605 ( -3.544 0.000 0.862) 3.648 5.751 ( -4.497 0.000 2.960) 5.384 5.872 ( -4.344 0.000 2.994) 5.276 5.880 ( -16.697 0.000 0.481) 16.704 5.927 ( 1.953 0.000 -4.073) 4.517 5.932 ( -7.293 0.000 6.370) 9.683 6.074 ( 6.060 0.000 0.106) 6.060 6.081 ( 3.050 0.000 1.105) 3.243 6.277 ( 2.494 0.000 -4.526) 5.168 6.388 ( -0.061 0.000 -2.554) 2.554 6.657 ( -0.690 0.000 -1.843) 1.968 6.818 ( -5.838 0.000 -12.601) 13.888 6.988 ( -5.124 0.000 -1.331) 5.294 7.153 ( 2.310 0.000 -2.363) 3.305 7.192 ( 1.405 0.000 -0.294) 1.435 7.364 ( 0.870 0.000 6.405) 6.464 7.560 ( -13.239 0.000 -15.377) 20.291 7.684 ( -3.084 0.000 16.016) 16.310 7.830 ( -17.159 0.000 9.606) 19.665 8.095 ( -1.154 0.000 3.861) 4.029 8.251 ( -10.943 0.000 4.646) 11.889 8.554 ( -0.750 0.000 -4.850) 4.908 8.678 ( 1.141 0.000 -3.672) 3.845 8.759 ( -3.133 0.000 3.541) 4.728 8.898 ( 4.378 0.000 3.769) 5.776 9.058 ( 1.330 0.000 -5.474) 5.633 9.128 ( 2.076 0.000 6.617) 6.935 9.400 ( 13.551 0.000 2.294) 13.743 9.468 ( -3.804 0.000 -2.186) 4.388 9.514 ( 8.388 0.000 -0.763) 8.423 9.775 ( 2.446 0.000 -4.271) 4.922 9.945 ( 7.579 0.000 -1.065) 7.653 10.256 ( 2.266 0.000 1.775) 2.879 10.514 ( 4.603 0.000 3.146) 5.575 10.679 ( 1.457 0.000 -6.791) 6.945 11.139 ( 6.758 0.000 3.836) 7.771 20.469 ( 0.024 0.000 0.638) 0.639 20.579 ( -1.448 0.000 -1.270) 1.926 20.839 ( -1.202 0.000 0.069) 1.204 20.901 ( -0.899 0.000 0.173) 0.915 22.794 ( -2.132 0.000 -2.561) 3.332 22.842 ( 1.730 0.000 2.486) 3.029 23.103 ( -0.680 0.000 -2.247) 2.348 23.134 ( 2.522 0.000 2.253) 3.382 24.660 ( -4.116 0.000 1.501) 4.381 24.781 ( 0.570 0.000 2.043) 2.121 24.845 ( -0.667 0.000 -0.413) 0.785 24.928 ( 0.853 0.000 1.136) 1.420 25.735 ( -5.882 0.000 -1.428) 6.053 25.773 ( -4.984 0.000 1.662) 5.254 26.041 ( -0.684 0.000 1.588) 1.729 26.064 ( -1.413 0.000 0.378) 1.463 28.306 ( 1.413 0.000 0.929) 1.692 28.307 ( -0.579 0.000 0.368) 0.686 28.500 ( -1.298 0.000 -0.802) 1.526 28.576 ( -1.672 0.000 0.963) 1.929 28.649 ( -1.072 0.000 0.057) 1.073 28.722 ( 0.626 0.000 -1.406) 1.539 28.856 ( -1.211 0.000 0.410) 1.278 29.005 ( -0.671 0.000 0.009) 0.671 32.309 ( 1.659 0.000 0.161) 1.667 32.430 ( -1.197 0.000 2.836) 3.078 32.436 ( 0.968 0.000 0.152) 0.979 32.590 ( -1.031 0.000 -0.798) 1.304 35.370 ( 0.833 0.000 0.699) 1.087 35.424 ( 0.295 0.000 1.027) 1.069 35.480 ( -0.880 0.000 -0.948) 1.294 35.541 ( -0.120 0.000 -0.132) 0.178 88.791 ( 1.670 0.000 -0.384) 1.714 88.844 ( 8.834 0.000 -12.971) 15.694 88.989 ( 3.900 0.000 0.049) 3.900 89.307 ( 4.531 0.000 6.212) 7.689 97.648 ( 1.043 0.000 0.039) 1.043 97.659 ( 1.722 0.000 0.373) 1.762 97.763 ( 3.505 0.000 -6.780) 7.633 97.773 ( 3.692 0.000 1.409) 3.952 98.685 ( 0.429 0.000 0.582) 0.723 98.722 ( -0.778 0.000 0.274) 0.825 98.758 ( -1.271 0.000 1.632) 2.069 98.817 ( -1.290 0.000 -1.455) 1.944 99.597 ( 0.044 0.000 0.804) 0.805 99.688 ( -2.404 0.000 0.312) 2.424 99.871 ( -1.621 0.000 -6.507) 6.706 100.453 ( -0.286 0.000 3.008) 3.021 ======================= 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| 1.209 ( 14.056 0.000 6.599) 15.528 1.362 ( 16.198 0.000 10.117) 19.098 1.797 ( 10.832 0.000 0.319) 10.837 1.816 ( 4.243 0.000 -9.944) 10.811 1.822 ( -1.283 0.000 -1.699) 2.129 1.978 ( -3.498 0.000 6.285) 7.193 2.092 ( 5.658 0.000 0.939) 5.736 2.181 ( 4.884 0.000 6.602) 8.212 2.302 ( -1.579 0.000 5.754) 5.967 2.347 ( -0.602 0.000 0.580) 0.836 2.440 ( -2.501 0.000 -1.182) 2.766 2.510 ( -2.164 0.000 5.735) 6.129 2.547 ( 1.970 0.000 8.592) 8.815 2.571 ( -8.909 0.000 2.374) 9.220 2.761 ( -0.220 0.000 1.948) 1.961 2.835 ( -2.385 0.000 -0.506) 2.438 2.952 ( 1.172 0.000 6.626) 6.729 2.974 ( -6.285 0.000 -0.294) 6.292 3.118 ( -0.034 0.000 -5.659) 5.659 3.133 ( 1.518 0.000 -2.346) 2.794 3.226 ( -2.984 0.000 -8.795) 9.287 3.310 ( -2.742 0.000 -2.199) 3.515 3.314 ( 0.422 0.000 -8.002) 8.014 3.639 ( 6.499 0.000 -5.973) 8.827 4.379 ( -3.036 0.000 2.139) 3.713 4.496 ( 3.754 0.000 -0.041) 3.755 4.658 ( -0.431 0.000 -3.346) 3.374 4.669 ( -3.028 0.000 -1.730) 3.487 4.790 ( -4.728 0.000 0.934) 4.819 4.898 ( 1.525 0.000 1.816) 2.372 4.989 ( 5.078 0.000 -1.308) 5.244 5.117 ( -3.813 0.000 2.910) 4.797 5.196 ( -7.458 0.000 -3.941) 8.435 5.416 ( 0.445 0.000 -6.428) 6.443 5.446 ( 0.054 0.000 1.738) 1.739 5.571 ( 0.174 0.000 1.573) 1.582 5.583 ( -2.653 0.000 0.835) 2.781 5.588 ( -11.133 0.000 -1.524) 11.237 5.733 ( -4.288 0.000 4.845) 6.470 5.738 ( -10.541 0.000 -0.098) 10.541 5.905 ( -0.789 0.000 -3.273) 3.366 5.933 ( -2.917 0.000 5.362) 6.104 6.152 ( 4.154 0.000 -1.735) 4.502 6.194 ( 6.792 0.000 3.037) 7.440 6.266 ( 2.072 0.000 -3.230) 3.838 6.348 ( -1.187 0.000 -3.027) 3.251 6.586 ( -4.687 0.000 -1.421) 4.898 6.626 ( -1.942 0.000 -10.483) 10.662 6.875 ( -5.829 0.000 -1.792) 6.098 7.198 ( -10.824 0.000 -8.669) 13.867 7.206 ( 3.585 0.000 1.319) 3.820 7.219 ( 0.639 0.000 -0.924) 1.124 7.438 ( 3.299 0.000 -0.179) 3.304 7.669 ( -15.177 0.000 11.767) 19.204 7.756 ( -4.733 0.000 10.321) 11.354 8.133 ( -0.972 0.000 6.118) 6.195 8.167 ( -4.584 0.000 3.139) 5.556 8.489 ( 0.239 0.000 -6.063) 6.067 8.650 ( 0.070 0.000 -3.310) 3.311 8.730 ( -4.643 0.000 3.599) 5.875 9.004 ( 3.274 0.000 3.277) 4.632 9.015 ( 0.656 0.000 -4.959) 5.002 9.235 ( 2.597 0.000 5.112) 5.734 9.392 ( -1.283 0.000 -3.917) 4.122 9.594 ( 7.628 0.000 -0.123) 7.629 9.677 ( 9.584 0.000 2.256) 9.846 9.781 ( 4.146 0.000 -5.006) 6.500 10.030 ( 4.801 0.000 -2.234) 5.296 10.328 ( 3.231 0.000 3.324) 4.635 10.599 ( 2.165 0.000 2.202) 3.089 10.618 ( -1.904 0.000 -4.024) 4.452 11.283 ( 5.045 0.000 3.694) 6.253 20.475 ( -0.037 0.000 0.470) 0.471 20.544 ( -1.063 0.000 -1.137) 1.557 20.819 ( -1.094 0.000 -0.024) 1.095 20.888 ( -0.824 0.000 0.127) 0.834 22.734 ( -1.846 0.000 -2.142) 2.828 22.896 ( 1.509 0.000 2.205) 2.671 23.068 ( -0.634 0.000 -2.062) 2.157 23.202 ( 2.439 0.000 2.155) 3.255 24.610 ( -2.674 0.000 0.070) 2.675 24.810 ( 0.305 0.000 1.891) 1.915 24.827 ( -0.670 0.000 -0.579) 0.886 24.955 ( 0.932 0.000 0.933) 1.319 25.624 ( -5.243 0.000 -1.364) 5.418 25.714 ( -4.049 0.000 1.529) 4.328 26.040 ( -1.223 0.000 1.239) 1.740 26.042 ( -1.348 0.000 0.045) 1.349 28.304 ( -0.071 0.000 0.008) 0.072 28.341 ( 1.716 0.000 0.638) 1.831 28.469 ( -1.227 0.000 -0.699) 1.412 28.569 ( -0.872 0.000 1.719) 1.928 28.631 ( -1.041 0.000 0.040) 1.042 28.705 ( -0.362 0.000 -2.234) 2.263 28.841 ( -1.187 0.000 0.574) 1.318 28.995 ( -0.567 0.000 -0.028) 0.567 32.344 ( 2.214 0.000 0.076) 2.215 32.435 ( -1.169 0.000 1.567) 1.955 32.457 ( 1.227 0.000 0.438) 1.303 32.560 ( -1.328 0.000 -1.089) 1.717 35.391 ( 0.802 0.000 0.582) 0.991 35.439 ( 0.201 0.000 0.935) 0.956 35.457 ( -0.654 0.000 -0.850) 1.072 35.537 ( -0.154 0.000 -0.225) 0.273 88.814 ( 1.409 0.000 -0.110) 1.414 88.852 ( 4.507 0.000 -6.475) 7.889 89.060 ( 3.971 0.000 0.460) 3.998 89.440 ( 3.127 0.000 5.832) 6.618 97.669 ( 1.117 0.000 0.512) 1.229 97.690 ( 1.423 0.000 0.411) 1.481 97.745 ( 1.467 0.000 -4.248) 4.494 97.855 ( 3.727 0.000 1.690) 4.092 98.698 ( 0.448 0.000 0.464) 0.645 98.710 ( -0.770 0.000 0.039) 0.771 98.753 ( -0.914 0.000 0.980) 1.340 98.782 ( -1.111 0.000 -1.141) 1.593 99.607 ( 0.094 0.000 0.723) 0.729 99.653 ( -2.051 0.000 0.522) 2.116 99.773 ( -1.341 0.000 -6.581) 6.716 100.480 ( 0.199 0.000 1.885) 1.895 ======================= 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| 1.427 ( 5.548 0.000 2.256) 5.989 1.637 ( 5.396 0.000 5.111) 7.432 1.784 ( -0.836 0.000 -1.108) 1.388 1.784 ( 2.390 0.000 -5.957) 6.419 1.923 ( 5.073 0.000 2.314) 5.576 1.999 ( -1.704 0.000 7.199) 7.398 2.151 ( 2.538 0.000 -6.659) 7.126 2.235 ( 4.026 0.000 -2.994) 5.018 2.329 ( -4.368 0.000 1.755) 4.707 2.362 ( 1.068 0.000 2.554) 2.768 2.372 ( -8.996 0.000 2.081) 9.234 2.491 ( -1.767 0.000 2.292) 2.894 2.565 ( 5.444 0.000 3.811) 6.645 2.687 ( 0.853 0.000 2.961) 3.081 2.759 ( -0.795 0.000 -0.479) 0.928 2.829 ( 0.428 0.000 5.886) 5.902 2.894 ( -2.906 0.000 0.455) 2.942 3.058 ( 2.443 0.000 5.524) 6.040 3.064 ( -2.513 0.000 -7.941) 8.329 3.075 ( -0.032 0.000 -2.087) 2.087 3.157 ( 1.319 0.000 -1.475) 1.979 3.226 ( -1.123 0.000 -6.365) 6.464 3.248 ( -1.992 0.000 -0.800) 2.146 3.677 ( 2.855 0.000 -2.142) 3.569 4.360 ( -1.088 0.000 0.868) 1.392 4.539 ( 1.644 0.000 0.336) 1.678 4.612 ( -1.908 0.000 -1.289) 2.303 4.616 ( -0.951 0.000 -1.203) 1.533 4.751 ( -1.503 0.000 0.736) 1.674 4.956 ( 3.174 0.000 0.725) 3.256 5.039 ( 1.258 0.000 -0.770) 1.475 5.050 ( -5.846 0.000 -1.124) 5.953 5.092 ( -0.201 0.000 0.467) 0.508 5.364 ( -0.787 0.000 -2.498) 2.619 5.424 ( -3.314 0.000 -0.975) 3.455 5.479 ( 1.282 0.000 2.537) 2.843 5.569 ( -3.620 0.000 -0.103) 3.621 5.581 ( -3.545 0.000 -1.083) 3.707 5.620 ( 0.959 0.000 1.991) 2.210 5.731 ( 2.160 0.000 -0.311) 2.183 5.823 ( -6.059 0.000 -0.596) 6.088 5.931 ( -1.048 0.000 1.110) 1.527 6.182 ( 1.524 0.000 -1.122) 1.892 6.241 ( 1.297 0.000 -2.056) 2.431 6.311 ( 0.478 0.000 -1.741) 1.805 6.361 ( 2.359 0.000 5.490) 5.975 6.498 ( -3.828 0.000 -0.321) 3.842 6.542 ( 2.696 0.000 -6.283) 6.837 6.767 ( -4.678 0.000 -0.751) 4.738 6.999 ( -3.699 0.000 -3.381) 5.011 7.236 ( 0.356 0.000 0.255) 0.437 7.269 ( 1.785 0.000 0.917) 2.006 7.490 ( 5.313 0.000 -3.597) 6.416 7.573 ( -9.204 0.000 7.810) 12.071 7.769 ( -1.972 0.000 3.342) 3.880 8.148 ( -1.184 0.000 1.483) 1.898 8.174 ( -0.864 0.000 3.747) 3.845 8.443 ( 0.676 0.000 -3.566) 3.630 8.619 ( -0.270 0.000 -1.551) 1.574 8.694 ( -2.587 0.000 1.748) 3.122 8.985 ( 0.282 0.000 -1.947) 1.968 9.064 ( 1.079 0.000 1.186) 1.604 9.305 ( 1.104 0.000 1.866) 2.168 9.348 ( -0.139 0.000 -1.922) 1.927 9.678 ( 2.684 0.000 -0.043) 2.684 9.798 ( 2.016 0.000 -2.048) 2.874 9.813 ( 3.781 0.000 1.055) 3.925 10.063 ( 1.558 0.000 -1.177) 1.952 10.427 ( 3.979 0.000 3.381) 5.221 10.533 ( -3.635 0.000 -3.149) 4.809 10.636 ( 0.576 0.000 0.765) 0.958 11.369 ( 1.713 0.000 1.547) 2.309 20.478 ( -0.022 0.000 0.162) 0.163 20.523 ( -0.383 0.000 -0.438) 0.582 20.805 ( -0.440 0.000 -0.026) 0.441 20.879 ( -0.336 0.000 0.043) 0.339 22.695 ( -0.731 0.000 -0.819) 1.098 22.931 ( 0.593 0.000 0.876) 1.058 23.044 ( -0.254 0.000 -0.834) 0.872 23.249 ( 1.041 0.000 0.892) 1.371 24.579 ( -0.950 0.000 -0.098) 0.955 24.814 ( -0.284 0.000 -0.271) 0.392 24.828 ( 0.050 0.000 0.768) 0.770 24.974 ( 0.442 0.000 0.356) 0.567 25.549 ( -2.122 0.000 -0.574) 2.198 25.677 ( -1.574 0.000 0.615) 1.690 26.026 ( -0.562 0.000 -0.020) 0.563 26.032 ( -0.590 0.000 0.443) 0.738 28.304 ( 0.060 0.000 -0.025) 0.065 28.369 ( 0.907 0.000 0.238) 0.937 28.449 ( -0.516 0.000 -0.270) 0.583 28.579 ( -0.193 0.000 1.340) 1.354 28.618 ( -0.439 0.000 0.010) 0.439 28.673 ( -0.488 0.000 -1.614) 1.686 28.831 ( -0.490 0.000 0.290) 0.569 28.988 ( -0.216 0.000 -0.019) 0.217 32.378 ( 1.641 0.000 -0.099) 1.644 32.425 ( -1.159 0.000 0.640) 1.324 32.484 ( 1.182 0.000 0.715) 1.381 32.526 ( -1.231 0.000 -0.995) 1.583 35.405 ( 0.337 0.000 0.217) 0.401 35.443 ( -0.244 0.000 -0.335) 0.414 35.449 ( 0.062 0.000 0.381) 0.386 35.533 ( -0.068 0.000 -0.105) 0.125 88.831 ( 0.497 0.000 0.178) 0.528 88.855 ( 1.473 0.000 -2.212) 2.657 89.115 ( 1.732 0.000 0.253) 1.750 89.519 ( 0.954 0.000 2.433) 2.613 97.695 ( 0.735 0.000 1.378) 1.562 97.711 ( 0.549 0.000 0.177) 0.577 97.722 ( 0.129 0.000 -2.614) 2.617 97.916 ( 1.588 0.000 0.837) 1.795 98.701 ( -0.269 0.000 -0.069) 0.278 98.708 ( 0.226 0.000 0.164) 0.280 98.749 ( -0.385 0.000 0.349) 0.520 98.760 ( -0.497 0.000 -0.397) 0.636 99.614 ( 0.051 0.000 0.289) 0.294 99.639 ( -0.583 0.000 1.002) 1.159 99.699 ( -0.698 0.000 -3.572) 3.639 100.497 ( 0.123 0.000 0.660) 0.672 ======================= 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| 0.455 ( 0.000 20.604 0.000) 20.604 0.505 ( 0.000 23.365 0.000) 23.365 0.801 ( 0.000 35.571 0.000) 35.571 1.739 ( 0.000 -6.308 0.000) 6.308 1.860 ( 0.000 2.347 0.000) 2.347 2.029 ( 0.000 2.549 0.000) 2.549 2.061 ( 0.000 -1.768 0.000) 1.768 2.167 ( 0.000 2.010 0.000) 2.010 2.203 ( 0.000 -0.910 0.000) 0.910 2.282 ( 0.000 -3.526 0.000) 3.526 2.367 ( 0.000 -7.217 0.000) 7.217 2.510 ( 0.000 3.652 0.000) 3.652 2.548 ( 0.000 -2.232 0.000) 2.232 2.675 ( 0.000 0.310 0.000) 0.310 2.762 ( 0.000 4.564 0.000) 4.564 2.856 ( 0.000 -2.713 0.000) 2.713 3.061 ( 0.000 11.184 0.000) 11.184 3.115 ( 0.000 -6.340 0.000) 6.340 3.222 ( 0.000 -3.330 0.000) 3.330 3.270 ( 0.000 -0.351 0.000) 0.351 3.349 ( 0.000 -2.435 0.000) 2.435 3.411 ( 0.000 3.097 0.000) 3.097 3.517 ( 0.000 2.694 0.000) 2.694 3.601 ( 0.000 -0.975 0.000) 0.975 4.437 ( 0.000 -4.817 0.000) 4.817 4.523 ( 0.000 -4.771 0.000) 4.771 4.807 ( 0.000 0.077 0.000) 0.077 4.817 ( 0.000 -3.934 0.000) 3.934 4.925 ( 0.000 -4.857 0.000) 4.857 5.107 ( 0.000 -3.785 0.000) 3.785 5.113 ( 0.000 1.968 0.000) 1.968 5.210 ( 0.000 0.221 0.000) 0.221 5.313 ( 0.000 3.621 0.000) 3.621 5.316 ( 0.000 -0.757 0.000) 0.757 5.476 ( 0.000 -1.212 0.000) 1.212 5.519 ( 0.000 -0.569 0.000) 0.569 5.591 ( 0.000 -7.248 0.000) 7.248 5.607 ( 0.000 -3.605 0.000) 3.605 5.764 ( 0.000 1.879 0.000) 1.879 5.874 ( 0.000 -0.949 0.000) 0.949 6.061 ( 0.000 5.565 0.000) 5.565 6.115 ( 0.000 9.941 0.000) 9.941 6.161 ( 0.000 -6.215 0.000) 6.215 6.239 ( 0.000 -4.088 0.000) 4.088 6.339 ( 0.000 3.583 0.000) 3.583 6.372 ( 0.000 4.216 0.000) 4.216 6.595 ( 0.000 5.912 0.000) 5.912 6.963 ( 0.000 -0.482 0.000) 0.482 7.040 ( 0.000 1.165 0.000) 1.165 7.164 ( 0.000 -0.499 0.000) 0.499 7.291 ( 0.000 -1.209 0.000) 1.209 7.364 ( 0.000 7.925 0.000) 7.925 7.458 ( 0.000 4.902 0.000) 4.902 7.767 ( 0.000 3.413 0.000) 3.413 8.033 ( 0.000 -4.231 0.000) 4.231 8.223 ( 0.000 3.349 0.000) 3.349 8.425 ( 0.000 -0.656 0.000) 0.656 8.649 ( 0.000 -2.866 0.000) 2.866 8.671 ( 0.000 -1.443 0.000) 1.443 8.725 ( 0.000 -1.590 0.000) 1.590 8.733 ( 0.000 -1.807 0.000) 1.807 8.995 ( 0.000 -1.512 0.000) 1.512 9.047 ( 0.000 1.179 0.000) 1.179 9.193 ( 0.000 2.364 0.000) 2.364 9.339 ( 0.000 0.954 0.000) 0.954 9.601 ( 0.000 -9.439 0.000) 9.439 9.803 ( 0.000 0.586 0.000) 0.586 9.832 ( 0.000 -2.119 0.000) 2.119 10.269 ( 0.000 5.172 0.000) 5.172 10.329 ( 0.000 1.290 0.000) 1.290 10.581 ( 0.000 -0.557 0.000) 0.557 10.910 ( 0.000 -4.098 0.000) 4.098 20.623 ( 0.000 0.844 0.000) 0.844 20.810 ( 0.000 -2.726 0.000) 2.726 20.910 ( 0.000 1.681 0.000) 1.681 20.923 ( 0.000 0.522 0.000) 0.522 22.785 ( 0.000 0.826 0.000) 0.826 22.867 ( 0.000 -0.402 0.000) 0.402 23.066 ( 0.000 1.135 0.000) 1.135 23.143 ( 0.000 -0.098 0.000) 0.098 24.660 ( 0.000 -0.254 0.000) 0.254 24.718 ( 0.000 -1.852 0.000) 1.852 24.879 ( 0.000 1.437 0.000) 1.437 24.899 ( 0.000 0.174 0.000) 0.174 25.871 ( 0.000 0.389 0.000) 0.389 25.878 ( 0.000 0.411 0.000) 0.411 26.092 ( 0.000 1.142 0.000) 1.142 26.359 ( 0.000 -2.983 0.000) 2.983 28.287 ( 0.000 -0.249 0.000) 0.249 28.307 ( 0.000 -0.284 0.000) 0.284 28.535 ( 0.000 0.062 0.000) 0.062 28.564 ( 0.000 -0.562 0.000) 0.562 28.645 ( 0.000 1.223 0.000) 1.223 28.671 ( 0.000 0.376 0.000) 0.376 28.702 ( 0.000 -0.376 0.000) 0.376 28.857 ( 0.000 -1.433 0.000) 1.433 32.287 ( 0.000 0.592 0.000) 0.592 32.345 ( 0.000 -0.385 0.000) 0.385 32.435 ( 0.000 1.543 0.000) 1.543 32.623 ( 0.000 -1.248 0.000) 1.248 35.351 ( 0.000 0.638 0.000) 0.638 35.505 ( 0.000 -2.168 0.000) 2.168 35.525 ( 0.000 0.959 0.000) 0.959 35.575 ( 0.000 0.821 0.000) 0.821 88.692 ( 0.000 0.524 0.000) 0.524 88.757 ( 0.000 -0.482 0.000) 0.482 88.934 ( 0.000 0.749 0.000) 0.749 89.124 ( 0.000 -1.926 0.000) 1.926 97.627 ( 0.000 -0.168 0.000) 0.168 97.637 ( 0.000 -0.113 0.000) 0.113 97.647 ( 0.000 0.310 0.000) 0.310 97.686 ( 0.000 -0.457 0.000) 0.457 98.673 ( 0.000 -0.201 0.000) 0.201 98.674 ( 0.000 0.426 0.000) 0.426 98.913 ( 0.000 4.239 0.000) 4.239 99.424 ( 0.000 -4.874 0.000) 4.874 99.628 ( 0.000 2.550 0.000) 2.550 99.733 ( 0.000 0.182 0.000) 0.182 99.772 ( 0.000 0.688 0.000) 0.688 99.976 ( 0.000 -1.909 0.000) 1.909 ======================= 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| 0.529 ( 9.789 16.191 3.372) 19.219 0.677 ( 11.872 14.075 15.090) 23.807 1.133 ( 24.998 25.109 6.479) 36.019 1.759 ( 2.077 -4.545 1.214) 5.142 1.878 ( -1.255 2.351 5.367) 5.992 1.989 ( 1.113 1.973 -10.740) 10.976 2.070 ( 1.181 -1.911 1.120) 2.510 2.166 ( -1.023 -5.364 0.853) 5.527 2.195 ( -2.950 5.892 4.079) 7.750 2.273 ( 0.063 -2.078 -0.917) 2.272 2.376 ( -2.123 -3.432 4.912) 6.357 2.504 ( -0.011 -0.489 -0.475) 0.682 2.551 ( -1.046 -3.533 3.292) 4.941 2.644 ( -2.999 0.956 -1.142) 3.349 2.790 ( 0.950 3.975 2.142) 4.615 2.863 ( -1.834 -2.179 3.288) 4.350 3.022 ( -3.499 9.074 -0.620) 9.745 3.111 ( -0.198 -5.293 -0.829) 5.361 3.185 ( -4.451 -1.957 0.294) 4.871 3.253 ( -0.367 0.505 -2.172) 2.259 3.337 ( 0.654 -3.055 -4.270) 5.291 3.393 ( -0.566 1.906 -2.424) 3.135 3.519 ( 1.389 3.404 -2.776) 4.607 3.592 ( 3.452 -0.642 -5.940) 6.900 4.417 ( -2.411 -3.995 0.578) 4.701 4.492 ( -4.111 1.510 0.097) 4.381 4.685 ( -3.072 -0.804 -9.636) 10.146 4.798 ( -1.723 -3.323 -1.410) 4.000 4.837 ( -0.394 0.662 2.328) 2.452 5.001 ( -4.529 4.079 -0.661) 6.131 5.077 ( -1.884 0.899 -7.631) 7.912 5.138 ( -3.164 -0.162 0.856) 3.282 5.283 ( 3.742 0.066 3.364) 5.032 5.393 ( -2.778 -4.127 -2.597) 5.612 5.514 ( 1.430 -0.821 -0.754) 1.813 5.538 ( -2.029 -0.343 1.731) 2.689 5.619 ( -0.592 -5.764 2.410) 6.276 5.715 ( 1.550 -5.975 6.694) 9.105 5.748 ( 2.534 -0.530 -2.962) 3.934 5.875 ( -0.214 -1.791 1.017) 2.071 6.029 ( -9.999 -1.979 5.827) 11.741 6.091 ( -3.024 9.423 -1.488) 10.007 6.107 ( 3.011 4.772 1.004) 5.732 6.182 ( -8.925 1.626 -0.162) 9.073 6.317 ( 0.476 2.987 -1.825) 3.533 6.460 ( -0.207 3.076 -0.645) 3.150 6.665 ( 7.376 -0.170 0.912) 7.435 6.982 ( -3.825 -3.645 -3.795) 6.505 7.039 ( 0.278 -1.151 1.513) 1.921 7.120 ( -3.776 1.959 -4.225) 5.996 7.242 ( 1.572 2.425 -4.854) 5.649 7.315 ( 1.555 0.288 0.049) 1.582 7.546 ( -2.296 2.670 11.873) 12.384 7.815 ( -6.130 -4.613 9.863) 12.495 8.017 ( -7.265 4.020 -7.306) 11.060 8.030 ( -5.145 -1.212 -0.867) 5.357 8.414 ( -8.207 -0.423 6.067) 10.215 8.635 ( -0.334 -1.265 -2.345) 2.685 8.692 ( 1.400 1.503 -3.067) 3.691 8.701 ( -0.077 -4.411 1.137) 4.555 8.786 ( 3.137 0.363 2.888) 4.279 9.044 ( 1.780 0.787 5.889) 6.202 9.111 ( 6.834 0.638 -3.985) 7.936 9.229 ( 6.607 2.993 0.661) 7.283 9.329 ( -1.032 -1.770 0.278) 2.068 9.549 ( -0.513 -4.811 -3.264) 5.836 9.794 ( 6.322 -0.663 -7.127) 9.550 9.868 ( -0.265 0.885 3.087) 3.222 10.245 ( -2.497 4.187 2.852) 5.648 10.401 ( 5.699 1.132 1.781) 6.077 10.635 ( 6.307 -4.003 -5.615) 9.345 10.957 ( 4.210 -4.450 1.957) 6.430 20.601 ( -1.914 2.122 -1.770) 3.361 20.669 ( -7.137 4.837 -3.506) 9.307 20.876 ( -1.109 2.014 -0.349) 2.326 20.919 ( -0.790 0.573 0.415) 1.061 22.802 ( 0.877 0.654 1.562) 1.907 22.851 ( -0.935 0.162 -1.392) 1.685 23.081 ( 0.888 0.258 0.954) 1.328 23.133 ( -0.248 0.027 -1.149) 1.176 24.665 ( -2.281 -1.872 2.665) 3.976 24.719 ( -0.354 -2.453 0.656) 2.564 24.880 ( 0.368 1.665 0.206) 1.717 24.917 ( 0.860 0.747 1.245) 1.687 25.832 ( -4.769 0.502 0.077) 4.796 25.854 ( -2.708 0.582 0.218) 2.779 26.085 ( -0.400 0.948 -0.687) 1.237 26.184 ( -8.355 5.770 -2.764) 10.524 28.278 ( 0.422 0.051 0.434) 0.608 28.311 ( -1.214 -0.265 1.558) 1.993 28.527 ( -0.639 0.226 -0.457) 0.817 28.613 ( -1.798 0.927 0.346) 2.052 28.655 ( -0.417 -1.207 -0.396) 1.337 28.698 ( 1.803 -1.653 0.580) 2.514 28.813 ( 8.274 -7.819 3.854) 12.019 28.854 ( -0.468 -1.308 0.198) 1.403 32.293 ( 0.736 0.539 0.083) 0.916 32.380 ( 0.556 -1.640 3.300) 3.727 32.440 ( 0.391 1.462 0.228) 1.530 32.609 ( -0.921 -0.688 -0.598) 1.296 35.358 ( 0.458 0.582 0.452) 0.868 35.465 ( -2.772 0.675 -0.503) 2.897 35.517 ( -0.152 1.362 -1.485) 2.021 35.551 ( -0.891 0.945 0.159) 1.308 88.754 ( 9.191 -2.875 -8.037) 12.544 88.765 ( 2.356 -0.736 -2.094) 3.237 88.954 ( 3.096 1.021 -1.139) 3.453 89.168 ( 3.412 -1.767 2.809) 4.759 97.629 ( 0.912 -0.059 -0.325) 0.970 97.637 ( 0.540 0.193 0.525) 0.777 97.692 ( 3.763 -2.004 -1.926) 4.678 97.715 ( 3.764 -1.292 -1.391) 4.215 98.669 ( 0.106 0.329 0.052) 0.349 98.691 ( 0.677 -0.489 0.913) 1.238 98.890 ( -1.950 4.310 -1.176) 4.874 99.074 ( -11.554 11.678 -8.083) 18.309 99.601 ( 0.020 1.408 0.696) 1.571 99.725 ( -1.403 0.540 0.102) 1.507 99.932 ( -0.635 -1.802 -3.349) 3.855 100.164 ( 9.504 -13.834 10.543) 19.821 ======================= 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| 0.846 ( 18.892 4.297 5.968) 20.273 1.063 ( 14.363 9.154 14.482) 22.357 1.608 ( 20.777 13.594 6.150) 25.579 1.834 ( 4.300 -1.110 1.631) 4.731 1.894 ( 4.014 1.195 -9.956) 10.801 1.945 ( -0.475 4.037 5.301) 6.681 2.078 ( 1.229 -1.966 0.524) 2.377 2.091 ( -5.361 1.323 0.941) 5.601 2.258 ( -0.378 -0.070 2.212) 2.245 2.295 ( 1.446 -3.872 7.302) 8.390 2.400 ( -1.222 1.846 5.881) 6.284 2.492 ( -1.805 -3.290 0.093) 3.753 2.559 ( -4.506 2.022 -1.552) 5.177 2.587 ( -0.678 -4.836 4.589) 6.701 2.802 ( -3.938 3.355 3.776) 6.405 2.865 ( -2.041 -0.812 3.754) 4.350 2.956 ( -3.636 3.799 0.298) 5.267 3.070 ( -2.546 -2.770 -4.320) 5.729 3.117 ( -2.101 -1.953 -0.366) 2.892 3.204 ( -2.340 2.171 -2.772) 4.228 3.280 ( 0.008 -2.885 -6.987) 7.559 3.346 ( -1.281 -0.344 -3.218) 3.480 3.487 ( 1.322 4.829 -7.196) 8.766 3.606 ( 5.962 0.212 -6.743) 9.003 4.381 ( -2.011 -2.099 0.682) 2.985 4.452 ( -1.062 1.056 0.925) 1.760 4.630 ( 1.294 -4.195 -3.168) 5.414 4.725 ( -4.623 -2.627 -2.060) 5.702 4.845 ( -2.669 -2.181 1.295) 3.682 4.937 ( -1.095 4.158 -1.909) 4.705 4.991 ( -0.982 3.522 -0.890) 3.764 5.109 ( -2.762 -2.602 3.483) 5.151 5.318 ( -2.212 -3.855 -3.186) 5.468 5.365 ( 1.024 -1.484 -1.390) 2.277 5.477 ( -0.225 -1.148 -5.549) 5.672 5.525 ( -1.725 -1.039 3.934) 4.420 5.598 ( -3.948 -1.196 2.555) 4.853 5.752 ( -1.821 0.684 3.497) 4.002 5.774 ( -1.917 -5.613 1.623) 6.150 5.848 ( -5.853 -1.307 -2.279) 6.416 5.927 ( -12.845 1.096 2.912) 13.217 5.975 ( -0.768 -1.265 0.359) 1.523 6.074 ( -1.518 4.778 1.130) 5.139 6.196 ( 5.167 5.962 0.504) 7.906 6.300 ( -0.024 3.008 -3.676) 4.750 6.404 ( -1.734 0.670 -5.108) 5.436 6.745 ( 1.466 3.752 -0.598) 4.072 6.786 ( -7.717 -3.029 -8.181) 11.647 6.953 ( -7.437 -0.487 -5.068) 9.013 7.082 ( 0.227 -3.307 2.318) 4.045 7.251 ( 2.580 2.169 -1.459) 3.673 7.403 ( 5.455 -0.731 1.702) 5.761 7.540 ( -10.981 1.553 0.974) 11.133 7.706 ( -12.403 -2.561 8.452) 15.226 7.836 ( -7.323 7.224 5.434) 11.634 8.029 ( -1.262 -2.600 3.038) 4.194 8.324 ( -8.230 2.774 4.702) 9.876 8.580 ( -0.829 1.101 -5.593) 5.760 8.666 ( 0.621 -1.184 -3.633) 3.871 8.735 ( 0.354 -3.101 3.016) 4.341 8.872 ( 1.572 2.648 4.431) 5.396 9.097 ( 2.012 2.127 -1.382) 3.237 9.193 ( 5.139 1.080 1.555) 5.477 9.312 ( -0.719 -5.411 -0.466) 5.478 9.432 ( 13.371 2.305 1.901) 13.701 9.572 ( 5.387 0.444 -1.045) 5.505 9.797 ( 2.840 0.163 -6.515) 7.109 9.929 ( 5.401 -1.486 -0.336) 5.612 10.258 ( 0.296 1.372 2.787) 3.120 10.510 ( 4.382 0.309 1.710) 4.714 10.645 ( 1.955 -3.063 -4.675) 5.921 11.077 ( 6.206 -5.621 3.286) 8.995 20.535 ( -2.458 4.132 -0.954) 4.902 20.590 ( -1.926 1.038 -1.265) 2.527 20.854 ( -1.339 1.409 -0.000) 1.944 20.907 ( -1.047 0.476 0.289) 1.186 22.801 ( -1.760 0.702 -2.167) 2.878 22.850 ( 1.553 0.589 2.064) 2.650 23.089 ( -0.540 -0.843 -1.303) 1.643 23.138 ( 1.588 0.027 1.403) 2.119 24.636 ( -3.142 -1.708 0.933) 3.696 24.717 ( -0.844 -3.823 0.822) 4.001 24.895 ( 0.824 2.770 0.626) 2.957 24.947 ( 1.090 1.384 1.173) 2.116 25.738 ( -5.812 0.683 -0.529) 5.876 25.793 ( -4.737 1.016 0.633) 4.886 26.064 ( -1.201 0.657 -0.587) 1.490 26.088 ( -3.452 2.576 0.713) 4.366 28.301 ( 1.247 -0.325 0.825) 1.530 28.306 ( -0.536 -0.124 0.478) 0.728 28.506 ( -0.998 0.638 -0.760) 1.408 28.586 ( -1.848 0.885 0.871) 2.226 28.637 ( -0.965 -1.046 -0.458) 1.495 28.719 ( 0.779 -0.342 -0.394) 0.938 28.842 ( -1.015 -1.390 -0.001) 1.721 28.921 ( 2.286 -5.851 1.384) 6.433 32.314 ( 1.494 0.433 0.234) 1.573 32.413 ( -0.111 -1.242 2.255) 2.577 32.452 ( 0.771 1.361 0.263) 1.586 32.586 ( -0.936 -0.429 -0.838) 1.328 35.375 ( 0.792 0.470 0.686) 1.149 35.436 ( -0.882 0.392 0.366) 1.032 35.495 ( -0.662 1.378 -1.043) 1.851 35.543 ( -0.322 0.175 -0.090) 0.377 88.782 ( 1.494 -0.763 -0.251) 1.696 88.805 ( 6.974 -2.596 -7.802) 10.782 89.008 ( 4.536 1.537 -0.842) 4.863 89.281 ( 4.521 -2.424 5.072) 7.214 97.645 ( 1.212 -0.193 -0.154) 1.237 97.661 ( 1.516 0.169 0.467) 1.595 97.726 ( 3.350 -2.248 -3.597) 5.405 97.765 ( 3.360 -0.997 0.620) 3.559 98.676 ( 0.445 0.219 0.166) 0.523 98.712 ( 0.558 -0.514 0.953) 1.218 98.833 ( -2.807 4.612 -1.118) 5.514 98.910 ( -4.428 6.729 -2.077) 8.319 99.614 ( 0.276 1.753 1.065) 2.070 99.693 ( -2.314 0.464 0.008) 2.360 99.863 ( -1.227 -0.565 -5.764) 5.920 100.330 ( 2.961 -9.622 4.661) 11.094 ======================= 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| 1.212 ( 15.903 1.782 6.366) 17.222 1.432 ( 12.840 5.847 11.193) 18.009 1.828 ( 5.666 1.637 -8.488) 10.336 1.839 ( 1.997 3.972 -0.472) 4.470 1.923 ( 1.050 4.194 -1.705) 4.648 1.986 ( -0.713 1.730 3.554) 4.016 2.079 ( 3.916 -0.220 3.945) 5.563 2.209 ( 5.931 2.828 1.471) 6.733 2.302 ( 4.368 -0.123 6.085) 7.492 2.345 ( -3.457 -1.399 3.379) 5.032 2.423 ( -4.100 -4.281 0.251) 5.933 2.447 ( -2.415 1.470 2.653) 3.878 2.553 ( 2.172 1.310 7.768) 8.172 2.594 ( -4.180 -1.140 2.706) 5.108 2.766 ( -5.086 0.904 6.270) 8.124 2.860 ( -1.662 1.865 -0.392) 2.529 2.945 ( 0.083 -2.396 3.548) 4.283 2.971 ( -2.930 0.036 -2.489) 3.845 3.085 ( -0.136 -2.328 -3.135) 3.908 3.139 ( -0.848 -0.403 -3.368) 3.497 3.185 ( -1.737 -0.911 -8.336) 8.564 3.288 ( -1.834 0.044 -3.047) 3.557 3.418 ( -0.318 5.851 -6.789) 8.968 3.635 ( 5.341 -0.325 -5.757) 7.859 4.367 ( -1.681 -0.825 1.717) 2.541 4.461 ( 1.092 -2.926 0.413) 3.150 4.616 ( -1.258 -3.599 -1.416) 4.067 4.628 ( -3.384 -2.573 -1.550) 4.525 4.788 ( -3.668 -1.387 0.261) 3.931 4.932 ( 1.934 2.998 -0.464) 3.598 5.019 ( 4.309 2.674 -1.507) 5.291 5.104 ( -3.138 -1.011 2.059) 3.887 5.218 ( -6.079 -0.380 -0.166) 6.093 5.328 ( 0.198 -4.423 -4.145) 6.065 5.424 ( -1.428 -3.808 -2.701) 4.882 5.529 ( -2.645 -2.575 0.799) 3.777 5.575 ( -0.805 -1.118 1.243) 1.856 5.598 ( -11.322 -0.314 -2.047) 11.509 5.706 ( -9.951 0.380 2.339) 10.230 5.770 ( -4.290 1.529 4.199) 6.195 5.801 ( -2.374 -3.263 -0.256) 4.043 6.007 ( 0.364 -0.154 -0.128) 0.416 6.161 ( 5.941 -0.298 6.013) 8.458 6.184 ( -2.749 2.302 -5.898) 6.902 6.292 ( 3.734 2.975 -1.624) 5.043 6.328 ( -0.844 -1.385 -4.336) 4.629 6.610 ( -2.902 -1.181 -7.271) 7.917 6.709 ( -4.278 8.296 -1.505) 9.455 6.799 ( -5.607 -4.450 -2.326) 7.527 7.081 ( -4.096 -5.010 -0.296) 6.478 7.270 ( 1.156 1.096 -1.500) 2.188 7.340 ( -2.614 6.221 -3.703) 7.697 7.512 ( 4.587 4.393 1.353) 6.494 7.649 ( -10.503 1.364 13.061) 16.816 7.804 ( -5.139 4.495 6.028) 9.108 8.048 ( -1.021 -2.754 4.209) 5.133 8.252 ( -5.890 2.248 3.237) 7.087 8.510 ( 0.384 1.493 -6.081) 6.273 8.634 ( 0.069 -0.711 -3.082) 3.164 8.759 ( -2.112 -0.752 3.232) 3.934 8.909 ( 0.284 0.698 0.131) 0.765 9.141 ( 2.771 5.452 2.299) 6.533 9.261 ( 4.088 -6.292 -4.643) 8.824 9.319 ( -0.164 3.379 4.021) 5.255 9.647 ( 8.957 2.552 1.063) 9.374 9.673 ( 6.411 -0.001 0.785) 6.459 9.779 ( 3.767 -1.210 -6.157) 7.319 10.003 ( 4.009 -2.440 -1.344) 4.882 10.314 ( 2.551 -0.330 3.257) 4.150 10.558 ( -0.525 -1.489 -0.270) 1.601 10.625 ( 1.113 -1.079 -1.959) 2.498 11.208 ( 4.868 -6.724 3.157) 8.881 20.505 ( -0.927 2.309 -0.010) 2.488 20.551 ( -1.265 0.603 -1.029) 1.739 20.832 ( -1.208 1.193 -0.011) 1.698 20.893 ( -0.917 0.365 0.183) 1.004 22.746 ( -1.729 1.181 -2.101) 2.966 22.898 ( 1.409 -0.036 1.752) 2.248 23.059 ( -0.710 -0.496 -1.569) 1.792 23.191 ( 1.913 -1.043 2.029) 2.977 24.593 ( -2.417 -1.366 0.058) 2.777 24.709 ( -0.952 -4.879 0.488) 4.995 24.917 ( 0.834 3.882 0.751) 4.041 24.975 ( 0.950 1.625 0.816) 2.052 25.639 ( -4.785 1.383 -0.990) 5.079 25.725 ( -4.125 0.788 0.964) 4.309 26.039 ( -1.446 -0.021 0.100) 1.450 26.052 ( -2.033 0.685 0.592) 2.226 28.303 ( -0.027 -0.035 0.026) 0.052 28.333 ( 1.430 -0.647 0.626) 1.690 28.482 ( -0.831 1.157 -0.679) 1.578 28.573 ( -1.222 0.372 1.479) 1.954 28.616 ( -0.886 -1.154 -0.638) 1.589 28.718 ( 0.008 0.945 -0.886) 1.295 28.823 ( -1.216 -1.657 0.067) 2.056 28.950 ( 0.469 -3.583 0.497) 3.648 32.345 ( 1.915 0.173 0.167) 1.930 32.424 ( -0.885 -0.914 1.353) 1.858 32.472 ( 1.207 1.254 0.325) 1.771 32.560 ( -1.016 0.017 -0.944) 1.387 35.395 ( 0.739 0.380 0.546) 0.994 35.434 ( -0.014 -0.291 0.415) 0.507 35.475 ( -0.744 1.267 -0.559) 1.572 35.537 ( -0.241 -0.030 -0.187) 0.306 88.804 ( 1.360 -0.857 -0.126) 1.612 88.829 ( 3.929 -1.827 -4.586) 6.309 89.077 ( 4.065 1.564 -0.067) 4.356 89.404 ( 3.284 -3.201 4.880) 6.697 97.666 ( 1.187 -0.247 0.260) 1.240 97.691 ( 1.328 0.041 0.367) 1.379 97.729 ( 1.600 -1.226 -3.161) 3.749 97.835 ( 3.349 -1.717 1.430) 4.026 98.687 ( 0.725 0.220 0.032) 0.758 98.729 ( 0.329 0.160 0.803) 0.883 98.786 ( -1.839 3.489 -0.355) 3.960 98.836 ( -2.947 3.664 -1.066) 4.821 99.620 ( -0.941 1.077 0.077) 1.432 99.663 ( -0.888 0.916 0.601) 1.411 99.783 ( -0.957 1.203 -5.349) 5.566 100.399 ( 1.294 -6.948 2.420) 7.470 ======================= 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| 1.461 ( 6.638 3.063 2.912) 7.869 1.672 ( 3.871 2.721 4.873) 6.792 1.814 ( 3.187 2.906 -4.237) 6.046 1.853 ( 0.506 5.891 -1.755) 6.167 1.941 ( 1.728 1.035 2.155) 2.950 2.022 ( -0.283 2.203 5.874) 6.280 2.133 ( 0.981 -0.689 -6.551) 6.660 2.258 ( 4.379 1.731 -1.691) 5.003 2.287 ( -2.172 -3.523 0.147) 4.142 2.354 ( -6.137 0.662 2.155) 6.538 2.424 ( -0.583 1.985 3.346) 3.933 2.466 ( -1.362 -1.060 2.166) 2.770 2.576 ( 2.528 0.861 2.200) 3.460 2.675 ( 1.661 -0.611 4.229) 4.584 2.778 ( -1.450 -0.045 3.986) 4.242 2.833 ( -0.925 0.260 2.396) 2.581 2.892 ( -1.920 0.058 -0.983) 2.158 3.041 ( -0.613 -1.818 -2.325) 3.014 3.053 ( 3.347 -1.161 -2.720) 4.467 3.069 ( -0.731 0.249 -0.779) 1.097 3.115 ( 0.357 -2.636 -0.208) 2.669 3.210 ( -2.815 0.051 -4.348) 5.180 3.352 ( -0.846 6.806 -2.568) 7.323 3.657 ( 2.251 -1.644 -2.250) 3.582 4.357 ( -0.946 -0.328 0.756) 1.255 4.495 ( 2.155 -4.721 0.765) 5.246 4.552 ( -2.655 -3.285 -1.266) 4.410 4.599 ( -0.595 -1.683 -0.455) 1.843 4.747 ( -1.492 -0.286 0.351) 1.559 4.969 ( 2.418 1.436 -0.885) 2.948 5.018 ( -4.832 0.748 -0.370) 4.904 5.082 ( 4.742 0.817 -2.300) 5.333 5.159 ( -4.397 1.873 3.146) 5.722 5.300 ( 0.345 -3.727 -2.171) 4.327 5.360 ( -2.413 -5.241 -0.583) 5.799 5.474 ( -0.843 -1.118 -0.972) 1.704 5.492 ( -3.342 -4.045 0.483) 5.269 5.561 ( -3.563 -3.850 0.430) 5.264 5.629 ( 2.060 0.545 0.956) 2.336 5.744 ( -0.452 0.385 -0.873) 1.056 5.771 ( -4.888 -2.700 2.292) 6.037 5.944 ( -2.328 2.456 -2.191) 4.031 6.138 ( 0.449 -3.320 -1.521) 3.680 6.278 ( -0.044 -1.639 -1.033) 1.938 6.327 ( 3.441 -2.560 5.892) 7.288 6.336 ( 2.215 6.441 -0.958) 6.879 6.520 ( 0.804 -0.811 -6.180) 6.285 6.635 ( -2.619 8.604 -0.714) 9.022 6.690 ( -4.876 -3.134 -0.433) 5.812 6.984 ( -2.905 -2.351 -1.635) 4.079 7.293 ( 1.652 1.274 0.087) 2.088 7.329 ( 0.343 5.228 0.152) 5.242 7.584 ( 3.865 6.699 -1.720) 7.923 7.622 ( -5.493 5.744 6.792) 10.455 7.786 ( -2.115 2.406 2.231) 3.904 8.086 ( 0.380 -3.503 3.337) 4.853 8.189 ( -3.441 -0.709 0.023) 3.514 8.474 ( 0.859 2.492 -2.717) 3.786 8.609 ( -0.281 -0.354 -0.962) 1.063 8.738 ( -2.093 1.309 0.994) 2.661 8.910 ( 0.469 -0.875 -0.636) 1.179 9.206 ( 1.211 8.698 2.194) 9.052 9.264 ( 1.406 -5.645 -2.252) 6.238 9.351 ( 0.121 3.416 1.173) 3.614 9.740 ( 2.659 4.452 0.202) 5.190 9.746 ( 1.814 -4.265 -1.179) 4.783 9.812 ( 3.268 -1.516 -0.774) 3.685 10.034 ( 1.183 -2.456 -0.592) 2.790 10.404 ( 4.007 -1.320 2.982) 5.166 10.499 ( -3.682 -1.767 -2.316) 4.695 10.636 ( 0.643 -0.539 -0.061) 0.841 11.289 ( 1.732 -7.200 1.329) 7.523 20.497 ( -0.218 1.563 0.069) 1.579 20.528 ( -0.480 0.452 -0.402) 0.772 20.818 ( -0.486 1.092 -0.014) 1.195 20.883 ( -0.368 0.301 0.062) 0.479 22.709 ( -0.702 1.307 -0.825) 1.698 22.926 ( 0.497 -0.797 0.524) 1.075 23.040 ( -0.234 0.048 -0.488) 0.543 23.231 ( 0.837 -1.610 0.869) 2.012 24.564 ( -0.899 -1.199 -0.062) 1.500 24.700 ( -0.418 -5.326 0.127) 5.344 24.934 ( 0.349 4.612 0.369) 4.640 24.993 ( 0.388 1.529 0.272) 1.601 25.572 ( -1.910 2.001 -0.485) 2.808 25.684 ( -1.605 0.486 0.445) 1.735 26.021 ( -0.638 -0.318 0.047) 0.714 26.033 ( -0.755 -0.003 0.243) 0.793 28.304 ( 0.077 0.032 -0.014) 0.084 28.356 ( 0.667 -1.031 0.206) 1.245 28.468 ( -0.244 1.596 -0.254) 1.634 28.573 ( -0.535 -0.449 1.135) 1.332 28.598 ( -0.295 -1.062 -0.639) 1.274 28.706 ( -0.183 2.321 -0.597) 2.404 28.808 ( -0.546 -2.122 0.093) 2.193 28.957 ( 0.059 -2.631 0.140) 2.636 32.376 ( 1.462 -0.153 -0.027) 1.470 32.416 ( -1.097 -0.780 0.525) 1.445 32.497 ( 1.093 1.020 0.486) 1.572 32.534 ( -0.954 0.626 -0.736) 1.358 35.407 ( 0.210 0.196 0.141) 0.319 35.442 ( 0.553 -0.165 0.290) 0.646 35.459 ( -0.705 0.948 -0.246) 1.207 35.532 ( -0.094 -0.097 -0.078) 0.156 88.820 ( 0.506 -0.934 0.084) 1.066 88.839 ( 1.321 -1.392 -1.629) 2.517 89.128 ( 1.685 1.346 0.088) 2.158 89.479 ( 1.079 -3.596 2.040) 4.273 97.688 ( 0.725 -0.479 0.910) 1.258 97.705 ( 0.269 -0.550 -0.749) 0.967 97.720 ( 0.468 0.028 -1.045) 1.146 97.890 ( 1.435 -2.298 0.707) 2.800 98.699 ( 0.636 0.426 -0.010) 0.766 98.737 ( -0.225 1.564 0.355) 1.619 98.768 ( 0.104 1.908 -0.070) 1.912 98.788 ( -1.840 2.195 -0.415) 2.894 99.597 ( -0.854 -0.329 -0.367) 0.986 99.674 ( 0.426 0.479 0.970) 1.162 99.726 ( -0.640 3.970 -2.601) 4.789 100.430 ( 0.409 -5.927 0.794) 5.994 ======================= 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| 0.873 ( 0.000 17.993 0.000) 17.993 0.999 ( 0.000 22.492 0.000) 22.492 1.389 ( 0.000 7.004 0.000) 7.004 1.685 ( 0.000 11.874 0.000) 11.874 1.866 ( 0.000 -14.384 0.000) 14.384 1.924 ( 0.000 3.472 0.000) 3.472 2.103 ( 0.000 3.692 0.000) 3.692 2.109 ( 0.000 -4.181 0.000) 4.181 2.207 ( 0.000 1.240 0.000) 1.240 2.225 ( 0.000 -3.057 0.000) 3.057 2.407 ( 0.000 8.038 0.000) 8.038 2.489 ( 0.000 -3.540 0.000) 3.540 2.546 ( 0.000 -1.515 0.000) 1.515 2.676 ( 0.000 1.255 0.000) 1.255 2.749 ( 0.000 -8.252 0.000) 8.252 2.901 ( 0.000 6.971 0.000) 6.971 2.916 ( 0.000 -10.322 0.000) 10.322 3.137 ( 0.000 -4.049 0.000) 4.049 3.247 ( 0.000 2.822 0.000) 2.822 3.307 ( 0.000 -1.551 0.000) 1.551 3.321 ( 0.000 7.702 0.000) 7.702 3.483 ( 0.000 3.465 0.000) 3.465 3.558 ( 0.000 -1.237 0.000) 1.237 3.574 ( 0.000 -0.045 0.000) 0.045 4.338 ( 0.000 -3.592 0.000) 3.592 4.393 ( 0.000 -6.167 0.000) 6.167 4.731 ( 0.000 -3.172 0.000) 3.172 4.762 ( 0.000 -4.045 0.000) 4.045 4.894 ( 0.000 2.766 0.000) 2.766 5.063 ( 0.000 -0.707 0.000) 0.707 5.173 ( 0.000 2.402 0.000) 2.402 5.175 ( 0.000 -3.255 0.000) 3.255 5.312 ( 0.000 0.534 0.000) 0.534 5.352 ( 0.000 -0.419 0.000) 0.419 5.436 ( 0.000 -2.010 0.000) 2.010 5.462 ( 0.000 -2.532 0.000) 2.532 5.517 ( 0.000 -1.620 0.000) 1.620 5.529 ( 0.000 -2.608 0.000) 2.608 5.824 ( 0.000 3.195 0.000) 3.195 5.857 ( 0.000 -0.213 0.000) 0.213 6.041 ( 0.000 -3.881 0.000) 3.881 6.123 ( 0.000 -5.212 0.000) 5.212 6.186 ( 0.000 5.431 0.000) 5.431 6.269 ( 0.000 4.149 0.000) 4.149 6.398 ( 0.000 1.346 0.000) 1.346 6.418 ( 0.000 -1.126 0.000) 1.126 6.813 ( 0.000 12.321 0.000) 12.321 6.970 ( 0.000 1.066 0.000) 1.066 7.090 ( 0.000 3.288 0.000) 3.288 7.194 ( 0.000 4.146 0.000) 4.146 7.244 ( 0.000 -3.097 0.000) 3.097 7.487 ( 0.000 0.880 0.000) 0.880 7.572 ( 0.000 5.223 0.000) 5.223 7.786 ( 0.000 -3.994 0.000) 3.994 8.011 ( 0.000 5.616 0.000) 5.616 8.297 ( 0.000 2.199 0.000) 2.199 8.405 ( 0.000 -0.860 0.000) 0.860 8.507 ( 0.000 -8.491 0.000) 8.491 8.663 ( 0.000 0.546 0.000) 0.546 8.696 ( 0.000 -1.321 0.000) 1.321 8.748 ( 0.000 3.277 0.000) 3.277 8.949 ( 0.000 -2.878 0.000) 2.878 9.064 ( 0.000 1.056 0.000) 1.056 9.246 ( 0.000 0.939 0.000) 0.939 9.366 ( 0.000 0.723 0.000) 0.723 9.371 ( 0.000 -9.284 0.000) 9.284 9.795 ( 0.000 -1.085 0.000) 1.085 9.796 ( 0.000 -1.235 0.000) 1.235 10.370 ( 0.000 3.852 0.000) 3.852 10.388 ( 0.000 3.562 0.000) 3.562 10.574 ( 0.000 0.510 0.000) 0.510 10.790 ( 0.000 -6.755 0.000) 6.755 20.651 ( 0.000 1.673 0.000) 1.673 20.750 ( 0.000 -2.759 0.000) 2.759 20.936 ( 0.000 0.597 0.000) 0.597 20.937 ( 0.000 0.805 0.000) 0.805 22.808 ( 0.000 1.198 0.000) 1.198 22.854 ( 0.000 -0.784 0.000) 0.784 23.095 ( 0.000 1.475 0.000) 1.475 23.138 ( 0.000 -0.418 0.000) 0.418 24.654 ( 0.000 -0.207 0.000) 0.207 24.679 ( 0.000 -1.544 0.000) 1.544 24.905 ( 0.000 0.846 0.000) 0.846 24.906 ( 0.000 0.442 0.000) 0.442 25.882 ( 0.000 0.550 0.000) 0.550 25.887 ( 0.000 0.389 0.000) 0.389 26.128 ( 0.000 2.235 0.000) 2.235 26.277 ( 0.000 -4.272 0.000) 4.272 28.283 ( 0.000 -0.013 0.000) 0.013 28.298 ( 0.000 -0.510 0.000) 0.510 28.537 ( 0.000 0.121 0.000) 0.121 28.550 ( 0.000 -0.571 0.000) 0.571 28.666 ( 0.000 0.579 0.000) 0.579 28.691 ( 0.000 -0.603 0.000) 0.603 28.698 ( 0.000 2.272 0.000) 2.272 28.814 ( 0.000 -2.478 0.000) 2.478 32.304 ( 0.000 0.843 0.000) 0.843 32.335 ( 0.000 -0.534 0.000) 0.534 32.478 ( 0.000 2.378 0.000) 2.378 32.586 ( 0.000 -2.194 0.000) 2.194 35.373 ( 0.000 1.347 0.000) 1.347 35.456 ( 0.000 -2.318 0.000) 2.318 35.550 ( 0.000 1.256 0.000) 1.256 35.583 ( 0.000 -0.039 0.000) 0.039 88.707 ( 0.000 0.812 0.000) 0.812 88.743 ( 0.000 -0.782 0.000) 0.782 88.960 ( 0.000 1.745 0.000) 1.745 89.070 ( 0.000 -2.895 0.000) 2.895 97.625 ( 0.000 0.022 0.000) 0.022 97.633 ( 0.000 -0.213 0.000) 0.213 97.654 ( 0.000 0.365 0.000) 0.365 97.674 ( 0.000 -0.584 0.000) 0.584 98.675 ( 0.000 0.328 0.000) 0.328 98.683 ( 0.000 0.252 0.000) 0.252 99.027 ( 0.000 6.126 0.000) 6.126 99.304 ( 0.000 -6.148 0.000) 6.148 99.677 ( 0.000 1.970 0.000) 1.970 99.731 ( 0.000 -0.494 0.000) 0.494 99.801 ( 0.000 2.018 0.000) 2.018 99.921 ( 0.000 -2.986 0.000) 2.986 ======================= 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| 0.964 ( 0.113 20.991 2.126) 21.098 1.008 ( 6.304 15.879 10.771) 20.197 1.536 ( 10.697 -0.206 4.774) 11.716 1.737 ( 5.956 12.128 -0.439) 13.519 1.853 ( -0.688 -12.870 -0.631) 12.904 1.949 ( 0.777 3.436 3.798) 5.180 2.055 ( 0.423 1.132 -6.280) 6.395 2.131 ( 2.290 0.156 0.419) 2.333 2.224 ( 2.263 0.960 -0.021) 2.458 2.291 ( 1.272 -3.692 6.470) 7.557 2.373 ( -2.733 8.334 -1.213) 8.854 2.472 ( -1.885 -3.298 2.919) 4.791 2.528 ( -1.827 1.039 -1.784) 2.757 2.669 ( -1.829 1.274 -0.059) 2.230 2.775 ( 0.106 -5.850 3.619) 6.879 2.852 ( -2.302 -3.734 1.072) 4.516 2.960 ( 0.206 -2.409 1.523) 2.857 3.113 ( -3.092 -2.892 0.640) 4.282 3.194 ( -3.881 3.648 -2.782) 6.009 3.286 ( -0.284 -1.211 -3.518) 3.731 3.316 ( -0.832 5.070 -0.081) 5.138 3.442 ( -3.572 2.123 -2.246) 4.724 3.573 ( 4.605 -0.888 -4.402) 6.433 3.575 ( 2.793 1.253 -3.892) 4.951 4.336 ( -0.755 -2.723 1.379) 3.145 4.416 ( 1.539 -5.665 0.726) 5.915 4.654 ( -6.180 -1.314 -4.375) 7.685 4.716 ( -1.086 -3.874 -2.244) 4.607 4.885 ( -4.877 4.077 5.642) 8.500 5.031 ( -2.716 -0.260 0.883) 2.868 5.107 ( -5.451 1.683 -2.095) 6.077 5.170 ( -0.425 1.496 -6.371) 6.558 5.267 ( -0.476 -2.377 1.708) 2.966 5.306 ( -2.502 -4.274 -0.557) 4.983 5.459 ( 3.435 -3.293 -3.851) 6.122 5.508 ( 1.330 -2.518 0.917) 2.992 5.542 ( 0.150 0.185 1.898) 1.913 5.609 ( 2.842 -3.308 5.608) 7.104 5.796 ( -0.711 3.160 -1.241) 3.468 5.860 ( -1.721 -0.113 2.562) 3.089 5.986 ( -6.506 -0.596 4.485) 7.924 6.128 ( -5.050 -3.852 1.546) 6.537 6.222 ( 3.417 4.774 -0.888) 5.938 6.276 ( 1.512 4.705 -1.338) 5.120 6.371 ( -0.163 2.098 -2.629) 3.367 6.506 ( 4.512 -2.022 4.602) 6.755 6.679 ( -4.825 6.534 -8.795) 11.972 6.986 ( -7.814 1.983 -5.098) 9.538 7.016 ( -2.126 -1.264 4.761) 5.366 7.175 ( -1.602 -6.145 -4.650) 7.871 7.210 ( -3.280 4.537 -1.641) 5.834 7.347 ( -3.543 0.746 -3.452) 5.003 7.637 ( -2.018 4.839 8.439) 9.935 7.774 ( -8.556 -1.411 9.894) 13.156 8.015 ( -1.307 4.090 1.235) 4.468 8.192 ( -4.221 8.287 -7.102) 11.701 8.347 ( -5.093 -5.749 0.719) 7.714 8.537 ( 0.332 -5.950 2.454) 6.444 8.689 ( -1.670 2.437 -0.016) 2.954 8.737 ( 3.206 1.854 -2.566) 4.506 8.800 ( 7.768 1.084 3.647) 8.650 9.009 ( 4.370 -4.894 1.015) 6.639 9.097 ( 3.159 0.233 -1.030) 3.331 9.251 ( 2.038 -4.389 -1.539) 5.078 9.331 ( 1.648 2.956 2.201) 4.038 9.457 ( 6.079 -2.022 0.102) 6.408 9.777 ( 3.340 -0.566 -5.114) 6.134 9.829 ( 1.354 -2.843 0.664) 3.218 10.353 ( -1.868 4.832 0.767) 5.237 10.450 ( 5.870 2.676 0.173) 6.453 10.577 ( 0.903 -0.708 -1.263) 1.706 10.825 ( 3.213 -7.428 1.363) 8.207 20.634 ( -1.417 1.524 -0.800) 2.229 20.699 ( -3.953 -0.783 -1.902) 4.456 20.917 ( -1.216 1.435 -0.570) 1.966 20.932 ( -1.102 0.504 0.666) 1.383 22.820 ( 0.626 0.998 1.074) 1.594 22.852 ( -0.011 -0.226 -0.570) 0.613 23.093 ( -0.459 0.855 0.260) 1.005 23.130 ( -0.346 -0.437 -0.718) 0.909 24.640 ( -1.756 -0.546 0.348) 1.871 24.669 ( -1.248 -1.949 0.155) 2.320 24.912 ( 1.073 1.259 0.527) 1.737 24.931 ( 1.581 0.431 1.006) 1.923 25.847 ( -4.107 0.832 0.055) 4.191 25.863 ( -2.669 0.269 0.084) 2.684 26.115 ( -1.234 1.829 -0.454) 2.252 26.215 ( -4.774 -1.486 -1.838) 5.327 28.281 ( 0.117 0.255 0.359) 0.456 28.302 ( -0.622 -0.537 1.126) 1.394 28.535 ( -0.060 0.540 -0.325) 0.633 28.593 ( 2.733 -2.568 0.214) 3.756 28.644 ( -2.413 1.155 0.258) 2.688 28.678 ( -0.204 -0.384 1.411) 1.476 28.750 ( 3.762 -0.212 0.149) 3.771 28.816 ( 0.171 -2.118 0.087) 2.127 32.310 ( 0.617 0.951 0.269) 1.166 32.354 ( 0.888 -1.033 1.541) 2.057 32.481 ( 0.376 2.273 -0.060) 2.304 32.580 ( -0.319 -1.896 -0.465) 1.978 35.377 ( 0.293 1.200 0.344) 1.282 35.446 ( -0.943 -1.638 -0.114) 1.894 35.544 ( -0.312 1.162 -0.618) 1.353 35.568 ( -1.153 0.351 -0.446) 1.285 88.726 ( 3.394 -0.206 -2.184) 4.041 88.748 ( 1.005 -0.819 -0.606) 1.432 88.986 ( 3.361 2.070 -0.468) 3.975 89.112 ( 3.483 -3.199 1.881) 5.089 97.629 ( 0.793 0.095 -0.339) 0.868 97.639 ( 0.773 -0.115 0.237) 0.816 97.669 ( 1.930 -0.182 -0.793) 2.095 97.694 ( 2.012 -0.912 0.083) 2.211 98.680 ( 0.345 0.527 0.252) 0.678 98.689 ( 0.437 0.099 0.537) 0.699 98.999 ( -2.448 5.516 -1.225) 6.158 99.178 ( -7.698 -0.485 -5.233) 9.321 99.658 ( -0.050 3.521 0.649) 3.581 99.737 ( -1.272 0.427 0.154) 1.351 99.886 ( 1.292 -2.035 -1.388) 2.782 99.959 ( 5.971 -6.134 5.294) 10.065 ======================= 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| 1.071 ( 9.593 14.744 3.565) 17.948 1.289 ( 9.044 10.655 14.435) 20.093 1.753 ( 6.645 -6.084 5.686) 10.654 1.818 ( 3.735 -4.101 -1.656) 5.789 1.879 ( 4.130 3.417 4.182) 6.799 1.992 ( 2.252 4.486 -2.809) 5.751 2.065 ( 7.082 1.243 -2.090) 7.488 2.176 ( 2.349 -3.635 -0.451) 4.352 2.256 ( -2.920 7.730 5.432) 9.889 2.322 ( -1.265 4.144 1.362) 4.541 2.390 ( 3.542 -3.538 3.341) 6.019 2.461 ( -3.139 0.624 -0.625) 3.261 2.519 ( 0.860 1.073 6.195) 6.345 2.612 ( -3.370 1.722 -1.017) 3.919 2.783 ( -4.229 -4.274 4.523) 7.524 2.856 ( -1.262 -3.148 2.727) 4.351 2.944 ( -3.244 -0.909 0.996) 3.513 3.063 ( -2.482 -2.514 -0.657) 3.594 3.081 ( -3.488 3.085 -5.921) 7.533 3.223 ( -1.598 -1.228 -5.371) 5.736 3.290 ( -2.241 2.641 -0.983) 3.601 3.340 ( -3.677 -0.032 -3.005) 4.749 3.571 ( 3.920 2.845 -7.523) 8.947 3.611 ( 5.385 0.233 -5.267) 7.536 4.343 ( -0.302 -0.945 1.465) 1.769 4.435 ( -1.396 -3.000 1.312) 3.560 4.548 ( -1.168 -1.852 -2.836) 3.583 4.652 ( -3.698 -3.972 -2.237) 5.869 4.821 ( -7.236 0.932 3.179) 7.959 4.994 ( -5.229 -3.385 1.366) 6.377 5.044 ( 0.523 3.609 1.873) 4.100 5.096 ( 0.067 3.571 -4.156) 5.480 5.227 ( -0.422 -3.460 -3.308) 4.806 5.327 ( -0.773 -4.319 -0.391) 4.405 5.425 ( -2.090 -2.173 -3.809) 4.858 5.485 ( -2.766 -3.726 0.278) 4.649 5.569 ( -0.131 0.917 2.361) 2.536 5.679 ( -2.717 -2.851 4.621) 6.071 5.788 ( -1.322 2.228 2.333) 3.486 5.851 ( 0.052 0.340 -2.974) 2.993 5.927 ( -7.843 0.317 6.309) 10.071 5.989 ( -11.839 0.364 2.203) 12.048 6.197 ( -2.448 7.380 -6.453) 10.104 6.290 ( 4.692 3.225 -1.887) 5.998 6.360 ( 1.192 -0.101 -4.251) 4.416 6.468 ( -5.914 6.777 -3.015) 9.487 6.676 ( 1.843 -8.111 -2.411) 8.660 6.714 ( -8.682 -3.312 -3.254) 9.845 7.003 ( -5.878 1.308 -2.284) 6.440 7.079 ( -5.135 3.258 2.101) 6.434 7.165 ( 0.704 -6.795 1.396) 6.973 7.342 ( 1.631 -4.028 0.583) 4.384 7.653 ( -5.251 7.474 4.218) 10.061 7.735 ( -6.438 3.979 9.851) 12.423 7.960 ( -4.307 2.415 -0.379) 4.952 8.114 ( -1.078 10.633 -0.435) 10.697 8.275 ( -4.689 -6.737 0.994) 8.268 8.563 ( 0.692 -4.158 -0.153) 4.218 8.626 ( -0.909 0.954 -3.868) 4.087 8.736 ( -1.677 0.281 -1.416) 2.213 8.968 ( 3.596 4.781 6.988) 9.199 9.072 ( 6.895 -5.483 -3.988) 9.670 9.137 ( 2.728 1.728 0.220) 3.237 9.308 ( 2.189 -1.489 4.479) 5.203 9.468 ( 10.080 1.531 1.178) 10.263 9.579 ( 7.241 -0.079 1.584) 7.413 9.772 ( 2.626 -0.766 -6.301) 6.869 9.872 ( 4.811 -3.343 -1.661) 6.089 10.336 ( -1.107 5.086 1.287) 5.362 10.546 ( 5.376 -0.824 -1.573) 5.662 10.570 ( -0.122 0.717 -0.674) 0.992 10.914 ( 4.803 -9.063 2.092) 10.469 20.592 ( -2.238 1.511 -0.984) 2.874 20.617 ( -3.209 0.840 -1.388) 3.596 20.890 ( -1.632 1.603 -0.047) 2.288 20.917 ( -1.356 0.288 0.405) 1.444 22.823 ( -0.901 1.196 -1.392) 2.044 22.859 ( 1.129 0.043 0.919) 1.457 23.081 ( -0.953 0.262 -0.443) 1.083 23.128 ( 0.396 -1.003 0.909) 1.411 24.606 ( -2.534 -0.805 0.195) 2.666 24.645 ( -1.778 -2.704 0.201) 3.242 24.945 ( 1.732 1.855 0.908) 2.695 24.972 ( 1.787 0.720 1.115) 2.226 25.764 ( -5.310 1.511 -0.269) 5.527 25.805 ( -4.340 0.029 0.200) 4.345 26.081 ( -2.101 1.027 -0.492) 2.389 26.123 ( -4.234 0.245 -0.743) 4.305 28.296 ( 0.782 -0.116 0.722) 1.071 28.302 ( -0.346 -0.233 0.555) 0.694 28.527 ( -0.221 1.314 -0.709) 1.509 28.604 ( -0.919 -1.424 -0.679) 1.826 28.614 ( -1.232 1.104 0.432) 1.710 28.700 ( 0.316 -1.726 1.781) 2.500 28.798 ( 1.160 -1.686 -0.835) 2.210 28.833 ( 1.760 -2.259 1.122) 3.075 32.329 ( 1.119 0.971 0.479) 1.557 32.384 ( 0.524 -1.424 1.557) 2.174 32.490 ( 0.752 2.017 -0.068) 2.154 32.568 ( -0.323 -1.267 -0.682) 1.475 35.389 ( 0.591 0.865 0.552) 1.184 35.431 ( -0.648 -0.725 0.065) 0.975 35.526 ( -0.876 1.213 -0.828) 1.710 35.547 ( -0.816 0.118 -0.262) 0.866 88.761 ( 2.797 -1.065 -1.484) 3.341 88.764 ( 2.540 -0.984 -1.828) 3.281 89.053 ( 4.839 2.685 -0.379) 5.547 89.209 ( 4.665 -3.970 3.048) 6.842 97.644 ( 1.325 0.151 -0.331) 1.374 97.662 ( 1.688 -0.251 -0.019) 1.707 97.694 ( 2.157 -0.416 -1.150) 2.479 97.736 ( 2.642 -1.528 0.524) 3.096 98.690 ( 0.594 0.830 0.128) 1.028 98.707 ( 0.836 -0.037 0.816) 1.169 98.932 ( -3.575 4.367 -1.321) 5.796 99.014 ( -6.223 2.163 -3.231) 7.337 99.671 ( -0.071 2.993 0.665) 3.067 99.705 ( -1.889 0.565 -0.751) 2.110 99.861 ( 0.281 1.044 -2.938) 3.131 100.114 ( 4.776 -9.554 4.711) 11.674 ======================= 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| 1.317 ( 12.871 7.692 5.260) 15.890 1.563 ( 6.328 4.006 10.915) 13.237 1.823 ( 4.768 -1.353 -1.849) 5.289 1.932 ( 6.008 2.078 1.817) 6.612 1.977 ( 3.036 4.114 -2.198) 5.565 2.050 ( 5.119 3.800 1.721) 6.604 2.117 ( -1.563 3.134 2.296) 4.188 2.198 ( 1.811 -6.781 2.919) 7.601 2.277 ( 1.433 2.525 -3.581) 4.610 2.349 ( -0.788 -0.867 3.307) 3.509 2.383 ( -3.417 -0.238 5.505) 6.484 2.471 ( -1.208 -1.255 2.163) 2.777 2.578 ( -0.965 0.924 3.138) 3.411 2.622 ( 2.178 6.491 5.830) 8.993 2.752 ( -5.392 -4.049 4.793) 8.273 2.851 ( -0.913 -3.833 0.955) 4.054 2.911 ( -1.669 2.777 3.427) 4.715 2.972 ( -0.883 0.519 -7.013) 7.087 3.028 ( -0.001 -2.583 -1.986) 3.259 3.126 ( -2.754 -1.112 -5.345) 6.115 3.203 ( -2.795 1.660 -5.050) 6.006 3.285 ( -2.094 -0.873 -1.700) 2.835 3.540 ( 1.459 4.957 -6.380) 8.210 3.629 ( 3.607 -0.194 -5.459) 6.546 4.355 ( -0.756 -0.124 1.586) 1.762 4.404 ( -1.439 -1.639 -0.412) 2.219 4.526 ( -1.485 -4.141 -0.048) 4.400 4.563 ( -3.189 -3.460 -1.625) 4.978 4.762 ( -3.055 0.365 2.501) 3.965 4.966 ( 0.280 -4.203 1.395) 4.437 5.055 ( 0.243 1.102 -1.395) 1.795 5.102 ( 1.754 4.198 0.466) 4.573 5.177 ( -2.929 -0.784 -2.742) 4.088 5.277 ( -0.062 -3.510 -3.101) 4.684 5.325 ( -4.866 -2.980 -3.379) 6.631 5.427 ( -4.583 -7.041 -0.541) 8.419 5.562 ( -4.374 0.398 0.537) 4.425 5.581 ( -9.385 -0.303 1.022) 9.445 5.746 ( -10.875 3.026 3.599) 11.848 5.805 ( -4.639 1.467 3.083) 5.760 5.808 ( -1.904 1.971 -2.878) 3.974 5.948 ( 1.489 -4.290 0.896) 4.628 6.160 ( 1.933 0.432 1.373) 2.410 6.221 ( -5.678 -0.612 -7.048) 9.071 6.304 ( -0.085 2.836 -5.093) 5.830 6.432 ( 2.380 7.271 0.884) 7.702 6.562 ( -0.887 -3.202 -3.152) 4.580 6.694 ( -4.432 -5.631 -2.204) 7.497 6.881 ( -2.543 6.054 -0.691) 6.602 7.033 ( -5.918 1.039 1.930) 6.311 7.204 ( 1.497 -4.609 2.187) 5.317 7.378 ( 0.621 -3.567 2.683) 4.506 7.641 ( 2.155 8.751 1.336) 9.111 7.749 ( -4.268 5.134 7.674) 10.171 7.901 ( -3.841 2.396 1.750) 4.854 8.100 ( -0.465 7.887 -0.063) 7.901 8.201 ( -5.764 -5.646 0.898) 8.119 8.540 ( 0.808 0.562 -3.993) 4.113 8.607 ( 0.568 -2.519 -1.498) 2.985 8.690 ( -1.770 -4.170 -0.691) 4.582 9.029 ( 0.064 7.716 1.107) 7.795 9.155 ( 5.142 0.398 -2.356) 5.670 9.229 ( 4.815 1.663 5.869) 7.771 9.387 ( 1.114 -0.158 4.165) 4.314 9.612 ( 4.441 -2.738 0.087) 5.218 9.690 ( 4.212 -3.673 -1.511) 5.789 9.768 ( 5.961 3.971 -3.649) 8.038 9.935 ( 4.216 -3.388 -1.528) 5.620 10.353 ( 1.271 3.617 1.689) 4.189 10.530 ( -1.445 -3.094 -2.160) 4.040 10.615 ( 2.827 3.257 -0.250) 4.320 11.013 ( 4.104 -10.826 2.013) 11.751 20.550 ( -1.655 1.539 -0.435) 2.302 20.566 ( -1.720 0.621 -0.807) 1.999 20.864 ( -1.412 1.555 0.047) 2.101 20.899 ( -1.149 0.061 0.246) 1.177 22.783 ( -1.307 2.177 -1.881) 3.160 22.882 ( 0.691 -1.574 0.126) 1.724 23.064 ( -0.544 1.153 0.011) 1.275 23.156 ( 0.911 -2.128 1.742) 2.897 24.567 ( -2.133 -0.732 -0.029) 2.255 24.619 ( -1.510 -3.346 0.136) 3.674 24.983 ( 1.598 2.303 0.897) 2.943 25.009 ( 1.310 1.160 0.765) 1.910 25.679 ( -4.146 2.102 -0.552) 4.681 25.735 ( -3.937 -0.052 0.248) 3.945 26.042 ( -2.022 0.320 -0.155) 2.054 26.061 ( -2.770 -0.005 -0.044) 2.770 28.303 ( 0.116 0.048 0.113) 0.169 28.318 ( 0.861 -0.673 0.548) 1.222 28.515 ( -0.194 1.724 -0.806) 1.913 28.577 ( -1.386 -0.755 -0.153) 1.585 28.602 ( -0.701 0.944 0.260) 1.204 28.720 ( 0.037 -1.873 1.492) 2.395 28.788 ( -0.388 -0.245 -1.212) 1.296 28.872 ( 1.225 -3.195 0.783) 3.510 32.353 ( 1.241 0.662 0.363) 1.453 32.399 ( -0.282 -1.275 0.965) 1.624 32.505 ( 1.010 1.650 0.044) 1.935 32.556 ( -0.289 -0.511 -0.626) 0.858 35.406 ( 0.600 0.563 0.443) 0.934 35.427 ( 0.071 -0.347 0.228) 0.421 35.503 ( -1.007 1.188 -0.534) 1.646 35.534 ( -0.525 -0.280 -0.196) 0.626 88.784 ( 1.361 -0.878 -0.273) 1.642 88.791 ( 2.724 -1.412 -2.112) 3.725 89.127 ( 4.063 3.111 -0.006) 5.118 89.314 ( 3.619 -4.832 2.923) 6.707 97.663 ( 1.227 0.099 -0.120) 1.237 97.686 ( 1.403 -0.684 -0.748) 1.731 97.714 ( 1.493 0.371 -0.576) 1.643 97.789 ( 2.543 -2.413 0.899) 3.619 98.703 ( 0.999 1.079 -0.100) 1.474 98.731 ( 1.062 -0.006 0.660) 1.250 98.864 ( -3.168 3.250 -0.589) 4.577 98.902 ( -4.398 1.969 -1.550) 5.062 99.644 ( -2.175 1.102 -1.131) 2.687 99.679 ( -0.425 0.110 -1.048) 1.137 99.850 ( 0.912 5.467 -1.046) 5.640 100.213 ( 2.571 -9.637 2.741) 10.344 ======================= 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| 1.550 ( 7.179 4.839 3.477) 9.329 1.708 ( 1.847 -0.477 4.469) 4.859 1.896 ( 4.211 4.222 -2.775) 6.577 1.959 ( -1.386 1.021 -1.585) 2.340 2.010 ( 1.749 7.862 0.013) 8.054 2.080 ( 2.781 2.654 1.470) 4.115 2.164 ( -2.508 3.866 0.151) 4.611 2.209 ( -1.954 -3.223 0.024) 3.769 2.281 ( 6.065 -0.970 0.045) 6.142 2.350 ( -0.819 -0.407 0.363) 0.984 2.421 ( -2.671 -1.709 4.085) 5.171 2.461 ( -0.744 -0.432 0.922) 1.261 2.586 ( -1.843 -0.071 2.260) 2.917 2.720 ( -1.520 -0.961 4.575) 4.916 2.721 ( 1.554 1.384 2.517) 3.265 2.838 ( -2.237 0.529 3.364) 4.075 2.890 ( 0.493 -0.519 -4.659) 4.713 2.984 ( -0.046 -2.897 -1.003) 3.067 3.030 ( 2.971 -0.674 0.059) 3.047 3.056 ( 1.271 -0.979 -1.179) 1.991 3.116 ( -1.325 1.670 -2.428) 3.232 3.201 ( -4.243 -1.225 -3.892) 5.887 3.502 ( -0.011 6.295 -2.216) 6.674 3.624 ( 1.199 -1.172 -2.472) 2.987 4.336 ( -1.544 -1.644 0.345) 2.282 4.415 ( 1.884 -1.235 0.290) 2.272 4.471 ( -2.890 -4.323 -0.593) 5.234 4.541 ( -0.175 -3.443 0.013) 3.448 4.764 ( 0.026 2.519 1.474) 2.918 5.011 ( 2.121 -0.865 0.620) 2.373 5.036 ( 0.130 -1.957 -1.302) 2.354 5.078 ( -3.752 1.787 -2.200) 4.702 5.126 ( -1.322 1.779 1.913) 2.928 5.227 ( -1.272 -6.339 -1.447) 6.625 5.266 ( -0.293 -2.757 -2.047) 3.447 5.357 ( -1.636 -7.602 -0.368) 7.784 5.471 ( -2.175 -0.229 -1.234) 2.511 5.480 ( -4.838 -1.390 0.994) 5.131 5.646 ( -1.977 0.996 0.550) 2.281 5.720 ( -5.991 -2.156 -0.021) 6.367 5.785 ( -0.128 4.010 -0.855) 4.102 6.003 ( 3.999 -2.086 1.266) 4.685 6.106 ( -4.030 3.862 -1.269) 5.725 6.228 ( 0.242 -2.238 -0.788) 2.385 6.280 ( 3.230 -0.548 3.159) 4.551 6.469 ( 0.126 -1.030 -4.284) 4.408 6.506 ( -0.729 4.147 -1.920) 4.628 6.606 ( -2.141 -2.189 0.323) 3.079 6.875 ( 0.332 7.737 1.061) 7.816 6.941 ( -4.213 1.309 -0.851) 4.493 7.247 ( 0.893 -2.887 1.060) 3.203 7.418 ( 0.628 -0.077 1.846) 1.951 7.716 ( 3.132 5.799 1.482) 6.755 7.749 ( -1.970 5.200 2.127) 5.954 7.872 ( -1.280 2.080 1.026) 2.649 8.097 ( 0.255 6.928 -0.364) 6.943 8.116 ( -4.045 -5.236 0.207) 6.620 8.533 ( 1.596 2.333 -1.448) 3.176 8.589 ( -1.043 -3.434 -0.752) 3.667 8.663 ( -0.724 -5.328 -0.393) 5.391 9.031 ( -0.097 9.836 -0.057) 9.837 9.203 ( 2.587 1.679 -1.184) 3.303 9.358 ( 1.648 1.383 6.213) 6.575 9.425 ( 0.505 4.578 0.587) 4.643 9.599 ( -0.234 -8.268 -3.976) 9.177 9.740 ( 2.335 -4.867 -0.324) 5.408 9.838 ( 2.773 4.207 -0.203) 5.043 9.971 ( 1.263 -2.853 -0.271) 3.132 10.408 ( 2.791 1.231 1.768) 3.526 10.474 ( -2.548 -1.109 -1.936) 3.387 10.643 ( 0.866 3.293 -0.112) 3.407 11.078 ( 1.596 -11.797 0.870) 11.936 20.530 ( -0.461 1.243 -0.049) 1.327 20.540 ( -0.653 0.531 -0.320) 0.901 20.847 ( -0.561 1.529 0.020) 1.629 20.887 ( -0.453 -0.080 0.085) 0.467 22.751 ( -0.586 2.570 -0.801) 2.755 22.886 ( 0.083 -2.866 -0.277) 2.881 23.062 ( -0.034 2.050 0.292) 2.071 23.183 ( 0.458 -2.757 0.795) 2.906 24.541 ( -0.825 -0.633 -0.041) 1.041 24.601 ( -0.597 -3.679 0.034) 3.728 25.012 ( 0.781 2.556 0.469) 2.714 25.028 ( 0.374 1.461 0.184) 1.519 25.624 ( -1.598 2.541 -0.315) 3.019 25.690 ( -1.569 -0.158 0.129) 1.582 26.016 ( -0.833 -0.076 0.011) 0.837 26.029 ( -0.989 -0.343 0.029) 1.047 28.306 ( 0.126 0.201 0.024) 0.239 28.333 ( 0.392 -1.046 0.168) 1.130 28.507 ( -0.019 1.704 -0.359) 1.742 28.559 ( -0.609 -0.974 -0.078) 1.151 28.597 ( -0.281 1.328 0.192) 1.371 28.735 ( 0.131 -2.853 1.061) 3.047 28.767 ( -0.460 1.702 -1.017) 2.036 28.890 ( 0.338 -3.260 0.259) 3.288 32.375 ( 0.910 0.126 0.093) 0.923 32.397 ( -0.640 -0.842 0.333) 1.108 32.522 ( 0.747 1.159 0.175) 1.390 32.545 ( -0.376 0.242 -0.373) 0.582 35.414 ( 0.134 0.476 0.083) 0.502 35.436 ( 0.434 -0.404 0.243) 0.640 35.484 ( -0.606 1.278 -0.236) 1.434 35.526 ( -0.200 -0.514 -0.061) 0.555 88.798 ( 0.544 -0.916 -0.077) 1.069 88.806 ( 0.974 -1.367 -0.774) 1.848 89.177 ( 1.591 3.226 0.072) 3.597 89.379 ( 1.308 -5.333 1.222) 5.625 97.680 ( 0.612 -0.200 0.356) 0.736 97.691 ( 0.338 -0.655 -0.910) 1.171 97.730 ( 0.588 1.004 -0.018) 1.163 97.828 ( 1.089 -3.128 0.444) 3.342 98.718 ( 0.788 1.226 -0.119) 1.462 98.754 ( 0.900 0.123 0.292) 0.954 98.821 ( -1.224 2.365 -0.119) 2.665 98.834 ( -2.393 1.749 -0.461) 3.000 99.605 ( -0.969 1.018 -0.670) 1.557 99.662 ( -0.210 -1.076 -0.679) 1.290 99.858 ( 0.459 7.859 -0.061) 7.872 100.261 ( 0.826 -9.330 0.910) 9.411 ======================= 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| 1.217 ( 0.000 -13.783 0.000) 13.783 1.217 ( 0.000 13.783 0.000) 13.783 1.462 ( 0.000 -20.333 0.000) 20.333 1.462 ( 0.000 20.333 0.000) 20.333 2.001 ( 0.000 -2.708 0.000) 2.708 2.001 ( 0.000 2.708 0.000) 2.708 2.126 ( 0.000 -7.995 0.000) 7.995 2.126 ( 0.000 7.995 0.000) 7.995 2.193 ( 0.000 -2.007 0.000) 2.007 2.193 ( 0.000 2.007 0.000) 2.007 2.439 ( 0.000 -2.503 0.000) 2.503 2.439 ( 0.000 2.503 0.000) 2.503 2.563 ( 0.000 -6.727 0.000) 6.727 2.563 ( 0.000 6.727 0.000) 6.727 2.751 ( 0.000 -5.557 0.000) 5.557 2.751 ( 0.000 5.557 0.000) 5.557 3.038 ( 0.000 -5.509 0.000) 5.509 3.038 ( 0.000 5.509 0.000) 5.509 3.278 ( 0.000 -1.230 0.000) 1.230 3.278 ( 0.000 1.230 0.000) 1.230 3.478 ( 0.000 -5.589 0.000) 5.589 3.478 ( 0.000 5.589 0.000) 5.589 3.553 ( 0.000 -2.645 0.000) 2.645 3.553 ( 0.000 2.645 0.000) 2.645 4.307 ( 0.000 -1.228 0.000) 1.228 4.307 ( 0.000 1.228 0.000) 1.228 4.704 ( 0.000 -0.809 0.000) 0.809 4.704 ( 0.000 0.809 0.000) 0.809 4.991 ( 0.000 -5.468 0.000) 5.468 4.991 ( 0.000 5.468 0.000) 5.468 5.172 ( 0.000 -2.269 0.000) 2.269 5.172 ( 0.000 2.269 0.000) 2.269 5.324 ( 0.000 -0.691 0.000) 0.691 5.324 ( 0.000 0.691 0.000) 0.691 5.428 ( 0.000 -0.903 0.000) 0.903 5.428 ( 0.000 0.903 0.000) 0.903 5.500 ( 0.000 -0.285 0.000) 0.285 5.500 ( 0.000 0.285 0.000) 0.285 5.864 ( 0.000 -0.066 0.000) 0.066 5.864 ( 0.000 0.066 0.000) 0.066 6.027 ( 0.000 -2.858 0.000) 2.858 6.027 ( 0.000 2.858 0.000) 2.858 6.286 ( 0.000 -3.136 0.000) 3.136 6.286 ( 0.000 3.136 0.000) 3.136 6.398 ( 0.000 -0.556 0.000) 0.556 6.398 ( 0.000 0.556 0.000) 0.556 6.976 ( 0.000 -2.090 0.000) 2.090 6.976 ( 0.000 2.090 0.000) 2.090 7.167 ( 0.000 -3.729 0.000) 3.729 7.167 ( 0.000 3.729 0.000) 3.729 7.366 ( 0.000 -10.109 0.000) 10.109 7.366 ( 0.000 10.109 0.000) 10.109 7.677 ( 0.000 -4.828 0.000) 4.828 7.677 ( 0.000 4.828 0.000) 4.828 8.211 ( 0.000 -10.080 0.000) 10.080 8.211 ( 0.000 10.080 0.000) 10.080 8.399 ( 0.000 -0.697 0.000) 0.697 8.399 ( 0.000 0.697 0.000) 0.697 8.677 ( 0.000 -0.613 0.000) 0.613 8.677 ( 0.000 0.613 0.000) 0.613 8.858 ( 0.000 -5.704 0.000) 5.704 8.858 ( 0.000 5.704 0.000) 5.704 9.130 ( 0.000 -5.918 0.000) 5.918 9.130 ( 0.000 5.918 0.000) 5.918 9.349 ( 0.000 -2.107 0.000) 2.107 9.349 ( 0.000 2.107 0.000) 2.107 9.781 ( 0.000 -0.050 0.000) 0.050 9.781 ( 0.000 0.050 0.000) 0.050 10.424 ( 0.000 -0.839 0.000) 0.839 10.424 ( 0.000 0.839 0.000) 0.839 10.643 ( 0.000 -6.013 0.000) 6.013 10.643 ( 0.000 6.013 0.000) 6.013 20.694 ( 0.000 -2.370 0.000) 2.370 20.694 ( 0.000 2.370 0.000) 2.370 20.944 ( 0.000 -0.082 0.000) 0.082 20.944 ( 0.000 0.082 0.000) 0.082 22.833 ( 0.000 -1.103 0.000) 1.103 22.833 ( 0.000 1.103 0.000) 1.103 23.123 ( 0.000 -1.023 0.000) 1.023 23.123 ( 0.000 1.023 0.000) 1.023 24.656 ( 0.000 -0.550 0.000) 0.550 24.656 ( 0.000 0.550 0.000) 0.550 24.913 ( 0.000 -0.087 0.000) 0.087 24.913 ( 0.000 0.087 0.000) 0.087 25.890 ( 0.000 -0.145 0.000) 0.145 25.890 ( 0.000 0.145 0.000) 0.145 26.190 ( 0.000 -3.582 0.000) 3.582 26.190 ( 0.000 3.582 0.000) 3.582 28.287 ( 0.000 -0.408 0.000) 0.408 28.287 ( 0.000 0.408 0.000) 0.408 28.541 ( 0.000 -0.288 0.000) 0.288 28.541 ( 0.000 0.288 0.000) 0.288 28.678 ( 0.000 -0.581 0.000) 0.581 28.678 ( 0.000 0.581 0.000) 0.581 28.756 ( 0.000 -2.855 0.000) 2.855 28.756 ( 0.000 2.855 0.000) 2.855 32.321 ( 0.000 -0.743 0.000) 0.743 32.321 ( 0.000 0.743 0.000) 0.743 32.533 ( 0.000 -2.603 0.000) 2.603 32.533 ( 0.000 2.603 0.000) 2.603 35.409 ( 0.000 -1.984 0.000) 1.984 35.409 ( 0.000 1.984 0.000) 1.984 35.574 ( 0.000 -0.839 0.000) 0.839 35.574 ( 0.000 0.839 0.000) 0.839 88.725 ( 0.000 -0.876 0.000) 0.876 88.725 ( 0.000 0.876 0.000) 0.876 89.008 ( 0.000 -2.684 0.000) 2.684 89.008 ( 0.000 2.684 0.000) 2.684 97.628 ( 0.000 -0.207 0.000) 0.207 97.628 ( 0.000 0.207 0.000) 0.207 97.663 ( 0.000 -0.464 0.000) 0.464 97.663 ( 0.000 0.464 0.000) 0.464 98.683 ( 0.000 -0.261 0.000) 0.261 98.683 ( 0.000 0.261 0.000) 0.261 99.166 ( 0.000 -6.580 0.000) 6.580 99.166 ( 0.000 6.580 0.000) 6.580 99.712 ( 0.000 -1.244 0.000) 1.244 99.712 ( 0.000 1.244 0.000) 1.244 99.856 ( 0.000 -2.943 0.000) 2.943 99.856 ( 0.000 2.943 0.000) 2.943 ======================= 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| 1.277 ( 0.949 -5.935 7.596) 9.687 1.277 ( 0.949 5.935 7.596) 9.687 1.490 ( 3.821 -13.174 1.631) 13.814 1.490 ( 3.821 13.174 1.631) 13.814 1.996 ( 0.344 -5.015 -1.614) 5.279 1.996 ( 0.344 5.015 -1.614) 5.279 2.115 ( 0.560 -8.286 -0.513) 8.321 2.115 ( 0.560 8.286 -0.513) 8.321 2.224 ( 4.938 -1.452 -2.374) 5.668 2.224 ( 4.938 1.452 -2.374) 5.668 2.485 ( -0.297 -2.920 2.334) 3.750 2.485 ( -0.297 2.920 2.334) 3.750 2.577 ( 1.111 -8.622 3.634) 9.422 2.577 ( 1.111 8.622 3.634) 9.422 2.720 ( -2.828 -4.183 0.607) 5.086 2.720 ( -2.828 4.183 0.607) 5.086 3.031 ( -2.304 -4.518 1.583) 5.313 3.031 ( -2.304 4.518 1.583) 5.313 3.247 ( -1.170 -2.009 -3.879) 4.523 3.247 ( -1.170 2.009 -3.879) 4.523 3.433 ( -4.950 -3.713 -0.367) 6.198 3.433 ( -4.950 3.713 -0.367) 6.198 3.573 ( 4.958 -1.012 -4.329) 6.659 3.573 ( 4.958 1.012 -4.329) 6.659 4.325 ( 1.037 -1.995 1.320) 2.607 4.325 ( 1.037 1.995 1.320) 2.607 4.654 ( -3.195 -1.517 -2.581) 4.378 4.654 ( -3.195 1.517 -2.581) 4.378 4.993 ( -6.289 -4.412 5.253) 9.307 4.993 ( -6.289 4.412 5.253) 9.307 5.145 ( 0.559 -2.919 -1.047) 3.151 5.145 ( 0.559 2.919 -1.047) 3.151 5.235 ( -4.256 -1.393 -3.766) 5.851 5.235 ( -4.256 1.393 -3.766) 5.851 5.460 ( 2.833 -1.987 -2.125) 4.061 5.460 ( 2.833 1.987 -2.125) 4.061 5.559 ( 2.219 -1.521 3.204) 4.184 5.559 ( 2.219 1.521 3.204) 4.184 5.849 ( -2.787 -1.348 2.420) 3.929 5.849 ( -2.787 1.348 2.420) 3.929 6.027 ( -2.369 -4.278 2.699) 5.585 6.027 ( -2.369 4.278 2.699) 5.585 6.302 ( 2.480 -1.887 -1.839) 3.618 6.302 ( 2.480 1.887 -1.839) 3.618 6.429 ( 3.594 -3.444 -0.139) 4.980 6.429 ( 3.594 3.444 -0.139) 4.980 6.883 ( -11.373 -9.750 -5.707) 16.030 6.883 ( -11.373 9.750 -5.707) 16.030 7.061 ( -3.389 -3.403 -2.562) 5.443 7.061 ( -3.389 3.403 -2.562) 5.443 7.310 ( -4.249 -3.811 -1.927) 6.024 7.310 ( -4.249 3.811 -1.927) 6.024 7.726 ( -2.755 -3.216 10.195) 11.040 7.726 ( -2.755 3.216 10.195) 11.040 8.165 ( -4.499 -8.211 -1.358) 9.461 8.165 ( -4.499 8.211 -1.358) 9.461 8.389 ( 0.836 -7.730 -1.614) 7.940 8.389 ( 0.836 7.730 -1.614) 7.940 8.743 ( 1.800 -1.434 1.026) 2.520 8.743 ( 1.800 1.434 1.026) 2.520 8.878 ( 4.562 -6.210 -0.087) 7.705 8.878 ( 4.562 6.210 -0.087) 7.705 9.138 ( 2.503 -3.915 0.260) 4.654 9.138 ( 2.503 3.915 0.260) 4.654 9.409 ( 5.523 -3.299 1.160) 6.538 9.409 ( 5.523 3.299 1.160) 6.538 9.783 ( 1.616 -1.220 -1.799) 2.709 9.783 ( 1.616 1.220 -1.799) 2.709 10.439 ( 1.688 -3.059 -0.764) 3.577 10.439 ( 1.688 3.059 -0.764) 3.577 10.660 ( 1.677 -7.210 0.750) 7.441 10.660 ( 1.677 7.210 0.750) 7.441 20.669 ( -2.145 -1.708 -0.950) 2.902 20.669 ( -2.145 1.708 -0.950) 2.902 20.935 ( -1.082 -0.301 0.162) 1.134 20.935 ( -1.082 0.301 0.162) 1.134 22.840 ( 0.474 -0.788 0.330) 0.977 22.840 ( 0.474 0.788 0.330) 0.977 23.114 ( -0.746 -0.963 -0.320) 1.259 23.114 ( -0.746 0.963 -0.320) 1.259 24.641 ( -1.693 -0.659 -0.005) 1.817 24.641 ( -1.693 0.659 -0.005) 1.817 24.931 ( 1.588 -0.462 0.714) 1.801 24.931 ( 1.588 0.462 0.714) 1.801 25.862 ( -3.238 -0.418 0.004) 3.265 25.862 ( -3.238 0.418 0.004) 3.265 26.164 ( -2.376 -2.646 -0.779) 3.641 26.164 ( -2.376 2.646 -0.779) 3.641 28.290 ( -0.132 -0.557 0.666) 0.878 28.290 ( -0.132 0.557 0.666) 0.878 28.553 ( 1.135 -1.224 -0.104) 1.673 28.553 ( 1.135 1.224 -0.104) 1.673 28.666 ( -1.445 -0.791 0.591) 1.750 28.666 ( -1.445 0.791 0.591) 1.750 28.771 ( 1.560 -1.868 -0.059) 2.435 28.771 ( 1.560 1.868 -0.059) 2.435 32.331 ( 0.686 -1.045 0.732) 1.448 32.331 ( 0.686 1.045 0.732) 1.448 32.533 ( 0.154 -2.408 -0.279) 2.429 32.533 ( 0.154 2.408 -0.279) 2.429 35.408 ( -0.098 -1.681 0.145) 1.690 35.408 ( -0.098 1.681 0.145) 1.690 35.564 ( -0.729 -0.625 -0.436) 1.055 35.564 ( -0.729 0.625 -0.436) 1.055 88.732 ( 1.323 -0.603 -0.759) 1.640 88.732 ( 1.323 0.603 -0.759) 1.640 89.042 ( 3.460 -3.055 0.620) 4.657 89.042 ( 3.460 3.055 0.620) 4.657 97.634 ( 0.882 -0.290 -0.219) 0.954 97.634 ( 0.882 0.290 -0.219) 0.954 97.676 ( 1.437 -0.678 -0.033) 1.589 97.676 ( 1.437 0.678 -0.033) 1.589 98.689 ( 0.411 -0.203 0.439) 0.635 98.689 ( 0.411 0.203 0.439) 0.635 99.113 ( -4.102 -4.733 -2.374) 6.698 99.113 ( -4.102 4.733 -2.374) 6.698 99.725 ( -0.031 -2.064 0.874) 2.241 99.725 ( -0.031 2.064 0.874) 2.241 99.875 ( 2.224 -1.677 0.621) 2.854 99.875 ( 2.224 1.677 0.621) 2.854 ======================= 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 ( 2.601 -8.956 5.614) 10.886 1.373 ( 2.601 8.956 5.614) 10.886 1.654 ( 8.740 -3.730 7.822) 12.308 1.654 ( 8.740 3.730 7.822) 12.308 2.005 ( 2.321 -4.861 0.258) 5.393 2.005 ( 2.321 4.861 0.258) 5.393 2.132 ( 3.047 -5.452 -2.813) 6.850 2.132 ( 3.047 5.452 -2.813) 6.850 2.298 ( 2.180 -2.753 3.846) 5.208 2.298 ( 2.180 2.753 3.846) 5.208 2.440 ( -3.123 -3.815 -2.016) 5.326 2.440 ( -3.123 3.815 -2.016) 5.326 2.620 ( -0.469 -1.867 0.111) 1.928 2.620 ( -0.469 1.867 0.111) 1.928 2.736 ( -0.294 -4.234 6.919) 8.117 2.736 ( -0.294 4.234 6.919) 8.117 2.994 ( -3.125 -3.432 0.667) 4.689 2.994 ( -3.125 3.432 0.667) 4.689 3.163 ( -2.114 -3.902 -6.418) 7.803 3.163 ( -2.114 3.902 -6.418) 7.803 3.333 ( -5.101 -1.080 -1.442) 5.410 3.333 ( -5.101 1.080 -1.442) 5.410 3.609 ( 5.373 -0.780 -5.968) 8.068 3.609 ( 5.373 0.780 -5.968) 8.068 4.359 ( 0.617 -2.635 1.872) 3.290 4.359 ( 0.617 2.635 1.872) 3.290 4.570 ( -3.358 -3.122 -2.537) 5.240 4.570 ( -3.358 3.122 -2.537) 5.240 4.888 ( -8.596 -4.767 2.757) 10.209 4.888 ( -8.596 4.767 2.757) 10.209 5.152 ( -0.378 -4.400 -1.871) 4.797 5.152 ( -0.378 4.400 -1.871) 4.797 5.189 ( 1.514 -5.594 -0.120) 5.796 5.189 ( 1.514 5.594 -0.120) 5.796 5.424 ( -3.443 -1.585 -3.120) 4.909 5.424 ( -3.443 1.585 -3.120) 4.909 5.620 ( -0.014 -2.917 3.340) 4.434 5.620 ( -0.014 2.917 3.340) 4.434 5.832 ( -0.890 -1.717 0.620) 2.031 5.832 ( -0.890 1.717 0.620) 2.031 5.964 ( -10.362 -2.202 4.531) 11.521 5.964 ( -10.362 2.202 4.531) 11.521 6.309 ( 0.835 -2.399 -6.309) 6.801 6.309 ( 0.835 2.399 -6.309) 6.801 6.455 ( -0.077 -9.925 -3.872) 10.654 6.455 ( -0.077 9.925 -3.872) 10.654 6.623 ( -6.908 -5.471 -1.904) 9.016 6.623 ( -6.908 5.471 -1.904) 9.016 7.026 ( -2.539 -2.520 1.732) 3.975 7.026 ( -2.539 2.520 1.732) 3.975 7.226 ( -3.061 -6.284 0.304) 6.997 7.226 ( -3.061 6.284 0.304) 6.997 7.774 ( -3.720 -1.949 8.819) 9.768 7.774 ( -3.720 1.949 8.819) 9.768 8.064 ( -3.219 -8.148 -4.003) 9.632 8.064 ( -3.219 8.148 -4.003) 9.632 8.395 ( -0.411 -11.178 1.017) 11.231 8.395 ( -0.411 11.178 1.017) 11.231 8.685 ( -2.407 -3.617 -4.971) 6.602 8.685 ( -2.407 3.617 -4.971) 6.602 9.029 ( 7.469 -1.112 4.591) 8.838 9.029 ( 7.469 1.112 4.591) 8.838 9.212 ( 3.645 -5.506 1.979) 6.893 9.212 ( 3.645 5.506 1.979) 6.893 9.528 ( 6.512 -3.634 0.967) 7.520 9.528 ( 6.512 3.634 0.967) 7.520 9.805 ( 4.316 -2.907 -3.038) 6.026 9.805 ( 4.316 2.907 -3.038) 6.026 10.447 ( 0.563 -5.111 -1.280) 5.299 10.447 ( 0.563 5.111 -1.280) 5.299 10.713 ( 3.247 -8.929 0.967) 9.551 10.713 ( 3.247 8.929 0.967) 9.551 20.616 ( -2.614 -0.715 -1.008) 2.891 20.616 ( -2.614 0.715 -1.008) 2.891 20.914 ( -1.588 -0.605 0.227) 1.714 20.914 ( -1.588 0.605 0.227) 1.714 22.848 ( 0.203 -0.998 -0.404) 1.096 22.848 ( 0.203 0.998 -0.404) 1.096 23.100 ( -0.652 -1.352 0.379) 1.548 23.100 ( -0.652 1.352 0.379) 1.548 24.606 ( -2.294 -0.870 -0.016) 2.454 24.606 ( -2.294 0.870 -0.016) 2.454 24.973 ( 2.078 -0.667 1.008) 2.404 24.973 ( 2.078 0.667 1.008) 2.404 25.793 ( -4.612 -1.052 -0.099) 4.731 25.793 ( -4.612 1.052 -0.099) 4.731 26.107 ( -3.192 -1.276 -0.672) 3.503 26.107 ( -3.192 1.276 -0.672) 3.503 28.297 ( 0.146 -0.197 0.625) 0.671 28.297 ( 0.146 0.197 0.625) 0.671 28.562 ( 0.344 -1.912 -0.816) 2.107 28.562 ( 0.344 1.912 -0.816) 2.107 28.653 ( -1.179 -2.193 1.275) 2.797 28.653 ( -1.179 2.193 1.275) 2.797 28.797 ( 1.453 -1.151 -0.006) 1.854 28.797 ( 1.453 1.151 -0.006) 1.854 32.354 ( 0.793 -1.331 0.917) 1.801 32.354 ( 0.793 1.331 0.917) 1.801 32.533 ( 0.369 -1.910 -0.390) 1.984 32.533 ( 0.369 1.910 -0.390) 1.984 35.410 ( 0.106 -1.047 0.287) 1.091 35.410 ( 0.106 1.047 0.287) 1.091 35.544 ( -0.994 -0.472 -0.524) 1.219 35.544 ( -0.994 0.472 -0.524) 1.219 88.751 ( 2.036 -0.161 -1.021) 2.283 88.751 ( 2.036 0.161 -1.021) 2.283 89.123 ( 4.801 -3.816 1.082) 6.228 89.123 ( 4.801 3.816 1.082) 6.228 97.652 ( 1.564 -0.523 -0.457) 1.712 97.652 ( 1.564 0.523 -0.457) 1.712 97.705 ( 1.956 -1.174 0.138) 2.286 97.705 ( 1.956 1.174 0.138) 2.286 98.704 ( 0.780 -0.398 0.501) 1.009 98.704 ( 0.780 0.398 0.501) 1.009 99.008 ( -5.016 -2.320 -2.223) 5.957 99.008 ( -5.016 2.320 -2.223) 5.957 99.710 ( -1.413 -0.473 -1.092) 1.847 99.710 ( -1.413 0.473 -1.092) 1.847 99.939 ( 3.275 -6.337 2.012) 7.412 99.939 ( 3.275 6.337 2.012) 7.412 ======================= 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| 1.501 ( 5.953 -8.039 5.073) 11.216 1.501 ( 5.953 8.039 5.073) 11.216 1.883 ( 8.801 -5.232 5.012) 11.400 1.883 ( 8.801 5.232 5.012) 11.400 2.072 ( 2.073 -4.680 3.253) 6.065 2.072 ( 2.073 4.680 3.253) 6.065 2.149 ( 3.718 -2.583 -4.023) 6.057 2.149 ( 3.718 2.583 -4.023) 6.057 2.305 ( -4.366 -1.987 2.210) 5.282 2.305 ( -4.366 1.987 2.210) 5.282 2.420 ( -1.027 -3.021 3.764) 4.934 2.420 ( -1.027 3.021 3.764) 4.934 2.621 ( 0.273 -4.001 1.524) 4.290 2.621 ( 0.273 4.001 1.524) 4.290 2.777 ( -1.678 -4.696 3.936) 6.353 2.777 ( -1.678 4.696 3.936) 6.353 2.959 ( -1.374 -1.890 0.144) 2.341 2.959 ( -1.374 1.890 0.144) 2.341 3.059 ( -1.508 -4.692 -6.362) 8.048 3.059 ( -1.508 4.692 -6.362) 8.048 3.247 ( -2.880 -2.281 -2.709) 4.564 3.247 ( -2.880 2.281 -2.709) 4.564 3.614 ( 2.681 -1.772 -5.550) 6.413 3.614 ( 2.681 1.772 -5.550) 6.413 4.372 ( -1.124 -1.750 0.903) 2.268 4.372 ( -1.124 1.750 0.903) 2.268 4.495 ( -2.630 -1.906 -1.291) 3.496 4.495 ( -2.630 1.906 -1.291) 3.496 4.828 ( -2.379 -5.639 3.718) 7.161 4.828 ( -2.379 5.639 3.718) 7.161 5.132 ( 0.537 -4.077 -2.690) 4.914 5.132 ( 0.537 4.077 -2.690) 4.914 5.200 ( 0.826 -3.729 -1.662) 4.165 5.200 ( 0.826 3.729 -1.662) 4.165 5.308 ( -6.214 -2.090 -2.452) 7.000 5.308 ( -6.214 2.090 -2.452) 7.000 5.576 ( -8.149 -0.497 1.253) 8.260 5.576 ( -8.149 0.497 1.253) 8.260 5.811 ( -10.391 -1.684 1.322) 10.609 5.811 ( -10.391 1.684 1.322) 10.609 5.855 ( 2.592 -3.428 0.535) 4.330 5.855 ( 2.592 3.428 0.535) 4.330 6.181 ( -3.189 -1.738 -3.897) 5.327 6.181 ( -3.189 1.738 -3.897) 5.327 6.441 ( 1.514 -7.448 -4.201) 8.684 6.441 ( 1.514 7.448 -4.201) 8.684 6.572 ( -1.936 -5.369 0.783) 5.761 6.572 ( -1.936 5.369 0.783) 5.761 6.990 ( -3.039 -5.024 0.922) 5.944 6.990 ( -3.039 5.024 0.922) 5.944 7.245 ( 1.375 -7.061 4.241) 8.351 7.245 ( 1.375 7.061 4.241) 8.351 7.795 ( -2.251 -2.399 5.034) 6.014 7.795 ( -2.251 2.399 5.034) 6.014 7.986 ( -1.870 -8.181 -2.904) 8.880 7.986 ( -1.870 8.181 -2.904) 8.880 8.385 ( -2.055 -12.633 1.027) 12.840 8.385 ( -2.055 12.633 1.027) 12.840 8.619 ( 0.641 -2.594 -4.304) 5.066 8.619 ( 0.641 2.594 -4.304) 5.066 9.180 ( 5.214 -5.678 3.217) 8.353 9.180 ( 5.214 5.678 3.217) 8.353 9.279 ( 1.472 -8.093 2.954) 8.740 9.279 ( 1.472 8.093 2.954) 8.740 9.610 ( 2.844 -2.568 -0.826) 3.920 9.610 ( 2.844 2.568 -0.826) 3.920 9.861 ( 5.297 -3.859 -1.972) 6.844 9.861 ( 5.297 3.859 -1.972) 6.844 10.440 ( 0.362 -4.357 -1.111) 4.511 10.440 ( 0.362 4.357 -1.111) 4.511 10.775 ( 2.819 -10.386 0.870) 10.797 10.775 ( 2.819 10.386 0.870) 10.797 20.570 ( -1.821 -0.361 -0.590) 1.948 20.570 ( -1.821 0.361 -0.590) 1.948 20.891 ( -1.381 -0.839 0.179) 1.626 20.891 ( -1.381 0.839 0.179) 1.626 22.835 ( -0.467 -2.535 -1.261) 2.870 22.835 ( -0.467 2.535 -1.261) 2.870 23.105 ( 0.069 -2.421 1.226) 2.715 23.105 ( 0.069 2.421 1.226) 2.715 24.570 ( -1.893 -1.153 -0.049) 2.217 24.570 ( -1.893 1.153 -0.049) 2.217 25.015 ( 1.703 -0.621 0.864) 2.007 25.015 ( 1.703 0.621 0.864) 2.007 25.719 ( -3.840 -1.442 -0.215) 4.107 25.719 ( -3.840 1.442 -0.215) 4.107 26.053 ( -2.616 -0.612 -0.257) 2.699 26.053 ( -2.616 0.612 -0.257) 2.699 28.307 ( 0.387 -0.326 0.327) 0.602 28.307 ( 0.387 0.326 0.327) 0.602 28.550 ( -0.417 -1.490 -0.969) 1.826 28.550 ( -0.417 1.490 -0.969) 1.826 28.652 ( -0.638 -3.298 1.203) 3.568 28.652 ( -0.638 3.298 1.203) 3.568 28.816 ( 0.760 -2.112 0.011) 2.244 28.816 ( 0.760 2.112 0.011) 2.244 32.373 ( 0.460 -1.123 0.621) 1.364 32.373 ( 0.460 1.123 0.621) 1.364 32.537 ( 0.476 -1.258 -0.282) 1.375 32.537 ( 0.476 1.258 -0.282) 1.375 35.418 ( 0.358 -0.531 0.293) 0.704 35.418 ( 0.358 0.531 0.293) 0.704 35.523 ( -0.884 -0.728 -0.362) 1.201 35.523 ( -0.884 0.728 -0.362) 1.201 88.774 ( 1.752 -0.110 -0.811) 1.934 88.774 ( 1.752 0.110 -0.811) 1.934 89.210 ( 3.897 -4.531 1.123) 6.081 89.210 ( 3.897 4.531 1.123) 6.081 97.671 ( 1.291 -0.570 -0.583) 1.527 97.671 ( 1.291 0.570 -0.583) 1.527 97.741 ( 1.813 -1.881 0.378) 2.640 97.741 ( 1.813 1.881 0.378) 2.640 98.724 ( 1.159 -0.715 0.220) 1.379 98.724 ( 1.159 0.715 0.220) 1.379 98.912 ( -4.182 -1.013 -1.113) 4.445 98.912 ( -4.182 1.013 -1.113) 4.445 99.667 ( -1.541 -0.965 -1.717) 2.501 99.667 ( -1.541 0.965 -1.717) 2.501 100.010 ( 2.419 -8.907 1.792) 9.402 100.010 ( 2.419 8.907 1.792) 9.402 ======================= 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| 1.651 ( 4.716 -4.184 3.745) 7.333 1.651 ( 4.716 4.184 3.745) 7.333 1.964 ( 0.086 -1.417 -3.804) 4.060 1.964 ( 0.086 1.417 -3.804) 4.060 2.119 ( 0.287 -2.392 4.874) 5.437 2.119 ( 0.287 2.392 4.874) 5.437 2.196 ( 3.799 -5.289 -2.417) 6.946 2.196 ( 3.799 5.289 -2.417) 6.946 2.290 ( -0.253 -5.185 1.871) 5.518 2.290 ( -0.253 5.185 1.871) 5.518 2.428 ( -1.292 -1.913 1.984) 3.044 2.428 ( -1.292 1.913 1.984) 3.044 2.619 ( -2.275 -3.545 1.030) 4.336 2.619 ( -2.275 3.545 1.030) 4.336 2.819 ( 0.797 -2.789 5.337) 6.075 2.819 ( 0.797 2.789 5.337) 6.075 2.919 ( -1.271 -3.272 -4.527) 5.728 2.919 ( -1.271 3.272 -4.527) 5.728 3.032 ( 2.884 -0.951 0.653) 3.106 3.032 ( 2.884 0.951 0.653) 3.106 3.160 ( -3.446 -2.311 -3.828) 5.645 3.160 ( -3.446 2.311 -3.828) 5.645 3.595 ( 0.604 -2.276 -2.250) 3.257 3.595 ( 0.604 2.276 -2.250) 3.257 4.348 ( -1.331 -3.391 -0.119) 3.645 4.348 ( -1.331 3.391 -0.119) 3.645 4.468 ( -0.361 -2.915 0.045) 2.938 4.468 ( -0.361 2.915 0.045) 2.938 4.864 ( 1.132 -6.626 2.548) 7.188 4.864 ( 1.132 6.626 2.548) 7.188 5.104 ( -0.771 -4.445 -1.277) 4.689 5.104 ( -0.771 4.445 -1.277) 4.689 5.170 ( -2.592 -4.792 -2.500) 5.994 5.170 ( -2.592 4.792 -2.500) 5.994 5.210 ( -1.220 -5.557 -0.684) 5.730 5.210 ( -1.220 5.557 -0.684) 5.730 5.470 ( -3.579 -0.090 0.436) 3.606 5.470 ( -3.579 0.090 0.436) 3.606 5.679 ( -4.380 -1.786 -1.053) 4.846 5.679 ( -4.380 1.786 -1.053) 4.846 5.898 ( 1.367 -5.905 0.227) 6.065 5.898 ( 1.367 5.905 0.227) 6.065 6.180 ( 1.114 -2.228 3.820) 4.561 6.180 ( 1.114 2.228 3.820) 4.561 6.365 ( -2.216 -6.608 -5.842) 9.095 6.365 ( -2.216 6.608 -5.842) 9.095 6.574 ( 0.228 -1.373 0.858) 1.635 6.574 ( 0.228 1.373 0.858) 1.635 6.961 ( -1.217 -3.542 0.464) 3.774 6.961 ( -1.217 3.542 0.464) 3.774 7.307 ( 0.858 -7.727 2.191) 8.077 7.307 ( 0.858 7.727 2.191) 8.077 7.811 ( -0.238 -1.041 1.622) 1.942 7.811 ( -0.238 1.041 1.622) 1.942 7.942 ( -0.803 -7.935 -0.904) 8.026 7.942 ( -0.803 7.935 -0.904) 8.026 8.361 ( -1.164 -13.293 0.193) 13.345 8.361 ( -1.164 13.293 0.193) 13.345 8.602 ( 0.660 -2.384 -1.571) 2.930 8.602 ( 0.660 2.384 -1.571) 2.930 9.251 ( 1.406 -9.062 0.209) 9.173 9.251 ( 1.406 9.062 0.209) 9.173 9.338 ( 1.235 -9.166 2.836) 9.673 9.338 ( 1.235 9.166 2.836) 9.673 9.616 ( 0.272 -6.247 -1.589) 6.452 9.616 ( 0.272 6.247 -1.589) 6.452 9.915 ( 2.041 -2.841 -0.295) 3.510 9.915 ( 2.041 2.841 -0.295) 3.510 10.437 ( 0.276 -1.753 -0.483) 1.839 10.437 ( 0.276 1.753 -0.483) 1.839 10.817 ( 1.122 -11.533 0.412) 11.595 10.817 ( 1.122 11.533 0.412) 11.595 20.545 ( -0.627 -0.167 -0.179) 0.673 20.545 ( -0.627 0.167 -0.179) 0.673 20.876 ( -0.546 -0.976 0.066) 1.120 20.876 ( -0.546 0.976 0.066) 1.120 22.816 ( -0.328 -3.343 -0.664) 3.424 22.816 ( -0.328 3.343 -0.664) 3.424 23.119 ( 0.174 -3.015 0.651) 3.089 23.119 ( 0.174 3.015 0.651) 3.089 24.547 ( -0.734 -1.348 -0.031) 1.535 24.547 ( -0.734 1.348 -0.031) 1.535 25.043 ( 0.675 -0.306 0.346) 0.818 25.043 ( 0.675 0.306 0.346) 0.818 25.671 ( -1.500 -1.619 -0.127) 2.210 25.671 ( -1.500 1.619 -0.127) 2.210 26.020 ( -1.006 -0.410 -0.038) 1.087 26.020 ( -1.006 0.410 -0.038) 1.087 28.315 ( 0.219 -0.602 0.096) 0.647 28.315 ( 0.219 0.602 0.096) 0.647 28.536 ( -0.259 -1.119 -0.403) 1.218 28.536 ( -0.259 1.119 -0.403) 1.218 28.654 ( -0.227 -3.693 0.461) 3.729 28.654 ( -0.227 3.693 0.461) 3.729 28.823 ( 0.203 -2.906 0.004) 2.913 28.823 ( 0.203 2.906 0.004) 2.913 32.382 ( 0.126 -0.546 0.200) 0.594 32.382 ( 0.126 0.546 0.200) 0.594 32.541 ( 0.228 -0.584 -0.091) 0.633 32.541 ( 0.228 0.584 -0.091) 0.633 35.426 ( 0.230 -0.550 0.123) 0.609 35.426 ( 0.230 0.550 0.123) 0.609 35.510 ( -0.390 -1.034 -0.124) 1.112 35.510 ( -0.390 1.034 -0.124) 1.112 88.789 ( 0.679 -0.159 -0.304) 0.761 88.789 ( 0.679 0.159 -0.304) 0.761 89.265 ( 1.476 -4.921 0.490) 5.161 89.265 ( 1.476 4.921 0.490) 5.161 97.681 ( 0.467 -0.244 -0.267) 0.590 97.681 ( 0.467 0.244 -0.267) 0.590 97.767 ( 0.768 -2.412 0.208) 2.540 97.767 ( 0.768 2.412 0.208) 2.540 98.744 ( 0.921 -0.983 -0.017) 1.347 98.744 ( 0.921 0.983 -0.017) 1.347 98.851 ( -1.998 -0.279 -0.231) 2.031 98.851 ( -1.998 0.279 -0.231) 2.031 99.634 ( -0.651 -1.483 -0.784) 1.800 99.634 ( -0.651 1.483 -0.784) 1.800 100.051 ( 0.868 -9.754 0.681) 9.817 100.051 ( 0.868 9.754 0.681) 9.817 ======================= 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| 0.419 ( -0.089 0.000 20.376) 20.376 0.479 ( -8.031 0.000 21.919) 23.344 0.905 ( -3.802 0.000 39.629) 39.811 1.695 ( 2.792 0.000 -11.250) 11.591 1.787 ( 0.797 0.000 -16.206) 16.226 1.929 ( 1.397 0.000 6.773) 6.916 2.132 ( 5.218 0.000 10.880) 12.067 2.139 ( -0.606 0.000 1.171) 1.318 2.236 ( -1.900 0.000 -3.308) 3.815 2.383 ( -1.544 0.000 6.926) 7.096 2.525 ( -3.386 0.000 3.423) 4.815 2.587 ( 1.084 0.000 6.870) 6.955 2.604 ( 1.267 0.000 -1.685) 2.108 2.674 ( 0.461 0.000 7.273) 7.287 2.771 ( -1.804 0.000 0.033) 1.804 2.826 ( 2.848 0.000 -3.531) 4.537 2.928 ( 1.962 0.000 2.068) 2.851 3.184 ( -2.053 0.000 -2.813) 3.483 3.221 ( -0.541 0.000 -3.485) 3.526 3.250 ( 3.072 0.000 -8.832) 9.351 3.280 ( -3.596 0.000 -5.004) 6.162 3.308 ( 0.710 0.000 -2.146) 2.260 3.426 ( -0.439 0.000 -5.152) 5.170 3.540 ( -2.479 0.000 -5.173) 5.736 4.336 ( -0.978 0.000 1.592) 1.868 4.453 ( 2.027 0.000 -2.208) 2.997 4.676 ( -6.726 0.000 6.789) 9.557 4.825 ( 1.111 0.000 1.506) 1.871 4.866 ( -1.707 0.000 0.149) 1.713 5.017 ( -0.671 0.000 1.786) 1.908 5.159 ( -0.740 0.000 3.123) 3.210 5.215 ( -1.443 0.000 0.747) 1.625 5.294 ( 0.282 0.000 5.689) 5.696 5.402 ( -0.573 0.000 -8.646) 8.665 5.525 ( 0.530 0.000 3.593) 3.631 5.532 ( 1.605 0.000 -3.926) 4.241 5.689 ( -1.213 0.000 -4.202) 4.374 5.795 ( 3.615 0.000 2.121) 4.192 5.892 ( 3.312 0.000 -0.645) 3.374 5.896 ( -4.096 0.000 2.471) 4.783 5.933 ( -0.377 0.000 0.345) 0.511 6.001 ( -1.649 0.000 1.020) 1.940 6.212 ( 1.792 0.000 -4.810) 5.133 6.233 ( -1.476 0.000 -3.994) 4.258 6.346 ( -1.768 0.000 0.011) 1.768 6.414 ( -3.446 0.000 -2.030) 4.000 6.544 ( 5.358 0.000 -1.807) 5.655 6.896 ( 1.902 0.000 -14.295) 14.421 7.055 ( -1.809 0.000 0.155) 1.815 7.152 ( 1.162 0.000 -1.936) 2.257 7.234 ( 4.940 0.000 0.629) 4.980 7.237 ( -5.439 0.000 -0.442) 5.457 7.651 ( 5.999 0.000 15.734) 16.839 8.053 ( -4.542 0.000 0.228) 4.547 8.107 ( 1.575 0.000 2.158) 2.672 8.204 ( -14.787 0.000 3.131) 15.115 8.515 ( 11.239 0.000 5.525) 12.524 8.682 ( -3.704 0.000 0.611) 3.754 8.694 ( -9.027 0.000 1.465) 9.145 8.716 ( 3.544 0.000 -1.495) 3.847 8.795 ( 0.229 0.000 2.647) 2.657 8.933 ( 5.056 0.000 -1.177) 5.191 9.060 ( 0.899 0.000 -0.607) 1.084 9.177 ( -1.552 0.000 0.459) 1.619 9.415 ( -7.105 0.000 6.982) 9.961 9.486 ( 9.528 0.000 -7.011) 11.829 9.594 ( 7.741 0.000 -9.123) 11.965 9.935 ( 6.737 0.000 -5.334) 8.593 10.241 ( -9.336 0.000 3.034) 9.817 10.314 ( 4.685 0.000 -0.525) 4.714 10.724 ( -19.056 0.000 3.624) 19.398 10.942 ( 3.535 0.000 -0.986) 3.670 20.470 ( 0.014 0.000 1.054) 1.054 20.608 ( 0.553 0.000 -2.108) 2.180 20.872 ( -0.477 0.000 0.927) 1.042 20.914 ( 0.309 0.000 -0.211) 0.375 22.784 ( 1.672 0.000 0.751) 1.833 22.861 ( -1.763 0.000 -0.896) 1.978 23.059 ( 1.523 0.000 0.567) 1.625 23.133 ( -1.225 0.000 -0.952) 1.552 24.751 ( 1.235 0.000 0.716) 1.428 24.830 ( -1.906 0.000 -1.356) 2.339 24.884 ( 0.449 0.000 0.983) 1.081 24.900 ( 0.883 0.000 0.197) 0.905 25.867 ( 1.134 0.000 0.022) 1.135 25.872 ( -0.722 0.000 -0.046) 0.723 26.045 ( 0.147 0.000 2.549) 2.553 26.270 ( -10.074 0.000 -2.284) 10.330 28.293 ( -0.432 0.000 2.403) 2.441 28.459 ( -9.757 0.000 -0.297) 9.762 28.545 ( 0.201 0.000 0.490) 0.530 28.606 ( 1.160 0.000 -1.145) 1.630 28.663 ( 0.121 0.000 0.198) 0.233 28.717 ( -1.786 0.000 0.961) 2.029 28.788 ( 15.656 0.000 -0.049) 15.656 28.850 ( 1.753 0.000 -2.098) 2.734 32.294 ( -0.682 0.000 1.167) 1.352 32.404 ( 0.763 0.000 -1.165) 1.392 32.496 ( 1.772 0.000 1.062) 2.065 32.603 ( 0.254 0.000 -1.198) 1.225 35.360 ( -0.227 0.000 1.418) 1.436 35.426 ( -0.355 0.000 1.875) 1.908 35.518 ( -0.000 0.000 -1.956) 1.956 35.574 ( -2.365 0.000 -1.205) 2.654 88.769 ( -2.480 0.000 0.669) 2.569 88.899 ( 0.878 0.000 -2.241) 2.407 89.074 ( -45.686 0.000 1.222) 45.702 89.131 ( 5.407 0.000 0.196) 5.411 97.614 ( 0.503 0.000 -0.327) 0.600 97.621 ( -1.858 0.000 -0.595) 1.951 97.666 ( -5.693 0.000 0.719) 5.738 97.693 ( 0.869 0.000 0.034) 0.870 98.682 ( -0.258 0.000 1.107) 1.136 98.733 ( 0.241 0.000 0.110) 0.265 98.789 ( 1.428 0.000 -0.022) 1.428 98.847 ( -0.435 0.000 -1.355) 1.423 99.599 ( -0.091 0.000 1.051) 1.055 99.712 ( 1.019 0.000 -1.514) 1.825 99.997 ( -5.735 0.000 1.054) 5.831 100.053 ( 29.170 0.000 -0.306) 29.172 ======================= 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| 0.728 ( 12.180 0.000 15.938) 20.059 0.743 ( 11.102 0.000 17.762) 20.946 1.363 ( 10.225 0.000 26.087) 28.019 1.646 ( 3.251 0.000 -14.170) 14.538 1.653 ( 7.036 0.000 -12.289) 14.160 2.000 ( -0.174 0.000 3.665) 3.669 2.143 ( -1.260 0.000 3.744) 3.951 2.188 ( -3.322 0.000 4.475) 5.573 2.357 ( 5.298 0.000 12.326) 13.416 2.404 ( -2.844 0.000 4.126) 5.011 2.465 ( -5.732 0.000 3.794) 6.874 2.593 ( -2.267 0.000 -0.157) 2.273 2.662 ( -1.190 0.000 4.434) 4.591 2.712 ( -2.045 0.000 0.205) 2.056 2.759 ( -1.127 0.000 3.920) 4.079 2.846 ( 2.388 0.000 -1.560) 2.853 2.977 ( 0.562 0.000 2.656) 2.715 3.080 ( 0.975 0.000 -12.262) 12.301 3.117 ( -2.858 0.000 -6.506) 7.107 3.216 ( -0.360 0.000 -2.985) 3.006 3.229 ( 3.210 0.000 -6.832) 7.549 3.286 ( -1.976 0.000 -0.372) 2.011 3.325 ( -2.234 0.000 -7.443) 7.771 3.485 ( 1.012 0.000 -3.884) 4.014 4.363 ( 2.219 0.000 1.422) 2.635 4.465 ( 1.166 0.000 -1.278) 1.730 4.662 ( -3.181 0.000 5.476) 6.333 4.812 ( -4.335 0.000 -0.873) 4.423 4.863 ( 0.579 0.000 1.671) 1.768 4.982 ( -4.900 0.000 1.966) 5.280 5.104 ( -9.966 0.000 5.272) 11.275 5.222 ( -0.298 0.000 2.853) 2.868 5.310 ( 1.078 0.000 -8.128) 8.199 5.385 ( 1.706 0.000 5.068) 5.348 5.435 ( -4.800 0.000 -6.774) 8.302 5.602 ( 1.479 0.000 6.250) 6.422 5.651 ( -1.220 0.000 -1.922) 2.276 5.819 ( -1.065 0.000 -2.300) 2.535 5.865 ( -1.025 0.000 0.371) 1.090 5.939 ( 1.164 0.000 -2.105) 2.405 5.986 ( 5.069 0.000 1.950) 5.431 5.988 ( -0.228 0.000 3.736) 3.743 6.120 ( -8.153 0.000 -1.781) 8.346 6.158 ( -1.918 0.000 -4.017) 4.451 6.233 ( -6.722 0.000 1.343) 6.855 6.364 ( -1.127 0.000 -1.004) 1.509 6.599 ( 4.010 0.000 -3.492) 5.317 6.747 ( -2.426 0.000 -12.924) 13.150 7.061 ( -2.091 0.000 0.927) 2.288 7.137 ( -3.788 0.000 0.054) 3.789 7.149 ( 1.418 0.000 -2.006) 2.457 7.321 ( 3.943 0.000 -0.962) 4.058 7.779 ( -19.389 0.000 -3.400) 19.685 7.891 ( 1.480 0.000 15.706) 15.775 8.103 ( -7.366 0.000 6.434) 9.780 8.143 ( -0.451 0.000 2.896) 2.931 8.555 ( -6.115 0.000 -2.928) 6.780 8.590 ( -12.692 0.000 4.890) 13.601 8.645 ( -2.785 0.000 4.558) 5.342 8.768 ( 3.230 0.000 -0.831) 3.335 8.861 ( 4.141 0.000 3.259) 5.270 8.972 ( 3.920 0.000 -3.858) 5.500 9.090 ( 5.114 0.000 -2.193) 5.564 9.234 ( 8.018 0.000 2.219) 8.319 9.443 ( 1.654 0.000 6.275) 6.489 9.449 ( -0.994 0.000 -7.664) 7.728 9.596 ( 5.445 0.000 -12.673) 13.794 9.901 ( -1.212 0.000 -0.764) 1.433 10.254 ( 5.217 0.000 0.901) 5.294 10.442 ( 7.938 0.000 1.933) 8.170 10.627 ( -3.154 0.000 3.510) 4.718 11.037 ( 7.902 0.000 0.481) 7.917 20.482 ( -0.195 0.000 1.391) 1.405 20.578 ( -0.816 0.000 -2.377) 2.513 20.866 ( -1.315 0.000 0.779) 1.528 20.912 ( -0.330 0.000 -0.171) 0.371 22.808 ( -2.520 0.000 -1.830) 3.114 22.834 ( 2.322 0.000 1.797) 2.936 23.096 ( -1.275 0.000 -1.858) 2.254 23.107 ( 2.849 0.000 1.357) 3.155 24.754 ( -4.826 0.000 -0.525) 4.855 24.785 ( 1.285 0.000 1.525) 1.994 24.872 ( -1.870 0.000 0.699) 1.996 24.921 ( 1.101 0.000 0.467) 1.197 25.822 ( -4.983 0.000 -0.433) 5.002 25.855 ( -2.670 0.000 0.673) 2.753 26.079 ( -0.383 0.000 3.430) 3.451 26.129 ( -5.490 0.000 0.844) 5.555 28.316 ( -0.276 0.000 2.604) 2.619 28.360 ( -4.358 0.000 1.592) 4.640 28.534 ( -1.932 0.000 0.891) 2.127 28.600 ( -0.454 0.000 -0.439) 0.632 28.660 ( -0.660 0.000 0.166) 0.680 28.705 ( -0.317 0.000 -0.487) 0.581 28.853 ( 0.959 0.000 -1.592) 1.858 28.929 ( 6.487 0.000 -4.543) 7.920 32.302 ( 0.151 0.000 1.179) 1.188 32.410 ( 1.391 0.000 -1.124) 1.789 32.494 ( -2.105 0.000 2.051) 2.939 32.587 ( -0.352 0.000 -1.615) 1.653 35.376 ( 0.053 0.000 1.803) 1.804 35.443 ( -0.312 0.000 2.252) 2.274 35.486 ( -1.027 0.000 -1.795) 2.068 35.540 ( -0.581 0.000 -0.709) 0.916 88.718 ( -2.557 0.000 2.814) 3.802 88.814 ( -4.205 0.000 4.455) 6.126 88.916 ( 3.574 0.000 -1.544) 3.893 89.265 ( 7.725 0.000 3.835) 8.625 97.620 ( 1.993 0.000 -1.249) 2.352 97.633 ( 1.698 0.000 0.117) 1.702 97.663 ( 1.348 0.000 -0.261) 1.374 97.729 ( 3.077 0.000 0.700) 3.156 98.691 ( -0.066 0.000 1.110) 1.112 98.736 ( -0.264 0.000 0.288) 0.391 98.791 ( -0.760 0.000 0.691) 1.027 98.815 ( -1.060 0.000 -2.043) 2.302 99.609 ( -0.153 0.000 1.223) 1.233 99.704 ( 0.068 0.000 -1.512) 1.514 99.885 ( -6.587 0.000 -2.338) 6.990 100.335 ( 12.150 0.000 -5.764) 13.448 ======================= 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| 1.103 ( 11.382 0.000 13.415) 17.593 1.131 ( 18.431 0.000 9.146) 20.575 1.534 ( 10.196 0.000 -15.275) 18.365 1.647 ( 8.031 0.000 -13.340) 15.571 1.756 ( 3.192 0.000 11.606) 12.037 2.015 ( 0.539 0.000 0.195) 0.573 2.204 ( -5.343 0.000 9.144) 10.591 2.218 ( 2.287 0.000 8.136) 8.452 2.383 ( -2.585 0.000 2.562) 3.639 2.398 ( -2.487 0.000 2.807) 3.750 2.519 ( -6.099 0.000 1.295) 6.235 2.596 ( 4.685 0.000 10.612) 11.600 2.639 ( -5.509 0.000 3.183) 6.363 2.682 ( -5.644 0.000 -6.185) 8.373 2.720 ( 2.408 0.000 -0.580) 2.477 2.846 ( -0.471 0.000 -2.426) 2.472 2.985 ( 0.363 0.000 -2.458) 2.485 3.007 ( 6.259 0.000 -10.533) 12.253 3.096 ( -0.689 0.000 7.704) 7.734 3.159 ( -5.582 0.000 1.473) 5.773 3.160 ( -1.252 0.000 -9.118) 9.204 3.249 ( -1.597 0.000 -0.484) 1.669 3.267 ( 2.093 0.000 -3.903) 4.429 3.474 ( 3.276 0.000 -4.309) 5.413 4.430 ( 4.050 0.000 0.766) 4.122 4.465 ( -1.578 0.000 1.980) 2.532 4.672 ( -2.005 0.000 3.955) 4.434 4.721 ( -4.822 0.000 -0.914) 4.908 4.864 ( -1.954 0.000 0.021) 1.954 4.934 ( -2.838 0.000 2.376) 3.702 5.002 ( -7.019 0.000 4.254) 8.208 5.223 ( -3.825 0.000 3.436) 5.142 5.243 ( -3.667 0.000 -4.580) 5.867 5.299 ( 1.390 0.000 -8.392) 8.506 5.462 ( 1.371 0.000 4.627) 4.825 5.598 ( -1.610 0.000 -2.795) 3.226 5.644 ( -3.547 0.000 4.177) 5.479 5.731 ( -5.666 0.000 -4.029) 6.952 5.857 ( -1.787 0.000 -2.548) 3.112 5.873 ( -5.382 0.000 -0.840) 5.447 5.949 ( -9.373 0.000 4.147) 10.249 6.086 ( -2.429 0.000 -1.415) 2.811 6.090 ( 3.397 0.000 2.906) 4.470 6.096 ( 2.163 0.000 5.957) 6.338 6.200 ( 3.266 0.000 0.630) 3.327 6.321 ( -1.299 0.000 -4.414) 4.601 6.563 ( -4.041 0.000 -9.940) 10.730 6.606 ( 0.477 0.000 -1.670) 1.737 6.958 ( -6.600 0.000 -1.010) 6.676 7.164 ( 2.945 0.000 -1.896) 3.503 7.167 ( 2.821 0.000 1.927) 3.416 7.261 ( -7.252 0.000 -7.527) 10.452 7.510 ( -9.569 0.000 2.934) 10.009 7.971 ( -8.287 0.000 8.858) 12.131 8.039 ( -10.090 0.000 7.744) 12.719 8.198 ( 2.100 0.000 5.910) 6.272 8.370 ( -17.531 0.000 5.477) 18.367 8.427 ( -2.586 0.000 -7.366) 7.807 8.626 ( -0.745 0.000 -0.716) 1.033 8.794 ( -0.143 0.000 0.570) 0.588 8.970 ( 0.528 0.000 -1.595) 1.680 8.975 ( 4.170 0.000 2.949) 5.107 9.182 ( 6.717 0.000 -1.973) 7.001 9.340 ( -1.999 0.000 -6.821) 7.108 9.439 ( 12.098 0.000 1.472) 12.187 9.562 ( 9.198 0.000 -12.850) 15.803 9.579 ( 6.003 0.000 6.628) 8.942 9.927 ( 4.575 0.000 -2.105) 5.036 10.355 ( 3.432 0.000 4.186) 5.413 10.568 ( 4.432 0.000 1.629) 4.722 10.612 ( -2.077 0.000 0.980) 2.296 11.193 ( 8.851 0.000 1.168) 8.928 20.490 ( -0.584 0.000 1.309) 1.433 20.541 ( -0.690 0.000 -2.009) 2.124 20.847 ( -1.721 0.000 0.651) 1.840 20.901 ( -0.714 0.000 -0.259) 0.760 22.749 ( -2.297 0.000 -1.443) 2.713 22.890 ( 1.946 0.000 1.715) 2.594 23.057 ( -0.830 0.000 -1.844) 2.022 23.173 ( 3.108 0.000 1.265) 3.355 24.675 ( -4.279 0.000 0.126) 4.281 24.818 ( 0.738 0.000 1.207) 1.414 24.847 ( -1.690 0.000 0.358) 1.728 24.944 ( 1.183 0.000 0.207) 1.201 25.714 ( -6.679 0.000 -0.633) 6.709 25.803 ( -4.383 0.000 0.985) 4.493 26.074 ( -2.414 0.000 -0.019) 2.414 26.092 ( -2.244 0.000 2.938) 3.697 28.324 ( -1.897 0.000 0.839) 2.074 28.337 ( 0.110 0.000 1.752) 1.756 28.508 ( -2.404 0.000 1.159) 2.669 28.596 ( -0.273 0.000 0.955) 0.993 28.645 ( -1.152 0.000 -0.044) 1.153 28.687 ( -0.398 0.000 -1.857) 1.899 28.847 ( 0.130 0.000 -1.342) 1.348 28.959 ( 2.832 0.000 -3.325) 4.367 32.323 ( 0.926 0.000 1.089) 1.430 32.427 ( 1.988 0.000 -0.922) 2.191 32.484 ( -1.946 0.000 2.181) 2.923 32.557 ( -0.737 0.000 -2.168) 2.290 35.397 ( 0.063 0.000 1.860) 1.862 35.455 ( -0.551 0.000 -1.539) 1.634 35.460 ( -0.587 0.000 2.101) 2.182 35.528 ( 0.201 0.000 -1.139) 1.157 88.753 ( 2.643 0.000 1.778) 3.185 88.818 ( -0.571 0.000 2.478) 2.542 88.976 ( 5.108 0.000 -1.173) 5.241 89.441 ( 5.770 0.000 6.385) 8.606 97.645 ( 2.252 0.000 -0.733) 2.368 97.666 ( 1.864 0.000 0.239) 1.880 97.681 ( 1.489 0.000 -0.921) 1.751 97.808 ( 4.509 0.000 2.033) 4.946 98.701 ( 0.020 0.000 0.774) 0.774 98.727 ( -1.089 0.000 0.110) 1.095 98.778 ( -0.587 0.000 -2.061) 2.143 98.784 ( -1.191 0.000 1.027) 1.572 99.618 ( -0.269 0.000 1.055) 1.089 99.686 ( -0.642 0.000 -0.764) 0.998 99.750 ( -4.693 0.000 -4.302) 6.366 100.421 ( 5.597 0.000 -3.998) 6.878 ======================= 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| 1.371 ( 7.511 0.000 6.277) 9.789 1.456 ( 15.356 0.000 -4.236) 15.930 1.623 ( 11.127 0.000 -1.643) 11.248 1.642 ( 7.292 0.000 -10.834) 13.059 1.840 ( 2.871 0.000 1.627) 3.300 2.006 ( -0.971 0.000 -2.889) 3.048 2.204 ( -3.803 0.000 7.734) 8.619 2.219 ( -3.819 0.000 -3.465) 5.157 2.406 ( -1.432 0.000 2.798) 3.143 2.409 ( -4.547 0.000 1.793) 4.888 2.473 ( -5.461 0.000 -11.472) 12.705 2.510 ( 4.229 0.000 4.253) 5.998 2.587 ( -4.735 0.000 3.569) 5.929 2.715 ( 0.018 0.000 1.971) 1.971 2.779 ( 0.297 0.000 3.463) 3.476 2.811 ( 2.955 0.000 -7.077) 7.670 2.982 ( 0.725 0.000 2.260) 2.373 3.052 ( 5.271 0.000 -1.032) 5.371 3.053 ( -0.975 0.000 -4.042) 4.158 3.065 ( -6.850 0.000 2.406) 7.260 3.183 ( -2.000 0.000 5.769) 6.106 3.228 ( -2.214 0.000 6.425) 6.796 3.246 ( -0.302 0.000 -2.998) 3.013 3.523 ( 7.838 0.000 -4.116) 8.853 4.448 ( -4.548 0.000 4.294) 6.255 4.499 ( 3.640 0.000 0.055) 3.640 4.644 ( -3.522 0.000 -0.527) 3.561 4.675 ( -2.429 0.000 3.525) 4.281 4.809 ( -4.080 0.000 0.932) 4.185 4.946 ( 0.556 0.000 2.905) 2.958 4.982 ( 1.096 0.000 0.313) 1.140 5.122 ( -4.759 0.000 -2.684) 5.464 5.168 ( -5.807 0.000 2.034) 6.153 5.284 ( 3.735 0.000 -4.913) 6.172 5.518 ( -0.894 0.000 4.536) 4.624 5.531 ( -7.383 0.000 -3.170) 8.035 5.587 ( 0.618 0.000 -1.899) 1.997 5.618 ( -2.955 0.000 2.971) 4.190 5.743 ( -5.310 0.000 -2.657) 5.938 5.750 ( -10.264 0.000 1.857) 10.430 5.913 ( -4.020 0.000 1.756) 4.387 5.968 ( -4.741 0.000 -2.828) 5.521 6.165 ( 1.434 0.000 3.834) 4.093 6.200 ( 3.584 0.000 1.831) 4.024 6.251 ( 1.059 0.000 -5.196) 5.302 6.361 ( 6.475 0.000 7.427) 9.854 6.432 ( 0.363 0.000 -6.391) 6.401 6.578 ( -3.374 0.000 0.675) 3.441 6.850 ( -5.748 0.000 -0.248) 5.753 7.048 ( -7.517 0.000 -2.924) 8.065 7.212 ( 3.254 0.000 -0.282) 3.266 7.232 ( 3.018 0.000 0.368) 3.040 7.446 ( -2.545 0.000 0.347) 2.568 7.864 ( -8.099 0.000 -0.776) 8.136 7.907 ( -16.465 0.000 8.922) 18.727 8.192 ( -5.995 0.000 -1.672) 6.223 8.236 ( -4.146 0.000 -0.972) 4.258 8.377 ( 4.306 0.000 -0.170) 4.309 8.615 ( -0.149 0.000 0.457) 0.481 8.750 ( -4.542 0.000 -2.298) 5.090 8.979 ( 0.554 0.000 2.012) 2.087 9.035 ( 2.519 0.000 -1.182) 2.782 9.248 ( 4.571 0.000 -3.578) 5.805 9.281 ( 2.208 0.000 -3.871) 4.456 9.617 ( 6.986 0.000 1.697) 7.189 9.642 ( 11.298 0.000 -5.835) 12.716 9.751 ( 5.917 0.000 4.884) 7.672 9.981 ( 5.030 0.000 -2.991) 5.853 10.449 ( 1.864 0.000 4.611) 4.973 10.577 ( -3.732 0.000 1.994) 4.231 10.623 ( 1.521 0.000 -0.211) 1.536 11.319 ( 5.078 0.000 -0.450) 5.098 20.491 ( -0.774 0.000 1.005) 1.268 20.516 ( -0.044 0.000 -1.283) 1.284 20.826 ( -1.529 0.000 0.663) 1.666 20.885 ( -0.631 0.000 -0.395) 0.744 22.709 ( -1.414 0.000 -0.073) 1.416 22.927 ( 0.908 0.000 0.500) 1.036 23.035 ( 0.051 0.000 -0.816) 0.818 23.227 ( 2.187 0.000 0.179) 2.194 24.619 ( -3.001 0.000 0.760) 3.096 24.828 ( -1.112 0.000 0.522) 1.229 24.829 ( 0.003 0.000 -0.385) 0.385 24.963 ( 1.034 0.000 -0.200) 1.054 25.606 ( -5.202 0.000 -0.269) 5.209 25.737 ( -4.358 0.000 0.545) 4.392 26.041 ( -1.390 0.000 -0.315) 1.426 26.071 ( -2.812 0.000 1.467) 3.172 28.311 ( -0.667 0.000 0.579) 0.883 28.359 ( 0.843 0.000 0.893) 1.228 28.484 ( -2.144 0.000 1.620) 2.687 28.601 ( -0.961 0.000 0.749) 1.219 28.624 ( -0.977 0.000 -0.377) 1.048 28.662 ( 0.079 0.000 -0.997) 1.000 28.829 ( -0.166 0.000 -1.693) 1.701 28.963 ( 1.576 0.000 -2.450) 2.913 32.353 ( 1.350 0.000 0.797) 1.567 32.456 ( 2.350 0.000 -0.555) 2.415 32.472 ( -2.212 0.000 1.801) 2.852 32.520 ( -0.602 0.000 -2.512) 2.583 35.415 ( -0.255 0.000 1.629) 1.649 35.437 ( 0.080 0.000 -1.054) 1.057 35.466 ( -0.921 0.000 1.393) 1.670 35.522 ( 0.529 0.000 -1.154) 1.270 88.822 ( 2.091 0.000 2.743) 3.449 88.840 ( 0.414 0.000 2.322) 2.358 89.047 ( 4.808 0.000 -1.687) 5.095 89.556 ( 0.241 0.000 4.798) 4.804 97.676 ( 2.156 0.000 -1.023) 2.386 97.694 ( 1.378 0.000 -0.071) 1.380 97.696 ( 0.978 0.000 0.703) 1.204 97.900 ( 2.793 0.000 2.647) 3.848 98.707 ( -0.812 0.000 -0.410) 0.910 98.707 ( 0.042 0.000 0.292) 0.295 98.755 ( -0.065 0.000 -1.279) 1.281 98.773 ( -1.402 0.000 0.901) 1.666 99.621 ( -0.400 0.000 0.583) 0.707 99.656 ( -1.843 0.000 -2.774) 3.331 99.680 ( 0.312 0.000 0.765) 0.826 100.451 ( 3.191 0.000 -3.919) 5.054 ======================= 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| 1.489 ( 1.355 0.000 2.306) 2.674 1.617 ( 12.937 0.000 -7.082) 14.749 1.635 ( 5.173 0.000 -11.404) 12.523 1.662 ( -3.707 0.000 -3.613) 5.176 1.934 ( -2.224 0.000 -3.164) 3.867 2.006 ( 9.263 0.000 2.112) 9.501 2.116 ( -0.027 0.000 -4.921) 4.921 2.266 ( 0.673 0.000 8.561) 8.587 2.296 ( -1.008 0.000 -6.508) 6.586 2.341 ( -3.966 0.000 -1.374) 4.198 2.392 ( -3.307 0.000 -0.611) 3.363 2.508 ( -5.810 0.000 -1.737) 6.064 2.596 ( 2.023 0.000 0.312) 2.047 2.677 ( -3.312 0.000 -6.864) 7.622 2.749 ( 1.747 0.000 -4.539) 4.864 2.767 ( -2.558 0.000 -1.382) 2.907 2.955 ( -8.014 0.000 5.106) 9.503 3.069 ( -1.905 0.000 4.236) 4.644 3.097 ( 6.408 0.000 1.005) 6.486 3.127 ( 1.926 0.000 2.566) 3.209 3.148 ( -2.155 0.000 2.780) 3.518 3.223 ( 0.461 0.000 -0.211) 0.507 3.318 ( -0.805 0.000 10.656) 10.687 3.620 ( 7.489 0.000 -2.683) 7.955 4.413 ( -4.939 0.000 4.337) 6.573 4.554 ( 1.680 0.000 0.809) 1.864 4.597 ( -0.575 0.000 -0.104) 0.584 4.673 ( -1.778 0.000 3.324) 3.769 4.765 ( -3.329 0.000 2.474) 4.148 4.992 ( 1.106 0.000 2.045) 2.325 5.017 ( 2.952 0.000 -1.572) 3.344 5.031 ( -4.005 0.000 -0.739) 4.073 5.113 ( -2.398 0.000 1.984) 3.112 5.315 ( 4.126 0.000 -0.663) 4.179 5.427 ( -1.034 0.000 -0.454) 1.129 5.508 ( -3.349 0.000 -0.543) 3.393 5.606 ( -8.258 0.000 3.894) 9.131 5.619 ( -1.782 0.000 3.982) 4.363 5.638 ( -3.932 0.000 -1.199) 4.110 5.663 ( 7.225 0.000 -2.472) 7.636 5.822 ( -4.148 0.000 -1.407) 4.380 5.905 ( -0.056 0.000 -2.300) 2.301 6.225 ( 0.245 0.000 4.822) 4.828 6.264 ( 4.121 0.000 -2.385) 4.761 6.272 ( 2.357 0.000 1.642) 2.872 6.335 ( -2.345 0.000 -2.831) 3.676 6.531 ( -3.741 0.000 3.572) 5.173 6.595 ( 7.119 0.000 7.708) 10.493 6.762 ( -4.617 0.000 0.898) 4.703 6.979 ( 0.444 0.000 0.559) 0.714 7.249 ( 0.069 0.000 1.033) 1.035 7.260 ( 1.095 0.000 -1.826) 2.129 7.423 ( 1.065 0.000 -2.116) 2.369 7.719 ( -14.360 0.000 5.579) 15.406 7.719 ( -3.409 0.000 -7.844) 8.553 8.110 ( -0.616 0.000 -4.360) 4.403 8.128 ( -2.198 0.000 -6.509) 6.870 8.481 ( 2.392 0.000 6.434) 6.864 8.628 ( -1.471 0.000 -8.419) 8.547 8.638 ( 0.574 0.000 3.093) 3.146 9.027 ( 0.316 0.000 5.289) 5.298 9.048 ( 0.863 0.000 -2.023) 2.200 9.252 ( 1.902 0.000 -5.979) 6.274 9.310 ( 3.516 0.000 -0.974) 3.649 9.707 ( 1.538 0.000 1.906) 2.449 9.765 ( 6.618 0.000 -0.907) 6.679 9.841 ( 0.035 0.000 1.896) 1.897 10.033 ( 4.772 0.000 -2.482) 5.379 10.472 ( -2.371 0.000 -0.948) 2.554 10.578 ( -2.009 0.000 8.975) 9.197 10.625 ( 0.278 0.000 -1.840) 1.861 11.344 ( 0.965 0.000 -3.978) 4.093 20.487 ( -0.779 0.000 0.680) 1.034 20.513 ( 0.745 0.000 -0.489) 0.891 20.814 ( -0.851 0.000 0.754) 1.137 20.874 ( -0.105 0.000 -0.492) 0.503 22.704 ( -0.124 0.000 1.560) 1.565 22.928 ( -0.345 0.000 -1.212) 1.260 23.043 ( 0.880 0.000 0.773) 1.171 23.241 ( 0.270 0.000 -1.512) 1.536 24.593 ( -1.464 0.000 1.404) 2.028 24.813 ( -0.136 0.000 -2.099) 2.103 24.824 ( -0.416 0.000 1.137) 1.211 24.969 ( 0.278 0.000 -0.838) 0.883 25.551 ( -1.483 0.000 0.706) 1.643 25.679 ( -2.418 0.000 -0.491) 2.467 26.023 ( -0.335 0.000 -0.228) 0.405 26.040 ( -1.691 0.000 0.235) 1.707 28.310 ( -0.299 0.000 0.662) 0.726 28.376 ( 0.227 0.000 0.281) 0.361 28.475 ( -1.355 0.000 2.267) 2.642 28.571 ( -1.365 0.000 -1.692) 2.175 28.609 ( -0.144 0.000 -0.623) 0.640 28.682 ( 0.950 0.000 2.148) 2.348 28.810 ( 0.397 0.000 -2.133) 2.170 28.962 ( 1.262 0.000 -2.216) 2.550 32.380 ( 0.916 0.000 0.306) 0.966 32.449 ( -2.516 0.000 1.411) 2.885 32.480 ( 0.182 0.000 -1.505) 1.516 32.499 ( 1.968 0.000 -1.007) 2.210 35.421 ( -0.877 0.000 1.216) 1.500 35.436 ( 0.667 0.000 -0.347) 0.751 35.459 ( -1.055 0.000 0.544) 1.187 35.521 ( 0.756 0.000 -0.975) 1.233 88.851 ( -0.656 0.000 2.166) 2.263 88.905 ( 1.178 0.000 5.763) 5.882 89.089 ( 2.684 0.000 -2.537) 3.693 89.546 ( -3.851 0.000 -0.363) 3.868 97.684 ( 0.476 0.000 -0.929) 1.044 97.707 ( 0.484 0.000 -0.438) 0.653 97.738 ( 1.584 0.000 2.575) 3.023 97.937 ( -0.862 0.000 0.927) 1.266 98.698 ( 0.051 0.000 -0.136) 0.145 98.708 ( -0.053 0.000 -0.106) 0.118 98.749 ( 0.638 0.000 -0.617) 0.887 98.757 ( -1.262 0.000 0.405) 1.325 99.617 ( -0.518 0.000 -0.007) 0.518 99.620 ( 0.045 0.000 -1.509) 1.509 99.729 ( 1.639 0.000 5.261) 5.510 100.446 ( 2.052 0.000 -5.178) 5.570 ======================= 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| 1.399 ( -12.832 0.000 -0.535) 12.843 1.438 ( -11.056 0.000 -12.524) 16.706 1.633 ( 9.669 0.000 -11.740) 15.209 1.757 ( 9.753 0.000 -3.765) 10.454 1.911 ( 1.342 0.000 0.236) 1.362 2.041 ( -5.412 0.000 8.753) 10.291 2.149 ( 5.872 0.000 -7.709) 9.691 2.224 ( -10.105 0.000 -4.783) 11.179 2.254 ( -3.364 0.000 -4.022) 5.243 2.361 ( 9.195 0.000 1.409) 9.302 2.373 ( -0.743 0.000 4.119) 4.186 2.436 ( 1.012 0.000 -2.368) 2.575 2.506 ( -4.336 0.000 -7.941) 9.047 2.568 ( -8.819 0.000 3.436) 9.465 2.685 ( -0.691 0.000 -5.150) 5.197 2.783 ( 3.541 0.000 -0.759) 3.622 2.912 ( -1.130 0.000 -0.085) 1.134 3.005 ( -4.920 0.000 2.423) 5.484 3.157 ( -0.191 0.000 0.835) 0.857 3.201 ( -0.800 0.000 6.774) 6.821 3.226 ( 7.260 0.000 0.806) 7.305 3.266 ( 2.342 0.000 3.223) 3.984 3.408 ( -0.343 0.000 7.863) 7.871 3.701 ( 3.774 0.000 -0.166) 3.777 4.382 ( -3.510 0.000 3.288) 4.810 4.548 ( -1.865 0.000 1.221) 2.229 4.646 ( 2.951 0.000 1.478) 3.301 4.688 ( 0.988 0.000 0.117) 0.994 4.770 ( -1.013 0.000 6.567) 6.644 4.943 ( -5.217 0.000 -1.059) 5.324 5.038 ( 2.078 0.000 -1.653) 2.656 5.071 ( 7.921 0.000 0.270) 7.925 5.103 ( -3.501 0.000 2.571) 4.343 5.415 ( 5.177 0.000 3.500) 6.249 5.440 ( -1.934 0.000 -0.837) 2.107 5.465 ( 5.443 0.000 -0.850) 5.509 5.590 ( 1.590 0.000 0.650) 1.718 5.591 ( -1.797 0.000 1.580) 2.392 5.626 ( -0.826 0.000 2.571) 2.701 5.640 ( 0.013 0.000 -5.836) 5.836 5.879 ( -1.263 0.000 -2.468) 2.772 5.896 ( 6.300 0.000 4.353) 7.657 6.226 ( -2.761 0.000 -5.425) 6.087 6.227 ( -2.630 0.000 -0.003) 2.630 6.342 ( -1.120 0.000 5.430) 5.545 6.343 ( 3.728 0.000 2.829) 4.680 6.551 ( 0.734 0.000 4.831) 4.887 6.725 ( -1.419 0.000 8.039) 8.163 6.794 ( 6.902 0.000 2.654) 7.394 7.069 ( 9.757 0.000 -0.456) 9.767 7.234 ( -1.793 0.000 0.247) 1.810 7.237 ( -1.192 0.000 -1.409) 1.845 7.414 ( 1.483 0.000 -5.840) 6.025 7.590 ( 0.482 0.000 -11.935) 11.944 7.597 ( -7.013 0.000 8.015) 10.650 8.048 ( 0.695 0.000 -5.871) 5.912 8.079 ( 2.076 0.000 -3.429) 4.008 8.506 ( 1.834 0.000 -7.292) 7.520 8.624 ( 3.290 0.000 3.674) 4.932 8.691 ( 0.506 0.000 4.504) 4.532 9.014 ( -2.003 0.000 -2.812) 3.453 9.093 ( -0.431 0.000 6.758) 6.771 9.185 ( -0.785 0.000 -8.003) 8.042 9.358 ( 3.315 0.000 -1.269) 3.549 9.711 ( -3.722 0.000 2.525) 4.497 9.789 ( -6.628 0.000 -1.068) 6.713 9.824 ( 1.210 0.000 -0.229) 1.232 10.077 ( 2.225 0.000 -1.139) 2.500 10.404 ( -4.952 0.000 1.236) 5.104 10.597 ( -0.792 0.000 -2.727) 2.839 10.663 ( -0.166 0.000 9.587) 9.589 11.279 ( -1.541 0.000 -6.741) 6.915 20.480 ( -0.726 0.000 0.329) 0.797 20.529 ( 1.447 0.000 0.054) 1.448 20.815 ( -0.031 0.000 0.801) 0.802 20.873 ( 0.573 0.000 -0.542) 0.789 22.736 ( 1.138 0.000 2.848) 3.067 22.893 ( -1.260 0.000 -2.525) 2.822 23.077 ( 1.147 0.000 2.106) 2.398 23.206 ( -1.530 0.000 -2.898) 3.277 24.598 ( -0.051 0.000 1.723) 1.724 24.785 ( 0.100 0.000 -2.952) 2.954 24.837 ( -0.025 0.000 1.781) 1.781 24.954 ( -0.535 0.000 -1.537) 1.628 25.575 ( 2.655 0.000 1.690) 3.147 25.654 ( 0.816 0.000 -1.487) 1.696 26.023 ( -0.293 0.000 -0.357) 0.462 26.025 ( 0.755 0.000 0.046) 0.756 28.312 ( -0.422 0.000 0.849) 0.948 28.367 ( -1.441 0.000 -0.023) 1.441 28.488 ( -0.502 0.000 3.003) 3.045 28.538 ( 0.024 0.000 -1.906) 1.906 28.608 ( 0.882 0.000 -0.738) 1.150 28.721 ( 0.717 0.000 1.954) 2.081 28.803 ( 1.390 0.000 -1.659) 2.165 28.958 ( 1.444 0.000 -2.757) 3.112 32.381 ( -1.277 0.000 0.203) 1.293 32.426 ( -1.396 0.000 0.667) 1.547 32.458 ( -0.281 0.000 -1.598) 1.622 32.533 ( 2.381 0.000 -0.277) 2.397 35.411 ( -1.521 0.000 0.626) 1.645 35.446 ( -0.993 0.000 0.169) 1.008 35.450 ( 1.061 0.000 0.356) 1.119 35.525 ( 0.855 0.000 -0.814) 1.181 88.855 ( -1.744 0.000 2.361) 2.936 88.994 ( -0.408 0.000 10.238) 10.246 89.079 ( -0.244 0.000 -2.802) 2.813 89.441 ( -4.715 0.000 -5.095) 6.942 97.678 ( -0.425 0.000 -0.256) 0.496 97.701 ( -0.532 0.000 -0.626) 0.822 97.797 ( 1.110 0.000 4.157) 4.303 97.898 ( -3.336 0.000 -1.062) 3.501 98.701 ( 0.335 0.000 -0.019) 0.335 98.703 ( -0.393 0.000 -0.215) 0.448 98.741 ( -0.638 0.000 -0.401) 0.754 98.766 ( 1.639 0.000 0.188) 1.649 99.605 ( -0.514 0.000 -0.435) 0.673 99.620 ( 1.202 0.000 -0.546) 1.321 99.832 ( 1.593 0.000 8.367) 8.518 100.409 ( 1.614 0.000 -7.570) 7.740 ======================= 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| 1.073 ( -15.536 0.000 -13.205) 20.389 1.125 ( -18.473 0.000 -0.751) 18.488 1.667 ( 7.581 0.000 -8.721) 11.556 1.823 ( -8.322 0.000 2.386) 8.657 1.948 ( 0.725 0.000 -2.052) 2.177 1.955 ( -10.333 0.000 2.520) 10.636 2.035 ( -4.018 0.000 -2.721) 4.852 2.137 ( 1.078 0.000 -0.958) 1.442 2.207 ( -0.085 0.000 1.627) 1.629 2.316 ( -4.938 0.000 -5.462) 7.363 2.344 ( -0.774 0.000 -2.168) 2.302 2.472 ( -0.458 0.000 1.326) 1.403 2.525 ( 7.717 0.000 -1.713) 7.905 2.539 ( 2.804 0.000 3.744) 4.678 2.664 ( 2.877 0.000 -2.919) 4.099 2.824 ( 3.113 0.000 -2.442) 3.956 2.851 ( -2.069 0.000 -3.807) 4.333 3.045 ( 2.754 0.000 5.423) 6.082 3.156 ( -0.551 0.000 0.697) 0.888 3.247 ( -0.867 0.000 4.614) 4.695 3.326 ( 3.637 0.000 -0.024) 3.637 3.361 ( 4.901 0.000 2.434) 5.473 3.467 ( -0.846 0.000 4.660) 4.736 3.735 ( -0.709 0.000 1.689) 1.831 4.373 ( -0.595 0.000 1.856) 1.949 4.514 ( -4.889 0.000 1.922) 5.253 4.707 ( 2.185 0.000 -1.220) 2.503 4.708 ( 3.506 0.000 1.220) 3.712 4.865 ( -1.671 0.000 -0.827) 1.865 4.869 ( 2.146 0.000 8.210) 8.486 5.049 ( -4.180 0.000 3.224) 5.279 5.056 ( 0.640 0.000 -0.277) 0.698 5.252 ( 11.942 0.000 -0.528) 11.954 5.438 ( 0.938 0.000 0.486) 1.057 5.501 ( 1.841 0.000 -3.813) 4.234 5.516 ( 3.753 0.000 0.856) 3.849 5.536 ( -5.924 0.000 -2.135) 6.297 5.642 ( 7.610 0.000 -1.598) 7.775 5.694 ( 5.941 0.000 7.383) 9.477 5.730 ( 9.265 0.000 -1.019) 9.321 5.801 ( -1.710 0.000 -5.476) 5.737 5.997 ( -0.099 0.000 4.139) 4.140 6.137 ( -3.574 0.000 -1.191) 3.767 6.152 ( -4.183 0.000 -3.405) 5.394 6.359 ( -2.177 0.000 2.883) 3.612 6.417 ( 0.617 0.000 4.156) 4.201 6.638 ( 2.998 0.000 2.948) 4.204 6.834 ( 4.969 0.000 6.550) 8.221 6.929 ( 5.065 0.000 2.805) 5.790 7.160 ( 3.491 0.000 -5.569) 6.573 7.225 ( -0.974 0.000 4.399) 4.505 7.255 ( 2.822 0.000 -5.838) 6.484 7.427 ( 13.272 0.000 -3.082) 13.625 7.479 ( 1.734 0.000 -12.675) 12.794 7.679 ( 0.900 0.000 16.890) 16.914 8.024 ( 2.196 0.000 -3.451) 4.091 8.108 ( 4.479 0.000 -1.495) 4.722 8.485 ( 7.289 0.000 -10.247) 12.575 8.709 ( 0.670 0.000 5.148) 5.191 8.737 ( -0.644 0.000 3.763) 3.818 8.926 ( -4.316 0.000 -3.415) 5.504 9.069 ( -2.004 0.000 -8.551) 8.783 9.148 ( -1.289 0.000 6.049) 6.185 9.384 ( 3.166 0.000 -4.139) 5.211 9.597 ( -12.689 0.000 -1.094) 12.736 9.664 ( -6.408 0.000 2.103) 6.745 9.805 ( -1.510 0.000 -2.603) 3.009 10.065 ( -2.844 0.000 -0.130) 2.847 10.352 ( -4.880 0.000 4.701) 6.776 10.538 ( -2.618 0.000 -3.154) 4.099 10.773 ( 0.330 0.000 11.062) 11.067 11.161 ( -3.209 0.000 -7.406) 8.071 20.471 ( -0.591 0.000 0.067) 0.595 20.558 ( 1.848 0.000 0.038) 1.849 20.828 ( 0.537 0.000 0.769) 0.938 20.881 ( 1.060 0.000 -0.556) 1.197 22.795 ( 1.679 0.000 3.274) 3.680 22.840 ( -1.476 0.000 -2.753) 3.124 23.119 ( 0.737 0.000 2.503) 2.609 23.140 ( -2.052 0.000 -3.249) 3.843 24.623 ( 0.677 0.000 1.686) 1.817 24.757 ( 0.256 0.000 -2.840) 2.852 24.857 ( -0.153 0.000 2.064) 2.069 24.924 ( -0.662 0.000 -1.785) 1.904 25.664 ( 5.180 0.000 2.183) 5.621 25.675 ( 3.878 0.000 -1.889) 4.313 26.021 ( 0.421 0.000 -0.465) 0.627 26.048 ( 1.429 0.000 0.802) 1.639 28.315 ( -0.493 0.000 1.109) 1.214 28.335 ( -2.266 0.000 0.042) 2.266 28.518 ( -0.238 0.000 3.573) 3.581 28.533 ( 1.496 0.000 -1.501) 2.119 28.621 ( 1.529 0.000 -0.754) 1.705 28.742 ( 0.346 0.000 0.547) 0.647 28.818 ( 1.617 0.000 -0.706) 1.765 28.949 ( 1.823 0.000 -4.351) 4.717 32.351 ( -2.575 0.000 0.814) 2.701 32.410 ( -0.925 0.000 -0.535) 1.068 32.438 ( -0.310 0.000 -1.236) 1.274 32.567 ( 2.025 0.000 -0.352) 2.055 35.388 ( -1.625 0.000 0.205) 1.638 35.431 ( -1.004 0.000 0.314) 1.052 35.476 ( 1.172 0.000 0.953) 1.510 35.531 ( 0.787 0.000 -0.814) 1.133 88.843 ( -2.699 0.000 2.465) 3.655 89.030 ( -2.132 0.000 -2.172) 3.043 89.123 ( -1.207 0.000 17.621) 17.662 89.299 ( -4.082 0.000 -7.344) 8.402 97.666 ( -0.950 0.000 0.167) 0.965 97.679 ( -1.275 0.000 -0.593) 1.406 97.819 ( -3.923 0.000 -1.751) 4.296 97.864 ( 0.508 0.000 6.282) 6.302 98.692 ( -0.732 0.000 -0.041) 0.733 98.708 ( 0.585 0.000 -0.084) 0.591 98.727 ( 0.050 0.000 -1.403) 1.404 98.801 ( 1.944 0.000 0.560) 2.023 99.593 ( -0.323 0.000 -0.483) 0.581 99.644 ( 2.094 0.000 -0.330) 2.120 99.943 ( 0.366 0.000 8.859) 8.867 100.334 ( 1.564 0.000 -12.040) 12.141 ======================= 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| 0.670 ( -19.159 0.000 -6.764) 20.318 0.785 ( -22.307 0.000 1.219) 22.340 1.418 ( -38.234 0.000 11.305) 39.870 1.718 ( 6.129 0.000 -2.700) 6.698 1.872 ( -2.639 0.000 -1.695) 3.137 1.961 ( 4.048 0.000 -3.947) 5.654 2.006 ( 0.259 0.000 -6.391) 6.396 2.163 ( 2.402 0.000 -4.732) 5.307 2.225 ( -2.593 0.000 9.512) 9.859 2.270 ( 1.507 0.000 4.881) 5.108 2.322 ( 1.922 0.000 -4.471) 4.867 2.523 ( 3.694 0.000 1.033) 3.836 2.592 ( 3.209 0.000 -2.605) 4.133 2.596 ( -0.815 0.000 3.641) 3.731 2.723 ( 4.712 0.000 0.352) 4.725 2.810 ( 1.553 0.000 -1.869) 2.430 2.834 ( 2.168 0.000 -3.687) 4.277 3.158 ( 3.988 0.000 4.157) 5.760 3.164 ( 0.434 0.000 1.251) 1.324 3.272 ( -0.166 0.000 1.822) 1.830 3.354 ( 1.279 0.000 -2.374) 2.697 3.441 ( 3.169 0.000 -0.481) 3.205 3.470 ( -2.376 0.000 0.682) 2.471 3.715 ( -3.348 0.000 0.976) 3.487 4.407 ( 2.664 0.000 0.880) 2.806 4.433 ( -6.401 0.000 1.748) 6.635 4.732 ( 2.239 0.000 -1.348) 2.613 4.803 ( 5.389 0.000 1.881) 5.708 4.871 ( 2.498 0.000 0.017) 2.498 4.907 ( -4.112 0.000 1.868) 4.516 5.071 ( 1.186 0.000 2.598) 2.856 5.152 ( 5.859 0.000 11.563) 12.962 5.357 ( -7.693 0.000 -3.166) 8.319 5.393 ( 6.492 0.000 -1.833) 6.746 5.472 ( 0.599 0.000 -2.667) 2.734 5.496 ( 4.063 0.000 -5.897) 7.161 5.602 ( 4.548 0.000 2.542) 5.211 5.731 ( 0.743 0.000 -2.812) 2.908 5.770 ( 5.511 0.000 3.760) 6.672 5.869 ( 7.334 0.000 -1.347) 7.457 5.889 ( 7.519 0.000 1.063) 7.594 5.997 ( -3.811 0.000 0.730) 3.881 6.049 ( -0.453 0.000 -1.193) 1.276 6.075 ( -3.378 0.000 0.521) 3.417 6.337 ( -2.700 0.000 1.043) 2.894 6.452 ( -0.710 0.000 2.894) 2.980 6.646 ( -2.046 0.000 -3.474) 4.032 6.953 ( 4.314 0.000 -2.906) 5.202 7.063 ( 8.043 0.000 5.465) 9.724 7.171 ( 2.337 0.000 -1.683) 2.880 7.186 ( 0.730 0.000 -8.121) 8.154 7.292 ( 0.107 0.000 5.428) 5.429 7.386 ( 0.585 0.000 -6.082) 6.110 7.694 ( 18.685 0.000 -1.288) 18.730 7.975 ( 8.101 0.000 20.546) 22.086 8.040 ( 2.220 0.000 -0.973) 2.423 8.194 ( 7.194 0.000 -0.208) 7.197 8.535 ( 9.364 0.000 -6.023) 11.133 8.739 ( -1.281 0.000 -0.554) 1.396 8.751 ( -0.784 0.000 2.957) 3.059 8.814 ( -4.743 0.000 -2.401) 5.317 8.958 ( -1.849 0.000 -5.856) 6.141 9.173 ( -2.274 0.000 3.850) 4.471 9.348 ( -13.462 0.000 -2.354) 13.666 9.372 ( 3.392 0.000 -8.366) 9.028 9.579 ( -8.276 0.000 4.825) 9.580 9.722 ( -2.467 0.000 -6.499) 6.951 9.995 ( -5.288 0.000 0.442) 5.306 10.334 ( -5.371 0.000 7.377) 9.125 10.441 ( -4.795 0.000 -3.349) 5.849 10.913 ( 0.949 0.000 13.357) 13.390 11.031 ( -3.353 0.000 -6.032) 6.902 20.463 ( -0.372 0.000 0.102) 0.385 20.586 ( 1.655 0.000 -0.675) 1.787 20.846 ( 0.634 0.000 0.763) 0.992 20.894 ( 1.173 0.000 -0.496) 1.274 22.794 ( -0.955 0.000 -1.854) 2.085 22.851 ( 1.146 0.000 2.551) 2.797 23.080 ( -1.208 0.000 -2.527) 2.801 23.148 ( -0.066 0.000 1.809) 1.811 24.653 ( 0.386 0.000 2.776) 2.802 24.736 ( 0.436 0.000 -1.962) 2.010 24.872 ( -0.594 0.000 1.859) 1.952 24.899 ( -0.199 0.000 -1.392) 1.406 25.738 ( 5.549 0.000 -1.493) 5.747 25.776 ( 5.140 0.000 1.968) 5.503 26.024 ( 0.239 0.000 -0.047) 0.243 26.098 ( 2.283 0.000 3.973) 4.582 28.301 ( -1.952 0.000 0.496) 2.014 28.323 ( -0.235 0.000 1.897) 1.911 28.551 ( -0.694 0.000 3.908) 3.969 28.553 ( 2.438 0.000 -1.100) 2.675 28.639 ( 1.552 0.000 -0.670) 1.690 28.747 ( -0.504 0.000 0.751) 0.904 28.834 ( 1.504 0.000 -1.333) 2.009 28.915 ( 1.276 0.000 -8.094) 8.194 32.322 ( -2.301 0.000 1.564) 2.782 32.381 ( -1.471 0.000 -0.801) 1.675 32.421 ( -0.198 0.000 -1.124) 1.141 32.592 ( 1.501 0.000 -0.571) 1.605 35.366 ( -1.253 0.000 0.328) 1.295 35.420 ( -0.919 0.000 0.701) 1.156 35.510 ( 1.231 0.000 1.819) 2.196 35.533 ( 0.613 0.000 -0.979) 1.156 88.820 ( -3.036 0.000 2.278) 3.795 88.974 ( -2.239 0.000 -1.361) 2.620 89.165 ( -2.386 0.000 -6.983) 7.379 89.367 ( 2.674 0.000 28.735) 28.859 97.649 ( -1.476 0.000 -0.506) 1.560 97.651 ( -1.079 0.000 0.325) 1.127 97.743 ( -2.959 0.000 -1.418) 3.281 97.956 ( 1.301 0.000 8.667) 8.764 98.680 ( -0.699 0.000 0.191) 0.725 98.708 ( -0.097 0.000 -2.562) 2.564 98.718 ( 0.643 0.000 -0.118) 0.654 98.836 ( 1.587 0.000 0.292) 1.613 99.586 ( -0.054 0.000 -0.144) 0.154 99.677 ( 2.308 0.000 -0.673) 2.404 100.022 ( -1.387 0.000 7.312) 7.443 100.176 ( -0.594 0.000 -22.042) 22.050 ======================= 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| 0.406 ( -13.456 0.000 16.940) 21.634 0.454 ( -21.215 0.000 8.673) 22.919 0.940 ( -38.589 0.000 24.618) 45.773 1.776 ( 1.406 0.000 -5.533) 5.709 1.840 ( 1.458 0.000 1.715) 2.251 1.926 ( 1.112 0.000 -11.285) 11.339 1.984 ( 2.373 0.000 3.092) 3.897 2.139 ( 0.305 0.000 -1.560) 1.590 2.295 ( 0.994 0.000 -5.622) 5.709 2.311 ( -0.422 0.000 9.103) 9.112 2.409 ( 5.613 0.000 6.829) 8.840 2.592 ( -4.558 0.000 4.483) 6.393 2.593 ( 1.672 0.000 4.164) 4.487 2.602 ( 1.599 0.000 -2.351) 2.843 2.774 ( 0.676 0.000 0.981) 1.191 2.826 ( 2.203 0.000 -4.100) 4.655 2.866 ( 5.133 0.000 -0.728) 5.184 3.190 ( 0.618 0.000 1.314) 1.453 3.239 ( 1.591 0.000 0.460) 1.656 3.289 ( 1.237 0.000 0.273) 1.267 3.318 ( 0.443 0.000 -6.832) 6.846 3.402 ( -3.613 0.000 -3.884) 5.305 3.458 ( 1.046 0.000 -2.517) 2.726 3.645 ( -4.016 0.000 -2.580) 4.773 4.361 ( -4.140 0.000 1.683) 4.469 4.454 ( 2.266 0.000 -1.721) 2.845 4.734 ( -1.379 0.000 -1.384) 1.953 4.843 ( -5.175 0.000 1.403) 5.361 4.868 ( 0.510 0.000 1.319) 1.414 4.957 ( 5.415 0.000 1.196) 5.546 5.117 ( 1.748 0.000 1.467) 2.282 5.213 ( -1.917 0.000 -2.185) 2.906 5.332 ( -2.023 0.000 -1.240) 2.372 5.452 ( 4.155 0.000 -4.324) 5.997 5.474 ( 2.985 0.000 2.870) 4.141 5.507 ( 4.578 0.000 -5.325) 7.023 5.699 ( 3.500 0.000 2.761) 4.459 5.807 ( -5.214 0.000 -3.486) 6.272 5.823 ( 5.965 0.000 4.972) 7.765 5.892 ( 1.378 0.000 2.123) 2.531 5.960 ( -3.337 0.000 2.022) 3.902 5.987 ( 4.582 0.000 5.425) 7.101 6.074 ( 6.304 0.000 8.586) 10.652 6.158 ( 9.053 0.000 -2.264) 9.332 6.297 ( -2.644 0.000 -0.165) 2.649 6.468 ( 0.667 0.000 0.436) 0.797 6.539 ( -3.466 0.000 -4.715) 5.851 6.960 ( 3.827 0.000 -7.368) 8.303 7.144 ( 2.718 0.000 -4.449) 5.214 7.157 ( -0.651 0.000 -6.582) 6.614 7.187 ( 1.372 0.000 -0.796) 1.586 7.323 ( 2.466 0.000 -3.990) 4.690 7.418 ( 0.931 0.000 11.509) 11.547 7.969 ( 10.281 0.000 3.938) 11.010 8.067 ( 1.709 0.000 -0.152) 1.716 8.262 ( 7.422 0.000 9.950) 12.413 8.330 ( 1.802 0.000 3.514) 3.949 8.668 ( 3.055 0.000 6.627) 7.297 8.708 ( 1.527 0.000 -3.188) 3.535 8.740 ( 1.952 0.000 -2.063) 2.840 8.769 ( -1.548 0.000 3.672) 3.985 8.885 ( -0.759 0.000 -2.341) 2.461 9.113 ( -6.059 0.000 -1.031) 6.146 9.200 ( -2.702 0.000 1.194) 2.954 9.338 ( 6.523 0.000 -8.361) 10.604 9.492 ( -9.495 0.000 6.498) 11.505 9.612 ( 0.144 0.000 -8.020) 8.022 9.918 ( -2.595 0.000 -1.082) 2.812 10.322 ( -6.340 0.000 7.735) 10.001 10.328 ( -3.499 0.000 -2.926) 4.561 10.943 ( -0.752 0.000 -3.369) 3.452 11.032 ( -3.168 0.000 1.414) 3.470 20.462 ( -0.112 0.000 0.500) 0.512 20.599 ( 1.366 0.000 -0.826) 1.596 20.863 ( 0.273 0.000 0.883) 0.924 20.907 ( 0.889 0.000 -0.355) 0.957 22.772 ( -0.009 0.000 -0.777) 0.777 22.878 ( -0.250 0.000 0.893) 0.927 23.051 ( 0.045 0.000 -1.264) 1.265 23.153 ( -0.806 0.000 0.449) 0.923 24.733 ( 0.831 0.000 -0.629) 1.042 24.736 ( 4.481 0.000 8.196) 9.341 24.874 ( -1.040 0.000 1.112) 1.522 24.891 ( 0.408 0.000 -0.576) 0.706 25.817 ( 4.872 0.000 -0.654) 4.916 25.855 ( 2.427 0.000 0.549) 2.488 26.028 ( -0.264 0.000 1.009) 1.043 26.256 ( 9.000 0.000 7.883) 11.964 28.285 ( -1.124 0.000 1.416) 1.808 28.387 ( 6.025 0.000 6.247) 8.679 28.579 ( -1.066 0.000 4.675) 4.795 28.585 ( 2.558 0.000 -1.072) 2.774 28.656 ( 1.103 0.000 -0.462) 1.196 28.739 ( -1.966 0.000 1.409) 2.418 28.765 ( -7.923 0.000 -12.579) 14.866 28.842 ( 1.863 0.000 -2.210) 2.890 32.304 ( -1.913 0.000 1.126) 2.219 32.385 ( 1.956 0.000 5.110) 5.471 32.409 ( 0.188 0.000 -1.142) 1.158 32.604 ( 0.886 0.000 -0.866) 1.239 35.356 ( -0.705 0.000 0.835) 1.093 35.417 ( -0.647 0.000 1.269) 1.424 35.529 ( 0.479 0.000 -1.290) 1.376 35.567 ( 2.913 0.000 2.114) 3.599 88.794 ( -2.570 0.000 1.719) 3.092 88.927 ( -1.354 0.000 -1.809) 2.259 89.093 ( 1.285 0.000 -3.855) 4.064 89.754 ( 4.960 0.000 3.928) 6.327 97.623 ( -0.901 0.000 -0.521) 1.041 97.639 ( -0.817 0.000 0.251) 0.855 97.698 ( -1.119 0.000 -0.623) 1.280 98.012 ( -5.988 0.000 -10.350) 11.957 98.678 ( -0.295 0.000 1.081) 1.120 98.687 ( 1.957 0.000 3.237) 3.782 98.726 ( 0.512 0.000 -0.049) 0.514 98.855 ( 0.672 0.000 -0.460) 0.814 99.589 ( 0.164 0.000 0.564) 0.587 99.702 ( 1.856 0.000 -1.167) 2.193 99.807 ( -10.185 0.000 -16.581) 19.460 100.045 ( -3.573 0.000 4.502) 5.747 ======================= 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| 0.672 ( -9.114 17.354 13.282) 23.678 0.727 ( 2.434 18.231 14.277) 23.283 1.121 ( -2.249 17.960 28.158) 33.474 1.693 ( 2.271 0.114 -7.306) 7.652 1.814 ( 0.308 2.461 -14.046) 14.263 1.957 ( 1.180 0.396 5.786) 5.919 2.053 ( 2.220 -0.564 2.251) 3.211 2.180 ( 1.316 -3.721 3.894) 5.545 2.239 ( 0.258 -1.037 -1.359) 1.729 2.324 ( -2.542 -1.430 5.508) 6.233 2.431 ( 2.754 -4.392 4.885) 7.123 2.562 ( -3.967 -1.545 2.806) 5.099 2.607 ( -1.085 -1.855 3.906) 4.458 2.690 ( -2.339 1.099 1.769) 3.132 2.783 ( 3.025 4.797 2.553) 6.219 2.893 ( 1.969 -2.379 2.365) 3.889 2.987 ( 2.588 6.303 -3.724) 7.765 3.159 ( -3.024 -2.230 -2.398) 4.457 3.195 ( -0.426 -2.150 -5.661) 6.071 3.230 ( 2.970 -0.174 -2.344) 3.788 3.267 ( 0.679 -2.142 -3.524) 4.180 3.337 ( -2.854 3.272 -5.943) 7.360 3.470 ( -0.226 3.031 -4.418) 5.363 3.534 ( -2.400 -0.451 -4.662) 5.263 4.409 ( 2.010 -3.526 -1.370) 4.284 4.509 ( 2.295 7.520 -11.745) 14.134 4.606 ( -5.280 -5.267 4.383) 8.650 4.793 ( 1.365 -2.756 -0.082) 3.077 4.886 ( -1.122 1.310 2.878) 3.355 5.010 ( -1.270 1.766 -0.977) 2.384 5.144 ( 0.465 -3.142 -0.152) 3.180 5.222 ( -4.293 2.469 5.673) 7.531 5.295 ( 0.135 0.142 5.183) 5.186 5.383 ( -1.270 -1.907 -7.832) 8.160 5.491 ( 0.697 -2.736 2.069) 3.500 5.544 ( 2.188 -1.010 -0.645) 2.495 5.615 ( 4.070 -8.256 2.427) 9.519 5.680 ( -0.224 -0.998 -2.522) 2.722 5.745 ( -1.541 -5.273 1.532) 5.703 5.915 ( -1.228 -0.241 -0.005) 1.252 6.051 ( 1.337 5.608 -0.508) 5.787 6.104 ( -0.605 6.998 -1.507) 7.184 6.201 ( 1.966 -2.059 -2.294) 3.656 6.255 ( -2.714 -0.544 -2.149) 3.504 6.361 ( -3.983 2.737 0.781) 4.896 6.452 ( -0.247 2.939 0.075) 2.950 6.556 ( 6.069 -0.054 2.307) 6.493 6.943 ( 0.749 0.654 -8.203) 8.263 7.055 ( 0.217 -1.676 2.487) 3.006 7.124 ( -0.952 2.602 -0.642) 2.844 7.165 ( 3.067 1.524 -1.518) 3.746 7.321 ( -3.790 3.102 -3.195) 5.847 7.670 ( 5.359 1.386 12.607) 13.769 7.957 ( -2.095 -1.226 8.404) 8.747 8.067 ( -0.989 -3.286 2.774) 4.413 8.227 ( -12.087 1.401 2.302) 12.384 8.494 ( 7.919 -2.221 3.310) 8.865 8.635 ( -2.189 -2.123 -2.232) 3.779 8.671 ( 3.736 -3.450 1.202) 5.226 8.725 ( -7.101 0.645 1.064) 7.209 8.779 ( 1.018 -1.507 3.705) 4.127 8.956 ( 3.758 1.519 0.938) 4.161 9.093 ( -1.663 2.394 0.328) 2.934 9.202 ( -0.684 2.108 0.164) 2.222 9.387 ( -0.721 -1.487 3.482) 3.855 9.472 ( 1.331 -5.836 -8.793) 10.637 9.621 ( 1.517 3.281 -7.466) 8.295 9.925 ( -0.538 -3.303 -1.736) 3.770 10.223 ( 1.430 2.629 -0.283) 3.006 10.319 ( 3.950 0.821 -1.137) 4.192 10.664 ( -9.556 -3.210 5.169) 11.329 10.898 ( 3.207 -4.081 -1.141) 5.314 20.592 ( -0.177 2.822 -2.706) 3.914 20.656 ( 0.884 4.423 -6.548) 7.951 20.888 ( -0.382 1.525 0.619) 1.690 20.930 ( 0.077 1.222 -0.179) 1.237 22.792 ( 1.713 0.714 0.658) 1.969 22.860 ( -1.411 -0.191 -0.696) 1.585 23.069 ( 1.253 0.928 0.355) 1.599 23.133 ( -1.155 -0.033 -0.914) 1.474 24.724 ( 0.690 -1.976 0.530) 2.159 24.732 ( -0.797 -4.706 2.399) 5.342 24.888 ( -0.499 1.360 0.991) 1.755 24.924 ( 0.389 0.393 1.265) 1.380 25.870 ( 1.225 0.289 -0.087) 1.262 25.875 ( -0.479 0.355 -0.119) 0.608 26.080 ( 0.122 1.947 0.407) 1.993 26.286 ( -4.972 -0.264 -3.996) 6.384 28.293 ( -0.452 -0.010 2.167) 2.214 28.417 ( -5.196 -3.298 2.436) 6.619 28.546 ( -0.139 0.139 0.600) 0.632 28.608 ( 1.373 -1.139 1.408) 2.273 28.645 ( 2.382 -0.664 0.207) 2.481 28.685 ( 2.292 -1.733 1.875) 3.431 28.717 ( 1.292 -1.078 1.237) 2.089 28.834 ( 1.649 -1.437 -2.111) 3.039 32.300 ( -0.714 0.614 1.203) 1.528 32.398 ( 0.945 -1.369 0.864) 1.874 32.446 ( 0.431 -0.474 2.149) 2.242 32.602 ( 0.246 -0.849 -1.671) 1.890 35.366 ( -0.210 0.540 1.315) 1.437 35.465 ( 0.493 1.113 -0.695) 1.402 35.514 ( -0.288 0.238 -1.380) 1.430 35.576 ( -1.383 0.179 -0.823) 1.619 88.754 ( -3.268 -1.122 1.338) 3.705 88.876 ( -9.100 -4.544 3.763) 10.845 88.929 ( -8.845 -1.793 3.174) 9.566 89.121 ( 3.069 -2.002 -0.407) 3.687 97.616 ( 0.036 0.149 -0.571) 0.591 97.625 ( 0.391 0.246 -0.613) 0.768 97.662 ( -3.274 -0.256 0.744) 3.367 97.687 ( 0.599 -0.485 0.026) 0.771 98.676 ( -0.206 0.016 0.634) 0.667 98.692 ( 0.371 -0.348 0.958) 1.085 98.897 ( -0.575 4.293 -1.223) 4.501 99.081 ( -3.059 11.416 -13.290) 17.785 99.612 ( -0.187 1.456 0.955) 1.751 99.724 ( 0.328 1.122 -1.420) 1.840 99.943 ( 9.916 -5.188 4.217) 11.959 99.990 ( 3.661 -2.864 1.020) 4.759 ======================= 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| 0.754 ( 3.396 9.876 15.591) 18.766 0.994 ( 10.520 14.415 13.193) 22.193 1.507 ( 10.607 11.422 19.201) 24.732 1.680 ( 6.988 2.219 -8.593) 11.295 1.683 ( 2.561 3.764 -12.469) 13.274 2.033 ( 0.172 1.594 4.163) 4.461 2.086 ( 0.341 -3.593 3.340) 4.918 2.179 ( -3.479 -2.193 1.938) 4.546 2.292 ( -0.268 -2.785 4.320) 5.147 2.376 ( 1.222 -3.123 9.135) 9.731 2.501 ( -2.040 -1.000 5.017) 5.508 2.538 ( -1.426 -1.780 4.413) 4.968 2.600 ( -2.571 0.386 -1.655) 3.081 2.665 ( -2.565 -3.577 4.233) 6.107 2.848 ( 0.375 5.491 2.200) 5.928 2.934 ( 0.966 -3.250 0.528) 3.432 2.972 ( -1.624 5.548 -3.796) 6.916 3.065 ( -1.744 -1.612 -5.520) 6.009 3.125 ( -0.324 -0.015 -2.855) 2.874 3.188 ( -0.629 -1.139 -7.798) 7.905 3.226 ( 0.429 0.881 -6.953) 7.022 3.292 ( 0.109 1.557 0.929) 1.816 3.375 ( -1.370 2.135 -7.757) 8.161 3.494 ( 1.232 1.038 -3.160) 3.547 4.395 ( -0.564 -0.423 -1.495) 1.653 4.460 ( 2.045 1.655 -3.505) 4.383 4.612 ( -1.779 -4.592 5.688) 7.524 4.779 ( -3.270 -3.870 -0.316) 5.077 4.888 ( -1.690 2.806 0.980) 3.419 4.960 ( -2.602 0.870 -0.282) 2.758 5.123 ( -8.453 -0.850 4.819) 9.767 5.185 ( -2.717 -1.532 2.541) 4.024 5.292 ( -0.263 -2.736 -5.172) 5.857 5.361 ( 0.976 0.203 2.833) 3.003 5.453 ( -4.715 -1.216 -3.411) 5.945 5.578 ( 1.620 -1.060 3.894) 4.349 5.674 ( -1.525 1.157 -0.094) 1.916 5.721 ( 4.734 -7.552 -0.015) 8.913 5.759 ( 2.777 -3.677 0.358) 4.622 5.867 ( -2.139 -1.463 -2.279) 3.451 6.024 ( -2.403 3.165 -1.323) 4.188 6.112 ( -0.753 5.299 1.094) 5.463 6.142 ( -1.318 -0.508 -0.208) 1.428 6.176 ( -5.256 2.203 -2.001) 6.040 6.303 ( -3.711 4.876 1.076) 6.221 6.384 ( -2.998 1.265 -3.760) 4.973 6.679 ( 4.134 4.051 -1.071) 5.886 6.790 ( -4.307 2.802 -9.826) 11.089 7.041 ( -5.569 -1.092 -0.155) 5.677 7.115 ( -2.201 0.490 2.332) 3.244 7.186 ( 1.803 2.240 -2.594) 3.873 7.320 ( 5.144 -1.424 0.238) 5.343 7.759 ( -14.506 -0.494 -0.879) 14.541 7.893 ( -0.163 -0.038 9.926) 9.928 8.088 ( -2.647 -0.512 5.941) 6.525 8.119 ( -9.286 -0.094 7.900) 12.192 8.531 ( -6.745 -3.737 2.883) 8.233 8.558 ( -3.962 -2.811 -2.944) 5.681 8.628 ( -1.339 -1.065 -3.198) 3.627 8.772 ( -1.293 1.369 5.849) 6.145 8.863 ( 4.909 2.183 4.118) 6.770 9.042 ( 6.147 2.001 -1.441) 6.623 9.090 ( 3.187 0.203 -1.687) 3.611 9.246 ( 6.420 0.109 0.161) 6.423 9.367 ( -2.997 -2.975 -0.414) 4.243 9.451 ( 5.253 -0.105 -1.015) 5.351 9.613 ( 5.594 1.033 -8.885) 10.550 9.886 ( 0.058 -2.163 -1.994) 2.942 10.278 ( 4.223 2.306 -0.001) 4.811 10.423 ( 7.587 -1.057 0.283) 7.666 10.612 ( -3.089 -1.409 3.056) 4.568 10.980 ( 7.082 -5.055 0.035) 8.701 20.554 ( -1.289 3.984 -1.494) 4.445 20.598 ( -1.354 1.982 -2.587) 3.529 20.881 ( -1.279 1.390 0.706) 2.017 20.924 ( -0.636 0.918 -0.081) 1.120 22.814 ( -2.106 0.489 -1.473) 2.617 22.839 ( 2.056 0.429 1.353) 2.499 23.089 ( -0.841 -0.223 -0.837) 1.207 23.117 ( 1.895 0.459 0.357) 1.982 24.706 ( -3.342 -3.038 0.574) 4.553 24.739 ( -0.260 -3.263 1.045) 3.436 24.898 ( 0.078 1.837 1.148) 2.167 24.941 ( 0.767 1.116 0.603) 1.482 25.827 ( -4.779 0.534 -0.386) 4.825 25.860 ( -2.353 0.303 0.277) 2.389 26.086 ( -0.947 0.732 1.723) 2.098 26.163 ( -4.937 1.878 -0.805) 5.343 28.313 ( -0.295 -0.192 2.502) 2.526 28.356 ( -3.843 -0.404 1.709) 4.225 28.536 ( -1.799 0.194 0.835) 1.993 28.611 ( -0.556 0.836 -0.340) 1.060 28.646 ( -1.004 -1.284 -0.057) 1.631 28.700 ( 0.636 -0.230 -0.241) 0.718 28.826 ( 2.993 -3.778 -1.727) 5.120 28.851 ( 4.843 -3.628 -0.866) 6.113 32.309 ( 0.102 0.637 1.249) 1.405 32.414 ( 1.386 0.075 -0.698) 1.553 32.469 ( -0.855 -1.226 2.549) 2.954 32.581 ( -0.344 -0.709 -1.876) 2.035 35.381 ( 0.065 0.430 1.667) 1.723 35.458 ( -0.904 0.110 0.200) 0.932 35.494 ( -0.427 1.301 -0.836) 1.604 35.546 ( -0.758 0.480 -0.817) 1.214 88.719 ( -1.519 0.216 2.408) 2.856 88.803 ( -3.271 -0.948 3.811) 5.111 88.928 ( 3.516 1.163 -1.375) 3.950 89.230 ( 7.224 -3.179 2.649) 8.325 97.617 ( 1.301 -0.062 -0.734) 1.495 97.642 ( 1.927 0.544 -0.604) 2.091 97.655 ( 0.663 -0.528 0.293) 0.897 97.720 ( 2.861 -0.761 0.557) 3.013 98.679 ( -0.254 -0.012 0.675) 0.722 98.711 ( 0.746 -0.800 0.803) 1.357 98.861 ( -2.006 4.771 -1.009) 5.273 98.941 ( -3.004 7.799 -4.114) 9.315 99.625 ( 0.053 1.646 1.413) 2.170 99.711 ( -0.206 0.584 -1.388) 1.520 99.871 ( -5.701 -1.139 -2.175) 6.207 100.226 ( 11.234 -8.425 -1.391) 14.111 ======================= 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| 1.060 ( 12.916 2.547 12.532) 18.176 1.312 ( 12.404 10.454 9.043) 18.572 1.605 ( 8.603 6.214 -13.197) 16.935 1.683 ( 7.933 3.857 -10.846) 13.980 1.827 ( 2.907 3.712 6.250) 7.829 2.051 ( 0.265 1.771 0.557) 1.875 2.148 ( -3.531 -3.220 5.682) 7.425 2.192 ( 2.862 -1.419 6.687) 7.411 2.329 ( 0.107 -2.253 4.976) 5.463 2.442 ( -3.701 0.871 2.262) 4.424 2.490 ( -2.095 -5.854 1.937) 6.513 2.533 ( -2.553 0.004 3.338) 4.202 2.621 ( -0.015 1.853 5.943) 6.225 2.667 ( -1.567 -1.621 2.698) 3.516 2.837 ( -1.106 5.091 -1.547) 5.434 2.867 ( -1.693 1.849 -4.748) 5.369 2.943 ( 0.598 -2.244 -1.719) 2.890 3.002 ( 0.328 -4.026 -4.341) 5.929 3.080 ( -1.861 -2.322 -1.248) 3.226 3.131 ( -3.210 0.585 -0.141) 3.265 3.199 ( 0.161 5.322 -0.945) 5.408 3.257 ( -0.653 0.181 -3.416) 3.483 3.312 ( 0.884 2.335 -3.172) 4.037 3.493 ( 3.203 1.415 -3.885) 5.230 4.397 ( 1.224 -2.066 0.583) 2.471 4.463 ( 0.011 -0.710 0.211) 0.741 4.644 ( -1.364 -3.129 4.503) 5.650 4.693 ( -5.444 -2.853 -0.876) 6.208 4.850 ( -2.803 0.005 -0.255) 2.814 4.935 ( -1.377 1.095 0.972) 2.010 5.019 ( -6.456 0.523 1.912) 6.753 5.167 ( -2.459 -2.025 0.442) 3.216 5.255 ( 1.318 -3.380 -4.049) 5.436 5.313 ( -5.047 1.922 -0.382) 5.414 5.417 ( -0.098 -3.549 1.356) 3.800 5.596 ( -3.713 -1.780 0.335) 4.131 5.625 ( -3.206 -0.320 0.644) 3.286 5.713 ( -3.514 -0.136 -5.314) 6.372 5.764 ( -1.485 -4.166 -0.877) 4.509 5.856 ( 0.265 -2.180 1.315) 2.560 5.982 ( -9.209 1.928 3.365) 9.992 6.063 ( -4.130 0.198 4.776) 6.317 6.090 ( 2.288 0.135 -1.157) 2.567 6.215 ( 4.209 5.330 1.657) 6.990 6.232 ( -4.500 4.796 0.874) 6.635 6.296 ( -1.797 -2.160 -5.070) 5.796 6.583 ( -4.365 0.864 -7.828) 9.004 6.733 ( -0.352 8.893 -1.485) 9.023 6.891 ( -7.928 -4.602 -0.746) 9.198 7.126 ( -1.384 -2.028 0.604) 2.528 7.208 ( 3.435 2.534 -2.056) 4.738 7.337 ( -2.145 4.510 -4.536) 6.747 7.538 ( -6.362 1.924 2.061) 6.959 7.953 ( -8.095 -1.686 9.214) 12.380 8.036 ( -11.181 0.575 8.997) 14.363 8.108 ( -1.047 -3.350 3.563) 5.001 8.420 ( -10.137 -1.380 0.505) 10.243 8.436 ( -1.685 1.739 -4.477) 5.090 8.596 ( 0.665 -1.751 -2.120) 2.829 8.803 ( 0.130 -0.755 3.268) 3.356 8.927 ( -1.745 4.373 0.960) 4.805 9.119 ( 4.411 5.322 3.705) 7.843 9.151 ( 3.601 -5.640 -2.929) 7.305 9.301 ( 2.940 1.659 -3.385) 4.780 9.474 ( 12.012 2.291 1.009) 12.270 9.532 ( 8.801 -0.391 -6.490) 10.942 9.629 ( 4.701 1.647 -0.833) 5.051 9.903 ( 4.449 -2.684 -2.871) 5.936 10.352 ( 2.206 -0.120 3.750) 4.352 10.533 ( 4.157 -1.590 0.401) 4.469 10.598 ( -1.076 -2.041 0.892) 2.474 11.116 ( 8.276 -6.773 0.302) 10.699 20.525 ( -1.285 2.565 0.134) 2.872 20.556 ( -1.106 1.283 -1.583) 2.318 20.862 ( -1.782 1.290 0.616) 2.284 20.909 ( -0.920 0.659 -0.172) 1.145 22.759 ( -2.143 0.977 -1.453) 2.767 22.888 ( 1.772 -0.303 1.237) 2.182 23.056 ( -0.932 0.139 -1.320) 1.621 23.169 ( 2.628 -0.435 1.115) 2.888 24.650 ( -3.680 -1.838 0.405) 4.133 24.735 ( -1.240 -4.409 0.608) 4.620 24.914 ( 0.538 3.034 0.858) 3.199 24.963 ( 1.193 1.451 0.184) 1.888 25.725 ( -6.300 1.036 -0.516) 6.405 25.807 ( -4.234 0.208 0.488) 4.267 26.073 ( -2.212 0.113 0.633) 2.303 26.105 ( -2.945 0.789 1.210) 3.280 28.322 ( -1.599 -0.113 1.045) 1.914 28.336 ( -0.182 -0.099 1.773) 1.785 28.512 ( -2.106 0.363 0.896) 2.318 28.602 ( -0.602 0.616 0.761) 1.150 28.622 ( -1.327 -1.657 -0.641) 2.217 28.703 ( 0.443 1.111 -1.027) 1.576 28.823 ( 0.268 -2.223 -1.766) 2.852 28.911 ( 3.355 -3.624 -1.741) 5.237 32.329 ( 0.780 0.536 1.081) 1.437 32.434 ( 1.778 0.273 -0.625) 1.904 32.473 ( -1.357 -0.590 1.807) 2.335 32.554 ( -0.361 -0.302 -1.984) 2.039 35.401 ( 0.095 0.308 1.697) 1.727 35.443 ( -0.602 -0.476 -0.303) 0.825 35.484 ( -0.722 1.451 0.394) 1.668 35.531 ( 0.021 0.276 -0.943) 0.983 88.753 ( 2.163 -0.068 1.752) 2.785 88.807 ( -0.579 -0.907 2.378) 2.611 88.990 ( 5.203 1.374 -1.151) 5.503 89.386 ( 5.949 -4.728 4.610) 8.888 97.639 ( 1.996 -0.340 -0.524) 2.091 97.671 ( 2.073 0.156 -0.661) 2.181 97.672 ( 1.135 -0.472 0.112) 1.234 97.791 ( 4.066 -1.522 1.518) 4.600 98.682 ( 0.042 -0.180 0.233) 0.297 98.731 ( 0.576 -0.508 0.632) 0.995 98.818 ( -2.347 4.633 -0.096) 5.194 98.868 ( -2.574 4.752 -1.526) 5.616 99.636 ( -0.426 1.562 0.760) 1.788 99.688 ( -1.245 0.170 -0.545) 1.370 99.759 ( -3.127 1.117 -3.622) 4.914 100.341 ( 5.859 -6.879 -2.319) 9.329 ======================= 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| 1.379 ( 10.767 1.877 7.732) 13.388 1.537 ( 11.367 6.458 -5.495) 14.181 1.673 ( 7.549 4.115 -2.350) 8.913 1.701 ( 7.848 5.290 -8.386) 12.645 1.870 ( 2.722 1.715 -0.193) 3.223 2.041 ( -0.774 2.726 -2.859) 4.026 2.158 ( -1.627 -2.774 5.163) 6.083 2.235 ( -2.077 0.444 -1.645) 2.686 2.301 ( -2.239 -4.179 -1.747) 5.053 2.437 ( -3.764 -0.673 -3.082) 4.911 2.500 ( 0.639 -1.075 3.211) 3.446 2.529 ( -1.084 0.324 3.691) 3.860 2.578 ( -4.304 3.233 1.303) 5.538 2.702 ( -0.729 0.573 -0.334) 0.986 2.802 ( 1.554 -0.625 -5.121) 5.388 2.860 ( -1.644 3.258 3.689) 5.189 2.939 ( 0.428 -4.244 -1.000) 4.381 2.993 ( 2.678 -1.401 0.555) 3.073 3.042 ( -2.513 -0.155 -0.496) 2.566 3.108 ( -1.951 -0.795 5.261) 5.668 3.152 ( -1.573 -0.846 1.989) 2.673 3.231 ( -3.295 2.431 0.241) 4.101 3.330 ( 1.344 4.776 1.727) 5.254 3.529 ( 6.271 0.355 -3.598) 7.239 4.426 ( -1.601 -1.614 3.323) 4.026 4.467 ( 1.069 -3.247 0.333) 3.435 4.601 ( -4.600 -2.716 -0.051) 5.342 4.655 ( -2.276 -2.614 3.152) 4.685 4.796 ( -3.774 -0.494 1.165) 3.980 4.941 ( 0.831 0.238 0.996) 1.319 4.971 ( 1.238 -0.988 -2.934) 3.334 5.106 ( -4.528 0.251 -0.166) 4.538 5.240 ( -0.262 1.636 -1.515) 2.245 5.265 ( -1.220 -0.051 0.521) 1.328 5.404 ( -3.326 -7.870 0.102) 8.545 5.518 ( -4.081 -2.985 -1.119) 5.179 5.551 ( -1.102 -2.778 -2.313) 3.779 5.593 ( -5.976 -1.182 0.914) 6.160 5.741 ( -2.321 1.908 1.520) 3.367 5.798 ( -11.137 0.187 1.542) 11.245 5.880 ( -3.511 -0.179 3.680) 5.090 5.970 ( -5.637 -0.365 -4.386) 7.152 6.128 ( 0.556 -1.253 1.583) 2.094 6.231 ( 1.525 -1.773 -4.200) 4.807 6.299 ( 2.988 6.602 2.723) 7.742 6.324 ( 5.510 -2.036 7.559) 9.573 6.455 ( -1.563 1.797 -5.219) 5.737 6.689 ( -3.045 6.455 0.185) 7.139 6.785 ( -6.165 -2.216 0.357) 6.561 7.024 ( -5.939 -2.325 -3.100) 7.091 7.249 ( 3.015 1.763 -0.513) 3.530 7.303 ( 1.693 5.714 -0.960) 6.036 7.530 ( 0.744 5.829 0.342) 5.886 7.844 ( -8.906 -1.357 -0.034) 9.009 7.931 ( -13.056 2.813 8.751) 15.967 8.111 ( -1.235 -3.987 0.229) 4.181 8.250 ( -6.224 -0.970 -5.388) 8.289 8.430 ( 2.151 3.371 1.718) 4.352 8.599 ( 0.696 -0.917 -0.059) 1.153 8.795 ( -4.567 1.232 -0.741) 4.787 8.903 ( 0.499 -0.142 0.586) 0.782 9.173 ( 3.455 -2.303 -2.482) 4.838 9.203 ( 1.749 7.024 0.498) 7.255 9.325 ( 3.580 3.390 -2.251) 5.420 9.612 ( 10.185 -0.813 -4.778) 11.280 9.668 ( 7.326 1.891 0.618) 7.591 9.739 ( 5.100 -1.097 3.593) 6.335 9.953 ( 5.334 -2.805 -3.423) 6.931 10.426 ( 1.210 -1.798 4.585) 5.071 10.538 ( -2.732 -1.550 0.254) 3.151 10.617 ( 1.517 -1.520 0.720) 2.265 11.231 ( 5.407 -7.736 -1.117) 9.504 20.511 ( -0.950 1.579 0.527) 1.916 20.528 ( -0.545 0.999 -0.891) 1.445 20.839 ( -1.605 1.127 0.583) 2.046 20.892 ( -0.778 0.485 -0.320) 0.971 22.721 ( -1.291 1.133 -0.179) 1.727 22.919 ( 0.922 -1.014 0.210) 1.386 23.037 ( -0.177 0.485 -0.518) 0.732 23.215 ( 1.747 -1.159 0.161) 2.103 24.601 ( -2.818 -1.371 0.748) 3.222 24.716 ( -1.258 -5.023 0.088) 5.179 24.929 ( 0.492 4.018 0.125) 4.050 24.981 ( 0.995 1.516 -0.245) 1.829 25.625 ( -4.813 1.660 -0.214) 5.095 25.739 ( -4.147 0.129 0.278) 4.158 26.040 ( -1.665 0.006 -0.199) 1.677 26.071 ( -2.864 -0.061 1.174) 3.096 28.312 ( -0.681 0.153 0.762) 1.033 28.356 ( 0.520 -0.300 1.221) 1.360 28.490 ( -1.667 0.569 1.109) 2.082 28.589 ( -1.297 -1.459 -1.130) 2.255 28.606 ( -0.582 -0.239 1.037) 1.213 28.698 ( 0.318 2.269 -0.681) 2.390 28.804 ( -0.062 -2.281 -1.860) 2.944 28.933 ( 1.727 -2.536 -1.745) 3.529 32.355 ( 1.145 0.227 0.733) 1.378 32.449 ( -0.741 -1.178 0.560) 1.500 32.473 ( 1.067 0.913 -0.018) 1.404 32.529 ( -0.328 0.541 -1.698) 1.812 35.415 ( -0.298 0.082 1.079) 1.123 35.438 ( 0.363 0.003 -0.057) 0.368 35.474 ( -1.121 0.740 0.502) 1.434 35.525 ( 0.281 0.210 -0.816) 0.888 88.812 ( 1.849 -0.804 2.542) 3.245 88.828 ( 0.231 -1.023 2.136) 2.380 89.062 ( 4.778 1.533 -1.423) 5.216 89.493 ( 1.381 -5.326 3.254) 6.392 97.669 ( 1.946 -0.495 -0.510) 2.072 97.687 ( 1.055 -0.555 -0.131) 1.199 97.701 ( 1.386 0.276 0.388) 1.465 97.870 ( 2.746 -2.541 1.791) 4.148 98.688 ( 0.585 0.041 0.052) 0.589 98.742 ( 0.315 0.121 0.210) 0.398 98.782 ( -1.969 3.958 0.074) 4.421 98.818 ( -2.309 3.031 -0.289) 3.821 99.612 ( -1.763 -0.094 -0.808) 1.941 99.676 ( 0.116 -0.333 0.234) 0.423 99.712 ( -0.030 4.457 -0.636) 4.502 100.386 ( 3.292 -5.775 -3.159) 7.360 ======================= 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| 1.527 ( 0.454 3.258 2.292) 4.010 1.629 ( 6.457 1.301 -10.802) 12.652 1.680 ( 4.385 3.900 -5.603) 8.114 1.743 ( 3.212 6.958 -5.617) 9.502 1.949 ( 0.534 0.693 -0.607) 1.065 2.024 ( 6.003 1.850 -0.835) 6.337 2.128 ( -0.950 0.584 -5.007) 5.130 2.231 ( 2.456 -1.782 2.998) 4.266 2.282 ( -1.205 -1.702 0.481) 2.140 2.330 ( -1.517 1.116 -2.190) 2.889 2.462 ( -6.971 2.634 -1.537) 7.609 2.496 ( -3.509 -0.679 -0.761) 3.654 2.575 ( 0.412 -1.411 0.261) 1.493 2.647 ( -0.744 -1.062 -5.909) 6.050 2.742 ( -0.876 0.862 -7.023) 7.130 2.815 ( -3.701 -0.461 -0.508) 3.764 2.927 ( -2.943 -0.341 3.275) 4.416 3.046 ( 0.538 -1.585 0.239) 1.690 3.102 ( 2.439 -0.607 8.182) 8.560 3.126 ( 0.629 -0.223 2.462) 2.551 3.165 ( -4.720 1.928 3.460) 6.162 3.221 ( 1.657 -0.428 4.319) 4.646 3.377 ( 0.389 5.026 5.643) 7.567 3.614 ( 6.505 -0.497 -1.470) 6.687 4.404 ( -4.318 -1.139 3.534) 5.695 4.517 ( 2.862 -4.588 1.223) 5.544 4.541 ( -2.877 -2.650 0.496) 3.943 4.645 ( -1.892 -2.577 2.466) 4.038 4.760 ( -3.013 -0.113 2.138) 3.696 4.958 ( 1.261 -0.227 0.240) 1.304 4.998 ( 5.605 -2.220 -4.068) 7.273 5.037 ( -3.465 0.454 0.523) 3.533 5.199 ( -3.417 4.122 1.048) 5.456 5.292 ( 2.817 -1.822 1.437) 3.650 5.347 ( -0.579 -5.423 -1.029) 5.550 5.482 ( -1.789 -6.268 1.315) 6.650 5.516 ( -3.148 -0.112 0.460) 3.184 5.568 ( -0.517 -6.443 0.432) 6.478 5.646 ( -2.879 0.580 -0.098) 2.938 5.724 ( -4.062 2.781 1.213) 5.070 5.796 ( -4.046 -2.022 -0.346) 4.536 5.933 ( 1.477 3.985 1.064) 4.381 6.162 ( 1.113 -4.149 2.545) 4.993 6.243 ( 2.959 -1.126 -1.899) 3.692 6.324 ( -3.538 -0.271 -3.474) 4.965 6.374 ( 1.259 6.080 4.313) 7.560 6.556 ( 6.098 -2.426 6.211) 9.036 6.653 ( -2.098 9.435 2.943) 10.104 6.688 ( -5.098 -4.361 0.943) 6.775 6.951 ( 0.246 -2.557 -1.670) 3.064 7.286 ( 1.823 -0.106 -0.577) 1.915 7.312 ( 0.805 4.572 -1.754) 4.963 7.528 ( -0.256 8.605 -2.891) 9.081 7.698 ( -5.119 -0.490 -4.987) 7.163 7.808 ( -8.998 6.810 4.311) 12.080 8.063 ( -2.490 -2.806 -4.186) 5.621 8.139 ( 0.133 -0.111 -4.026) 4.029 8.512 ( 1.643 2.354 5.710) 6.391 8.604 ( 0.369 -0.197 -1.124) 1.199 8.707 ( -1.055 2.719 -2.955) 4.152 8.929 ( 0.130 -2.081 1.677) 2.676 9.193 ( 0.156 7.157 -1.538) 7.322 9.225 ( 3.624 -2.584 -2.173) 4.953 9.350 ( 0.823 4.295 -0.752) 4.437 9.723 ( 4.935 0.111 -0.505) 4.962 9.747 ( 2.195 -0.764 0.542) 2.387 9.829 ( 1.718 -1.468 1.916) 2.962 9.999 ( 4.142 -2.975 -2.947) 5.890 10.458 ( -2.166 -1.006 -0.872) 2.543 10.509 ( -1.319 -3.151 4.625) 5.749 10.645 ( 0.199 -0.196 2.038) 2.057 11.261 ( 1.520 -7.403 -3.983) 8.543 20.503 ( -0.675 1.336 0.505) 1.580 20.521 ( 0.422 0.643 -0.302) 0.826 20.825 ( -0.848 0.980 0.635) 1.443 20.879 ( -0.201 0.365 -0.446) 0.611 22.716 ( -0.017 1.214 1.469) 1.905 22.923 ( -0.040 -0.711 -0.811) 1.079 23.039 ( 0.501 -0.031 0.387) 0.633 23.224 ( 0.088 -1.594 -1.481) 2.178 24.576 ( -1.398 -1.335 1.194) 2.272 24.699 ( -0.534 -5.215 -0.296) 5.251 24.931 ( 0.069 4.631 -0.534) 4.662 24.988 ( 0.323 1.547 -0.708) 1.732 25.574 ( -1.380 1.997 0.633) 2.508 25.684 ( -2.163 0.382 -0.443) 2.240 26.019 ( -0.523 -0.233 -0.175) 0.598 26.040 ( -1.584 -0.104 0.301) 1.616 28.313 ( -0.417 0.227 0.844) 0.968 28.372 ( -0.208 -0.457 0.915) 1.044 28.483 ( -0.771 0.752 1.425) 1.786 28.557 ( -0.575 -0.976 -1.711) 2.052 28.604 ( -0.521 -0.298 0.419) 0.732 28.706 ( 0.614 1.864 0.684) 2.079 28.787 ( 0.608 -2.012 -1.865) 2.810 28.936 ( 1.020 -2.222 -1.907) 3.100 32.378 ( 0.805 -0.082 0.291) 0.860 32.429 ( -1.791 -1.243 0.437) 2.224 32.497 ( 0.552 1.046 -0.419) 1.254 32.512 ( 1.039 1.018 -1.064) 1.803 35.418 ( -0.427 -0.054 0.692) 0.815 35.450 ( 0.636 0.646 0.399) 0.991 35.457 ( -1.254 0.162 0.117) 1.270 35.523 ( 0.500 0.082 -0.767) 0.919 88.841 ( -0.644 -0.879 2.135) 2.397 88.880 ( 0.851 -2.035 4.460) 4.976 89.108 ( 2.580 1.775 -1.645) 3.537 89.495 ( -2.503 -4.444 -0.890) 5.178 97.681 ( 0.497 -0.236 -0.642) 0.846 97.705 ( 0.663 -0.215 -0.113) 0.706 97.732 ( 1.192 -0.490 1.877) 2.277 97.903 ( -0.338 -2.826 0.420) 2.877 98.700 ( 0.583 0.461 0.112) 0.752 98.742 ( -0.799 1.742 0.012) 1.916 98.765 ( 0.569 2.157 -0.133) 2.235 98.785 ( -1.612 2.149 0.243) 2.697 99.592 ( -0.023 -0.276 0.041) 0.280 99.670 ( -0.429 1.718 -0.959) 2.014 99.746 ( 1.484 2.513 4.194) 5.110 100.386 ( 1.801 -5.364 -4.711) 7.363 ======================= 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| 1.405 ( -12.880 1.841 -3.661) 13.516 1.493 ( -9.509 3.546 -8.477) 13.223 1.672 ( 7.640 3.724 -11.987) 14.695 1.814 ( 9.799 4.685 -4.012) 11.579 1.936 ( -0.052 2.030 0.357) 2.062 2.060 ( -3.587 1.470 6.130) 7.253 2.128 ( 1.189 -1.358 -6.360) 6.612 2.221 ( -2.299 -0.038 -4.779) 5.303 2.261 ( -0.847 -2.793 -3.769) 4.767 2.354 ( 3.996 0.172 4.047) 5.690 2.382 ( -2.520 3.158 0.710) 4.102 2.448 ( -0.673 -0.291 -2.286) 2.400 2.508 ( -2.222 0.645 -2.948) 3.747 2.578 ( -5.925 0.750 0.222) 5.977 2.648 ( -0.490 -1.121 -4.962) 5.111 2.798 ( 2.527 -0.536 -1.534) 3.004 2.928 ( -0.239 1.210 -1.461) 1.911 3.001 ( -3.687 -0.163 2.899) 4.694 3.124 ( -1.691 -2.699 2.567) 4.091 3.184 ( 1.838 -0.926 3.088) 3.712 3.247 ( 1.083 1.397 6.101) 6.352 3.282 ( 2.022 1.228 4.373) 4.972 3.462 ( 1.731 4.458 5.856) 7.561 3.695 ( 3.402 -0.433 0.688) 3.498 4.375 ( -2.985 -0.879 2.532) 4.012 4.500 ( -2.999 -3.885 1.637) 5.174 4.580 ( 2.938 -3.983 0.841) 5.020 4.656 ( -0.522 -3.265 2.660) 4.244 4.748 ( 0.020 -1.682 1.561) 2.295 4.987 ( -3.107 2.712 0.829) 4.206 5.014 ( 3.763 -1.509 -2.705) 4.874 5.065 ( 8.201 -0.535 -1.323) 8.325 5.150 ( -4.541 2.504 2.273) 5.662 5.360 ( 1.225 -3.534 1.700) 4.109 5.383 ( 5.068 -3.815 2.129) 6.691 5.475 ( 1.617 -1.904 -1.523) 2.926 5.528 ( 1.785 -3.186 2.566) 4.463 5.558 ( 1.885 -3.771 0.872) 4.305 5.593 ( -1.838 -0.651 -3.012) 3.588 5.690 ( 0.206 1.948 -0.799) 2.115 5.810 ( 0.053 -0.297 2.812) 2.828 6.003 ( 3.676 3.856 2.285) 5.797 6.157 ( -2.383 -3.318 -3.243) 5.216 6.241 ( -2.144 -0.652 1.218) 2.550 6.303 ( 3.227 -0.595 2.116) 3.905 6.413 ( -2.529 3.496 4.721) 6.395 6.630 ( 0.420 1.750 2.332) 2.946 6.670 ( 2.176 0.909 2.380) 3.351 6.758 ( 4.644 -1.410 6.623) 8.211 6.981 ( 5.601 -5.326 -3.089) 8.323 7.288 ( -0.163 -0.966 -0.115) 0.987 7.322 ( 2.461 2.412 -0.519) 3.485 7.452 ( -1.562 8.954 -7.322) 11.672 7.564 ( -3.573 1.347 -7.021) 7.992 7.753 ( -2.674 9.133 3.949) 10.303 7.992 ( -0.122 -1.683 -3.529) 3.912 8.137 ( 3.590 2.208 -3.361) 5.391 8.542 ( 1.518 2.381 -3.394) 4.415 8.641 ( 2.401 0.910 3.199) 4.102 8.708 ( 0.643 1.134 1.709) 2.149 8.927 ( -1.728 -2.392 -0.070) 2.952 9.172 ( -1.818 3.731 0.992) 4.267 9.240 ( 2.055 2.218 -5.518) 6.291 9.344 ( -1.042 0.599 1.204) 1.702 9.724 ( -2.663 0.574 -0.775) 2.832 9.758 ( -3.924 -1.843 0.170) 4.339 9.844 ( -0.387 0.701 0.661) 1.038 10.028 ( 2.011 -4.206 -1.539) 4.910 10.388 ( -5.283 -0.748 1.298) 5.492 10.543 ( 0.977 -2.455 0.275) 2.657 10.677 ( -1.000 -0.395 5.774) 5.873 11.206 ( -1.240 -6.569 -6.253) 9.154 20.500 ( -0.171 1.599 0.293) 1.635 20.535 ( 1.361 0.496 0.142) 1.455 20.826 ( 0.084 0.950 0.686) 1.175 20.877 ( 0.541 0.308 -0.525) 0.814 22.750 ( 1.144 1.215 2.760) 3.225 22.897 ( -1.125 0.216 -2.184) 2.467 23.064 ( 1.049 -0.954 1.757) 2.258 23.189 ( -1.271 -1.503 -2.829) 3.446 24.580 ( 0.064 -1.420 1.445) 2.027 24.693 ( 0.327 -4.919 -0.729) 4.983 24.923 ( -0.481 4.309 -0.344) 4.349 24.976 ( -0.476 1.802 -1.239) 2.238 25.594 ( 2.206 1.669 1.401) 3.100 25.666 ( 1.202 0.921 -1.177) 1.918 26.021 ( 0.741 -0.157 0.148) 0.772 26.029 ( 0.203 0.200 -0.230) 0.366 28.314 ( -0.601 0.152 0.971) 1.151 28.364 ( -1.743 -0.390 0.621) 1.891 28.495 ( 0.005 0.720 1.935) 2.064 28.538 ( 0.542 0.027 -1.526) 1.620 28.603 ( 0.485 -0.352 -0.251) 0.649 28.722 ( 0.454 -0.103 0.222) 0.516 28.791 ( 1.541 -0.917 -0.683) 1.919 28.927 ( 0.737 -2.566 -2.536) 3.682 32.378 ( -1.357 -0.222 0.196) 1.388 32.411 ( -0.505 -0.898 0.044) 1.032 32.480 ( -0.777 1.516 -0.859) 1.908 32.539 ( 2.033 0.385 -0.325) 2.095 35.413 ( -1.198 0.189 0.599) 1.353 35.439 ( -0.827 -0.233 0.001) 0.859 35.467 ( 0.911 1.038 0.504) 1.471 35.525 ( 0.751 -0.027 -0.730) 1.048 88.844 ( -1.726 -0.880 2.293) 3.002 88.938 ( -0.800 -3.810 6.220) 7.337 89.115 ( -0.419 2.222 -0.048) 2.262 89.407 ( -3.881 -2.943 -4.722) 6.783 97.677 ( -0.441 -0.030 -0.092) 0.451 97.702 ( -0.493 0.115 -0.539) 0.739 97.776 ( 0.547 -1.690 3.355) 3.796 97.872 ( -2.707 -2.250 -1.102) 3.689 98.702 ( -0.683 0.702 0.295) 1.023 98.728 ( -0.478 1.198 -0.492) 1.381 98.770 ( 0.127 2.517 0.154) 2.525 98.797 ( 2.541 2.534 0.359) 3.607 99.606 ( 0.989 0.514 0.554) 1.245 99.650 ( -0.360 2.187 -1.166) 2.505 99.833 ( 1.372 0.336 7.165) 7.303 100.346 ( 0.813 -5.581 -7.054) 9.031 ======================= 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| 1.098 ( -16.095 3.363 -7.707) 18.159 1.190 ( -16.984 5.849 -4.129) 18.431 1.689 ( 6.299 2.280 -7.389) 9.973 1.892 ( 1.690 0.060 -5.566) 5.817 1.975 ( 5.428 1.974 -0.976) 5.857 1.989 ( -8.913 2.040 2.759) 9.551 2.025 ( -10.074 2.815 2.615) 10.782 2.170 ( 1.261 2.077 -4.776) 5.358 2.213 ( -7.841 3.572 2.611) 9.003 2.276 ( -1.069 -4.352 -2.181) 4.984 2.362 ( -2.523 2.284 -3.070) 4.584 2.458 ( 1.788 -1.732 0.079) 2.491 2.528 ( 3.165 1.805 1.542) 3.957 2.536 ( 0.621 -1.755 1.332) 2.289 2.653 ( 5.518 -0.045 -2.559) 6.083 2.821 ( 1.354 0.194 -3.233) 3.510 2.883 ( 1.952 1.089 -2.639) 3.458 3.056 ( 2.607 0.351 4.046) 4.826 3.124 ( -0.810 -2.437 1.908) 3.199 3.234 ( -0.073 -0.310 3.556) 3.571 3.306 ( 2.711 -1.400 0.695) 3.129 3.363 ( 0.481 0.760 4.636) 4.722 3.539 ( 1.298 4.823 3.186) 5.924 3.733 ( -0.732 -0.170 1.958) 2.097 4.359 ( -1.091 -1.165 1.087) 1.932 4.474 ( -2.576 -2.662 2.104) 4.260 4.640 ( 2.730 -4.634 -0.356) 5.390 4.680 ( 2.082 -2.888 2.222) 4.197 4.787 ( 2.395 -3.685 0.512) 4.425 4.974 ( -0.899 3.992 2.683) 4.893 5.015 ( 1.566 -3.083 -2.816) 4.459 5.079 ( -3.719 2.674 3.872) 5.998 5.258 ( 10.410 -0.083 0.694) 10.433 5.402 ( 0.292 -2.417 2.217) 3.293 5.465 ( 3.829 -4.000 -2.308) 5.999 5.490 ( 0.308 -1.715 -1.325) 2.189 5.507 ( 0.312 -0.861 -3.808) 3.916 5.635 ( 8.349 -4.623 -1.278) 9.629 5.676 ( 3.137 -0.347 3.921) 5.034 5.724 ( 6.584 1.662 -0.138) 6.792 5.810 ( 1.166 1.516 0.796) 2.072 6.043 ( -3.000 -0.431 2.584) 3.983 6.062 ( -1.723 1.070 -3.209) 3.796 6.258 ( -2.027 5.675 -1.380) 6.182 6.350 ( -0.206 1.404 4.583) 4.798 6.442 ( 0.226 0.277 5.146) 5.158 6.694 ( 4.977 -1.179 -0.129) 5.116 6.762 ( 4.312 0.806 4.353) 6.180 6.904 ( 5.796 -1.796 4.703) 7.677 7.033 ( 4.254 -8.164 -3.419) 9.820 7.300 ( -0.582 -0.564 2.301) 2.439 7.361 ( 4.438 3.645 -10.679) 12.125 7.401 ( 7.119 -1.200 -3.994) 8.251 7.439 ( -2.385 5.787 -3.561) 7.201 7.815 ( 1.935 8.673 10.409) 13.686 7.981 ( 1.330 -0.496 -1.203) 1.861 8.178 ( 5.005 3.622 -2.667) 6.729 8.549 ( 6.063 3.846 -6.786) 9.879 8.692 ( -0.156 -2.144 2.552) 3.337 8.738 ( -0.280 0.257 2.550) 2.578 8.874 ( -3.874 -0.404 -0.206) 3.900 9.134 ( -2.153 3.393 -4.332) 5.909 9.199 ( -1.000 3.492 -0.441) 3.659 9.347 ( -0.580 -3.287 1.462) 3.644 9.615 ( -11.148 1.498 -1.535) 11.353 9.645 ( -5.265 -1.602 -1.076) 5.607 9.839 ( -0.451 2.319 -1.079) 2.597 10.019 ( -2.103 -3.896 -0.251) 4.434 10.325 ( -5.337 -1.400 3.671) 6.627 10.533 ( -1.094 0.195 -1.995) 2.283 10.736 ( -1.313 -3.369 8.502) 9.239 11.099 ( -2.975 -5.636 -6.749) 9.283 20.509 ( 1.117 2.748 0.199) 2.973 20.565 ( 1.942 0.568 0.096) 2.026 20.840 ( 0.753 1.092 0.686) 1.493 20.885 ( 1.084 0.338 -0.527) 1.252 22.804 ( 1.324 0.843 2.852) 3.255 22.849 ( -1.305 0.715 -2.460) 2.875 23.098 ( 0.164 -1.451 1.251) 1.923 23.138 ( -0.751 -0.560 -2.014) 2.221 24.605 ( 0.946 -1.381 1.464) 2.224 24.693 ( 0.894 -4.013 -1.061) 4.246 24.909 ( -1.026 3.148 0.257) 3.321 24.950 ( -0.868 1.979 -1.321) 2.533 25.661 ( 4.043 0.650 0.574) 4.135 25.705 ( 4.647 1.551 -0.448) 4.919 26.039 ( 1.536 1.088 -0.579) 1.969 26.050 ( 1.943 0.390 1.178) 2.305 28.314 ( -0.712 -0.061 1.054) 1.273 28.333 ( -2.393 -0.167 0.534) 2.457 28.521 ( 0.379 0.462 2.200) 2.280 28.543 ( 1.315 0.720 -0.669) 1.642 28.615 ( 1.427 -0.465 -0.591) 1.612 28.727 ( 0.333 -1.434 -0.397) 1.525 28.813 ( 1.355 -0.451 -0.319) 1.464 28.904 ( 0.200 -3.440 -3.657) 5.025 32.349 ( -2.251 -0.046 0.614) 2.333 32.401 ( -0.645 -0.642 -0.561) 1.069 32.458 ( -0.689 1.597 -0.829) 1.927 32.567 ( 1.761 -0.109 -0.347) 1.798 35.392 ( -1.545 0.365 0.167) 1.596 35.431 ( -0.376 -0.032 0.321) 0.496 35.492 ( 1.192 1.178 0.919) 1.912 35.531 ( 0.801 0.029 -0.746) 1.095 88.832 ( -2.652 -0.907 2.333) 3.647 88.972 ( -2.031 -4.754 3.779) 6.404 89.117 ( -3.300 0.098 7.684) 8.364 89.283 ( -3.583 -1.557 -6.081) 7.228 97.666 ( -1.025 0.017 0.235) 1.052 97.680 ( -1.276 0.164 -0.572) 1.408 97.797 ( -3.197 -2.101 -0.462) 3.853 97.822 ( -1.070 -2.807 3.322) 4.479 98.690 ( -1.038 0.569 0.425) 1.258 98.712 ( -0.630 0.097 -0.754) 0.987 98.796 ( 2.531 4.387 0.456) 5.085 98.854 ( 3.741 4.330 0.425) 5.738 99.611 ( -0.490 1.767 -0.689) 1.959 99.656 ( 1.931 1.082 -0.018) 2.213 99.930 ( 0.251 -1.122 7.910) 7.993 100.258 ( -0.266 -6.329 -10.728) 12.459 ======================= 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 ( -16.383 8.546 -3.596) 18.824 0.878 ( -19.104 8.990 3.302) 21.370 1.641 ( -30.505 16.055 7.441) 35.266 1.734 ( 3.349 -0.530 -2.249) 4.068 1.816 ( -1.092 -0.385 -3.446) 3.635 1.999 ( 1.383 -0.428 -3.077) 3.401 2.040 ( 4.032 2.446 -5.036) 6.900 2.156 ( 0.717 1.345 -2.864) 3.244 2.173 ( -1.672 -3.562 5.690) 6.918 2.280 ( 1.058 -0.946 1.655) 2.180 2.315 ( -0.276 0.708 -1.096) 1.334 2.496 ( 2.749 -2.528 0.434) 3.760 2.536 ( 0.103 -1.187 1.267) 1.739 2.625 ( 2.189 0.681 4.034) 4.640 2.739 ( 6.260 0.002 -1.224) 6.379 2.789 ( 0.129 0.980 -3.296) 3.441 2.931 ( 5.142 4.403 -2.336) 7.162 3.113 ( 1.584 -2.262 0.730) 2.856 3.162 ( 0.826 -2.125 4.010) 4.612 3.258 ( 0.297 0.340 0.365) 0.581 3.353 ( 2.544 -2.164 0.127) 3.342 3.385 ( -0.684 -0.203 -0.237) 0.752 3.559 ( -0.919 4.453 -0.142) 4.549 3.712 ( -3.639 -0.293 1.080) 3.807 4.365 ( 1.093 -2.820 -0.327) 3.042 4.467 ( -0.123 1.446 1.927) 2.412 4.661 ( 1.966 -5.406 -1.190) 5.874 4.778 ( 4.117 -2.652 2.111) 5.333 4.813 ( 1.476 -3.849 -0.736) 4.188 4.960 ( -1.051 3.653 1.017) 3.934 5.067 ( 4.604 -2.297 0.404) 5.161 5.157 ( 3.938 1.622 10.305) 11.151 5.336 ( -6.145 -1.813 -4.133) 7.624 5.381 ( 3.172 -2.220 1.286) 4.080 5.443 ( 3.072 -0.809 -5.073) 5.985 5.516 ( 5.108 -1.921 -6.339) 8.365 5.524 ( 0.987 -0.568 -0.320) 1.183 5.701 ( -0.750 -3.804 2.852) 4.813 5.750 ( 5.702 -2.456 1.614) 6.414 5.871 ( 7.580 -0.483 0.461) 7.609 5.901 ( -0.550 -0.279 0.224) 0.656 6.010 ( 6.025 -0.819 1.802) 6.342 6.075 ( 1.644 8.780 1.179) 9.010 6.166 ( -4.078 5.498 -2.219) 7.196 6.370 ( -2.232 3.025 2.613) 4.579 6.471 ( -0.974 0.570 0.912) 1.451 6.707 ( -0.794 2.454 -4.661) 5.327 6.918 ( 7.083 -2.320 2.872) 7.987 7.012 ( 2.635 -3.293 -2.106) 4.714 7.067 ( 4.604 -3.579 -0.495) 5.853 7.281 ( -0.237 5.767 -2.425) 6.261 7.329 ( -0.434 -1.117 -1.665) 2.052 7.439 ( 2.757 5.032 3.119) 6.531 7.535 ( 13.930 -8.288 -4.769) 16.897 7.989 ( 2.125 -2.556 0.357) 3.343 8.056 ( 5.893 7.013 16.697) 19.045 8.244 ( 5.829 3.129 -1.666) 6.822 8.592 ( 5.641 0.404 -4.315) 7.114 8.701 ( -0.553 -3.074 0.553) 3.172 8.743 ( 1.276 0.890 -2.355) 2.823 8.813 ( -5.664 1.954 4.000) 7.204 9.026 ( -3.015 4.150 -6.256) 8.090 9.193 ( -1.423 1.200 1.771) 2.569 9.355 ( 0.335 -3.613 0.625) 3.682 9.390 ( -12.539 3.466 -2.025) 13.166 9.544 ( -4.572 -2.260 -1.740) 5.389 9.802 ( -0.501 4.948 -4.280) 6.562 9.965 ( -4.005 -2.497 0.618) 4.760 10.284 ( -5.336 -2.448 4.709) 7.526 10.464 ( -4.464 1.977 -2.142) 5.332 10.798 ( -3.173 -8.014 9.025) 12.480 10.980 ( -3.003 -4.607 -5.410) 7.714 20.551 ( 4.197 4.777 0.040) 6.359 20.596 ( 2.130 1.162 -0.786) 2.550 20.862 ( 0.942 1.404 0.631) 1.805 20.900 ( 1.235 0.483 -0.316) 1.363 22.797 ( -0.948 0.452 -1.920) 2.188 22.857 ( 0.726 0.392 2.043) 2.203 23.076 ( -0.538 -0.282 -1.909) 2.003 23.145 ( 0.148 -0.374 1.471) 1.525 24.639 ( 0.925 -1.144 2.018) 2.498 24.699 ( 1.050 -2.743 -0.963) 3.091 24.896 ( -1.041 1.821 0.670) 2.202 24.923 ( -1.008 1.732 -0.626) 2.099 25.739 ( 5.469 0.621 -0.544) 5.531 25.790 ( 4.698 0.731 0.417) 4.773 26.060 ( 1.676 1.637 -0.813) 2.480 26.125 ( 4.652 2.162 3.602) 6.268 28.299 ( -1.861 -0.115 0.677) 1.983 28.320 ( -0.576 -0.246 1.752) 1.861 28.550 ( -0.182 0.135 2.801) 2.810 28.565 ( 2.076 0.907 -0.577) 2.337 28.635 ( 1.676 -0.376 -0.610) 1.823 28.722 ( -0.886 -2.585 -0.248) 2.743 28.822 ( 0.975 -1.148 -2.419) 2.850 28.847 ( -2.122 -3.719 -3.941) 5.819 32.323 ( -1.966 0.174 1.199) 2.309 32.377 ( -1.464 -0.397 -0.486) 1.593 32.441 ( -0.342 1.630 -0.829) 1.860 32.589 ( 1.502 -0.427 -0.548) 1.655 35.371 ( -1.171 0.481 0.314) 1.304 35.435 ( 0.522 0.606 0.318) 0.861 35.525 ( 1.228 0.919 1.292) 2.005 35.535 ( 0.797 0.478 -0.651) 1.135 88.809 ( -2.930 -0.914 2.116) 3.728 88.955 ( -2.065 -2.522 0.324) 3.275 89.121 ( -4.806 -4.239 0.749) 6.452 89.225 ( -4.180 -6.642 11.072) 13.571 97.650 ( -1.209 -0.045 0.178) 1.223 97.651 ( -1.417 0.106 -0.417) 1.481 97.731 ( -2.738 -0.997 -1.183) 3.145 97.837 ( -3.278 -6.361 4.294) 8.345 98.680 ( -0.785 0.426 0.525) 1.036 98.693 ( -0.615 -0.200 -0.628) 0.902 98.857 ( 3.353 4.630 0.788) 5.771 98.944 ( 7.871 9.494 0.496) 12.343 99.597 ( -0.215 1.286 -0.454) 1.380 99.690 ( 2.019 1.100 -0.280) 2.316 99.999 ( -1.427 -2.039 6.628) 7.080 100.089 ( -3.565 -6.362 -16.469) 18.012 ======================= 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 ( -5.540 16.521 12.877) 21.667 0.675 ( -12.671 15.482 10.998) 22.830 1.215 ( -30.164 21.057 12.898) 38.982 1.735 ( -0.591 -3.447 -1.883) 3.972 1.848 ( 2.943 2.056 2.280) 4.252 1.980 ( -0.073 1.325 -10.221) 10.307 1.987 ( 2.318 1.568 -1.294) 3.083 2.152 ( 0.891 -0.451 -1.043) 1.444 2.230 ( 2.200 -4.303 1.390) 5.029 2.306 ( -1.651 -0.358 3.940) 4.287 2.344 ( 2.607 -3.434 2.322) 4.897 2.548 ( 1.163 -2.409 3.176) 4.152 2.576 ( -0.401 1.322 5.094) 5.278 2.680 ( 0.496 0.040 2.458) 2.508 2.752 ( -0.072 3.949 -1.709) 4.304 2.828 ( 4.095 -2.164 0.416) 4.650 2.977 ( 3.858 5.813 -3.593) 7.848 3.160 ( 2.164 -0.340 2.221) 3.120 3.197 ( 0.118 -4.920 1.058) 5.034 3.247 ( 0.436 -1.504 -3.725) 4.041 3.336 ( -1.361 -2.081 -4.641) 5.265 3.391 ( 1.342 2.635 -1.116) 3.161 3.514 ( -1.649 3.428 -3.055) 4.878 3.638 ( -4.304 -0.598 -2.320) 4.926 4.382 ( 2.283 -3.243 -1.397) 4.205 4.518 ( 4.123 3.368 -0.980) 5.414 4.672 ( 1.445 -4.775 -4.324) 6.602 4.780 ( -0.168 -3.081 -1.016) 3.248 4.868 ( 0.338 -1.407 2.629) 3.001 4.995 ( 2.969 3.321 0.589) 4.493 5.148 ( 2.737 1.675 0.151) 3.212 5.206 ( -1.350 -0.493 -2.358) 2.761 5.308 ( -1.484 -0.986 -1.078) 2.082 5.408 ( 3.100 -5.130 4.252) 7.349 5.449 ( 3.034 -1.590 -5.187) 6.216 5.526 ( 0.080 -1.054 -0.135) 1.065 5.542 ( 4.009 -3.780 -0.692) 5.554 5.709 ( -4.569 -7.127 6.269) 10.534 5.796 ( -4.326 0.445 -1.496) 4.599 5.878 ( 3.948 -1.970 1.674) 4.719 6.018 ( 7.383 1.219 3.239) 8.154 6.083 ( 0.927 2.134 0.525) 2.385 6.122 ( 1.519 7.222 -0.051) 7.380 6.215 ( 8.452 3.163 4.370) 10.027 6.341 ( -2.046 4.263 -1.195) 4.877 6.458 ( -1.989 -1.613 1.786) 3.122 6.599 ( -3.525 3.843 -6.390) 8.248 6.972 ( 1.809 -1.935 -5.185) 5.822 7.013 ( 0.791 -2.202 1.171) 2.616 7.132 ( 3.417 -0.258 -1.571) 3.769 7.217 ( -1.143 2.124 -6.749) 7.167 7.408 ( 2.486 5.479 -3.576) 6.999 7.457 ( 1.193 2.444 9.515) 9.896 7.783 ( 8.484 -5.392 10.542) 14.567 8.024 ( 1.952 -3.298 1.569) 4.141 8.300 ( 8.149 2.543 2.753) 8.969 8.333 ( -1.398 1.287 8.462) 8.673 8.631 ( 2.899 -5.746 -1.011) 6.515 8.675 ( -0.339 -2.374 -3.110) 3.927 8.755 ( -0.335 -0.254 1.031) 1.114 8.779 ( -3.062 2.349 3.639) 5.304 8.932 ( -2.168 3.390 -1.277) 4.222 9.159 ( -5.015 2.752 -0.729) 5.767 9.223 ( -3.322 2.385 -0.085) 4.090 9.373 ( -0.538 -3.544 2.285) 4.251 9.484 ( 3.339 -1.829 -6.201) 7.276 9.726 ( -1.488 6.124 -7.528) 9.818 9.925 ( -0.466 -0.334 0.059) 0.576 10.245 ( -5.009 -2.548 4.216) 7.025 10.352 ( -5.015 1.974 -2.297) 5.858 10.785 ( -8.969 -10.902 5.971) 15.328 10.902 ( -0.867 -4.183 -2.944) 5.188 20.607 ( 1.025 0.920 -1.226) 1.844 20.647 ( 8.052 6.255 -4.970) 11.343 20.881 ( 0.578 1.667 0.374) 1.803 20.919 ( 1.183 0.965 0.098) 1.530 22.775 ( 0.254 0.612 -0.762) 1.009 22.875 ( -0.360 -0.419 0.665) 0.864 23.059 ( 0.307 0.854 -0.852) 1.245 23.152 ( -0.666 -0.203 0.430) 0.818 24.686 ( 1.032 -2.307 4.045) 4.769 24.708 ( 0.951 -1.873 -0.331) 2.127 24.893 ( -0.795 1.340 1.099) 1.907 24.907 ( -0.382 0.900 0.517) 1.106 25.822 ( 4.772 0.593 -0.613) 4.848 25.854 ( 2.547 0.239 0.225) 2.568 26.074 ( 0.901 2.119 -0.623) 2.385 26.278 ( 7.672 -0.048 2.182) 7.976 28.286 ( -0.965 0.096 1.252) 1.584 28.359 ( 2.356 -1.933 4.849) 5.727 28.571 ( -1.423 -0.508 3.765) 4.057 28.594 ( 1.694 0.539 -1.349) 2.231 28.650 ( -6.077 -3.485 -3.206) 7.704 28.655 ( 1.091 -0.374 -0.198) 1.171 28.745 ( -3.340 -0.405 -0.393) 3.387 28.830 ( 1.457 -1.170 -2.067) 2.786 32.308 ( -1.562 0.402 1.167) 1.991 32.364 ( -0.310 -0.860 2.294) 2.469 32.432 ( 0.173 1.598 -0.425) 1.662 32.604 ( 1.216 -0.662 -1.035) 1.728 35.362 ( -0.650 0.562 0.788) 1.167 35.453 ( 1.532 1.050 -0.507) 1.925 35.528 ( 0.189 0.106 -1.135) 1.155 35.573 ( 1.740 0.450 1.133) 2.125 88.783 ( -2.575 -0.921 1.641) 3.189 88.922 ( -1.495 -1.210 -0.844) 2.100 89.050 ( -2.865 -4.869 -0.296) 5.657 89.227 ( -15.209 -18.322 11.671) 26.519 97.625 ( -0.762 0.197 -0.569) 0.971 97.635 ( -0.863 -0.195 0.130) 0.894 97.690 ( -1.125 -0.659 -0.505) 1.398 97.773 ( -8.000 -6.523 0.950) 10.366 98.675 ( -0.192 -0.158 0.063) 0.256 98.683 ( -0.497 0.373 0.717) 0.949 98.900 ( 1.368 3.973 -0.323) 4.214 99.145 ( 15.843 11.465 -6.971) 20.761 99.603 ( 1.095 1.824 0.913) 2.314 99.714 ( 1.798 0.699 -0.349) 1.960 99.805 ( -7.372 0.023 -10.624) 12.931 100.020 ( -3.139 -2.308 3.851) 5.478 ======================= 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| 1.071 ( -3.165 18.377 9.772) 21.053 1.111 ( -0.637 17.256 12.611) 21.382 1.481 ( 1.192 6.864 9.060) 11.429 1.748 ( -1.709 9.673 3.801) 10.533 1.836 ( -0.225 -7.392 -3.216) 8.064 1.939 ( 2.601 0.154 -2.750) 3.788 1.997 ( -2.862 -0.028 -4.304) 5.169 2.080 ( 2.974 -3.711 0.491) 4.781 2.183 ( 3.029 -2.663 2.314) 4.650 2.376 ( -0.669 -1.661 7.970) 8.168 2.412 ( -2.144 6.419 0.569) 6.792 2.545 ( -1.290 -2.953 4.484) 5.522 2.559 ( -2.002 0.951 0.803) 2.357 2.696 ( -0.896 0.256 1.528) 1.790 2.802 ( 1.710 -5.778 4.296) 7.400 2.897 ( -1.244 -4.741 0.846) 4.974 2.938 ( 3.447 1.241 0.738) 3.737 3.132 ( 0.212 -2.069 -1.291) 2.448 3.174 ( 0.851 0.024 -7.677) 7.725 3.214 ( 1.746 -1.263 -7.309) 7.620 3.324 ( 1.555 6.847 1.257) 7.133 3.413 ( -2.371 3.545 -6.351) 7.650 3.507 ( -3.905 -0.607 -5.343) 6.645 3.534 ( 0.378 0.707 -2.105) 2.253 4.337 ( 1.640 -2.386 0.418) 2.925 4.439 ( -1.207 -6.996 3.561) 7.942 4.606 ( 0.739 1.119 -9.224) 9.321 4.707 ( -0.324 -4.323 -1.926) 4.743 4.951 ( 4.080 4.132 3.651) 6.859 5.088 ( 0.812 2.743 -3.098) 4.217 5.125 ( -2.713 2.506 -0.018) 3.694 5.208 ( -5.854 -2.325 6.404) 8.983 5.307 ( -1.476 -0.361 -0.069) 1.521 5.348 ( -1.128 -0.438 -1.287) 1.767 5.421 ( -2.801 -3.604 0.519) 4.594 5.473 ( 4.766 -3.490 3.870) 7.062 5.529 ( 2.614 -1.453 -0.804) 3.096 5.614 ( 0.570 -4.434 3.362) 5.593 5.751 ( 0.801 4.086 -3.714) 5.579 5.909 ( 0.079 -0.815 -0.578) 1.003 6.112 ( -0.553 -3.329 -1.312) 3.621 6.139 ( 1.101 0.630 -0.118) 1.274 6.186 ( 3.176 -1.542 3.607) 5.047 6.241 ( -0.391 2.535 -1.336) 2.892 6.388 ( -3.300 0.366 -0.345) 3.338 6.485 ( 3.592 -3.063 7.172) 8.586 6.658 ( -2.985 12.136 -9.189) 15.512 6.998 ( 1.307 4.142 -1.408) 4.566 7.072 ( 0.000 1.290 -0.781) 1.508 7.132 ( -1.334 -5.259 -6.003) 8.091 7.210 ( 0.943 5.179 0.255) 5.271 7.383 ( -5.743 1.178 -5.252) 7.871 7.726 ( 5.508 3.790 9.761) 11.832 7.938 ( 0.858 -3.667 7.478) 8.373 8.082 ( -1.006 6.759 6.996) 9.780 8.250 ( -4.869 1.232 -2.368) 5.553 8.401 ( -3.027 -5.567 -2.034) 6.655 8.530 ( 5.508 -8.845 2.088) 10.627 8.682 ( 2.637 5.179 1.870) 6.105 8.741 ( -5.000 1.398 1.010) 5.289 8.748 ( -0.622 -0.843 3.638) 3.786 8.984 ( -0.298 0.299 3.549) 3.574 9.125 ( -3.726 0.262 3.033) 4.811 9.232 ( -3.565 -3.732 -2.271) 5.638 9.298 ( 5.552 -3.044 -4.614) 7.834 9.380 ( 0.935 -0.682 1.513) 1.904 9.678 ( 0.168 2.201 -6.060) 6.449 9.828 ( -0.678 -4.691 -1.404) 4.944 10.323 ( 2.804 5.031 -2.811) 6.409 10.366 ( 1.919 3.164 -1.971) 4.193 10.610 ( -3.437 -1.478 2.810) 4.679 10.778 ( 2.471 -6.673 -1.101) 7.201 20.632 ( 0.050 1.683 -1.438) 2.214 20.693 ( 0.480 -0.383 -4.077) 4.123 20.924 ( -0.136 1.572 0.219) 1.593 20.952 ( -0.150 0.514 0.226) 0.581 22.812 ( 1.322 1.091 0.422) 1.765 22.851 ( -0.516 -0.578 -0.267) 0.819 23.094 ( 0.521 1.230 -0.094) 1.339 23.129 ( -0.811 -0.330 -0.769) 1.166 24.672 ( -0.609 -1.334 1.178) 1.881 24.683 ( 0.080 -1.569 0.350) 1.610 24.915 ( -0.381 0.959 1.022) 1.452 24.929 ( 0.380 0.140 1.455) 1.510 25.879 ( 0.877 0.498 -0.222) 1.033 25.884 ( -0.269 0.370 -0.239) 0.516 26.121 ( -0.117 2.119 -0.206) 2.133 26.245 ( -1.305 -3.071 -2.568) 4.211 28.297 ( -0.475 0.465 1.908) 2.020 28.353 ( -1.243 -2.367 2.944) 3.976 28.551 ( -0.758 0.316 1.057) 1.339 28.574 ( -0.359 -1.066 2.301) 2.562 28.668 ( 0.593 0.740 -0.014) 0.948 28.679 ( 2.721 1.302 -1.226) 3.256 28.697 ( -1.112 -0.653 0.233) 1.311 28.791 ( 1.399 -2.418 -2.074) 3.479 32.319 ( -0.576 1.029 1.360) 1.800 32.366 ( 0.292 -1.237 2.208) 2.547 32.471 ( 0.352 2.005 -0.474) 2.090 32.569 ( 0.280 -2.053 -1.442) 2.524 35.384 ( -0.166 1.126 1.000) 1.515 35.450 ( 0.084 -1.611 -0.306) 1.642 35.539 ( 0.029 1.457 -0.810) 1.667 35.577 ( -0.507 -0.190 -0.758) 0.931 88.741 ( -2.872 0.197 2.186) 3.614 88.799 ( -5.115 -2.362 4.444) 7.175 88.945 ( -0.080 1.771 -0.969) 2.020 89.062 ( 2.840 -3.177 -0.831) 4.342 97.621 ( -0.312 0.282 -0.282) 0.506 97.630 ( 0.602 0.140 -0.343) 0.707 97.657 ( -1.248 -0.121 0.257) 1.280 97.674 ( 0.370 -0.678 -0.065) 0.775 98.682 ( 0.202 0.487 0.647) 0.835 98.693 ( -0.130 0.168 0.782) 0.811 99.006 ( -0.329 5.436 -1.639) 5.687 99.181 ( -1.520 -0.539 -8.340) 8.494 99.664 ( 0.153 3.113 0.518) 3.159 99.754 ( -0.696 1.121 -0.514) 1.417 99.848 ( 6.783 -2.800 3.487) 8.124 99.925 ( -1.678 -3.324 0.189) 3.728 ======================= 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| 1.076 ( -2.367 17.852 8.700) 19.999 1.316 ( 6.496 14.721 12.439) 20.338 1.680 ( 7.258 -0.313 5.895) 9.355 1.776 ( -0.606 1.967 -0.858) 2.230 1.798 ( 6.011 8.196 -6.237) 11.925 1.936 ( 0.826 -3.598 -0.074) 3.693 2.002 ( 2.083 -2.677 4.055) 5.286 2.136 ( 2.666 -4.761 2.162) 5.870 2.290 ( 5.499 -2.030 3.904) 7.043 2.358 ( -3.414 4.570 0.367) 5.716 2.444 ( -1.856 -2.836 7.397) 8.137 2.527 ( -2.790 -0.003 1.847) 3.346 2.597 ( -0.997 0.258 6.895) 6.972 2.658 ( -2.948 1.573 -0.159) 3.345 2.852 ( 0.142 -4.277 1.263) 4.462 2.926 ( -0.506 -2.556 5.042) 5.676 2.944 ( -0.375 -0.801 -4.264) 4.355 3.033 ( -3.181 -1.238 -8.446) 9.110 3.130 ( -1.745 -0.014 -0.368) 1.783 3.199 ( -0.249 0.060 -1.904) 1.922 3.302 ( 1.951 6.249 -9.833) 11.813 3.349 ( -1.215 3.543 1.199) 3.933 3.395 ( -0.013 -0.019 -8.470) 8.470 3.514 ( 0.680 -0.074 -2.728) 2.813 4.359 ( 0.080 -1.192 0.933) 1.516 4.481 ( 1.252 -6.199 3.689) 7.322 4.510 ( -1.695 1.942 -5.051) 5.671 4.672 ( -1.647 -5.233 -2.155) 5.894 4.988 ( -5.846 6.127 1.226) 8.557 5.034 ( -0.877 4.875 -2.766) 5.673 5.092 ( -2.612 -0.610 3.594) 4.485 5.148 ( -7.575 -2.473 3.909) 8.875 5.219 ( -2.975 -3.088 -2.512) 4.970 5.377 ( -3.951 -5.410 0.701) 6.736 5.388 ( 1.192 1.750 0.577) 2.194 5.524 ( 0.065 -5.721 1.010) 5.810 5.593 ( 1.639 -0.355 3.078) 3.505 5.682 ( 4.432 -3.533 2.466) 6.181 5.761 ( 2.930 4.113 -2.746) 5.748 5.852 ( -3.021 -0.543 -4.337) 5.313 6.074 ( -1.801 1.767 2.504) 3.554 6.159 ( 0.158 0.118 -1.575) 1.588 6.197 ( -3.486 2.742 0.324) 4.447 6.225 ( -1.006 3.402 -2.355) 4.258 6.331 ( -3.142 0.081 -0.727) 3.226 6.506 ( -3.602 8.996 -5.107) 10.954 6.652 ( 2.911 -6.864 7.192) 10.359 6.812 ( -10.054 -0.350 -7.857) 12.764 7.056 ( -3.168 1.236 -1.639) 3.775 7.153 ( 1.433 -4.941 1.450) 5.345 7.177 ( -4.647 3.521 -1.200) 5.953 7.287 ( 2.847 -0.484 -1.121) 3.098 7.812 ( -9.254 5.623 0.973) 10.872 7.916 ( -1.941 2.341 6.350) 7.041 8.072 ( -4.767 -0.230 5.246) 7.092 8.199 ( -6.411 4.413 4.226) 8.857 8.355 ( -2.709 -7.715 2.598) 8.579 8.549 ( -1.776 -0.918 -2.686) 3.348 8.614 ( -4.031 0.131 -3.380) 5.262 8.775 ( 0.684 -2.964 1.956) 3.616 8.925 ( 9.889 3.052 7.893) 13.016 9.007 ( -0.038 -1.762 0.489) 1.829 9.122 ( 0.090 1.347 1.106) 1.745 9.197 ( 7.142 -3.870 -2.119) 8.395 9.366 ( 5.696 2.090 0.262) 6.073 9.473 ( 6.586 0.941 1.484) 6.816 9.642 ( 2.564 1.865 -6.102) 6.876 9.802 ( 0.970 -4.863 -3.329) 5.973 10.343 ( 2.068 3.301 -1.401) 4.139 10.424 ( 6.601 0.813 -1.990) 6.942 10.585 ( -2.397 0.078 1.748) 2.968 10.835 ( 5.193 -7.964 -0.534) 9.522 20.607 ( -1.155 1.702 -1.293) 2.430 20.639 ( -1.908 0.921 -2.757) 3.476 20.917 ( -1.221 1.625 0.453) 2.083 20.942 ( -1.079 0.573 0.135) 1.229 22.828 ( -1.151 0.733 -0.862) 1.614 22.847 ( 1.350 0.110 0.556) 1.464 23.092 ( -0.964 0.518 -0.465) 1.189 23.120 ( 1.054 -0.240 0.052) 1.082 24.656 ( -2.410 -1.411 0.753) 2.892 24.677 ( -1.339 -2.249 0.512) 2.668 24.933 ( 0.992 1.343 1.165) 2.036 24.957 ( 1.359 0.315 0.977) 1.703 25.843 ( -4.077 0.849 -0.371) 4.181 25.864 ( -2.400 0.007 -0.058) 2.400 26.109 ( -1.456 1.363 0.371) 2.028 26.175 ( -3.294 -0.778 -1.756) 3.813 28.312 ( -0.462 0.222 2.250) 2.307 28.343 ( -2.451 -0.850 1.895) 3.212 28.544 ( -1.446 0.560 0.857) 1.772 28.597 ( 0.143 -1.965 0.473) 2.026 28.644 ( -1.682 1.177 -0.309) 2.076 28.699 ( 1.259 -0.205 0.289) 1.308 28.742 ( 3.749 -1.986 -0.817) 4.320 28.800 ( 2.221 -2.222 -1.436) 3.454 32.330 ( 0.040 1.279 1.435) 1.923 32.396 ( 0.588 -1.533 1.677) 2.347 32.475 ( 0.509 1.485 -0.172) 1.579 32.555 ( 0.170 -1.633 -1.740) 2.393 35.395 ( 0.020 0.852 1.262) 1.523 35.442 ( -0.552 -1.126 -0.145) 1.262 35.528 ( -0.403 1.424 -0.551) 1.579 35.554 ( -0.814 0.181 -0.916) 1.239 88.729 ( -0.897 0.727 1.955) 2.270 88.777 ( -2.141 -1.320 2.819) 3.778 88.969 ( 3.981 2.719 -1.082) 4.941 89.142 ( 6.180 -4.651 0.774) 7.773 97.620 ( 0.786 0.318 -0.415) 0.944 97.641 ( 0.912 -0.513 -0.168) 1.060 97.657 ( 1.098 0.649 -0.055) 1.276 97.699 ( 2.279 -1.139 0.260) 2.561 98.690 ( -0.112 0.762 0.552) 0.947 98.705 ( 0.588 0.013 0.834) 1.020 98.967 ( -2.256 4.671 -1.146) 5.313 99.055 ( -3.942 2.241 -5.118) 6.838 99.681 ( 0.003 3.155 1.064) 3.330 99.729 ( -1.249 0.971 -0.693) 1.727 99.848 ( -2.489 -0.449 -1.601) 2.993 100.039 ( 8.104 -8.145 1.669) 11.610 ======================= 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| 1.219 ( 7.176 11.353 9.557) 16.484 1.556 ( 8.133 11.343 8.555) 16.371 1.732 ( 1.747 1.645 -5.778) 6.257 1.777 ( 6.328 -0.977 -5.106) 8.189 1.859 ( 5.503 7.099 -3.944) 9.810 2.004 ( 3.115 -2.840 1.872) 4.613 2.103 ( 4.311 -3.879 5.244) 7.819 2.186 ( 1.622 -2.707 -2.426) 3.981 2.307 ( -4.082 1.875 2.448) 5.116 2.406 ( -0.419 1.024 3.657) 3.821 2.495 ( -1.746 0.125 4.730) 5.043 2.519 ( 0.442 -0.644 5.704) 5.757 2.632 ( 1.113 -0.650 3.483) 3.714 2.661 ( -0.902 0.424 4.856) 4.957 2.853 ( -4.729 -5.094 -0.781) 6.995 2.869 ( 2.152 -1.209 -4.016) 4.714 2.901 ( -3.137 -1.332 -3.863) 5.152 2.934 ( -0.412 2.763 -1.396) 3.123 3.077 ( -4.970 0.428 2.153) 5.433 3.145 ( -3.253 0.015 -1.637) 3.641 3.264 ( -3.600 0.947 -1.191) 3.908 3.318 ( -3.450 1.382 1.250) 3.921 3.357 ( 8.235 4.996 -8.419) 12.793 3.515 ( 3.118 0.052 -3.492) 4.682 4.368 ( 0.634 -0.147 0.371) 0.749 4.448 ( -2.807 -0.297 -0.629) 2.891 4.539 ( 1.217 -5.409 2.517) 6.089 4.609 ( -3.485 -4.540 -1.106) 5.830 4.886 ( -6.689 2.941 1.735) 7.510 4.977 ( -3.985 1.630 -0.508) 4.336 5.028 ( -2.285 0.940 -2.057) 3.215 5.134 ( -0.239 -1.293 0.209) 1.331 5.178 ( -1.606 -2.676 2.421) 3.950 5.290 ( -4.483 -3.071 -1.047) 5.534 5.377 ( -3.426 -0.193 -0.307) 3.445 5.492 ( -4.085 -6.691 -1.181) 7.928 5.621 ( -2.141 1.004 1.137) 2.624 5.722 ( -6.427 -0.696 -3.558) 7.379 5.759 ( 2.074 2.286 -0.934) 3.224 5.818 ( 5.507 -1.182 1.695) 5.882 6.020 ( -12.727 1.750 -0.610) 12.861 6.085 ( -8.604 -0.308 1.256) 8.700 6.126 ( 0.605 4.227 5.251) 6.768 6.223 ( -1.446 -1.179 -3.149) 3.660 6.250 ( -0.546 0.996 -3.258) 3.450 6.444 ( -1.515 9.625 0.487) 9.756 6.558 ( -4.933 -3.667 -4.307) 7.505 6.763 ( -3.486 -6.816 2.541) 8.067 6.911 ( -4.367 6.514 -3.512) 8.593 7.134 ( -3.616 2.285 0.976) 4.387 7.186 ( 2.216 -4.228 -0.033) 4.774 7.364 ( 3.030 -2.523 1.686) 4.288 7.646 ( -4.432 9.238 -1.973) 10.434 7.939 ( -6.730 0.529 6.467) 9.348 8.031 ( -6.426 -1.044 4.365) 7.838 8.132 ( -3.515 0.407 0.387) 3.560 8.316 ( -6.651 -2.306 3.123) 7.701 8.476 ( 0.491 1.844 -4.662) 5.037 8.567 ( 1.126 -1.255 -2.224) 2.790 8.760 ( -3.901 -7.082 2.983) 8.618 9.006 ( 0.817 2.169 -1.356) 2.686 9.101 ( 1.591 6.298 1.779) 6.735 9.200 ( 7.804 0.420 6.166) 9.955 9.345 ( 7.180 0.255 -0.216) 7.187 9.507 ( 9.366 1.066 2.011) 9.639 9.583 ( 7.113 5.065 -8.506) 12.190 9.631 ( 2.637 -1.758 2.395) 3.972 9.809 ( 5.039 -5.280 -4.484) 8.566 10.367 ( 1.303 1.719 0.962) 2.361 10.506 ( 3.997 -3.401 -0.956) 5.335 10.571 ( -0.138 3.073 0.402) 3.102 10.928 ( 6.476 -10.044 -0.823) 11.979 20.572 ( -1.640 1.566 -0.654) 2.360 20.586 ( -1.901 1.132 -1.136) 2.487 20.895 ( -1.853 1.564 0.443) 2.465 20.922 ( -1.350 0.399 0.028) 1.408 22.790 ( -1.587 1.779 -1.324) 2.727 22.870 ( 0.840 -1.405 0.064) 1.639 23.072 ( -0.625 1.413 -0.208) 1.559 23.150 ( 1.521 -1.415 0.845) 2.243 24.616 ( -3.056 -1.089 0.529) 3.287 24.653 ( -2.038 -2.988 0.422) 3.642 24.966 ( 1.544 1.845 0.800) 2.536 24.990 ( 1.648 0.834 0.361) 1.882 25.756 ( -5.427 1.640 -0.403) 5.684 25.806 ( -4.136 -0.382 -0.072) 4.155 26.081 ( -2.445 0.589 0.412) 2.548 26.112 ( -3.156 -0.271 -0.119) 3.170 28.321 ( -1.174 0.069 1.424) 1.847 28.332 ( -0.657 -0.267 1.799) 1.934 28.525 ( -1.445 0.903 0.303) 1.731 28.585 ( -1.062 -1.736 -0.738) 2.164 28.623 ( -0.885 1.417 0.348) 1.707 28.721 ( 1.008 -0.533 0.119) 1.147 28.765 ( 1.129 -1.634 -2.030) 2.840 28.838 ( 2.945 -2.877 -0.610) 4.162 32.348 ( 0.420 1.216 1.115) 1.702 32.417 ( 0.071 -1.618 1.067) 1.940 32.484 ( 0.851 1.359 -0.292) 1.630 32.542 ( 0.405 -0.901 -1.570) 1.855 35.410 ( 0.101 0.491 1.253) 1.349 35.433 ( -0.360 -0.506 -0.029) 0.622 35.513 ( -0.919 1.181 -0.222) 1.513 35.536 ( -0.385 0.079 -0.646) 0.756 88.752 ( 1.118 0.116 1.653) 1.999 88.783 ( -0.417 -1.200 2.068) 2.428 89.040 ( 5.457 3.381 -0.886) 6.481 89.262 ( 6.052 -6.251 1.675) 8.860 97.637 ( 1.578 0.164 -0.317) 1.618 97.656 ( 1.215 -0.671 -0.246) 1.410 97.683 ( 1.816 0.812 -0.003) 1.990 97.750 ( 3.116 -2.062 0.712) 3.804 98.693 ( 0.206 0.987 0.077) 1.011 98.725 ( 0.702 -0.230 0.627) 0.969 98.915 ( -3.239 3.798 0.113) 4.993 98.952 ( -3.858 2.497 -2.140) 5.069 99.669 ( -1.493 1.104 -0.889) 2.059 99.690 ( -2.540 -0.069 -0.473) 2.585 99.821 ( 1.100 5.046 -0.960) 5.253 100.160 ( 5.483 -9.197 -0.099) 10.708 ======================= 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| 1.466 ( 9.564 5.968 7.659) 13.629 1.700 ( 6.423 7.054 -6.980) 11.821 1.728 ( 2.037 -0.353 -1.069) 2.327 1.844 ( 7.996 5.084 -3.290) 10.030 1.908 ( 5.050 4.854 -2.934) 7.594 2.075 ( 3.853 -0.425 1.047) 4.015 2.124 ( 0.976 -0.213 -7.677) 7.741 2.226 ( 3.077 -2.481 0.864) 4.046 2.254 ( -4.214 0.485 1.346) 4.450 2.386 ( -2.692 -1.942 1.263) 3.551 2.496 ( -1.773 0.294 1.790) 2.537 2.532 ( -5.105 -0.091 1.511) 5.325 2.656 ( -2.237 0.531 -0.372) 2.329 2.725 ( 1.130 3.666 -0.520) 3.872 2.752 ( -1.577 -5.931 -4.372) 7.535 2.843 ( -1.782 -1.102 -1.748) 2.729 2.894 ( 1.534 0.255 5.956) 6.156 2.992 ( 3.463 0.187 5.163) 6.219 3.048 ( -3.364 -0.133 4.626) 5.722 3.073 ( -1.043 -0.268 -0.491) 1.184 3.179 ( -5.489 1.553 1.751) 5.967 3.253 ( -4.464 -0.767 -0.357) 4.544 3.440 ( 4.801 5.014 0.208) 6.945 3.537 ( 3.967 0.336 -2.668) 4.792 4.390 ( -1.038 -2.506 -0.651) 2.789 4.396 ( -0.678 -1.188 1.582) 2.091 4.539 ( -4.600 -3.063 0.916) 5.602 4.569 ( -0.576 -4.455 2.102) 4.959 4.815 ( -4.393 2.391 2.629) 5.650 4.931 ( 1.464 -1.236 -3.938) 4.379 4.991 ( 0.368 2.901 -1.911) 3.493 5.118 ( -1.293 -0.030 -1.388) 1.898 5.199 ( -0.284 -3.271 3.340) 4.683 5.238 ( -1.674 -4.739 -0.293) 5.034 5.282 ( -6.036 -1.114 0.068) 6.138 5.396 ( -3.918 -6.900 -1.944) 8.170 5.528 ( -5.410 1.027 -2.861) 6.206 5.592 ( -6.534 0.104 0.167) 6.537 5.756 ( -6.794 0.005 -0.369) 6.804 5.829 ( -5.703 2.843 3.469) 7.255 5.854 ( -8.668 -2.540 0.031) 9.032 5.962 ( 2.344 -1.453 0.366) 2.782 6.178 ( -3.813 5.070 2.820) 6.943 6.198 ( -0.153 0.317 -3.475) 3.493 6.254 ( 5.089 -2.600 5.487) 7.923 6.442 ( -1.270 0.557 -0.957) 1.685 6.494 ( 0.566 4.819 -0.510) 4.879 6.671 ( -5.070 -3.403 0.088) 6.107 6.890 ( -0.392 4.860 1.387) 5.070 7.024 ( -7.518 4.006 -2.017) 8.754 7.225 ( 2.061 -2.675 -0.387) 3.399 7.398 ( 1.322 0.455 -1.290) 1.902 7.651 ( 4.001 6.275 -0.358) 7.451 7.837 ( -6.349 0.798 -1.910) 6.678 7.967 ( -6.095 -1.181 3.313) 7.037 8.088 ( -2.013 -1.957 -1.106) 3.018 8.218 ( -6.859 3.407 1.686) 7.842 8.490 ( 3.002 2.057 0.762) 3.718 8.581 ( 1.267 -0.957 0.060) 1.589 8.717 ( -4.340 -7.557 1.752) 8.889 9.004 ( 1.430 6.938 -2.325) 7.455 9.139 ( 2.959 2.596 -0.086) 3.938 9.368 ( 3.550 0.155 -0.928) 3.673 9.408 ( 2.554 8.393 3.054) 9.290 9.565 ( 2.754 -3.801 -2.286) 5.221 9.670 ( 5.516 -2.525 1.147) 6.174 9.741 ( 5.965 2.075 0.244) 6.320 9.869 ( 7.352 -4.012 -4.346) 9.436 10.406 ( 1.496 0.310 1.764) 2.334 10.514 ( -2.543 -2.810 1.975) 4.274 10.603 ( 3.206 3.375 -0.966) 4.754 11.015 ( 5.211 -11.606 -1.899) 12.863 20.544 ( -1.155 1.246 -0.069) 1.701 20.552 ( -1.313 0.927 -0.354) 1.646 20.869 ( -1.673 1.465 0.352) 2.251 20.900 ( -1.134 0.178 -0.133) 1.156 22.758 ( -0.942 2.284 -0.343) 2.494 22.878 ( 0.438 -2.626 -0.246) 2.674 23.066 ( -0.216 2.132 -0.047) 2.144 23.177 ( 0.876 -2.304 0.129) 2.468 24.574 ( -2.526 -0.858 0.624) 2.739 24.623 ( -1.755 -3.410 0.226) 3.842 24.997 ( 1.398 2.264 0.159) 2.666 25.015 ( 1.167 1.298 -0.236) 1.761 25.670 ( -4.134 2.282 -0.169) 4.725 25.737 ( -3.781 -0.497 -0.084) 3.815 26.042 ( -2.173 0.242 0.039) 2.187 26.065 ( -2.813 -0.502 0.562) 2.913 28.318 ( -0.716 0.417 1.210) 1.466 28.346 ( -0.181 -0.668 1.687) 1.824 28.508 ( -0.722 1.008 0.015) 1.240 28.557 ( -0.752 -1.337 -1.258) 1.984 28.615 ( -0.884 1.233 0.672) 1.660 28.734 ( 0.538 -2.492 -0.472) 2.593 28.753 ( 0.374 1.391 -1.593) 2.147 28.870 ( 1.713 -3.101 -0.897) 3.655 32.365 ( 0.576 0.765 0.644) 1.154 32.418 ( -0.871 -1.526 0.545) 1.839 32.500 ( 1.516 1.330 -0.438) 2.064 32.535 ( 0.384 -0.076 -1.103) 1.170 35.420 ( -0.183 0.317 0.612) 0.713 35.435 ( 0.348 -0.263 0.480) 0.649 35.495 ( -1.037 1.075 -0.163) 1.503 35.526 ( -0.218 -0.182 -0.395) 0.487 88.793 ( 1.207 -0.772 2.063) 2.512 88.803 ( 0.125 -1.117 1.902) 2.210 89.117 ( 4.622 3.624 -0.992) 5.957 89.356 ( 3.212 -6.865 0.795) 7.620 97.662 ( 1.598 -0.064 -0.157) 1.607 97.674 ( 1.049 -0.552 0.105) 1.190 97.712 ( 1.505 0.955 0.055) 1.783 97.806 ( 2.358 -3.101 0.674) 3.954 98.702 ( 0.866 1.083 -0.034) 1.387 98.741 ( 0.885 -0.309 0.114) 0.944 98.864 ( -3.315 3.070 0.709) 4.573 98.879 ( -3.379 2.243 -0.282) 4.065 99.622 ( -1.960 0.867 -0.817) 2.293 99.665 ( -0.483 -0.766 0.113) 0.912 99.840 ( 1.452 7.395 -0.252) 7.540 100.222 ( 3.196 -8.964 -1.732) 9.673 ======================= 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| 1.608 ( -0.353 3.722 1.120) 3.903 1.664 ( 0.460 1.446 -9.751) 9.869 1.778 ( 7.662 4.728 -4.184) 9.928 1.916 ( 3.649 3.934 -2.146) 5.779 1.958 ( 3.320 4.362 -2.672) 6.099 2.075 ( 3.622 1.998 -5.934) 7.234 2.118 ( 1.239 -0.685 -5.355) 5.539 2.217 ( 1.298 -0.765 3.072) 3.421 2.279 ( 0.065 1.557 0.794) 1.749 2.337 ( -2.311 -0.187 -2.318) 3.279 2.419 ( -5.412 -3.912 -2.995) 7.318 2.501 ( -1.972 -0.018 2.810) 3.433 2.581 ( -3.260 -0.147 -2.228) 3.951 2.661 ( -1.080 1.081 -5.167) 5.388 2.726 ( 1.357 -2.863 -2.298) 3.914 2.778 ( -3.111 1.367 -3.854) 5.138 2.962 ( -2.178 1.736 3.706) 4.636 3.012 ( -0.741 -1.364 0.217) 1.567 3.085 ( -0.687 -0.279 6.713) 6.754 3.118 ( -2.059 -0.652 3.693) 4.278 3.196 ( -2.094 0.209 5.733) 6.107 3.208 ( 1.698 -0.376 7.871) 8.061 3.500 ( 2.024 5.594 2.109) 6.312 3.603 ( 4.837 -0.414 0.511) 4.882 4.348 ( -2.268 -2.956 0.912) 3.836 4.438 ( 2.354 -3.522 0.631) 4.283 4.481 ( -4.471 -1.624 2.604) 5.422 4.572 ( -1.347 -3.745 1.941) 4.428 4.780 ( -3.133 2.177 0.575) 3.858 4.928 ( 4.109 -3.668 -6.349) 8.405 4.994 ( 1.677 3.123 -0.708) 3.614 5.064 ( -1.609 2.066 0.181) 2.626 5.192 ( -1.294 -4.462 -1.150) 4.786 5.232 ( -1.589 -2.388 4.044) 4.958 5.258 ( 1.905 -3.737 1.641) 4.504 5.356 ( -0.535 -6.561 0.230) 6.586 5.454 ( -1.940 -1.192 -0.088) 2.278 5.510 ( -3.613 -0.850 1.459) 3.988 5.643 ( -3.108 -0.055 -0.526) 3.152 5.710 ( -4.349 -2.510 -0.415) 5.039 5.839 ( -2.239 5.059 5.131) 7.546 6.046 ( 4.542 1.102 -0.145) 4.676 6.081 ( -5.240 0.506 0.739) 5.316 6.232 ( 0.071 -0.756 1.019) 1.271 6.293 ( -1.891 -0.161 -1.034) 2.162 6.489 ( 5.965 -3.597 6.464) 9.503 6.519 ( -0.341 5.439 1.608) 5.682 6.615 ( -3.037 -2.242 0.873) 3.874 6.889 ( -2.523 10.264 -0.280) 10.573 6.907 ( -0.973 -0.092 -1.484) 1.777 7.231 ( 0.303 -3.337 -2.386) 4.113 7.376 ( 0.246 -0.809 -5.267) 5.334 7.696 ( 2.616 5.205 -3.749) 6.928 7.734 ( -2.711 5.282 -2.740) 6.539 7.908 ( -4.086 -0.317 1.456) 4.349 8.036 ( -0.218 -1.892 -3.139) 3.672 8.159 ( -3.380 6.255 3.137) 7.771 8.566 ( 2.126 2.051 4.158) 5.100 8.580 ( -0.923 -3.645 -0.868) 3.859 8.686 ( -0.995 -2.986 2.078) 3.772 9.004 ( 1.397 7.725 -2.413) 8.213 9.191 ( 3.314 0.129 -0.798) 3.411 9.326 ( -1.418 4.667 -4.461) 6.610 9.453 ( -1.818 3.928 0.796) 4.400 9.638 ( 2.409 -5.848 5.054) 8.096 9.733 ( 2.271 -4.218 -0.663) 4.836 9.815 ( 3.624 2.144 -1.027) 4.334 9.926 ( 4.004 -3.051 -3.605) 6.191 10.439 ( 0.151 -0.185 0.301) 0.384 10.497 ( -2.320 0.609 4.137) 4.782 10.637 ( 1.439 1.831 0.087) 2.331 11.048 ( 2.183 -11.724 -3.622) 12.464 20.532 ( -0.505 1.088 0.230) 1.222 20.536 ( -0.114 0.683 -0.026) 0.693 20.851 ( -0.793 1.356 0.323) 1.604 20.885 ( -0.424 0.029 -0.296) 0.518 22.756 ( 0.204 2.454 1.240) 2.757 22.886 ( 0.450 -2.730 0.237) 2.777 23.059 ( -0.208 1.944 -0.589) 2.042 23.176 ( -0.224 -2.716 -1.371) 3.050 24.550 ( -1.215 -0.796 0.833) 1.674 24.604 ( -0.752 -3.530 0.112) 3.611 25.010 ( 0.338 2.577 -0.623) 2.673 25.024 ( 0.420 1.471 -0.580) 1.636 25.625 ( -1.238 2.478 0.411) 2.800 25.688 ( -1.645 -0.181 -0.263) 1.676 26.017 ( -0.845 0.033 0.038) 0.846 26.034 ( -1.359 -0.485 0.290) 1.472 28.321 ( -0.708 0.538 1.300) 1.575 28.356 ( -0.867 -0.943 1.730) 2.153 28.505 ( 0.365 1.089 0.020) 1.149 28.539 ( 0.360 -0.679 -1.423) 1.617 28.607 ( -0.917 0.904 0.565) 1.406 28.719 ( -0.099 -2.779 -2.134) 3.505 28.762 ( 1.033 1.864 0.294) 2.151 28.877 ( 0.700 -2.996 -1.323) 3.349 32.379 ( 0.358 0.187 0.262) 0.482 32.404 ( -1.122 -0.996 0.197) 1.513 32.519 ( 0.828 0.953 -0.336) 1.306 32.531 ( 0.652 0.561 -0.811) 1.182 35.421 ( -0.252 0.392 0.488) 0.675 35.444 ( -0.201 -0.513 0.450) 0.712 35.480 ( -0.261 1.298 -0.057) 1.325 35.520 ( 0.117 -0.379 -0.446) 0.596 88.819 ( -0.523 -0.882 2.075) 2.315 88.835 ( 0.268 -1.801 2.893) 3.419 89.164 ( 2.191 3.414 -1.071) 4.196 89.377 ( -0.139 -5.956 -1.491) 6.141 97.678 ( 0.528 0.042 -0.086) 0.537 97.697 ( 0.861 -0.586 0.845) 1.341 97.731 ( 0.602 0.752 0.188) 0.981 97.832 ( 0.280 -3.447 -0.143) 3.461 98.719 ( 0.903 1.189 0.168) 1.503 98.757 ( 0.719 -0.018 -0.114) 0.728 98.826 ( -1.507 2.451 0.520) 2.924 98.834 ( -2.116 2.020 0.481) 2.965 99.604 ( 0.024 1.282 0.652) 1.439 99.671 ( 0.149 -1.044 1.398) 1.751 99.857 ( 0.698 7.205 0.084) 7.239 100.231 ( 1.279 -8.622 -3.532) 9.405 ======================= 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| 1.478 ( -10.929 4.300 -3.508) 12.258 1.559 ( -4.485 1.998 -6.279) 7.971 1.784 ( 0.792 6.241 -11.624) 13.218 1.910 ( 6.222 2.898 -5.162) 8.589 1.993 ( 0.844 3.207 -0.812) 3.414 2.049 ( -1.274 -3.229 -6.871) 7.698 2.133 ( 1.956 0.602 1.458) 2.513 2.187 ( -4.515 -0.847 -1.438) 4.814 2.244 ( 1.411 2.439 -6.586) 7.164 2.340 ( 2.853 -0.987 4.308) 5.260 2.360 ( -2.602 -4.022 0.427) 4.810 2.480 ( -2.329 -0.924 1.069) 2.724 2.543 ( 0.818 2.326 -0.427) 2.502 2.614 ( -0.317 2.826 -2.801) 3.992 2.664 ( -3.896 2.129 -2.847) 5.274 2.764 ( 4.814 -1.291 -2.128) 5.419 2.936 ( -3.902 -0.222 -2.104) 4.439 2.999 ( -0.817 -0.881 2.883) 3.124 3.081 ( -2.454 -0.203 4.151) 4.827 3.157 ( 1.057 -1.761 3.900) 4.408 3.278 ( -1.339 1.224 6.666) 6.909 3.303 ( 0.994 0.398 7.342) 7.419 3.572 ( 2.773 5.138 3.273) 6.693 3.685 ( 2.820 -0.604 2.069) 3.549 4.340 ( -0.185 -1.599 1.007) 1.899 4.438 ( -3.391 -2.244 2.245) 4.645 4.488 ( 2.581 -3.531 0.701) 4.430 4.574 ( -1.100 -4.002 2.437) 4.813 4.724 ( -1.586 0.293 -1.390) 2.129 4.911 ( 1.605 -6.709 -5.568) 8.865 5.047 ( 2.893 2.532 0.065) 3.845 5.102 ( 6.317 3.092 -0.057) 7.034 5.182 ( -3.123 1.580 3.347) 4.843 5.266 ( 4.451 -4.828 1.792) 6.807 5.318 ( 1.136 -2.836 2.633) 4.033 5.371 ( 1.837 -6.245 0.340) 6.519 5.468 ( 3.914 -1.523 0.158) 4.203 5.497 ( 0.123 -2.055 0.763) 2.195 5.621 ( 1.853 2.934 -0.709) 3.542 5.710 ( 2.225 0.045 -0.759) 2.351 5.854 ( -1.925 3.329 4.000) 5.549 6.018 ( -4.515 -2.763 2.281) 5.764 6.112 ( 3.796 -0.107 -1.907) 4.250 6.204 ( 3.034 -3.113 1.685) 4.662 6.348 ( 1.644 5.750 5.563) 8.168 6.497 ( -3.991 3.723 1.039) 5.556 6.582 ( -1.407 -1.817 0.323) 2.320 6.668 ( 5.311 -5.140 6.793) 10.038 6.846 ( 0.535 6.381 -1.388) 6.553 6.923 ( 3.326 1.395 -2.728) 4.523 7.190 ( -0.869 -4.816 -3.599) 6.074 7.317 ( 1.048 -3.699 -6.372) 7.443 7.650 ( -2.011 6.293 -3.871) 7.657 7.674 ( -1.450 8.477 -3.933) 9.457 7.869 ( -0.879 1.404 0.878) 1.875 8.054 ( 5.077 3.082 -2.366) 6.393 8.158 ( -1.072 3.699 3.555) 5.241 8.558 ( 0.704 -3.238 -1.712) 3.730 8.631 ( 0.208 -0.240 3.446) 3.461 8.710 ( -0.003 -0.829 2.967) 3.081 8.994 ( 0.505 7.433 -2.704) 7.926 9.217 ( 1.232 -1.254 -1.762) 2.489 9.258 ( -3.316 3.465 -0.089) 4.797 9.392 ( -4.656 0.917 -1.235) 4.904 9.670 ( -2.708 -3.416 0.461) 4.384 9.745 ( -1.277 -2.787 0.095) 3.068 9.844 ( 0.119 0.904 1.100) 1.429 9.938 ( 2.473 -3.009 -3.124) 4.993 10.407 ( -4.187 2.593 1.458) 5.136 10.530 ( 1.205 0.376 2.273) 2.600 10.653 ( -0.893 0.112 1.827) 2.037 11.014 ( -0.609 -10.757 -4.932) 11.850 20.534 ( 0.541 1.274 0.212) 1.400 20.547 ( 1.187 0.487 0.242) 1.306 20.851 ( 0.322 1.280 0.354) 1.367 20.881 ( 0.491 0.027 -0.396) 0.632 22.788 ( 1.040 2.287 2.426) 3.492 22.889 ( -0.361 -1.314 -0.386) 1.416 23.055 ( 0.465 0.569 0.011) 0.735 23.145 ( -0.770 -2.492 -2.553) 3.650 24.552 ( 0.302 -0.825 0.994) 1.327 24.602 ( 0.451 -3.335 -0.005) 3.365 24.996 ( -0.944 2.477 -0.753) 2.755 25.015 ( -0.516 1.484 -0.920) 1.821 25.637 ( 1.682 2.125 0.818) 2.831 25.682 ( 1.572 0.362 -0.554) 1.705 26.019 ( 0.948 0.029 0.324) 1.002 26.030 ( 0.803 -0.149 -0.022) 0.817 28.320 ( -1.062 0.422 1.310) 1.738 28.350 ( -1.965 -0.832 1.513) 2.616 28.519 ( 1.041 1.341 0.387) 1.742 28.540 ( 1.473 0.149 -1.166) 1.884 28.600 ( -0.333 0.349 0.265) 0.550 28.696 ( 0.219 -2.498 -2.182) 3.324 28.785 ( 1.024 0.663 0.604) 1.361 28.866 ( -0.024 -2.796 -1.864) 3.360 32.375 ( -1.167 0.036 0.147) 1.177 32.393 ( -0.262 -0.743 -0.040) 0.789 32.513 ( -0.478 1.417 -0.545) 1.592 32.544 ( 1.226 0.028 -0.406) 1.292 35.419 ( -0.835 0.396 0.494) 1.048 35.435 ( -0.872 -0.224 0.076) 0.903 35.490 ( 1.028 1.057 0.334) 1.512 35.522 ( 0.674 -0.339 -0.485) 0.897 88.825 ( -1.627 -0.722 2.251) 2.870 88.863 ( -1.251 -2.843 3.793) 4.902 89.167 ( -0.836 2.769 -0.336) 2.912 89.327 ( -2.397 -4.244 -3.567) 6.040 97.680 ( -0.450 0.366 0.317) 0.661 97.707 ( -0.457 0.156 0.065) 0.488 97.742 ( -0.227 -0.911 1.463) 1.738 97.813 ( -1.635 -2.883 -0.967) 3.453 98.724 ( -0.837 1.198 0.436) 1.526 98.746 ( -1.371 0.483 -0.419) 1.513 98.829 ( 1.282 2.476 0.522) 2.837 98.849 ( 3.169 1.765 0.738) 3.702 99.630 ( 1.356 1.640 1.598) 2.662 99.688 ( -0.062 0.543 0.874) 1.030 99.873 ( 0.171 4.102 2.044) 4.586 100.190 ( -0.417 -8.362 -5.510) 10.023 ======================= 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| 1.239 ( -12.442 8.971 -3.786) 15.799 1.344 ( -12.073 7.381 -4.928) 14.984 1.722 ( 1.812 -0.839 -6.324) 6.632 1.835 ( -2.952 -5.102 -7.345) 9.417 1.935 ( -3.320 -0.099 -1.399) 3.604 2.064 ( 0.781 3.519 1.976) 4.110 2.121 ( 0.880 3.938 -2.546) 4.771 2.141 ( -0.550 -4.297 -2.690) 5.099 2.247 ( 4.546 2.451 -1.914) 5.508 2.310 ( -6.630 -0.712 4.783) 8.206 2.437 ( 0.786 1.024 1.589) 2.047 2.445 ( -2.233 1.635 -0.090) 2.769 2.515 ( -4.470 5.667 -1.069) 7.296 2.583 ( 1.144 2.432 1.684) 3.172 2.646 ( 4.812 -1.228 -3.677) 6.180 2.841 ( 6.107 -1.150 -1.365) 6.363 2.848 ( -2.513 -1.022 -1.392) 3.049 3.023 ( 1.034 -3.128 0.334) 3.312 3.111 ( 0.505 1.766 3.750) 4.176 3.228 ( 2.932 -0.937 3.371) 4.565 3.305 ( -0.626 1.105 2.369) 2.688 3.364 ( -1.490 -0.851 4.895) 5.187 3.637 ( 1.064 4.041 2.008) 4.636 3.727 ( -0.814 -0.457 2.219) 2.407 4.337 ( -1.238 -0.441 -0.035) 1.315 4.429 ( -0.645 -2.055 2.387) 3.215 4.531 ( 2.270 -3.964 -1.013) 4.679 4.611 ( 3.083 -3.689 2.442) 5.392 4.722 ( 2.422 -1.049 -0.561) 2.699 4.897 ( 3.111 -6.557 -2.471) 7.667 5.063 ( -1.043 3.878 -0.029) 4.016 5.144 ( -1.345 2.816 2.047) 3.732 5.235 ( 4.543 -1.650 2.130) 5.282 5.334 ( -0.012 -5.555 -0.419) 5.571 5.387 ( 3.613 -1.419 1.071) 4.027 5.430 ( 6.254 -3.493 0.445) 7.177 5.510 ( 2.536 0.916 -3.520) 4.434 5.549 ( 5.190 -1.835 -1.264) 5.648 5.692 ( 4.991 1.867 0.646) 5.368 5.753 ( 5.454 0.603 -1.717) 5.749 5.852 ( 1.076 1.745 1.746) 2.693 5.965 ( -4.888 -4.140 1.772) 6.646 6.181 ( 5.849 6.989 1.374) 9.217 6.361 ( 1.885 3.079 1.084) 3.770 6.425 ( 1.104 -0.610 6.804) 6.920 6.441 ( -0.507 5.724 3.088) 6.524 6.597 ( 4.768 -4.809 0.349) 6.781 6.735 ( -1.303 -6.360 0.954) 6.561 6.919 ( 5.436 0.795 0.238) 5.499 6.960 ( 6.596 3.682 -1.255) 7.657 7.151 ( 0.360 -6.840 -1.487) 7.009 7.290 ( 2.835 -5.895 -5.167) 8.336 7.570 ( -0.970 7.867 -6.212) 10.070 7.608 ( -1.510 7.348 -2.527) 7.916 7.914 ( 3.677 3.069 2.034) 5.203 8.121 ( 3.632 8.609 1.415) 9.451 8.199 ( 1.763 -0.151 2.855) 3.359 8.559 ( 0.939 -3.696 -1.753) 4.197 8.655 ( -0.382 0.219 2.258) 2.300 8.737 ( 1.490 -1.041 -0.061) 1.819 8.958 ( -2.778 6.931 -0.608) 7.492 9.190 ( -2.360 1.202 -1.072) 2.857 9.222 ( -1.764 -2.106 0.307) 2.764 9.287 ( -6.583 -0.927 -0.038) 6.648 9.591 ( -5.495 -1.509 -1.466) 5.884 9.660 ( -6.563 0.226 -2.588) 7.058 9.852 ( -1.444 -0.599 1.918) 2.475 9.937 ( -0.339 -3.046 -1.333) 3.342 10.354 ( -3.712 4.449 1.551) 5.998 10.566 ( 1.018 2.023 0.116) 2.268 10.644 ( -3.599 -3.651 3.734) 6.342 10.934 ( -2.240 -9.183 -5.037) 10.711 20.558 ( 2.187 1.600 0.191) 2.716 20.578 ( 2.281 0.504 0.175) 2.343 20.868 ( 1.182 1.288 0.404) 1.794 20.892 ( 1.175 0.185 -0.370) 1.245 22.829 ( 0.519 1.416 1.859) 2.394 22.864 ( -0.954 0.435 -1.353) 1.712 23.072 ( 0.611 -0.621 0.444) 0.978 23.114 ( 0.382 -1.572 -1.476) 2.190 24.578 ( 1.381 -0.843 1.026) 1.916 24.617 ( 1.386 -2.841 -0.113) 3.163 24.967 ( -1.700 2.140 -0.382) 2.759 24.989 ( -1.416 1.281 -0.842) 2.087 25.689 ( 3.724 1.708 0.259) 4.106 25.728 ( 4.193 0.423 -0.322) 4.226 26.049 ( 2.061 0.370 0.208) 2.104 26.065 ( 3.290 0.326 0.552) 3.351 28.314 ( -1.226 0.111 1.165) 1.695 28.327 ( -2.333 -0.393 1.205) 2.655 28.543 ( 0.661 1.509 1.113) 1.989 28.560 ( 1.980 0.832 -0.706) 2.261 28.604 ( 0.862 -0.425 -0.193) 0.980 28.679 ( 0.123 -2.940 -1.899) 3.503 28.803 ( 0.531 -0.328 0.149) 0.642 28.837 ( -0.869 -2.302 -2.188) 3.292 32.353 ( -1.660 0.406 0.333) 1.741 32.385 ( -0.723 -0.876 -0.271) 1.167 32.498 ( -0.571 1.904 -0.542) 2.060 32.559 ( 0.995 -0.719 -0.382) 1.285 35.403 ( -1.270 0.632 0.152) 1.427 35.428 ( -0.237 -0.321 0.311) 0.506 35.515 ( 1.359 0.885 0.576) 1.721 35.531 ( 1.022 -0.006 -0.433) 1.109 88.814 ( -2.565 -0.578 2.280) 3.480 88.872 ( -2.738 -3.829 4.198) 6.308 89.134 ( -3.699 1.415 1.401) 4.201 89.235 ( -3.346 -2.720 -4.131) 5.972 97.670 ( -1.231 0.460 0.436) 1.385 97.688 ( -1.432 0.468 -0.411) 1.561 97.744 ( -1.911 -2.082 1.328) 3.123 97.771 ( -1.970 -2.120 -0.311) 2.911 98.708 ( -1.370 0.840 0.344) 1.643 98.717 ( -1.322 0.313 -0.594) 1.483 98.882 ( 3.724 3.525 0.802) 5.190 98.934 ( 5.855 2.157 1.123) 6.340 99.665 ( 0.269 2.762 0.209) 2.783 99.689 ( 0.823 1.860 0.200) 2.043 99.908 ( -0.315 -0.271 4.456) 4.475 100.100 ( -2.160 -7.686 -7.485) 10.944 ======================= 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| 1.022 ( -8.485 14.725 -1.620) 17.072 1.126 ( -11.835 12.826 3.275) 17.757 1.618 ( -5.533 -7.131 -3.093) 9.541 1.832 ( 3.264 -7.326 1.303) 8.126 1.890 ( -0.964 1.281 -0.061) 1.604 1.985 ( -9.678 8.449 1.081) 12.893 2.093 ( 1.537 -2.549 -3.073) 4.278 2.140 ( -4.444 3.811 -2.777) 6.479 2.229 ( -4.746 6.130 0.371) 7.761 2.326 ( 4.410 4.369 1.861) 6.481 2.332 ( -4.035 1.683 0.804) 4.445 2.438 ( 0.397 0.111 -0.736) 0.843 2.547 ( 1.321 0.559 5.509) 5.693 2.639 ( 2.106 0.482 0.922) 2.349 2.698 ( 4.986 -3.278 -2.338) 6.409 2.822 ( 0.382 -1.082 -0.712) 1.350 2.915 ( 3.464 -4.012 -1.237) 5.443 3.044 ( 2.385 -4.370 -1.182) 5.116 3.168 ( 2.411 4.165 2.528) 5.436 3.293 ( 0.269 1.940 -0.131) 1.962 3.320 ( 0.436 -0.921 1.297) 1.650 3.383 ( 2.556 -0.400 -0.082) 2.589 3.638 ( -2.080 2.775 -0.186) 3.473 3.702 ( -4.078 -0.601 0.979) 4.237 4.314 ( -0.502 -1.235 -0.808) 1.559 4.443 ( -0.794 -4.778 1.755) 5.152 4.564 ( 4.420 -1.237 -1.912) 4.972 4.689 ( 2.953 -4.919 0.237) 5.742 4.781 ( 4.522 1.364 0.420) 4.742 4.980 ( 5.713 -4.415 2.248) 7.562 5.046 ( 1.386 3.542 0.288) 3.814 5.191 ( 2.980 0.727 3.219) 4.446 5.265 ( -3.306 -4.390 -3.734) 6.645 5.309 ( 1.336 -3.449 3.769) 5.281 5.454 ( 3.783 1.192 -4.000) 5.633 5.497 ( 1.667 0.483 -2.339) 2.913 5.515 ( 3.932 -1.144 -4.554) 6.124 5.588 ( -1.005 -3.955 2.340) 4.704 5.750 ( 2.703 1.245 1.884) 3.522 5.846 ( 3.619 -2.204 -0.138) 4.240 5.896 ( -0.578 0.989 0.216) 1.166 5.990 ( 8.741 -1.563 1.241) 8.965 6.278 ( -1.539 6.714 -2.187) 7.227 6.294 ( -0.014 7.304 1.131) 7.391 6.429 ( -2.246 1.990 3.148) 4.349 6.489 ( -0.449 1.449 -1.790) 2.346 6.695 ( 1.996 -1.762 -0.668) 2.745 6.843 ( 11.564 -5.626 2.853) 13.172 6.951 ( 2.505 0.804 -1.216) 2.898 7.114 ( 7.603 4.631 0.677) 8.928 7.199 ( 2.912 -8.348 4.432) 9.890 7.313 ( 5.093 -3.360 0.440) 6.117 7.514 ( 4.840 5.623 -7.064) 10.245 7.573 ( -0.302 4.431 -2.297) 5.000 7.986 ( 2.452 3.071 0.482) 3.959 8.229 ( 6.004 3.146 2.456) 7.210 8.275 ( 1.468 3.473 8.123) 8.955 8.535 ( -2.031 -3.551 -1.094) 4.234 8.668 ( 0.250 0.092 -0.346) 0.437 8.760 ( 3.315 -0.532 -3.910) 5.153 8.896 ( -6.431 5.583 3.976) 9.399 9.101 ( -5.305 2.516 -3.387) 6.778 9.198 ( 0.705 -2.020 -3.749) 4.317 9.218 ( -5.606 -7.098 7.712) 11.887 9.455 ( -9.943 2.107 -0.312) 10.168 9.522 ( -4.647 0.444 -3.517) 5.845 9.829 ( -1.948 -1.455 -1.144) 2.687 9.899 ( -3.162 -3.648 0.401) 4.844 10.323 ( -1.185 5.895 0.172) 6.016 10.533 ( -4.460 4.411 -1.616) 6.478 10.634 ( -2.494 -6.926 4.219) 8.485 10.845 ( -2.420 -7.586 -3.984) 8.904 20.603 ( 2.624 1.240 -0.131) 2.906 20.629 ( 4.204 0.777 -0.552) 4.311 20.895 ( 1.505 1.354 0.275) 2.043 20.911 ( 1.378 0.436 0.038) 1.446 22.816 ( -0.789 1.259 -1.607) 2.189 22.860 ( -0.174 -0.242 0.732) 0.790 23.077 ( 0.768 0.565 -0.661) 1.160 23.129 ( 0.799 -1.134 0.921) 1.665 24.616 ( 1.682 -0.777 1.101) 2.155 24.643 ( 1.749 -2.177 -0.104) 2.794 24.936 ( -1.812 1.665 0.194) 2.468 24.955 ( -1.883 0.961 -0.213) 2.125 25.764 ( 5.126 1.467 -0.306) 5.341 25.800 ( 4.407 0.127 -0.159) 4.412 26.087 ( 2.250 1.259 -0.131) 2.582 26.147 ( 5.115 -0.447 1.266) 5.288 28.299 ( -1.686 0.113 0.985) 1.956 28.313 ( -1.067 -0.393 1.483) 1.869 28.560 ( -0.757 0.802 2.163) 2.428 28.589 ( 2.729 1.314 -1.214) 3.263 28.622 ( 0.853 -1.063 0.192) 1.376 28.654 ( -0.653 -2.796 -1.903) 3.444 28.791 ( -1.785 -0.941 -1.980) 2.826 28.805 ( -0.077 -1.199 -0.568) 1.329 32.331 ( -1.510 0.609 0.763) 1.798 32.364 ( -1.361 -0.711 -0.005) 1.536 32.484 ( -0.341 2.227 -0.610) 2.335 32.569 ( 0.871 -1.409 -0.549) 1.745 35.387 ( -0.893 0.952 0.281) 1.336 35.433 ( 0.443 -0.742 0.243) 0.898 35.538 ( 0.829 0.623 -0.231) 1.062 35.551 ( 1.519 0.462 0.399) 1.637 88.791 ( -2.861 -0.455 2.130) 3.595 88.862 ( -3.746 -4.379 4.191) 7.125 89.071 ( -5.516 0.066 1.175) 5.640 89.143 ( -3.698 -2.610 -1.709) 4.839 97.651 ( -1.379 0.242 0.279) 1.427 97.657 ( -1.580 0.384 -0.432) 1.683 97.707 ( -2.192 -0.980 -0.391) 2.433 97.744 ( -2.780 -2.697 1.366) 4.107 98.690 ( -0.997 0.446 -0.070) 1.094 98.695 ( -0.767 0.251 0.019) 0.807 98.955 ( 3.820 4.583 0.437) 5.982 99.068 ( 8.734 1.601 0.975) 8.933 99.650 ( -0.206 3.430 -1.003) 3.580 99.717 ( 1.142 1.132 0.170) 1.617 99.943 ( -1.944 -2.903 3.645) 5.049 99.963 ( -3.564 -4.731 -7.496) 9.554 ======================= 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| 0.970 ( -2.855 16.253 9.461) 19.022 1.051 ( -4.026 18.821 7.780) 20.760 1.510 ( -7.957 -2.767 2.911) 8.913 1.803 ( -10.315 14.795 2.616) 18.225 1.854 ( -0.067 -11.099 -0.410) 11.107 1.947 ( -0.366 4.576 4.745) 6.602 2.022 ( 1.778 2.246 -6.628) 7.220 2.114 ( 1.166 -0.706 -5.360) 5.530 2.139 ( -1.913 -1.906 -0.754) 2.804 2.319 ( -1.865 0.410 5.157) 5.500 2.410 ( 1.525 7.730 1.861) 8.096 2.486 ( 2.418 -3.362 4.017) 5.769 2.592 ( -2.416 -1.137 2.564) 3.702 2.667 ( 1.426 0.168 0.778) 1.633 2.748 ( 1.693 -5.741 1.388) 6.144 2.857 ( 3.738 0.108 1.027) 3.878 2.922 ( -0.363 -4.890 -1.517) 5.133 3.088 ( 4.158 -3.473 -0.897) 5.491 3.221 ( 1.154 1.759 -1.576) 2.628 3.284 ( 2.354 6.042 -2.062) 6.805 3.289 ( -1.352 -1.448 -4.228) 4.669 3.448 ( 3.390 1.540 -0.967) 3.847 3.577 ( -2.947 2.027 -2.321) 4.264 3.621 ( -4.973 -0.857 -1.798) 5.357 4.311 ( 1.090 -2.187 -0.498) 2.494 4.439 ( -1.937 -7.222 2.221) 7.800 4.628 ( 6.068 -0.028 -5.262) 8.032 4.715 ( 2.281 -3.551 -2.165) 4.743 4.856 ( 2.817 1.710 2.317) 4.028 5.056 ( 2.750 -0.945 1.199) 3.145 5.134 ( 3.006 -0.362 -0.658) 3.098 5.209 ( 0.658 0.548 2.750) 2.880 5.304 ( 2.279 0.169 1.758) 2.884 5.327 ( 1.454 -0.739 -0.298) 1.658 5.430 ( 0.922 -0.178 -5.252) 5.336 5.479 ( -2.053 -2.026 -1.469) 3.237 5.513 ( 1.004 -1.438 -1.627) 2.392 5.584 ( -3.900 -4.615 6.578) 8.932 5.808 ( -2.499 0.342 -2.634) 3.647 5.846 ( 5.248 -0.893 1.985) 5.681 5.987 ( 6.390 -0.864 4.296) 7.749 6.120 ( 4.173 -3.395 0.499) 5.402 6.200 ( -2.861 3.352 -2.396) 5.016 6.270 ( -1.796 2.996 -1.324) 3.736 6.427 ( -1.593 1.738 1.105) 2.604 6.450 ( -2.825 0.005 0.458) 2.862 6.732 ( 4.647 8.899 -6.034) 11.713 6.934 ( 3.767 -0.743 -1.309) 4.056 7.046 ( 4.582 3.163 0.946) 5.648 7.184 ( 1.844 5.008 -0.611) 5.371 7.218 ( -0.142 -1.991 -3.846) 4.333 7.498 ( 1.687 -1.363 3.020) 3.718 7.519 ( 4.957 4.644 -0.479) 6.809 7.690 ( 13.634 -4.516 7.919) 16.401 8.021 ( 1.073 4.455 2.081) 5.033 8.312 ( 3.587 -1.300 -1.581) 4.130 8.406 ( -0.620 2.988 8.097) 8.653 8.483 ( -1.699 -6.347 -0.719) 6.610 8.652 ( 0.613 0.993 -2.415) 2.682 8.750 ( -1.490 -0.783 0.103) 1.686 8.832 ( -6.319 3.740 3.223) 8.019 8.993 ( -5.708 1.785 2.456) 6.465 9.167 ( -2.688 -1.949 0.808) 3.417 9.246 ( 2.647 -7.726 0.814) 8.208 9.300 ( -5.975 4.197 -0.817) 7.347 9.430 ( -3.499 -1.936 -2.176) 4.553 9.761 ( -2.127 -0.517 -5.064) 5.517 9.856 ( -2.599 -4.604 0.877) 5.359 10.315 ( 1.341 6.404 -2.034) 6.852 10.419 ( -5.197 3.727 -2.109) 6.734 10.632 ( -2.911 -4.238 3.394) 6.161 10.782 ( -0.670 -6.693 -2.442) 7.156 20.632 ( 1.472 1.399 -0.906) 2.224 20.690 ( 4.246 -0.476 -2.631) 5.018 20.917 ( 0.921 1.387 -0.081) 1.667 20.938 ( 1.207 0.530 0.581) 1.440 22.799 ( 0.377 1.436 -0.751) 1.664 22.859 ( -0.393 -1.048 0.115) 1.125 23.086 ( 0.768 1.513 -0.335) 1.730 23.142 ( -0.182 -0.760 0.281) 0.830 24.653 ( 1.096 -0.886 1.330) 1.938 24.669 ( 1.293 -1.574 0.043) 2.037 24.918 ( -0.955 0.933 1.060) 1.705 24.926 ( -1.660 0.725 0.514) 1.882 25.840 ( 4.120 0.985 -0.502) 4.266 25.861 ( 2.913 0.220 -0.116) 2.923 26.115 ( 1.289 2.041 -0.332) 2.437 26.238 ( 4.030 -3.092 -0.209) 5.084 28.290 ( -0.805 0.347 1.249) 1.527 28.324 ( -0.001 -1.279 2.699) 2.987 28.564 ( -1.645 -0.064 2.342) 2.863 28.584 ( -2.729 -1.019 -0.345) 2.933 28.634 ( 2.644 0.961 -0.629) 2.883 28.654 ( 1.654 -0.039 -0.663) 1.782 28.740 ( -2.625 0.102 -0.592) 2.693 28.795 ( 0.610 -1.890 -1.755) 2.651 32.320 ( -1.113 0.706 1.126) 1.734 32.350 ( -0.845 -0.598 1.294) 1.657 32.474 ( 0.024 2.300 -0.649) 2.390 32.574 ( 0.650 -1.939 -0.949) 2.255 35.380 ( -0.463 1.160 0.620) 1.395 35.445 ( 0.740 -1.381 -0.099) 1.570 35.543 ( 0.429 1.108 -0.675) 1.366 35.577 ( 0.955 -0.139 0.108) 0.971 88.766 ( -2.747 -0.291 1.996) 3.408 88.838 ( -4.980 -4.260 4.744) 8.090 88.991 ( -4.343 0.453 -0.025) 4.367 89.074 ( -2.735 -3.043 -0.836) 4.176 97.632 ( -0.726 0.413 -0.398) 0.925 97.634 ( -0.855 0.084 0.065) 0.861 97.675 ( -1.203 -0.513 -0.185) 1.321 97.702 ( -3.275 -1.733 0.575) 3.750 98.678 ( -0.321 0.403 0.081) 0.522 98.690 ( -0.405 0.162 0.634) 0.769 99.004 ( 2.135 5.464 -0.765) 5.916 99.208 ( 7.464 -2.202 -3.708) 8.620 99.659 ( 1.605 2.763 0.300) 3.209 99.721 ( 0.650 -0.146 -0.579) 0.882 99.819 ( -3.301 1.529 -3.413) 4.988 99.953 ( -2.355 -3.668 2.493) 5.022 ======================= 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 ( 1.520 -10.804 12.532) 16.616 1.383 ( 1.520 10.804 12.532) 16.616 1.505 ( -2.742 -18.423 3.947) 19.039 1.505 ( -2.742 18.423 3.947) 19.039 1.965 ( 0.798 -4.789 -2.435) 5.432 1.965 ( 0.798 4.789 -2.435) 5.432 2.053 ( 2.489 -6.348 -5.466) 8.739 2.053 ( 2.489 6.348 -5.466) 8.739 2.209 ( -4.367 -12.078 1.988) 12.997 2.209 ( -4.367 12.078 1.988) 12.997 2.537 ( -0.069 -1.482 4.951) 5.169 2.537 ( -0.069 1.482 4.951) 5.169 2.617 ( 0.546 -7.597 5.682) 9.503 2.617 ( 0.546 7.597 5.682) 9.503 2.748 ( 0.493 -4.786 0.766) 4.872 2.748 ( 0.493 4.786 0.766) 4.872 3.052 ( 0.490 -5.040 0.007) 5.064 3.052 ( 0.490 5.040 0.007) 5.064 3.189 ( 1.552 -1.121 -7.145) 7.397 3.189 ( 1.552 1.121 -7.145) 7.397 3.441 ( 0.928 -2.811 -3.824) 4.835 3.441 ( 0.928 2.811 -3.824) 4.835 3.513 ( -2.956 -2.477 -2.935) 4.846 3.513 ( -2.956 2.477 -2.935) 4.846 4.332 ( 0.459 -2.394 2.274) 3.334 4.332 ( 0.459 2.394 2.274) 3.334 4.635 ( 0.059 -2.192 -4.658) 5.148 4.635 ( 0.059 2.192 -4.658) 5.148 5.043 ( 5.324 -4.316 2.493) 7.293 5.043 ( 5.324 4.316 2.493) 7.293 5.213 ( -4.550 -1.513 1.740) 5.101 5.213 ( -4.550 1.513 1.740) 5.101 5.291 ( -6.165 -2.647 -1.221) 6.820 5.291 ( -6.165 2.647 -1.221) 6.820 5.411 ( 1.399 -2.278 1.948) 3.308 5.411 ( 1.399 2.278 1.948) 3.308 5.537 ( 2.502 -2.183 1.592) 3.683 5.537 ( 2.502 2.183 1.592) 3.683 5.855 ( 2.555 -4.488 -2.347) 5.672 5.855 ( 2.555 4.488 -2.347) 5.672 6.082 ( 0.441 -1.245 3.637) 3.870 6.082 ( 0.441 1.245 3.637) 3.870 6.238 ( 1.429 -2.617 -3.090) 4.294 6.238 ( 1.429 2.617 -3.090) 4.294 6.419 ( -0.777 -2.575 2.648) 3.775 6.419 ( -0.777 2.575 2.648) 3.775 6.928 ( -1.352 -11.475 -5.836) 12.944 6.928 ( -1.352 11.475 -5.836) 12.944 7.076 ( -2.000 -1.210 -3.474) 4.187 7.076 ( -2.000 1.210 -3.474) 4.187 7.336 ( -2.637 -5.150 -2.533) 6.316 7.336 ( -2.637 5.150 -2.533) 6.316 7.828 ( 5.645 -5.701 9.579) 12.495 7.828 ( 5.645 5.701 9.579) 12.495 8.271 ( -6.850 -7.634 2.845) 10.644 8.271 ( -6.850 7.634 2.845) 10.644 8.327 ( 4.671 -6.940 -2.615) 8.764 8.327 ( 4.671 6.940 -2.615) 8.764 8.730 ( -0.225 -0.615 4.724) 4.769 8.730 ( -0.225 0.615 4.724) 4.769 8.890 ( -2.832 -9.075 -0.171) 9.508 8.890 ( -2.832 9.075 -0.171) 9.508 9.128 ( -1.992 -1.386 0.949) 2.606 9.128 ( -1.992 1.386 0.949) 2.606 9.343 ( 2.769 -2.877 -0.065) 3.994 9.343 ( 2.769 2.877 -0.065) 3.994 9.738 ( 0.372 -3.567 -3.814) 5.235 9.738 ( 0.372 3.567 -3.814) 5.235 10.399 ( 0.656 -1.292 -1.939) 2.420 10.399 ( 0.656 1.292 -1.939) 2.420 10.641 ( 0.872 -4.923 -0.166) 5.002 10.641 ( 0.872 4.923 -0.166) 5.002 20.668 ( 0.220 -1.617 -1.984) 2.569 20.668 ( 0.220 1.617 -1.984) 2.569 20.950 ( -0.126 -0.688 0.385) 0.799 20.950 ( -0.126 0.688 0.385) 0.799 22.835 ( 0.503 -0.943 0.125) 1.076 22.835 ( 0.503 0.943 0.125) 1.076 23.117 ( -0.239 -0.850 -0.509) 1.019 23.117 ( -0.239 0.850 -0.509) 1.019 24.662 ( -0.308 -0.328 0.461) 0.644 24.662 ( -0.308 0.328 0.461) 0.644 24.928 ( 0.013 -0.273 1.188) 1.219 24.928 ( 0.013 0.273 1.188) 1.219 25.887 ( 0.236 -0.151 -0.272) 0.391 25.887 ( 0.236 0.151 -0.272) 0.391 26.176 ( -0.299 -3.004 -1.113) 3.218 26.176 ( -0.299 3.004 -1.113) 3.218 28.315 ( -0.545 -1.286 2.150) 2.564 28.315 ( -0.545 1.286 2.150) 2.564 28.559 ( -1.010 -0.463 1.631) 1.973 28.559 ( -1.010 0.463 1.631) 1.973 28.677 ( 0.720 -0.587 -0.057) 0.930 28.677 ( 0.720 0.587 -0.057) 0.930 28.735 ( 0.961 -2.718 -1.867) 3.435 28.735 ( 0.961 2.718 -1.867) 3.435 32.342 ( -0.223 -1.100 1.735) 2.066 32.342 ( -0.223 1.100 1.735) 2.066 32.520 ( 0.347 -2.408 -1.128) 2.682 32.520 ( 0.347 2.408 -1.128) 2.682 35.414 ( -0.092 -1.616 0.453) 1.681 35.414 ( -0.092 1.616 0.453) 1.681 35.565 ( -0.104 -0.912 -0.728) 1.172 35.565 ( -0.104 0.912 -0.728) 1.172 88.760 ( -2.845 -1.380 2.816) 4.234 88.760 ( -2.845 1.380 2.816) 4.234 88.995 ( 1.503 -2.855 -1.125) 3.417 88.995 ( 1.503 2.855 -1.125) 3.417 97.628 ( -0.220 -0.295 -0.040) 0.370 97.628 ( -0.220 0.295 -0.040) 0.370 97.661 ( 0.069 -0.466 -0.169) 0.501 97.661 ( 0.069 0.466 -0.169) 0.501 98.692 ( 0.068 -0.326 0.776) 0.845 98.692 ( 0.068 0.326 0.776) 0.845 99.117 ( -0.487 -4.570 -3.746) 5.929 99.117 ( -0.487 4.570 -3.746) 5.929 99.731 ( 1.230 -2.825 1.343) 3.361 99.731 ( 1.230 2.825 1.343) 3.361 99.855 ( -0.117 -2.738 -0.038) 2.741 99.855 ( -0.117 2.738 -0.038) 2.741 ======================= 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| 1.450 ( -3.571 -14.232 6.299) 15.968 1.450 ( -3.571 14.232 6.299) 15.968 1.619 ( 6.432 -7.277 8.665) 13.016 1.619 ( 6.432 7.277 8.665) 13.016 1.954 ( 1.721 -2.366 -2.997) 4.188 1.954 ( 1.721 2.366 -2.997) 4.188 2.051 ( 2.589 -5.127 -3.594) 6.775 2.051 ( 2.589 5.127 -3.594) 6.775 2.265 ( 5.392 -5.394 6.646) 10.116 2.265 ( 5.392 5.394 6.646) 10.116 2.512 ( -4.722 -2.743 0.431) 5.478 2.512 ( -4.722 2.743 0.431) 5.478 2.659 ( -2.085 -2.584 1.903) 3.827 2.659 ( -2.085 2.584 1.903) 3.827 2.812 ( 1.443 -3.066 7.504) 8.234 2.812 ( 1.443 3.066 7.504) 8.234 2.990 ( -1.664 -2.307 -7.164) 7.709 2.990 ( -1.664 2.307 -7.164) 7.709 3.165 ( -1.579 -2.506 -0.279) 2.975 3.165 ( -1.579 2.506 -0.279) 2.975 3.377 ( -0.166 -1.477 -7.599) 7.743 3.377 ( -0.166 1.477 -7.599) 7.743 3.463 ( 0.430 -4.796 -2.396) 5.378 3.463 ( 0.430 4.796 -2.396) 5.378 4.374 ( 0.778 -2.962 3.036) 4.312 4.374 ( 0.778 2.962 3.036) 4.312 4.572 ( -1.380 -3.838 -4.242) 5.885 4.572 ( -1.380 3.838 -4.242) 5.885 5.085 ( -7.926 -2.096 2.117) 8.467 5.085 ( -7.926 2.096 2.117) 8.467 5.119 ( -1.392 -2.421 -2.991) 4.092 5.119 ( -1.392 2.421 -2.991) 4.092 5.220 ( -3.109 -6.747 4.021) 8.447 5.220 ( -3.109 6.747 4.021) 8.447 5.437 ( -0.390 -2.679 0.225) 2.717 5.437 ( -0.390 2.679 0.225) 2.717 5.616 ( 3.767 -2.245 2.996) 5.311 5.616 ( 3.767 2.245 2.996) 5.311 5.828 ( -0.703 -1.930 -4.814) 5.233 5.828 ( -0.703 1.930 -4.814) 5.233 6.128 ( -0.837 -2.686 3.371) 4.390 6.128 ( -0.837 2.686 3.371) 4.390 6.233 ( 1.541 -1.576 -3.028) 3.745 6.233 ( 1.541 1.576 -3.028) 3.745 6.456 ( -1.746 -9.465 3.863) 10.371 6.456 ( -1.746 9.465 3.863) 10.371 6.712 ( -9.289 -8.681 -7.123) 14.573 6.712 ( -9.289 8.681 -7.123) 14.573 7.076 ( -0.733 -1.285 1.331) 1.990 7.076 ( -0.733 1.285 1.331) 1.990 7.255 ( -2.203 -2.794 -2.286) 4.229 7.255 ( -2.203 2.794 -2.286) 4.229 7.937 ( -3.118 -2.859 6.891) 8.086 7.937 ( -3.118 2.859 6.891) 8.086 8.106 ( -6.817 -5.572 -2.781) 9.233 8.106 ( -6.817 5.572 -2.781) 9.233 8.433 ( 0.269 -8.510 6.178) 10.519 8.433 ( 0.269 8.510 6.178) 10.519 8.676 ( -4.566 -4.663 -6.217) 9.014 8.676 ( -4.566 4.663 -6.217) 9.014 8.982 ( 7.945 -1.896 6.994) 10.753 8.982 ( 7.945 1.896 6.994) 10.753 9.139 ( 3.694 -1.083 -0.152) 3.853 9.139 ( 3.694 1.083 -0.152) 3.853 9.436 ( 6.308 -3.775 1.698) 7.545 9.436 ( 6.308 3.775 1.698) 7.545 9.706 ( 1.610 -3.958 -5.061) 6.624 9.706 ( 1.610 3.958 -5.061) 6.624 10.408 ( 2.221 -2.419 -1.810) 3.750 10.408 ( 2.221 2.419 -1.810) 3.750 10.665 ( 2.398 -6.960 -0.261) 7.366 10.665 ( 2.398 6.960 -0.261) 7.366 20.636 ( -1.464 -0.944 -1.642) 2.394 20.636 ( -1.464 0.944 -1.642) 2.394 20.942 ( -1.184 -0.621 0.339) 1.379 20.942 ( -1.184 0.621 0.339) 1.379 22.842 ( 0.133 -0.510 -0.203) 0.565 22.842 ( 0.133 0.510 -0.203) 0.565 23.108 ( -0.166 -0.799 -0.186) 0.837 23.108 ( -0.166 0.799 -0.186) 0.837 24.647 ( -1.999 -0.496 0.458) 2.110 24.647 ( -1.999 0.496 0.458) 2.110 24.954 ( 1.468 -0.578 1.097) 1.921 24.954 ( 1.468 0.578 1.097) 1.921 25.859 ( -3.118 -0.520 -0.273) 3.173 25.859 ( -3.118 0.520 -0.273) 3.173 26.144 ( -2.042 -1.779 -0.837) 2.835 26.144 ( -2.042 1.779 -0.837) 2.835 28.323 ( -1.097 -0.803 2.030) 2.443 28.323 ( -1.097 0.803 2.030) 2.443 28.562 ( -0.654 -1.176 0.874) 1.604 28.562 ( -0.654 1.176 0.874) 1.604 28.673 ( -0.556 -1.531 -0.041) 1.629 28.673 ( -0.556 1.531 -0.041) 1.629 28.754 ( 2.854 -1.930 -1.401) 3.719 28.754 ( 2.854 1.930 -1.401) 3.719 32.361 ( 0.164 -1.604 1.749) 2.379 32.361 ( 0.164 1.604 1.749) 2.379 32.515 ( 0.618 -2.003 -1.245) 2.438 32.515 ( 0.618 2.003 -1.245) 2.438 35.417 ( -0.169 -1.168 0.596) 1.322 35.417 ( -0.169 1.168 0.596) 1.322 35.550 ( -0.616 -0.596 -0.756) 1.143 35.550 ( -0.616 0.596 -0.756) 1.143 88.750 ( -1.341 -1.167 2.120) 2.767 88.750 ( -1.341 1.167 2.120) 2.767 89.044 ( 4.995 -4.184 -0.474) 6.533 89.044 ( 4.995 4.184 -0.474) 6.533 97.629 ( 0.611 -0.500 -0.132) 0.801 97.629 ( 0.611 0.500 -0.132) 0.801 97.675 ( 1.630 -0.993 -0.051) 1.909 97.675 ( 1.630 0.993 -0.051) 1.909 98.703 ( 0.231 -0.343 0.754) 0.860 98.703 ( 0.231 0.343 0.754) 0.860 99.047 ( -3.031 -2.452 -2.922) 4.872 99.047 ( -3.031 2.452 -2.922) 4.872 99.732 ( -1.970 -1.185 -0.189) 2.307 99.732 ( -1.970 1.185 -0.189) 2.307 99.893 ( 3.841 -5.029 0.747) 6.372 99.893 ( 3.841 5.029 0.747) 6.372 ======================= 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| 1.495 ( 1.567 -13.024 5.991) 14.421 1.495 ( 1.567 13.024 5.991) 14.421 1.796 ( 6.169 -4.408 2.416) 7.958 1.796 ( 6.169 4.408 2.416) 7.958 1.968 ( 5.624 -0.683 -4.291) 7.107 1.968 ( 5.624 0.683 -4.291) 7.107 2.080 ( 3.659 -5.989 -1.081) 7.101 2.080 ( 3.659 5.989 -1.081) 7.101 2.393 ( -4.315 -4.640 1.634) 6.544 2.393 ( -4.315 4.640 1.634) 6.544 2.486 ( 2.997 -1.901 7.967) 8.721 2.486 ( 2.997 1.901 7.967) 8.721 2.634 ( -1.135 -0.814 0.771) 1.595 2.634 ( -1.135 0.814 0.771) 1.595 2.847 ( -2.400 -1.605 -2.278) 3.678 2.847 ( -2.400 1.605 -2.278) 3.678 2.919 ( 0.171 -3.394 -0.830) 3.498 2.919 ( 0.171 3.394 -0.830) 3.498 3.115 ( -4.891 -2.714 1.973) 5.931 3.115 ( -4.891 2.714 1.973) 5.931 3.294 ( -3.004 -1.739 -2.855) 4.494 3.294 ( -3.004 1.739 -2.855) 4.494 3.474 ( 4.737 -4.055 -4.095) 7.460 3.474 ( 4.737 4.055 -4.095) 7.460 4.402 ( -0.723 -3.251 1.116) 3.512 4.402 ( -0.723 3.251 1.116) 3.512 4.518 ( -1.178 -3.267 -1.232) 3.685 4.518 ( -1.178 3.267 -1.232) 3.685 4.954 ( -8.315 -3.013 2.685) 9.243 4.954 ( -8.315 3.013 2.685) 9.243 5.080 ( 0.456 -3.466 -3.238) 4.765 5.080 ( 0.456 3.466 -3.238) 4.765 5.206 ( -2.493 -4.289 1.126) 5.087 5.206 ( -2.493 4.289 1.126) 5.087 5.392 ( -5.043 -2.090 -0.189) 5.463 5.392 ( -5.043 2.090 -0.189) 5.463 5.672 ( -2.472 -3.232 -0.114) 4.070 5.672 ( -2.472 3.232 -0.114) 4.070 5.797 ( 3.629 -1.330 -0.657) 3.921 5.797 ( 3.629 1.330 -0.657) 3.921 6.061 ( -12.220 -1.776 -0.084) 12.349 6.061 ( -12.220 1.776 -0.084) 12.349 6.179 ( -2.071 -1.693 -2.451) 3.628 6.179 ( -2.071 1.693 -2.451) 3.628 6.406 ( -2.301 -9.827 0.763) 10.122 6.406 ( -2.301 9.827 0.763) 10.122 6.616 ( -1.876 -6.661 0.170) 6.922 6.616 ( -1.876 6.661 0.170) 6.922 7.039 ( -2.373 -6.062 -0.690) 6.547 7.039 ( -2.373 6.062 -0.690) 6.547 7.260 ( 1.149 -6.154 2.824) 6.868 7.260 ( 1.149 6.154 2.824) 6.868 7.879 ( -4.201 -9.715 -2.388) 10.851 7.879 ( -4.201 9.715 -2.388) 10.851 8.025 ( -5.001 -2.149 2.861) 6.149 8.025 ( -5.001 2.149 2.861) 6.149 8.455 ( -3.159 -7.379 2.943) 8.549 8.455 ( -3.159 7.379 2.943) 8.549 8.575 ( -0.630 -4.935 -2.403) 5.525 8.575 ( -0.630 4.935 -2.403) 5.525 9.111 ( 3.812 -5.402 -0.717) 6.650 9.111 ( 3.812 5.402 -0.717) 6.650 9.278 ( 6.873 -6.187 5.756) 10.893 9.278 ( 6.873 6.187 5.756) 10.893 9.557 ( 3.983 -3.686 2.234) 5.869 9.557 ( 3.983 3.686 2.234) 5.869 9.702 ( 6.666 -5.111 -6.292) 10.495 9.702 ( 6.666 5.111 -6.292) 10.495 10.423 ( 1.248 -3.471 -0.658) 3.747 10.423 ( 1.248 3.471 -0.658) 3.747 10.714 ( 3.946 -9.152 -0.830) 10.001 10.714 ( 3.946 9.152 -0.830) 10.001 20.593 ( -1.898 -0.412 -0.822) 2.109 20.593 ( -1.898 0.412 -0.822) 2.109 20.920 ( -1.703 -0.647 0.238) 1.837 20.920 ( -1.703 0.647 0.238) 1.837 22.832 ( -0.531 -2.031 -0.860) 2.269 22.832 ( -0.531 2.031 -0.860) 2.269 23.111 ( 0.317 -2.018 0.505) 2.104 23.111 ( 0.317 2.018 0.505) 2.104 24.612 ( -2.628 -0.816 0.423) 2.785 24.612 ( -2.628 0.816 0.423) 2.785 24.993 ( 1.926 -0.604 0.615) 2.110 24.993 ( 1.926 0.604 0.615) 2.110 25.788 ( -4.568 -1.258 -0.303) 4.748 25.788 ( -4.568 1.258 -0.303) 4.748 26.097 ( -2.811 -0.891 -0.130) 2.951 26.097 ( -2.811 0.891 -0.130) 2.951 28.325 ( -0.941 -0.300 1.698) 1.964 28.325 ( -0.941 0.300 1.698) 1.964 28.550 ( -0.968 -1.424 -0.326) 1.753 28.550 ( -0.968 1.424 -0.326) 1.753 28.667 ( -0.211 -2.713 0.054) 2.722 28.667 ( -0.211 2.713 0.054) 2.722 28.786 ( 2.280 -2.082 -0.952) 3.231 28.786 ( 2.280 2.082 -0.952) 3.231 32.379 ( 0.054 -1.703 1.207) 2.088 32.379 ( 0.054 1.703 1.207) 2.088 32.516 ( 0.993 -1.457 -1.059) 2.057 32.516 ( 0.993 1.457 -1.059) 2.057 35.421 ( -0.052 -0.563 0.600) 0.825 35.421 ( -0.052 0.563 0.600) 0.825 35.532 ( -0.771 -0.514 -0.486) 1.046 35.532 ( -0.771 0.514 -0.486) 1.046 88.761 ( 0.150 -0.756 1.734) 1.898 88.761 ( 0.150 0.756 1.734) 1.898 89.135 ( 5.802 -5.315 -0.110) 7.869 89.135 ( 5.802 5.315 -0.110) 7.869 97.644 ( 1.256 -0.474 -0.161) 1.352 97.644 ( 1.256 0.474 -0.161) 1.352 97.709 ( 2.254 -1.636 0.174) 2.791 97.709 ( 2.254 1.636 0.174) 2.791 98.714 ( 0.441 -0.802 0.307) 0.965 98.714 ( 0.441 0.802 0.307) 0.965 98.968 ( -3.818 -0.963 -1.007) 4.064 98.968 ( -3.818 0.963 -1.007) 4.064 99.684 ( -2.373 -0.460 -1.063) 2.641 99.684 ( -2.373 0.460 -1.063) 2.641 99.968 ( 3.901 -8.298 0.446) 9.180 99.968 ( 3.901 8.298 0.446) 9.180 ======================= 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| 1.614 ( 4.722 -7.131 4.666) 9.743 1.614 ( 4.722 7.131 4.666) 9.743 1.846 ( 4.051 -4.130 -6.879) 8.988 1.846 ( 4.051 4.130 -6.879) 8.988 2.056 ( 7.448 -3.636 -2.866) 8.769 2.056 ( 7.448 3.636 -2.866) 8.769 2.127 ( 3.728 -2.951 -1.846) 5.100 2.127 ( 3.728 2.951 -1.846) 5.100 2.325 ( -4.243 -4.500 2.078) 6.524 2.325 ( -4.243 4.500 2.078) 6.524 2.522 ( -5.054 -1.977 3.125) 6.262 2.522 ( -5.054 1.977 3.125) 6.262 2.645 ( 0.128 -1.435 -4.041) 4.290 2.645 ( 0.128 1.435 -4.041) 4.290 2.808 ( 0.563 -2.536 -1.268) 2.891 2.808 ( 0.563 2.536 -1.268) 2.891 2.953 ( 1.038 -3.834 6.872) 7.937 2.953 ( 1.038 3.834 6.872) 7.937 3.060 ( -2.974 -1.183 1.922) 3.734 3.060 ( -2.974 1.183 1.922) 3.734 3.216 ( -4.947 -1.996 0.466) 5.355 3.216 ( -4.947 1.996 0.466) 5.355 3.522 ( 4.352 -2.256 -1.443) 5.110 3.522 ( 4.352 2.256 -1.443) 5.110 4.375 ( -1.895 -0.829 -0.833) 2.230 4.375 ( -1.895 0.829 -0.833) 2.230 4.504 ( -1.502 -0.840 2.048) 2.675 4.504 ( -1.502 0.840 2.048) 2.675 4.883 ( -2.740 -3.326 0.703) 4.366 4.883 ( -2.740 3.326 0.703) 4.366 5.068 ( 1.655 -3.978 -2.326) 4.896 5.068 ( 1.655 3.978 -2.326) 4.896 5.175 ( -1.861 -1.939 -0.102) 2.689 5.175 ( -1.861 1.939 -0.102) 2.689 5.289 ( -6.296 -2.568 0.415) 6.813 5.289 ( -6.296 2.568 0.415) 6.813 5.569 ( -6.560 -2.090 -1.426) 7.031 5.569 ( -6.560 2.090 -1.426) 7.031 5.785 ( -9.902 -2.579 -2.036) 10.433 5.785 ( -9.902 2.579 -2.036) 10.433 5.907 ( 0.801 -3.277 3.071) 4.561 5.907 ( 0.801 3.277 3.071) 4.561 6.196 ( 1.842 -1.422 3.057) 3.842 6.196 ( 1.842 1.422 3.057) 3.842 6.360 ( -3.662 -6.928 -1.428) 7.965 6.360 ( -3.662 6.928 -1.428) 7.965 6.591 ( -1.061 -3.731 0.683) 3.939 6.591 ( -1.061 3.731 0.683) 3.939 7.003 ( -2.503 -5.986 0.642) 6.519 7.003 ( -2.503 5.986 0.642) 6.519 7.297 ( 0.717 -7.768 -0.338) 7.808 7.297 ( 0.717 7.768 -0.338) 7.808 7.810 ( 0.504 -5.849 -4.182) 7.208 7.810 ( 0.504 5.849 -4.182) 7.208 7.968 ( -4.224 -3.628 1.368) 5.733 7.968 ( -4.224 3.628 1.368) 5.733 8.420 ( -3.894 -10.259 2.408) 11.234 8.420 ( -3.894 10.259 2.408) 11.234 8.584 ( 1.346 -2.643 1.493) 3.320 8.584 ( 1.346 2.643 1.493) 3.320 9.149 ( 4.408 -4.786 -4.435) 7.874 9.149 ( 4.408 4.786 -4.435) 7.874 9.410 ( 0.905 -5.719 6.103) 8.412 9.410 ( 0.905 5.719 6.103) 8.412 9.586 ( 0.728 -5.034 -0.681) 5.131 9.586 ( 0.728 5.034 -0.681) 5.131 9.799 ( 8.675 -2.943 -3.416) 9.777 9.799 ( 8.675 2.943 -3.416) 9.777 10.440 ( 0.513 -2.870 1.274) 3.182 10.440 ( 0.513 2.870 1.274) 3.182 10.767 ( 3.686 -10.608 -1.641) 11.349 10.767 ( 3.686 10.608 -1.641) 11.349 20.560 ( -1.403 -0.206 -0.204) 1.432 20.560 ( -1.403 0.206 -0.204) 1.432 20.894 ( -1.498 -0.772 0.090) 1.688 20.894 ( -1.498 0.772 0.090) 1.688 22.816 ( -0.338 -2.974 -0.388) 3.018 22.816 ( -0.338 2.974 -0.388) 3.018 23.121 ( 0.161 -2.784 0.102) 2.791 23.121 ( 0.161 2.784 0.102) 2.791 24.575 ( -2.187 -1.087 0.421) 2.478 24.575 ( -2.187 1.087 0.421) 2.478 25.026 ( 1.525 -0.413 -0.017) 1.581 25.026 ( 1.525 0.413 -0.017) 1.581 25.714 ( -3.734 -1.644 -0.178) 4.084 25.714 ( -3.734 1.644 -0.178) 4.084 26.052 ( -2.561 -0.606 0.198) 2.640 26.052 ( -2.561 0.606 0.198) 2.640 28.330 ( -0.634 -0.686 1.641) 1.889 28.330 ( -0.634 0.686 1.641) 1.889 28.531 ( -0.427 -1.138 -0.821) 1.467 28.531 ( -0.427 1.138 -0.821) 1.467 28.662 ( -0.379 -3.051 -0.223) 3.082 28.662 ( -0.379 3.051 -0.223) 3.082 28.806 ( 1.335 -2.750 -0.778) 3.155 28.806 ( 1.335 2.750 -0.778) 3.155 32.388 ( -0.181 -1.276 0.576) 1.412 32.388 ( -0.181 1.276 0.576) 1.412 32.524 ( 1.089 -0.880 -0.739) 1.583 32.524 ( 1.089 0.880 -0.739) 1.583 35.428 ( 0.085 -0.387 0.494) 0.633 35.428 ( 0.085 0.387 0.494) 0.633 35.515 ( -0.689 -0.780 -0.263) 1.074 35.515 ( -0.689 0.780 -0.263) 1.074 88.787 ( 0.499 -0.251 1.818) 1.902 88.787 ( 0.499 0.251 1.818) 1.902 89.218 ( 4.224 -5.708 -0.495) 7.118 89.218 ( 4.224 5.708 -0.495) 7.118 97.665 ( 1.222 -0.289 0.070) 1.258 97.665 ( 1.222 0.289 0.070) 1.258 97.747 ( 1.839 -2.281 0.139) 2.934 97.747 ( 1.839 2.281 0.139) 2.934 98.727 ( 0.956 -1.037 -0.040) 1.411 98.727 ( 0.956 1.037 -0.040) 1.411 98.902 ( -3.690 -0.324 0.314) 3.718 98.902 ( -3.690 0.324 0.314) 3.718 99.644 ( -1.317 -1.097 -0.307) 1.741 99.644 ( -1.317 1.097 -0.307) 1.741 100.022 ( 2.542 -9.250 -0.672) 9.616 100.022 ( 2.542 9.250 -0.672) 9.616 ======================= 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| 1.667 ( -1.130 -1.419 -3.557) 3.993 1.667 ( -1.130 1.419 -3.557) 3.993 1.873 ( 7.401 -3.916 -2.439) 8.721 1.873 ( 7.401 3.916 -2.439) 8.721 2.086 ( 0.169 -1.120 -7.079) 7.169 2.086 ( 0.169 1.120 -7.079) 7.169 2.162 ( 4.809 -5.253 -3.623) 7.990 2.162 ( 4.809 5.253 -3.623) 7.990 2.296 ( -2.225 -2.806 1.664) 3.949 2.296 ( -2.225 2.806 1.664) 3.949 2.451 ( -4.996 -5.273 0.416) 7.276 2.451 ( -4.996 5.273 0.416) 7.276 2.593 ( -0.015 -2.772 -2.658) 3.840 2.593 ( -0.015 2.772 -2.658) 3.840 2.778 ( -0.618 -2.263 -3.375) 4.110 2.778 ( -0.618 2.263 -3.375) 4.110 2.986 ( -2.676 -1.037 2.612) 3.881 2.986 ( -2.676 1.037 2.612) 3.881 3.098 ( -2.494 -1.093 4.167) 4.978 3.098 ( -2.494 1.093 4.167) 4.978 3.197 ( 0.795 -0.593 8.172) 8.232 3.197 ( 0.795 0.593 8.172) 8.232 3.585 ( 3.357 -1.986 1.187) 4.077 3.585 ( 3.357 1.986 1.187) 4.077 4.346 ( -0.753 -3.105 0.075) 3.196 4.346 ( -0.753 3.105 0.075) 3.196 4.502 ( -1.943 -2.558 2.594) 4.129 4.502 ( -1.943 2.558 2.594) 4.129 4.847 ( -1.132 -3.727 -3.266) 5.084 4.847 ( -1.132 3.727 -3.266) 5.084 5.076 ( 0.988 -3.964 -1.733) 4.438 5.076 ( 0.988 3.964 -1.733) 4.438 5.148 ( 1.411 -4.298 0.977) 4.628 5.148 ( 1.411 4.298 0.977) 4.628 5.247 ( -1.970 -3.044 3.463) 5.014 5.247 ( -1.970 3.044 3.463) 5.014 5.474 ( -3.340 -1.974 0.056) 3.880 5.474 ( -3.340 1.974 0.056) 3.880 5.664 ( -2.216 -1.722 -0.029) 2.806 5.664 ( -2.216 1.722 -0.029) 2.806 5.956 ( -0.842 -5.374 4.383) 6.986 5.956 ( -0.842 5.374 4.383) 6.986 6.167 ( -4.222 -3.882 -4.024) 7.007 6.167 ( -4.222 3.882 -4.024) 7.007 6.384 ( 3.800 -6.046 6.318) 9.535 6.384 ( 3.800 6.046 6.318) 9.535 6.582 ( -1.124 -1.360 0.043) 1.765 6.582 ( -1.124 1.360 0.043) 1.765 6.964 ( -2.168 -3.382 -0.260) 4.026 6.964 ( -2.169 3.382 -0.260) 4.026 7.269 ( -0.097 -6.957 -5.365) 8.786 7.269 ( -0.097 6.957 -5.365) 8.786 7.794 ( 1.104 -2.510 -2.935) 4.016 7.794 ( 1.104 2.510 -2.935) 4.016 7.927 ( -0.949 -5.296 -0.230) 5.385 7.927 ( -0.949 5.296 -0.230) 5.385 8.386 ( -2.824 -11.646 2.112) 12.168 8.386 ( -2.824 11.646 2.112) 12.168 8.632 ( 0.848 -2.742 3.385) 4.438 8.632 ( 0.848 2.742 3.385) 4.438 9.164 ( 3.578 -4.990 -5.299) 8.111 9.164 ( 3.578 4.990 -5.299) 8.111 9.420 ( -4.047 -5.406 1.659) 6.954 9.420 ( -4.047 5.406 1.659) 6.954 9.622 ( 1.854 -4.514 2.594) 5.527 9.622 ( 1.854 4.514 2.594) 5.527 9.872 ( 4.408 -2.486 -3.352) 6.070 9.872 ( 4.408 2.486 -3.352) 6.070 10.465 ( -0.394 -2.344 2.896) 3.747 10.465 ( -0.394 2.344 2.896) 3.747 10.793 ( 1.920 -11.065 -2.549) 11.516 10.793 ( 1.920 11.065 -2.549) 11.516 20.544 ( -0.386 -0.028 0.098) 0.400 20.544 ( -0.386 0.028 0.098) 0.400 20.876 ( -0.645 -0.828 -0.032) 1.050 20.876 ( -0.645 0.828 -0.032) 1.050 22.819 ( 0.413 -3.225 0.882) 3.369 22.819 ( 0.413 3.225 0.882) 3.369 23.114 ( -0.382 -2.941 -1.126) 3.173 23.114 ( -0.382 2.941 -1.126) 3.173 24.553 ( -0.979 -1.194 0.492) 1.621 24.553 ( -0.979 1.194 0.492) 1.621 25.039 ( 0.445 -0.194 -0.606) 0.776 25.039 ( 0.445 0.194 -0.606) 0.776 25.670 ( -1.296 -1.537 0.072) 2.012 25.670 ( -1.296 1.537 0.072) 2.012 26.022 ( -1.107 -0.476 0.201) 1.222 26.022 ( -1.107 0.476 0.201) 1.222 28.336 ( -0.973 -0.878 1.746) 2.183 28.336 ( -0.973 0.878 1.746) 2.183 28.524 ( 0.725 -0.745 -0.764) 1.290 28.524 ( 0.725 0.745 -0.764) 1.290 28.650 ( -0.475 -2.977 -0.683) 3.091 28.650 ( -0.475 2.977 -0.683) 3.091 28.815 ( 0.678 -2.763 -0.725) 2.936 28.815 ( 0.678 2.763 -0.725) 2.936 32.387 ( -0.361 -0.600 0.217) 0.733 32.387 ( -0.361 0.600 0.217) 0.733 32.533 ( 0.747 -0.317 -0.547) 0.979 32.533 ( 0.747 0.317 -0.547) 0.979 35.432 ( -0.195 -0.575 0.420) 0.738 35.432 ( -0.195 0.575 0.420) 0.738 35.506 ( -0.114 -0.985 -0.206) 1.013 35.506 ( -0.114 0.985 -0.206) 1.013 88.811 ( -0.214 -0.306 2.198) 2.229 88.811 ( -0.214 0.306 2.198) 2.229 89.256 ( 1.416 -5.109 -1.347) 5.470 89.256 ( 1.416 5.109 -1.347) 5.470 97.684 ( 0.632 -0.482 0.534) 0.957 97.684 ( 0.632 0.482 0.534) 0.957 97.767 ( 0.507 -2.492 -0.244) 2.555 97.767 ( 0.507 2.492 -0.244) 2.555 98.745 ( 1.005 -1.027 0.056) 1.438 98.745 ( 1.005 1.027 0.056) 1.438 98.856 ( -2.107 -0.189 0.578) 2.193 98.856 ( -2.107 0.189 0.578) 2.193 99.639 ( 0.101 -1.754 1.302) 2.187 99.639 ( 0.101 1.754 1.302) 2.187 100.036 ( 0.822 -9.118 -1.979) 9.366 100.036 ( 0.822 9.118 -1.979) 9.366 ======================= 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| 1.557 ( -5.876 -2.313 -3.847) 7.394 1.557 ( -5.876 2.313 -3.847) 7.394 1.916 ( -3.452 -4.803 -12.502) 13.830 1.916 ( -3.452 4.803 -12.502) 13.830 1.992 ( 4.173 -1.515 -0.637) 4.485 1.992 ( 4.173 1.515 -0.637) 4.485 2.181 ( 2.733 -3.461 -6.649) 7.979 2.181 ( 2.733 3.461 -6.649) 7.979 2.281 ( -3.222 -2.361 4.951) 6.362 2.281 ( -3.222 2.361 4.951) 6.362 2.396 ( -0.502 -5.413 -0.097) 5.437 2.396 ( -0.502 5.413 -0.097) 5.437 2.595 ( 1.419 -2.511 -0.849) 3.007 2.595 ( 1.419 2.511 -0.849) 3.007 2.738 ( -0.309 -2.437 -2.006) 3.171 2.738 ( -0.309 2.437 -2.006) 3.171 2.958 ( -2.386 -2.285 0.738) 3.385 2.958 ( -2.386 2.285 0.738) 3.385 3.110 ( 0.074 -2.250 3.975) 4.568 3.110 ( 0.074 2.250 3.975) 4.568 3.298 ( -0.963 -0.706 7.838) 7.928 3.298 ( -0.963 0.706 7.838) 7.928 3.657 ( 2.650 -2.449 2.406) 4.337 3.657 ( 2.650 2.449 2.406) 4.337 4.355 ( 0.898 -3.294 0.673) 3.480 4.355 ( 0.898 3.294 0.673) 3.480 4.497 ( -1.189 -2.811 2.214) 3.771 4.497 ( -1.189 2.811 2.214) 3.771 4.778 ( -1.264 -4.757 -3.816) 6.228 4.778 ( -1.264 4.757 -3.816) 6.228 5.110 ( 4.700 -2.896 -1.204) 5.650 5.110 ( 4.700 2.896 -1.204) 5.650 5.235 ( 2.526 -2.452 2.869) 4.541 5.235 ( 2.526 2.452 2.869) 4.541 5.257 ( 1.128 -3.788 2.730) 4.804 5.257 ( 1.128 3.788 2.730) 4.804 5.465 ( 2.118 -0.886 0.363) 2.324 5.465 ( 2.118 0.886 0.363) 2.324 5.686 ( 3.588 -2.370 -0.567) 4.337 5.686 ( 3.588 2.370 -0.567) 4.337 5.935 ( -5.719 -4.115 2.506) 7.478 5.935 ( -5.719 4.115 2.506) 7.478 6.138 ( 5.061 -2.362 0.891) 5.656 6.138 ( 5.061 2.362 0.891) 5.656 6.505 ( 0.423 -7.355 4.657) 8.716 6.505 ( 0.423 7.355 4.657) 8.716 6.560 ( -0.333 -2.468 1.095) 2.721 6.560 ( -0.333 2.468 1.095) 2.721 6.938 ( 0.778 -3.117 -1.802) 3.684 6.938 ( 0.778 3.117 -1.802) 3.684 7.197 ( -0.196 -5.744 -6.690) 8.820 7.197 ( -0.196 5.744 -6.690) 8.820 7.752 ( -2.256 -1.850 -2.994) 4.181 7.752 ( -2.256 1.850 -2.994) 4.181 7.953 ( 4.078 -7.157 0.054) 8.238 7.953 ( 4.078 7.157 0.054) 8.238 8.378 ( -0.730 -11.489 1.968) 11.679 8.378 ( -0.730 11.489 1.968) 11.679 8.672 ( -0.269 -2.550 3.022) 3.964 8.672 ( -0.269 2.550 3.022) 3.964 9.154 ( 1.194 -5.691 -4.199) 7.172 9.154 ( 1.194 5.691 -4.199) 7.172 9.345 ( -5.656 -4.149 0.368) 7.024 9.345 ( -5.656 4.149 0.368) 7.024 9.656 ( -1.404 -2.723 1.705) 3.506 9.656 ( -1.404 2.723 1.705) 3.506 9.890 ( 1.731 -2.216 -2.279) 3.619 9.890 ( 1.731 2.216 -2.279) 3.619 10.481 ( -1.696 -3.904 3.294) 5.382 10.481 ( -1.696 3.904 3.294) 5.382 10.778 ( -0.010 -10.124 -2.970) 10.551 10.778 ( -0.010 10.124 -2.970) 10.551 20.550 ( 0.923 -0.283 0.217) 0.990 20.550 ( 0.923 0.283 0.217) 0.990 20.874 ( 0.455 -0.744 -0.076) 0.876 20.874 ( 0.455 0.744 -0.076) 0.876 22.843 ( 0.595 -2.644 1.569) 3.131 22.843 ( 0.595 2.644 1.569) 3.131 23.090 ( -0.271 -2.392 -1.811) 3.012 23.090 ( -0.271 2.392 -1.811) 3.012 24.554 ( 0.454 -1.103 0.544) 1.311 24.554 ( 0.454 1.103 0.544) 1.311 25.028 ( -0.847 -0.431 -0.852) 1.277 25.028 ( -0.847 0.431 -0.852) 1.277 25.674 ( 1.586 -1.138 0.150) 1.957 25.674 ( 1.586 1.138 0.150) 1.957 26.023 ( 1.040 -0.349 0.223) 1.120 26.023 ( 1.040 0.349 0.223) 1.120 28.332 ( -1.622 -0.740 1.639) 2.421 28.332 ( -1.622 0.740 1.639) 2.421 28.539 ( 1.722 -0.435 -0.360) 1.812 28.539 ( 1.722 0.435 -0.360) 1.812 28.634 ( -0.347 -2.735 -1.069) 2.957 28.634 ( -0.347 2.735 -1.069) 2.957 28.814 ( 0.233 -1.951 -0.736) 2.098 28.814 ( 0.233 1.951 -0.736) 2.098 32.380 ( -0.665 -0.439 0.058) 0.799 32.380 ( -0.665 0.439 0.058) 0.799 32.537 ( 0.304 -0.764 -0.460) 0.943 32.537 ( 0.304 0.764 -0.460) 0.943 35.428 ( -0.766 -0.386 0.306) 0.910 35.428 ( -0.766 0.386 0.306) 0.910 35.510 ( 0.831 -0.764 -0.091) 1.132 35.510 ( 0.831 0.764 -0.091) 1.132 88.823 ( -1.465 -0.794 2.619) 3.104 88.823 ( -1.465 0.794 2.619) 3.104 89.238 ( -1.388 -3.841 -1.883) 4.498 89.238 ( -1.388 3.841 -1.883) 4.498 97.694 ( -0.413 -0.904 0.870) 1.321 97.694 ( -0.413 0.904 0.870) 1.321 97.758 ( -0.872 -2.036 -0.545) 2.281 97.758 ( -0.872 2.036 -0.545) 2.281 98.745 ( -1.189 -0.595 0.084) 1.332 98.745 ( -1.189 0.595 0.084) 1.332 98.863 ( 2.425 -0.492 0.691) 2.569 98.863 ( 2.425 0.492 0.691) 2.569 99.670 ( 0.942 -1.739 2.316) 3.046 99.670 ( 0.942 1.739 2.316) 3.046 100.009 ( -0.779 -7.979 -2.903) 8.527 100.009 ( -0.779 7.979 -2.903) 8.527 ======================= 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| 1.409 ( -7.206 -4.038 -3.073) 8.813 1.409 ( -7.206 4.038 -3.073) 8.813 1.713 ( -6.738 -3.622 -6.673) 10.152 1.713 ( -6.738 3.622 -6.673) 10.152 2.009 ( 0.052 -5.353 -2.071) 5.740 2.009 ( 0.052 5.353 -2.071) 5.740 2.156 ( 1.475 -2.339 -5.333) 6.007 2.156 ( 1.475 2.339 -5.333) 6.007 2.285 ( -0.831 -2.050 3.951) 4.528 2.285 ( -0.831 2.050 3.951) 4.528 2.440 ( 2.237 -1.629 3.202) 4.232 2.440 ( 2.237 1.629 3.202) 4.232 2.603 ( 1.686 -1.909 -1.616) 3.017 2.603 ( 1.686 1.909 -1.616) 3.017 2.712 ( -2.621 -7.280 -0.738) 7.772 2.712 ( -2.621 7.280 -0.738) 7.772 2.935 ( 0.323 -4.892 -1.123) 5.030 2.935 ( 0.323 4.892 -1.123) 5.030 3.178 ( 3.059 -3.571 3.399) 5.802 3.178 ( 3.059 3.571 3.399) 5.802 3.334 ( -1.651 -1.528 4.152) 4.722 3.334 ( -1.651 1.528 4.152) 4.722 3.703 ( -0.240 -1.993 1.843) 2.725 3.703 ( -0.240 1.993 1.843) 2.725 4.361 ( -0.978 -2.911 0.015) 3.071 4.361 ( -0.978 2.911 0.015) 3.071 4.531 ( 2.902 -2.994 1.212) 4.342 4.531 ( 2.902 2.994 1.212) 4.342 4.766 ( 3.623 -4.763 -0.988) 6.066 4.766 ( 3.623 4.763 -0.988) 6.066 5.152 ( 0.757 -3.748 -0.922) 3.933 5.152 ( 0.757 3.748 -0.922) 3.933 5.227 ( -1.388 -2.914 0.823) 3.331 5.227 ( -1.388 2.914 0.823) 3.331 5.382 ( 6.273 -0.858 2.696) 6.881 5.382 ( 6.273 0.858 2.696) 6.881 5.529 ( 4.637 -0.671 -2.214) 5.183 5.529 ( 4.637 0.671 -2.214) 5.183 5.741 ( 5.451 -1.918 -2.699) 6.378 5.741 ( 5.451 1.918 -2.699) 6.378 5.890 ( -1.979 -2.399 2.662) 4.094 5.890 ( -1.979 2.399 2.662) 4.094 6.324 ( 10.716 -5.456 5.805) 13.353 6.324 ( 10.716 5.456 5.805) 13.353 6.473 ( -3.253 -4.342 -0.631) 5.462 6.473 ( -3.253 4.342 -0.631) 5.462 6.596 ( -0.277 -6.109 2.532) 6.619 6.596 ( -0.277 6.109 2.532) 6.619 6.963 ( 3.526 -3.656 -0.617) 5.116 6.963 ( 3.526 3.656 -0.617) 5.116 7.152 ( 2.572 -6.131 -3.678) 7.598 7.152 ( 2.572 6.131 -3.678) 7.598 7.676 ( -1.624 -1.443 -4.759) 5.232 7.676 ( -1.624 1.443 -4.759) 5.232 8.036 ( 4.596 -7.657 0.983) 8.985 8.036 ( 4.596 7.657 0.983) 8.985 8.401 ( 0.161 -10.563 3.175) 11.031 8.401 ( 0.161 10.563 3.175) 11.031 8.692 ( 0.641 -2.564 0.640) 2.719 8.692 ( 0.641 2.564 0.640) 2.719 9.110 ( -3.344 -6.168 -0.645) 7.046 9.110 ( -3.344 6.168 -0.645) 7.046 9.250 ( -5.394 -2.456 -0.913) 5.997 9.250 ( -5.394 2.456 -0.913) 5.997 9.609 ( -4.460 -3.079 -0.682) 5.463 9.609 ( -4.460 3.079 -0.682) 5.463 9.878 ( -1.565 -2.536 -0.624) 3.045 9.878 ( -1.565 2.536 -0.624) 3.045 10.482 ( -1.864 -6.507 2.593) 7.248 10.482 ( -1.864 6.507 2.593) 7.248 10.734 ( -1.509 -8.594 -2.757) 9.151 10.734 ( -1.509 8.594 -2.757) 9.151 20.579 ( 2.297 -0.469 0.164) 2.350 20.579 ( 2.297 0.469 0.164) 2.350 20.889 ( 1.290 -0.535 -0.020) 1.396 20.889 ( 1.290 0.535 -0.020) 1.396 22.858 ( -0.369 -1.011 0.447) 1.165 22.858 ( -0.369 1.011 0.447) 1.165 23.080 ( 0.930 -1.253 -0.724) 1.720 23.080 ( 0.930 1.253 -0.724) 1.720 24.577 ( 1.555 -0.859 0.510) 1.848 24.577 ( 1.555 0.859 0.510) 1.848 24.997 ( -1.795 -0.539 -0.595) 1.966 24.997 ( -1.795 0.539 -0.595) 1.966 25.721 ( 3.788 -1.034 -0.043) 3.926 25.721 ( 3.788 1.034 -0.043) 3.926 26.060 ( 2.897 -0.563 0.354) 2.973 26.060 ( 2.897 0.563 0.354) 2.973 28.319 ( -1.838 -0.325 1.352) 2.305 28.319 ( -1.838 0.325 1.352) 2.305 28.569 ( 1.749 -0.452 0.352) 1.840 28.569 ( 1.749 0.452 0.352) 1.840 28.617 ( -0.005 -2.215 -1.461) 2.653 28.617 ( -0.005 2.215 -1.461) 2.653 28.806 ( -0.326 -0.721 -0.791) 1.119 28.806 ( -0.326 0.721 -0.791) 1.119 32.366 ( -1.105 -0.798 0.059) 1.364 32.366 ( -1.105 0.798 0.059) 1.364 32.535 ( 0.087 -1.474 -0.442) 1.541 32.535 ( 0.087 1.474 -0.442) 1.541 35.417 ( -0.760 -0.638 0.221) 1.017 35.417 ( -0.760 0.638 0.221) 1.017 35.528 ( 1.297 -0.336 0.060) 1.341 35.528 ( 1.297 0.336 0.060) 1.341 88.818 ( -2.622 -1.230 2.857) 4.068 88.818 ( -2.622 1.230 2.857) 4.068 89.177 ( -3.456 -2.486 -1.682) 4.577 89.177 ( -3.456 2.486 -1.682) 4.577 97.685 ( -1.594 -0.809 0.558) 1.873 97.685 ( -1.594 0.809 0.558) 1.873 97.733 ( -1.504 -1.123 -0.223) 1.890 97.733 ( -1.504 1.123 -0.223) 1.890 98.720 ( -1.534 -0.200 -0.151) 1.554 98.720 ( -1.534 0.200 -0.151) 1.554 98.939 ( 5.147 -1.513 1.041) 5.465 98.939 ( 5.147 1.513 1.041) 5.465 99.707 ( 0.761 -0.808 1.452) 1.828 99.707 ( 0.761 0.808 1.452) 1.828 99.956 ( -1.865 -5.045 -2.541) 5.948 99.956 ( -1.865 5.045 -2.541) 5.948 ======================= 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| 1.278 ( -4.859 -5.515 -0.893) 7.405 1.278 ( -4.859 5.515 -0.893) 7.405 1.575 ( -6.194 -9.252 1.058) 11.184 1.575 ( -6.194 9.252 1.058) 11.184 1.996 ( 0.371 -4.902 -1.134) 5.045 1.996 ( 0.371 4.902 -1.134) 5.045 2.115 ( 0.034 -4.239 -3.129) 5.269 2.115 ( 0.034 4.239 -3.129) 5.269 2.320 ( -1.438 -1.962 4.385) 5.015 2.320 ( -1.438 1.962 4.385) 5.015 2.499 ( -0.113 -6.473 2.354) 6.889 2.499 ( -0.113 6.473 2.354) 6.889 2.595 ( -4.630 -9.631 -1.433) 10.782 2.595 ( -4.630 9.631 -1.433) 10.782 2.655 ( 2.391 -3.527 -0.354) 4.276 2.655 ( 2.391 3.527 -0.354) 4.276 2.955 ( 3.553 -4.019 -1.686) 5.623 2.955 ( 3.553 4.019 -1.686) 5.623 3.261 ( 1.658 -3.600 2.250) 4.558 3.261 ( 1.658 3.600 2.250) 4.558 3.354 ( 2.744 -2.293 -0.475) 3.607 3.354 ( 2.744 2.293 -0.475) 3.607 3.682 ( -3.606 -1.412 0.405) 3.894 3.682 ( -3.606 1.412 0.405) 3.894 4.336 ( -1.411 -3.460 -0.308) 3.750 4.336 ( -1.411 3.460 -0.308) 3.750 4.595 ( 4.188 -3.331 -0.546) 5.379 4.595 ( 4.188 3.331 -0.546) 5.379 4.864 ( 6.252 -5.601 0.971) 8.450 4.864 ( 6.252 5.601 0.971) 8.450 5.133 ( 0.755 -4.490 -1.377) 4.756 5.133 ( 0.755 4.490 -1.377) 4.756 5.248 ( 0.851 -2.045 3.737) 4.344 5.248 ( 0.851 2.045 3.737) 4.344 5.479 ( 3.625 -1.366 -1.588) 4.186 5.479 ( 3.625 1.366 -1.588) 4.186 5.533 ( -0.119 -1.993 -2.874) 3.499 5.533 ( -0.119 1.993 -2.874) 3.499 5.791 ( 1.423 -2.485 0.831) 2.981 5.791 ( 1.423 2.485 0.831) 2.981 5.941 ( 5.402 -2.658 -0.058) 6.020 5.941 ( 5.402 2.658 -0.058) 6.020 6.363 ( -4.717 -1.456 -1.368) 5.123 6.363 ( -4.717 1.456 -1.368) 5.123 6.490 ( -1.173 -2.108 -0.123) 2.416 6.490 ( -1.173 2.108 -0.123) 2.416 6.715 ( 12.415 -4.767 3.026) 13.638 6.715 ( 12.415 4.767 3.026) 13.638 7.035 ( 3.980 -6.248 3.781) 8.317 7.035 ( 3.980 6.248 3.781) 8.317 7.219 ( 7.289 -4.929 -0.119) 8.800 7.219 ( 7.289 4.929 -0.119) 8.800 7.604 ( -0.189 -1.738 -5.451) 5.725 7.604 ( -0.189 1.738 -5.451) 5.725 8.114 ( 3.955 -7.630 0.315) 8.600 8.114 ( 3.955 7.630 0.315) 8.600 8.440 ( -1.351 -6.348 4.964) 8.171 8.440 ( -1.351 6.348 4.964) 8.171 8.709 ( 2.274 -3.239 -2.503) 4.682 8.709 ( 2.274 3.239 -2.503) 4.682 9.039 ( -7.299 -7.357 4.302) 11.221 9.039 ( -7.299 7.357 4.302) 11.221 9.155 ( -3.354 -2.307 -2.082) 4.573 9.155 ( -3.354 2.307 -2.082) 4.573 9.506 ( -6.656 -2.309 -0.974) 7.112 9.506 ( -6.656 2.309 -0.974) 7.112 9.829 ( -2.877 -2.101 -0.915) 3.678 9.829 ( -2.877 2.101 -0.915) 3.678 10.472 ( -1.856 -7.174 0.946) 7.471 10.472 ( -1.856 7.174 0.946) 7.471 10.676 ( -1.955 -7.555 -2.173) 8.100 10.676 ( -1.955 7.555 -2.173) 8.100 20.625 ( 3.096 -0.797 -0.306) 3.211 20.625 ( 3.096 0.797 -0.306) 3.211 20.913 ( 1.512 -0.309 0.151) 1.550 20.913 ( 1.512 0.309 0.151) 1.550 22.844 ( -0.692 -1.182 -0.690) 1.534 22.844 ( -0.692 1.182 -0.690) 1.534 23.100 ( 1.301 -1.408 0.347) 1.949 23.100 ( 1.301 1.408 0.347) 1.949 24.612 ( 1.978 -0.591 0.466) 2.116 24.612 ( 1.978 0.591 0.466) 2.116 24.960 ( -2.153 -0.487 0.018) 2.208 24.960 ( -2.153 0.487 0.018) 2.208 25.792 ( 4.621 -0.927 -0.247) 4.720 25.792 ( 4.621 0.927 -0.247) 4.720 26.119 ( 3.483 -1.674 0.275) 3.874 26.119 ( 3.483 1.674 0.275) 3.874 28.304 ( -1.427 -0.368 1.237) 1.925 28.304 ( -1.427 0.368 1.237) 1.925 28.586 ( -1.507 -1.695 1.334) 2.631 28.586 ( -1.507 1.695 1.334) 2.631 28.617 ( 2.798 -1.212 -1.819) 3.550 28.617 ( 2.798 1.212 -1.819) 3.550 28.786 ( -0.972 -0.405 -0.921) 1.399 28.786 ( -0.972 0.405 -0.921) 1.399 32.347 ( -1.313 -0.828 0.403) 1.604 32.347 ( -1.313 0.828 0.403) 1.604 32.531 ( 0.105 -2.079 -0.568) 2.158 32.531 ( 0.105 2.079 -0.568) 2.158 35.410 ( -0.344 -1.181 0.252) 1.255 35.410 ( -0.344 1.181 0.252) 1.255 35.551 ( 1.244 -0.402 0.013) 1.308 35.551 ( 1.244 0.402 0.013) 1.308 88.800 ( -3.164 -1.490 2.934) 4.565 88.800 ( -3.164 1.490 2.934) 4.565 89.095 ( -4.265 -1.828 -1.226) 4.799 89.095 ( -4.265 1.828 -1.226) 4.799 97.659 ( -1.728 -0.319 0.078) 1.759 97.659 ( -1.728 0.319 0.078) 1.759 97.705 ( -1.845 -0.969 0.141) 2.089 97.705 ( -1.845 0.969 0.141) 2.089 98.697 ( -0.961 -0.147 -0.068) 0.974 98.697 ( -0.961 0.147 -0.068) 0.974 99.042 ( 5.865 -3.189 0.521) 6.697 99.042 ( 5.865 3.189 0.521) 6.697 99.716 ( -0.054 -1.833 -0.909) 2.047 99.716 ( -0.054 1.833 -0.909) 2.047 99.905 ( -2.107 -0.354 -0.468) 2.187 99.905 ( -2.107 0.354 -0.468) 2.187 ======================= 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| 1.261 ( -0.661 -8.884 6.764) 11.185 1.261 ( -0.661 8.884 6.764) 11.185 1.521 ( -4.161 -15.254 4.118) 16.338 1.521 ( -4.161 15.254 4.118) 16.338 1.980 ( 0.597 -4.341 -3.046) 5.337 1.980 ( 0.597 4.341 -3.046) 5.337 2.091 ( 0.289 -1.943 -3.717) 4.204 2.091 ( 0.289 1.943 -3.717) 4.204 2.302 ( -7.635 -7.395 3.847) 11.304 2.302 ( -7.635 7.395 3.847) 11.304 2.460 ( -0.917 -5.517 2.925) 6.312 2.460 ( -0.917 5.517 2.925) 6.312 2.579 ( -0.033 -6.054 2.709) 6.633 2.579 ( -0.033 6.054 2.709) 6.633 2.717 ( 3.584 -4.680 -0.279) 5.901 2.717 ( 3.584 4.680 -0.279) 5.901 3.005 ( 3.521 -4.734 -0.081) 5.901 3.005 ( 3.521 4.734 -0.081) 5.901 3.252 ( -0.613 -1.535 -3.967) 4.297 3.252 ( -0.613 1.535 -3.967) 4.297 3.418 ( 4.605 -4.463 -1.432) 6.571 3.418 ( 4.605 4.463 -1.432) 6.571 3.605 ( -4.620 -0.947 -1.484) 4.944 3.605 ( -4.620 0.947 -1.484) 4.944 4.318 ( -0.669 -3.196 0.682) 3.336 4.318 ( -0.669 3.196 0.682) 3.336 4.648 ( 3.530 -2.109 -2.828) 4.991 4.648 ( 3.530 2.109 -2.828) 4.991 4.944 ( 3.495 -5.895 0.991) 6.924 4.944 ( 3.495 5.895 0.991) 6.924 5.190 ( 3.581 -2.700 2.411) 5.092 5.190 ( 3.581 2.700 2.411) 5.092 5.319 ( 2.150 -1.027 3.123) 3.928 5.319 ( 2.150 1.027 3.123) 3.928 5.439 ( -2.028 -1.111 -5.660) 6.114 5.439 ( -2.028 1.111 -5.660) 6.114 5.512 ( -2.031 -1.813 2.460) 3.669 5.512 ( -2.031 1.813 2.460) 3.669 5.823 ( 2.394 -1.198 -0.580) 2.739 5.823 ( 2.394 1.198 -0.580) 2.739 6.024 ( 3.156 -3.902 1.970) 5.392 6.024 ( 3.156 3.902 1.970) 5.392 6.277 ( -1.872 -2.519 -3.698) 4.850 6.277 ( -1.872 2.519 -3.698) 4.850 6.441 ( -3.644 -0.617 1.008) 3.830 6.441 ( -3.644 0.617 1.008) 3.830 6.889 ( 7.916 -4.373 -2.623) 9.417 6.889 ( 7.916 4.373 -2.623) 9.417 7.139 ( 2.394 -4.670 -0.904) 5.325 7.139 ( 2.394 4.670 -0.904) 5.325 7.352 ( 3.929 -9.536 1.453) 10.416 7.352 ( 3.929 9.536 1.453) 10.416 7.610 ( 6.833 -3.695 2.615) 8.196 7.610 ( 6.833 3.695 2.615) 8.196 8.185 ( 4.473 -9.057 0.945) 10.146 8.185 ( 4.473 9.057 0.945) 10.146 8.429 ( -4.772 -0.860 0.763) 4.909 8.429 ( -4.772 0.860 0.763) 4.909 8.708 ( -0.301 -2.986 0.222) 3.009 8.708 ( -0.301 2.986 0.222) 3.009 8.957 ( -7.512 -6.309 3.983) 10.587 8.957 ( -7.512 6.309 3.983) 10.587 9.129 ( 0.663 -0.388 0.602) 0.976 9.129 ( 0.663 0.388 0.602) 0.976 9.383 ( -5.976 -3.102 -1.032) 6.812 9.383 ( -5.976 3.102 -1.032) 6.812 9.776 ( -1.118 -2.396 -2.506) 3.643 9.776 ( -1.118 2.396 -2.506) 3.643 10.433 ( -2.224 -3.607 -1.287) 4.429 10.433 ( -2.224 3.607 -1.287) 4.429 10.640 ( -0.306 -5.358 -0.786) 5.424 10.640 ( -0.306 5.358 -0.786) 5.424 20.665 ( 2.314 -1.547 -1.301) 3.073 20.665 ( 2.314 1.547 -1.301) 3.073 20.938 ( 0.993 -0.513 0.343) 1.169 20.938 ( 0.993 0.513 0.343) 1.169 22.831 ( -0.015 -1.480 -0.414) 1.537 22.831 ( -0.015 1.480 -0.414) 1.537 23.118 ( 0.507 -1.379 0.033) 1.469 23.118 ( 0.507 1.379 0.033) 1.469 24.647 ( 1.404 -0.361 0.464) 1.522 24.647 ( 1.404 0.361 0.464) 1.522 24.932 ( -1.591 -0.221 0.730) 1.765 24.932 ( -1.591 0.221 0.730) 1.765 25.858 ( 3.391 -0.552 -0.321) 3.451 25.858 ( 3.391 0.552 -0.321) 3.451 26.169 ( 2.186 -3.015 -0.399) 3.745 26.169 ( 2.186 3.015 -0.399) 3.745 28.302 ( -0.618 -0.773 1.658) 1.931 28.302 ( -0.618 0.773 1.658) 1.931 28.568 ( -1.900 -0.440 1.304) 2.346 28.568 ( -1.900 0.440 1.304) 2.346 28.651 ( 2.573 -0.398 -0.766) 2.714 28.651 ( 2.573 0.398 -0.766) 2.714 28.757 ( -1.040 -1.486 -1.260) 2.208 28.757 ( -1.040 1.486 -1.260) 2.208 32.336 ( -0.930 -0.717 1.120) 1.623 32.336 ( -0.930 0.717 1.120) 1.623 32.526 ( 0.206 -2.439 -0.841) 2.588 32.526 ( 0.206 2.439 -0.841) 2.588 35.410 ( -0.056 -1.606 0.327) 1.640 35.410 ( -0.056 1.606 0.327) 1.640 35.566 ( 0.705 -0.864 -0.332) 1.164 35.566 ( 0.705 0.864 -0.332) 1.164 88.779 ( -3.169 -1.538 3.049) 4.659 88.779 ( -3.169 1.538 3.049) 4.659 89.020 ( -2.714 -2.018 -1.219) 3.595 89.020 ( -2.714 2.018 -1.219) 3.595 97.637 ( -0.904 -0.062 -0.003) 0.906 97.637 ( -0.904 0.062 -0.003) 0.906 97.676 ( -1.561 -0.672 -0.025) 1.700 97.676 ( -1.561 0.672 -0.025) 1.700 98.688 ( -0.355 -0.359 0.355) 0.618 98.688 ( -0.355 0.359 0.355) 0.618 99.121 ( 3.739 -5.144 -1.773) 6.602 99.121 ( 3.739 5.144 -1.773) 6.602 99.705 ( 0.542 -1.390 -0.536) 1.585 99.705 ( 0.542 1.390 -0.536) 1.585 99.874 ( -1.842 -3.389 0.466) 3.885 99.874 ( -1.842 3.389 0.466) 3.885 ======================= 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| 0.879 ( 0.006 0.000 21.722) 21.722 0.943 ( -7.007 0.000 20.738) 21.889 1.330 ( -0.686 0.000 -17.097) 17.110 1.369 ( 6.101 0.000 -17.938) 18.947 1.710 ( -3.454 0.000 22.998) 23.256 1.983 ( 1.934 0.000 -3.503) 4.002 2.213 ( -0.995 0.000 6.927) 6.998 2.273 ( 0.806 0.000 5.405) 5.464 2.408 ( 3.403 0.000 9.868) 10.438 2.466 ( -1.874 0.000 -0.215) 1.886 2.566 ( 4.622 0.000 -0.651) 4.668 2.603 ( -6.506 0.000 0.042) 6.506 2.667 ( 5.362 0.000 1.880) 5.682 2.749 ( -3.020 0.000 -0.469) 3.056 2.772 ( 4.163 0.000 -0.573) 4.203 2.835 ( -3.381 0.000 -0.333) 3.398 2.916 ( 4.243 0.000 -3.501) 5.501 2.917 ( -2.336 0.000 -9.667) 9.945 3.088 ( 0.483 0.000 -2.679) 2.722 3.188 ( -0.526 0.000 0.787) 0.947 3.189 ( -1.661 0.000 -3.288) 3.684 3.265 ( -0.921 0.000 -7.788) 7.842 3.354 ( -1.447 0.000 3.216) 3.526 3.436 ( 0.085 0.000 -4.327) 4.328 4.375 ( -1.377 0.000 1.893) 2.341 4.413 ( 1.470 0.000 -1.640) 2.202 4.846 ( -6.024 0.000 8.644) 10.536 4.857 ( 1.808 0.000 1.139) 2.137 4.868 ( -2.620 0.000 -0.094) 2.621 5.010 ( 3.558 0.000 -4.358) 5.626 5.196 ( 4.889 0.000 0.262) 4.896 5.230 ( -3.799 0.000 -4.775) 6.102 5.297 ( -2.019 0.000 6.327) 6.641 5.431 ( 0.223 0.000 -5.535) 5.539 5.444 ( -1.055 0.000 7.461) 7.536 5.588 ( 1.654 0.000 -5.493) 5.736 5.653 ( 0.646 0.000 7.892) 7.918 5.802 ( -1.769 0.000 -3.123) 3.589 5.881 ( 2.686 0.000 -0.337) 2.708 5.889 ( 1.631 0.000 -2.248) 2.777 5.975 ( -1.777 0.000 4.558) 4.892 6.027 ( -0.496 0.000 1.681) 1.752 6.097 ( 2.045 0.000 -4.779) 5.198 6.106 ( -2.212 0.000 -6.812) 7.162 6.368 ( -3.788 0.000 2.199) 4.380 6.427 ( -1.404 0.000 0.182) 1.416 6.473 ( 5.030 0.000 0.010) 5.030 6.624 ( 0.725 0.000 -10.362) 10.387 7.080 ( 0.093 0.000 1.606) 1.609 7.114 ( 0.609 0.000 -1.543) 1.659 7.233 ( -4.899 0.000 0.254) 4.905 7.242 ( 5.065 0.000 -0.157) 5.068 7.910 ( 11.304 0.000 7.628) 13.637 8.016 ( -12.952 0.000 -3.184) 13.338 8.194 ( 1.254 0.000 5.623) 5.761 8.274 ( -6.651 0.000 0.338) 6.659 8.595 ( 11.004 0.000 2.501) 11.284 8.656 ( -2.970 0.000 -2.902) 4.152 8.711 ( 1.191 0.000 2.167) 2.473 8.737 ( -6.208 0.000 0.632) 6.240 8.870 ( -1.721 0.000 4.239) 4.575 8.956 ( 0.283 0.000 -2.092) 2.111 9.087 ( -2.495 0.000 7.773) 8.163 9.204 ( -3.868 0.000 3.169) 5.000 9.293 ( 10.405 0.000 -9.620) 14.171 9.367 ( 4.775 0.000 -10.955) 11.951 9.595 ( -8.135 0.000 8.941) 12.088 9.783 ( 7.522 0.000 -8.201) 11.128 10.289 ( -10.052 0.000 1.262) 10.131 10.304 ( 8.136 0.000 -0.401) 8.146 10.818 ( -10.365 0.000 4.531) 11.312 10.901 ( 6.773 0.000 -2.931) 7.380 20.503 ( -0.025 0.000 2.024) 2.024 20.555 ( 0.180 0.000 -2.590) 2.596 20.892 ( -0.647 0.000 0.853) 1.071 20.907 ( 0.556 0.000 -0.496) 0.745 22.807 ( 2.753 0.000 1.253) 3.025 22.836 ( -2.808 0.000 -1.339) 3.111 23.077 ( 2.326 0.000 1.151) 2.595 23.106 ( -2.130 0.000 -1.391) 2.544 24.772 ( 2.147 0.000 1.207) 2.463 24.800 ( -2.466 0.000 -1.373) 2.822 24.899 ( -0.876 0.000 0.450) 0.984 24.903 ( 1.288 0.000 0.050) 1.289 25.868 ( 1.489 0.000 0.107) 1.493 25.871 ( -1.273 0.000 -0.098) 1.277 26.117 ( 1.222 0.000 3.906) 4.093 26.203 ( -3.633 0.000 -3.767) 5.234 28.362 ( -0.331 0.000 3.618) 3.633 28.433 ( -2.164 0.000 -2.482) 3.293 28.551 ( -0.341 0.000 0.568) 0.663 28.576 ( 1.488 0.000 -1.506) 2.117 28.699 ( -1.040 0.000 2.851) 3.035 28.738 ( -3.538 0.000 0.439) 3.565 28.780 ( 4.576 0.000 -0.597) 4.614 28.792 ( 2.991 0.000 -2.605) 3.967 32.328 ( -1.144 0.000 1.891) 2.210 32.370 ( 1.194 0.000 -1.887) 2.233 32.528 ( 0.197 0.000 1.767) 1.778 32.568 ( 0.270 0.000 -1.852) 1.872 35.404 ( -0.344 0.000 2.547) 2.570 35.464 ( 0.241 0.000 -2.820) 2.831 35.478 ( -0.336 0.000 2.708) 2.728 35.535 ( -0.295 0.000 -2.353) 2.371 88.795 ( -3.180 0.000 1.739) 3.625 88.843 ( 2.312 0.000 -2.602) 3.481 89.104 ( -19.903 0.000 1.389) 19.952 89.127 ( 10.898 0.000 -0.622) 10.915 97.608 ( 1.032 0.000 -0.130) 1.040 97.610 ( -1.504 0.000 -0.310) 1.535 97.681 ( -2.645 0.000 0.602) 2.713 97.690 ( 1.648 0.000 -0.267) 1.670 98.711 ( -0.610 0.000 1.419) 1.545 98.732 ( 0.593 0.000 -0.381) 0.705 98.792 ( 1.255 0.000 0.400) 1.317 98.813 ( -0.993 0.000 -1.537) 1.830 99.630 ( -0.390 0.000 1.779) 1.821 99.672 ( 0.880 0.000 -2.014) 2.198 100.022 ( -10.239 0.000 1.131) 10.301 100.043 ( 15.459 0.000 -0.721) 15.476 ======================= 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| 1.092 ( 1.324 0.000 9.101) 9.196 1.130 ( 4.526 0.000 12.866) 13.639 1.201 ( 8.735 0.000 -10.400) 13.582 1.340 ( 10.320 0.000 -11.661) 15.572 1.873 ( -1.175 0.000 10.429) 10.495 1.966 ( 3.700 0.000 -6.217) 7.235 2.269 ( -0.540 0.000 2.993) 3.041 2.337 ( 1.940 0.000 1.389) 2.386 2.433 ( -1.108 0.000 0.129) 1.115 2.466 ( -5.769 0.000 -3.679) 6.843 2.508 ( 5.276 0.000 -3.715) 6.453 2.606 ( -2.901 0.000 -4.816) 5.622 2.666 ( -5.599 0.000 -1.221) 5.731 2.711 ( 1.037 0.000 -1.320) 1.679 2.761 ( -1.775 0.000 3.553) 3.972 2.803 ( -3.124 0.000 -1.166) 3.335 2.869 ( 4.841 0.000 4.325) 6.492 2.936 ( 2.021 0.000 -1.907) 2.779 3.094 ( -0.955 0.000 -5.593) 5.674 3.172 ( 2.419 0.000 6.048) 6.514 3.192 ( -1.340 0.000 3.960) 4.180 3.213 ( 0.293 0.000 -2.584) 2.600 3.364 ( -2.612 0.000 5.789) 6.351 3.407 ( 0.912 0.000 -3.429) 3.548 4.395 ( 1.408 0.000 1.387) 1.977 4.438 ( 3.370 0.000 -1.256) 3.596 4.797 ( -5.016 0.000 -0.742) 5.070 4.822 ( -6.128 0.000 7.857) 9.964 4.894 ( -0.639 0.000 1.156) 1.321 5.005 ( -0.397 0.000 -1.520) 1.571 5.138 ( 0.497 0.000 -5.128) 5.152 5.218 ( -8.087 0.000 3.665) 8.878 5.295 ( -1.509 0.000 4.915) 5.141 5.307 ( -5.844 0.000 -5.384) 7.946 5.518 ( 0.416 0.000 7.094) 7.106 5.558 ( 0.726 0.000 -6.679) 6.719 5.725 ( -1.247 0.000 -5.991) 6.120 5.748 ( -1.729 0.000 6.612) 6.834 5.855 ( -1.236 0.000 -1.330) 1.816 5.878 ( 0.543 0.000 -3.732) 3.772 6.041 ( 0.212 0.000 1.874) 1.886 6.041 ( -0.656 0.000 -0.532) 0.845 6.079 ( 4.714 0.000 -2.177) 5.193 6.099 ( 3.304 0.000 4.287) 5.412 6.296 ( -6.479 0.000 4.688) 7.997 6.359 ( -6.673 0.000 -1.401) 6.819 6.522 ( -1.731 0.000 -7.441) 7.640 6.565 ( 3.356 0.000 2.722) 4.321 7.066 ( -5.503 0.000 0.008) 5.503 7.107 ( 1.412 0.000 -1.588) 2.125 7.167 ( -1.187 0.000 1.679) 2.056 7.278 ( -0.756 0.000 -1.841) 1.990 7.737 ( -14.816 0.000 -1.936) 14.942 8.151 ( 8.526 0.000 6.037) 10.447 8.178 ( -4.724 0.000 -0.656) 4.769 8.223 ( -7.467 0.000 6.533) 9.922 8.435 ( -9.282 0.000 -8.392) 12.513 8.608 ( -2.672 0.000 1.218) 2.936 8.779 ( 3.069 0.000 1.721) 3.519 8.869 ( -20.557 0.000 10.455) 23.063 8.924 ( 6.950 0.000 -0.719) 6.987 8.936 ( 4.345 0.000 3.632) 5.663 8.998 ( 5.821 0.000 -5.431) 7.961 9.263 ( 5.391 0.000 -15.423) 16.338 9.294 ( 6.777 0.000 4.739) 8.269 9.313 ( -0.863 0.000 -5.991) 6.053 9.621 ( -0.115 0.000 9.045) 9.045 9.813 ( 5.131 0.000 -6.418) 8.217 10.260 ( 5.288 0.000 0.212) 5.292 10.471 ( 9.174 0.000 0.467) 9.186 10.743 ( -6.300 0.000 5.862) 8.606 11.027 ( 10.830 0.000 -1.161) 10.892 20.520 ( -0.690 0.000 2.073) 2.185 20.525 ( -0.358 0.000 -2.299) 2.326 20.883 ( -1.440 0.000 0.751) 1.624 20.904 ( -0.191 0.000 -0.603) 0.632 22.775 ( -2.546 0.000 -1.121) 2.782 22.868 ( 2.640 0.000 1.263) 2.927 23.059 ( -1.587 0.000 -1.422) 2.131 23.134 ( 2.886 0.000 1.088) 3.085 24.737 ( -3.427 0.000 -0.730) 3.504 24.815 ( 1.173 0.000 1.120) 1.622 24.879 ( -1.622 0.000 0.113) 1.626 24.922 ( 1.181 0.000 -0.454) 1.265 25.813 ( -5.261 0.000 -0.329) 5.271 25.864 ( -1.940 0.000 0.171) 1.947 26.113 ( -3.028 0.000 -1.885) 3.567 26.168 ( -1.267 0.000 4.580) 4.752 28.371 ( -2.610 0.000 -0.811) 2.733 28.380 ( -2.013 0.000 3.075) 3.675 28.545 ( -1.052 0.000 0.227) 1.076 28.587 ( 1.741 0.000 -0.523) 1.818 28.689 ( -2.068 0.000 -1.051) 2.320 28.695 ( -3.022 0.000 3.011) 4.266 28.806 ( 1.920 0.000 -2.688) 3.303 28.845 ( 5.308 0.000 -3.226) 6.212 32.336 ( -0.353 0.000 1.816) 1.850 32.377 ( 2.013 0.000 -1.851) 2.735 32.535 ( -1.300 0.000 1.881) 2.287 32.542 ( -0.691 0.000 -2.447) 2.543 35.427 ( -0.390 0.000 2.702) 2.730 35.437 ( 0.030 0.000 -2.486) 2.487 35.500 ( -0.741 0.000 2.765) 2.863 35.508 ( 0.068 0.000 -2.070) 2.071 88.783 ( -0.985 0.000 3.389) 3.530 88.878 ( 4.427 0.000 -1.875) 4.808 88.925 ( -7.823 0.000 4.855) 9.207 89.358 ( 12.915 0.000 5.279) 13.952 97.605 ( 1.021 0.000 -0.142) 1.031 97.637 ( 1.892 0.000 0.274) 1.911 97.672 ( 0.025 0.000 0.634) 0.635 97.747 ( 5.038 0.000 1.232) 5.186 98.714 ( -0.485 0.000 0.855) 0.983 98.736 ( 0.423 0.000 -0.617) 0.748 98.771 ( -1.865 0.000 -1.608) 2.463 98.807 ( -0.163 0.000 0.995) 1.008 99.639 ( -0.626 0.000 1.521) 1.645 99.661 ( 0.546 0.000 -2.256) 2.321 99.842 ( -9.940 0.000 -1.993) 10.138 100.231 ( 10.514 0.000 -4.211) 11.326 ======================= 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| 1.133 ( 13.062 0.000 -12.780) 18.274 1.207 ( 8.994 0.000 -14.197) 16.806 1.441 ( 11.432 0.000 11.017) 15.877 1.499 ( 5.958 0.000 10.068) 11.698 1.885 ( -3.678 0.000 0.948) 3.798 1.990 ( 3.267 0.000 -2.400) 4.054 2.228 ( -2.437 0.000 -3.842) 4.550 2.336 ( -1.447 0.000 -16.375) 16.439 2.359 ( 0.445 0.000 -5.764) 5.781 2.362 ( 2.283 0.000 -2.890) 3.683 2.483 ( -4.450 0.000 -0.972) 4.555 2.537 ( 4.132 0.000 -6.142) 7.403 2.597 ( -3.952 0.000 5.288) 6.602 2.712 ( -4.390 0.000 0.670) 4.441 2.763 ( -2.348 0.000 0.700) 2.450 2.785 ( 1.890 0.000 -0.357) 1.923 2.910 ( 1.500 0.000 -7.485) 7.634 2.998 ( 3.118 0.000 8.609) 9.156 3.119 ( 0.291 0.000 8.212) 8.217 3.168 ( -2.738 0.000 1.124) 2.959 3.214 ( 1.343 0.000 -0.154) 1.352 3.267 ( -1.910 0.000 5.966) 6.264 3.400 ( 3.040 0.000 -2.477) 3.921 3.409 ( -2.770 0.000 11.395) 11.727 4.440 ( 2.782 0.000 -0.015) 2.782 4.496 ( 3.833 0.000 0.559) 3.873 4.709 ( -4.398 0.000 -0.322) 4.410 4.783 ( -7.334 0.000 4.265) 8.484 4.876 ( -1.634 0.000 1.092) 1.965 4.984 ( -0.962 0.000 1.368) 1.673 5.099 ( -10.201 0.000 5.217) 11.457 5.145 ( 3.446 0.000 -3.357) 4.810 5.176 ( -2.606 0.000 -2.715) 3.763 5.289 ( -4.711 0.000 3.109) 5.644 5.485 ( 0.427 0.000 -6.651) 6.664 5.604 ( -0.850 0.000 7.633) 7.680 5.622 ( -3.906 0.000 -5.985) 7.147 5.717 ( -4.698 0.000 3.085) 5.620 5.799 ( -4.045 0.000 -2.360) 4.683 5.851 ( -1.061 0.000 -1.731) 2.030 6.000 ( -3.755 0.000 0.533) 3.792 6.027 ( -4.851 0.000 -1.687) 5.136 6.146 ( 4.608 0.000 -1.133) 4.745 6.190 ( -1.855 0.000 -5.313) 5.627 6.226 ( -1.114 0.000 6.288) 6.386 6.341 ( 3.818 0.000 8.772) 9.567 6.425 ( -3.218 0.000 -1.691) 3.635 6.623 ( -0.590 0.000 3.697) 3.744 6.956 ( -6.519 0.000 1.222) 6.632 7.145 ( 3.920 0.000 0.657) 3.975 7.172 ( -8.501 0.000 -1.484) 8.629 7.193 ( 1.639 0.000 0.054) 1.640 7.539 ( -7.505 0.000 -0.398) 7.515 8.025 ( -15.130 0.000 -5.226) 16.007 8.102 ( -3.138 0.000 -1.654) 3.548 8.230 ( -0.937 0.000 -7.510) 7.568 8.366 ( 2.618 0.000 9.162) 9.529 8.472 ( -22.944 0.000 3.649) 23.232 8.642 ( -2.890 0.000 1.587) 3.297 8.791 ( -4.392 0.000 -4.489) 6.280 8.969 ( 1.325 0.000 -3.924) 4.142 8.989 ( 2.547 0.000 1.306) 2.862 9.103 ( 6.668 0.000 -2.576) 7.148 9.224 ( 2.697 0.000 -2.376) 3.595 9.345 ( 13.406 0.000 -5.089) 14.340 9.485 ( 9.923 0.000 3.122) 10.403 9.752 ( 3.509 0.000 8.492) 9.189 9.843 ( 5.980 0.000 -5.428) 8.076 10.380 ( 7.365 0.000 -0.526) 7.384 10.571 ( 3.861 0.000 -1.669) 4.206 10.720 ( -4.867 0.000 7.398) 8.855 11.194 ( 8.771 0.000 -1.074) 8.836 20.500 ( -0.020 0.000 -1.607) 1.607 20.523 ( -1.272 0.000 1.686) 2.112 20.864 ( -1.775 0.000 0.811) 1.952 20.890 ( -0.587 0.000 -0.785) 0.980 22.736 ( -1.565 0.000 0.263) 1.587 22.911 ( 1.443 0.000 0.162) 1.452 23.030 ( -0.444 0.000 -0.533) 0.694 23.188 ( 2.515 0.000 0.100) 2.517 24.680 ( -3.165 0.000 0.515) 3.206 24.823 ( -0.380 0.000 -1.105) 1.169 24.856 ( -1.409 0.000 0.515) 1.500 24.936 ( 1.437 0.000 -0.830) 1.659 25.707 ( -6.656 0.000 -0.059) 6.657 25.814 ( -4.047 0.000 0.046) 4.048 26.060 ( -1.692 0.000 -1.082) 2.008 26.157 ( -4.610 0.000 2.599) 5.292 28.334 ( -1.237 0.000 -0.011) 1.237 28.370 ( -1.199 0.000 1.013) 1.569 28.525 ( -1.380 0.000 0.250) 1.402 28.622 ( 0.461 0.000 1.378) 1.453 28.648 ( -0.318 0.000 -1.250) 1.290 28.669 ( -3.386 0.000 2.426) 4.165 28.797 ( 0.859 0.000 -3.135) 3.251 28.886 ( 3.672 0.000 -3.146) 4.835 32.354 ( 0.278 0.000 1.637) 1.661 32.399 ( 2.856 0.000 -1.587) 3.267 32.497 ( -0.766 0.000 -3.353) 3.440 32.529 ( -1.958 0.000 1.968) 2.776 35.417 ( 0.393 0.000 -1.792) 1.834 35.446 ( -0.621 0.000 2.502) 2.578 35.493 ( 0.701 0.000 -1.939) 2.061 35.506 ( -1.552 0.000 1.972) 2.510 88.837 ( 1.843 0.000 4.914) 5.249 88.892 ( -2.875 0.000 4.263) 5.142 88.938 ( 5.172 0.000 -2.339) 5.676 89.591 ( 4.436 0.000 7.360) 8.593 97.632 ( 2.063 0.000 -0.127) 2.066 97.667 ( 1.623 0.000 -0.128) 1.628 97.688 ( 1.034 0.000 0.936) 1.395 97.874 ( 5.367 0.000 4.383) 6.929 98.714 ( -0.361 0.000 0.324) 0.485 98.721 ( -1.828 0.000 -0.948) 2.059 98.735 ( 0.487 0.000 -1.716) 1.784 98.808 ( -1.213 0.000 1.157) 1.676 99.638 ( -0.519 0.000 -2.861) 2.907 99.640 ( -0.878 0.000 0.987) 1.321 99.709 ( -2.659 0.000 0.282) 2.674 100.315 ( 6.276 0.000 -5.674) 8.461 ======================= 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| 1.227 ( 13.199 0.000 -15.315) 20.218 1.282 ( 17.046 0.000 -7.613) 18.668 1.643 ( -1.490 0.000 7.806) 7.947 1.673 ( 1.212 0.000 0.305) 1.250 1.838 ( 4.212 0.000 -0.659) 4.263 1.974 ( -3.279 0.000 0.412) 3.305 2.108 ( -2.173 0.000 -7.969) 8.260 2.214 ( 0.724 0.000 -3.859) 3.927 2.344 ( -1.253 0.000 4.590) 4.758 2.385 ( -3.453 0.000 -3.988) 5.275 2.402 ( 6.161 0.000 -5.675) 8.377 2.493 ( 0.043 0.000 -10.196) 10.196 2.612 ( -2.093 0.000 4.972) 5.395 2.639 ( -2.735 0.000 -3.078) 4.118 2.714 ( -1.708 0.000 -3.023) 3.472 2.763 ( -0.506 0.000 -3.727) 3.761 2.891 ( 7.283 0.000 -6.177) 9.550 3.129 ( -4.021 0.000 2.515) 4.743 3.163 ( 2.167 0.000 10.328) 10.553 3.179 ( -0.951 0.000 4.090) 4.199 3.231 ( -0.269 0.000 1.684) 1.705 3.244 ( -6.535 0.000 3.637) 7.479 3.475 ( 6.425 0.000 0.146) 6.427 3.484 ( -3.714 0.000 11.543) 12.125 4.488 ( 4.217 0.000 -1.285) 4.408 4.556 ( -1.119 0.000 4.704) 4.835 4.645 ( -3.584 0.000 0.592) 3.633 4.693 ( -3.177 0.000 -1.772) 3.637 4.877 ( -1.276 0.000 3.266) 3.507 5.004 ( 0.878 0.000 0.947) 1.291 5.006 ( -6.433 0.000 3.526) 7.336 5.075 ( -3.537 0.000 -1.860) 3.996 5.229 ( -6.138 0.000 4.168) 7.419 5.245 ( 5.300 0.000 2.773) 5.981 5.424 ( -2.045 0.000 -6.815) 7.115 5.531 ( 3.523 0.000 -2.503) 4.321 5.588 ( -5.838 0.000 1.366) 5.995 5.702 ( -2.987 0.000 2.775) 4.077 5.704 ( -4.389 0.000 -0.382) 4.406 5.835 ( -7.739 0.000 5.681) 9.600 5.872 ( -6.881 0.000 -5.365) 8.726 5.881 ( -2.528 0.000 -2.792) 3.766 6.159 ( 3.984 0.000 -1.982) 4.450 6.190 ( 3.817 0.000 -4.429) 5.847 6.300 ( -0.423 0.000 5.635) 5.651 6.393 ( -2.101 0.000 4.337) 4.819 6.536 ( 7.676 0.000 6.565) 10.101 6.639 ( -2.922 0.000 5.989) 6.663 6.890 ( -5.648 0.000 4.775) 7.396 7.026 ( -6.231 0.000 -1.068) 6.322 7.204 ( 1.500 0.000 -3.114) 3.457 7.233 ( 3.434 0.000 2.584) 4.297 7.448 ( -3.739 0.000 -0.460) 3.768 7.712 ( -9.625 0.000 -12.299) 15.618 8.033 ( -6.641 0.000 2.107) 6.967 8.116 ( -4.226 0.000 -4.533) 6.198 8.123 ( -16.257 0.000 -2.183) 16.403 8.519 ( 3.055 0.000 8.653) 9.177 8.559 ( -5.831 0.000 -14.839) 15.944 8.665 ( 0.748 0.000 3.717) 3.792 8.996 ( 2.890 0.000 -1.369) 3.198 9.055 ( 3.789 0.000 0.354) 3.806 9.152 ( 1.872 0.000 -0.689) 1.994 9.253 ( 2.328 0.000 0.024) 2.328 9.567 ( 14.683 0.000 -1.364) 14.746 9.652 ( 6.589 0.000 1.866) 6.848 9.879 ( 1.247 0.000 6.384) 6.505 9.887 ( 6.303 0.000 -5.537) 8.390 10.460 ( 2.788 0.000 -0.559) 2.844 10.583 ( 1.441 0.000 -3.521) 3.804 10.746 ( -3.395 0.000 10.446) 10.984 11.254 ( 2.984 0.000 -5.880) 6.594 20.492 ( 0.676 0.000 -0.919) 1.141 20.517 ( -1.411 0.000 1.339) 1.945 20.845 ( -1.560 0.000 0.957) 1.830 20.871 ( -0.443 0.000 -0.893) 0.997 22.730 ( -0.555 0.000 1.883) 1.963 22.916 ( -0.018 0.000 -1.519) 1.519 23.036 ( 0.931 0.000 0.911) 1.303 23.212 ( 1.113 0.000 -1.426) 1.809 24.646 ( -2.370 0.000 1.809) 2.981 24.788 ( -0.521 0.000 -3.414) 3.454 24.848 ( -0.697 0.000 1.310) 1.484 24.947 ( 0.977 0.000 -1.302) 1.628 25.612 ( -4.712 0.000 0.744) 4.770 25.736 ( -4.738 0.000 -0.656) 4.783 26.030 ( -0.927 0.000 -0.603) 1.106 26.092 ( -4.159 0.000 0.256) 4.167 28.327 ( -0.337 0.000 0.758) 0.830 28.370 ( 0.432 0.000 -0.168) 0.464 28.510 ( -0.708 0.000 0.269) 0.757 28.588 ( -2.368 0.000 -0.967) 2.558 28.639 ( -2.999 0.000 2.217) 3.729 28.684 ( 1.595 0.000 1.560) 2.231 28.776 ( 0.478 0.000 -2.175) 2.227 28.902 ( 2.275 0.000 -2.972) 3.743 32.377 ( 0.474 0.000 1.309) 1.393 32.436 ( 3.291 0.000 -1.278) 3.530 32.456 ( 0.132 0.000 -3.194) 3.196 32.511 ( -2.579 0.000 1.824) 3.158 35.414 ( 1.016 0.000 -0.986) 1.416 35.457 ( -1.081 0.000 2.123) 2.382 35.489 ( 1.130 0.000 -1.724) 2.062 35.492 ( -1.824 0.000 0.826) 2.003 88.899 ( -0.958 0.000 3.368) 3.502 88.943 ( 2.478 0.000 7.410) 7.813 88.991 ( 4.589 0.000 -3.323) 5.666 89.621 ( -4.944 0.000 0.004) 4.944 97.661 ( 1.465 0.000 -0.124) 1.470 97.687 ( 1.184 0.000 -0.526) 1.296 97.731 ( 2.243 0.000 2.008) 3.010 97.964 ( 0.061 0.000 2.668) 2.669 98.695 ( -0.089 0.000 -0.455) 0.463 98.710 ( -0.261 0.000 -0.041) 0.264 98.727 ( 0.632 0.000 -1.357) 1.497 98.792 ( -1.871 0.000 0.821) 2.043 99.605 ( -0.156 0.000 -1.411) 1.420 99.631 ( -1.049 0.000 0.355) 1.107 99.759 ( 2.759 0.000 6.886) 7.418 100.326 ( 3.615 0.000 -7.358) 8.197 ======================= 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| 1.310 ( 13.102 0.000 -11.294) 17.297 1.491 ( -0.376 0.000 -7.681) 7.690 1.504 ( 5.439 0.000 -4.988) 7.380 1.608 ( -9.455 0.000 4.088) 10.301 1.933 ( -2.748 0.000 2.101) 3.459 1.956 ( 7.072 0.000 -3.428) 7.859 2.085 ( 4.036 0.000 -0.237) 4.043 2.247 ( 2.403 0.000 2.405) 3.399 2.306 ( -8.050 0.000 -6.948) 10.634 2.309 ( -0.624 0.000 -0.956) 1.142 2.386 ( 0.787 0.000 -5.537) 5.593 2.413 ( 0.356 0.000 1.139) 1.193 2.549 ( -4.866 0.000 0.377) 4.880 2.622 ( -1.702 0.000 2.972) 3.424 2.702 ( 3.477 0.000 -3.291) 4.788 2.707 ( -1.208 0.000 -4.130) 4.303 3.013 ( 13.698 0.000 -5.482) 14.754 3.089 ( -8.199 0.000 6.248) 10.309 3.122 ( -8.629 0.000 1.896) 8.835 3.182 ( -0.680 0.000 -0.245) 0.722 3.263 ( 1.412 0.000 2.580) 2.941 3.272 ( 0.285 0.000 4.967) 4.975 3.524 ( -3.907 0.000 8.019) 8.920 3.579 ( 6.513 0.000 -1.344) 6.650 4.539 ( -6.820 0.000 6.264) 9.260 4.557 ( 5.040 0.000 -1.201) 5.181 4.610 ( -1.228 0.000 1.393) 1.857 4.661 ( 0.630 0.000 -2.406) 2.487 4.896 ( -2.610 0.000 6.118) 6.652 4.975 ( 1.370 0.000 -1.297) 1.886 5.004 ( -2.412 0.000 -1.665) 2.930 5.008 ( -0.561 0.000 -0.856) 1.023 5.198 ( -3.904 0.000 6.013) 7.169 5.347 ( 2.711 0.000 -3.910) 4.757 5.380 ( 4.688 0.000 3.042) 5.589 5.492 ( -5.178 0.000 -0.272) 5.185 5.581 ( 1.827 0.000 -3.391) 3.852 5.637 ( -5.083 0.000 -2.629) 5.723 5.651 ( -3.633 0.000 0.750) 3.710 5.709 ( -5.993 0.000 2.787) 6.609 5.803 ( 6.681 0.000 0.827) 6.732 5.916 ( -1.749 0.000 4.119) 4.475 6.178 ( 1.289 0.000 -4.982) 5.146 6.205 ( 2.446 0.000 -3.040) 3.901 6.345 ( 0.625 0.000 5.012) 5.051 6.418 ( -1.604 0.000 4.356) 4.642 6.663 ( -3.513 0.000 8.320) 9.031 6.703 ( 6.371 0.000 2.126) 6.716 6.863 ( -4.872 0.000 7.212) 8.704 6.956 ( 0.343 0.000 -3.121) 3.140 7.194 ( 2.787 0.000 -3.596) 4.549 7.277 ( -1.067 0.000 1.248) 1.642 7.383 ( -2.596 0.000 -3.115) 4.055 7.481 ( -3.056 0.000 -11.087) 11.501 7.857 ( -12.786 0.000 8.315) 15.252 8.007 ( -2.906 0.000 -3.978) 4.926 8.026 ( 0.585 0.000 -1.261) 1.390 8.332 ( 0.066 0.000 -16.560) 16.560 8.664 ( 2.348 0.000 8.495) 8.814 8.728 ( 1.064 0.000 4.443) 4.568 9.003 ( 0.188 0.000 -2.052) 2.061 9.078 ( 2.396 0.000 -7.000) 7.398 9.185 ( -0.732 0.000 6.029) 6.073 9.291 ( 2.586 0.000 -1.296) 2.893 9.740 ( 1.990 0.000 1.500) 2.492 9.750 ( 7.368 0.000 -0.563) 7.389 9.906 ( -4.926 0.000 4.020) 6.358 9.938 ( 7.533 0.000 -5.834) 9.527 10.473 ( -1.216 0.000 1.445) 1.889 10.560 ( 0.871 0.000 -3.950) 4.045 10.822 ( -2.372 0.000 12.486) 12.710 11.192 ( 0.577 0.000 -10.010) 10.026 20.502 ( 1.367 0.000 -0.529) 1.466 20.505 ( -1.448 0.000 0.941) 1.727 20.834 ( -0.946 0.000 1.065) 1.425 20.859 ( 0.119 0.000 -0.919) 0.927 22.757 ( 0.539 0.000 3.122) 3.169 22.882 ( -1.023 0.000 -2.909) 3.084 23.076 ( 1.706 0.000 2.237) 2.813 23.192 ( -0.736 0.000 -2.765) 2.861 24.639 ( -1.462 0.000 2.830) 3.185 24.744 ( 0.170 0.000 -4.029) 4.033 24.861 ( -0.076 0.000 2.147) 2.148 24.938 ( 0.094 0.000 -2.038) 2.040 25.577 ( -0.836 0.000 1.627) 1.829 25.657 ( -2.986 0.000 -1.514) 3.348 26.018 ( 0.070 0.000 -0.160) 0.174 26.040 ( -2.028 0.000 -0.303) 2.050 28.334 ( -0.352 0.000 1.388) 1.432 28.372 ( 0.357 0.000 -0.875) 0.945 28.512 ( 0.676 0.000 0.391) 0.781 28.541 ( -2.109 0.000 -0.585) 2.189 28.621 ( -2.170 0.000 2.464) 3.283 28.702 ( 1.418 0.000 -2.635) 2.992 28.787 ( 0.542 0.000 2.460) 2.519 28.899 ( 1.392 0.000 -3.429) 3.701 32.393 ( -0.038 0.000 0.975) 0.976 32.434 ( 0.586 0.000 -2.267) 2.342 32.477 ( 3.227 0.000 -1.178) 3.436 32.483 ( -3.014 0.000 1.658) 3.440 35.429 ( 1.552 0.000 -0.250) 1.572 35.451 ( -1.957 0.000 1.157) 2.273 35.471 ( -1.363 0.000 0.751) 1.556 35.493 ( 1.335 0.000 -1.524) 2.026 88.918 ( -1.475 0.000 3.767) 4.045 89.015 ( 2.925 0.000 -4.027) 4.977 89.080 ( 3.122 0.000 9.736) 10.224 89.476 ( -6.744 0.000 -6.662) 9.479 97.677 ( 0.470 0.000 0.158) 0.495 97.694 ( 0.417 0.000 -0.690) 0.806 97.802 ( 2.906 0.000 3.085) 4.239 97.941 ( -3.123 0.000 -0.963) 3.269 98.697 ( 0.182 0.000 0.093) 0.204 98.705 ( -0.192 0.000 -0.197) 0.275 98.735 ( 1.729 0.000 -0.489) 1.797 98.765 ( -2.027 0.000 0.265) 2.045 99.600 ( 0.633 0.000 -0.436) 0.769 99.615 ( -1.028 0.000 -0.117) 1.035 99.906 ( 2.328 0.000 11.085) 11.327 100.281 ( 1.857 0.000 -9.738) 9.913 ======================= 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| 1.219 ( -13.775 0.000 -4.281) 14.425 1.390 ( -2.727 0.000 0.206) 2.735 1.470 ( -1.726 0.000 -1.695) 2.419 1.688 ( 11.296 0.000 -3.112) 11.717 1.922 ( -1.022 0.000 0.371) 1.087 2.008 ( 5.207 0.000 -4.843) 7.111 2.106 ( -7.550 0.000 -3.392) 8.277 2.197 ( 6.412 0.000 2.484) 6.876 2.234 ( -5.673 0.000 6.286) 8.467 2.316 ( -0.919 0.000 -4.308) 4.405 2.352 ( -4.522 0.000 -3.916) 5.982 2.402 ( 5.911 0.000 1.887) 6.205 2.573 ( 0.777 0.000 6.883) 6.926 2.608 ( -3.615 0.000 -1.368) 3.865 2.637 ( -2.948 0.000 1.126) 3.155 2.723 ( 3.732 0.000 -4.432) 5.794 2.915 ( -12.363 0.000 2.372) 12.588 3.108 ( -1.432 0.000 5.368) 5.556 3.157 ( 2.071 0.000 -1.269) 2.429 3.196 ( 9.480 0.000 -2.791) 9.882 3.296 ( -0.762 0.000 1.057) 1.303 3.315 ( 2.204 0.000 0.477) 2.255 3.530 ( -2.732 0.000 3.628) 4.542 3.658 ( 6.179 0.000 -4.103) 7.417 4.485 ( -6.753 0.000 5.089) 8.456 4.590 ( -0.364 0.000 2.219) 2.249 4.651 ( 3.682 0.000 -1.613) 4.020 4.651 ( 1.511 0.000 -2.156) 2.633 4.923 ( -5.054 0.000 -0.049) 5.054 4.935 ( -0.113 0.000 5.959) 5.960 4.997 ( 2.295 0.000 -1.111) 2.549 5.038 ( 7.216 0.000 -3.554) 8.043 5.205 ( -4.166 0.000 6.515) 7.733 5.355 ( 4.871 0.000 -7.502) 8.944 5.440 ( -1.347 0.000 0.181) 1.359 5.500 ( 6.235 0.000 1.033) 6.320 5.550 ( 0.104 0.000 1.639) 1.643 5.563 ( -0.474 0.000 -2.427) 2.473 5.664 ( -0.889 0.000 0.435) 0.990 5.690 ( 4.076 0.000 4.227) 5.872 5.840 ( -7.920 0.000 -1.735) 8.108 5.974 ( 7.728 0.000 1.582) 7.888 6.154 ( -2.911 0.000 -3.859) 4.834 6.161 ( -0.269 0.000 -0.067) 0.277 6.408 ( -1.978 0.000 -0.161) 1.984 6.430 ( 2.899 0.000 3.078) 4.228 6.689 ( -2.997 0.000 5.702) 6.442 6.796 ( 4.230 0.000 -0.502) 4.259 6.890 ( 1.597 0.000 2.229) 2.742 6.966 ( 6.491 0.000 -5.246) 8.346 7.213 ( -4.342 0.000 -4.187) 6.033 7.252 ( 3.762 0.000 3.786) 5.337 7.341 ( 1.241 0.000 1.346) 1.831 7.364 ( -0.351 0.000 -5.958) 5.968 7.864 ( -1.361 0.000 13.352) 13.421 7.959 ( 1.638 0.000 -2.385) 2.893 8.057 ( 1.587 0.000 3.566) 3.903 8.210 ( 5.636 0.000 -15.413) 16.411 8.759 ( 0.493 0.000 3.871) 3.902 8.771 ( -0.190 0.000 0.830) 0.852 8.970 ( -2.616 0.000 0.436) 2.652 9.015 ( -0.807 0.000 -5.376) 5.436 9.230 ( -1.275 0.000 4.785) 4.953 9.300 ( 1.663 0.000 -3.942) 4.278 9.745 ( -3.969 0.000 -0.049) 3.969 9.787 ( -0.018 0.000 -2.603) 2.603 9.815 ( -9.352 0.000 4.573) 10.410 10.005 ( 5.921 0.000 -4.685) 7.551 10.467 ( -2.688 0.000 4.160) 4.953 10.528 ( -0.239 0.000 -3.257) 3.266 10.928 ( -1.502 0.000 13.510) 13.593 11.083 ( 0.142 0.000 -11.027) 11.028 20.490 ( -1.292 0.000 0.563) 1.410 20.523 ( 1.816 0.000 -0.620) 1.919 20.836 ( -0.221 0.000 1.086) 1.108 20.856 ( 0.805 0.000 -0.920) 1.222 22.809 ( 1.249 0.000 3.605) 3.815 22.828 ( -1.158 0.000 -3.310) 3.506 23.131 ( 1.351 0.000 2.785) 3.095 23.136 ( -1.871 0.000 -3.202) 3.709 24.656 ( -0.656 0.000 3.621) 3.680 24.711 ( 0.835 0.000 -3.616) 3.711 24.886 ( -0.069 0.000 2.564) 2.564 24.911 ( -0.378 0.000 -2.314) 2.345 25.616 ( 0.528 0.000 -1.884) 1.957 25.617 ( 3.040 0.000 2.050) 3.666 26.018 ( -0.440 0.000 -0.138) 0.462 26.030 ( 1.356 0.000 0.418) 1.418 28.341 ( -0.683 0.000 1.672) 1.806 28.360 ( -0.685 0.000 -0.830) 1.076 28.512 ( -0.710 0.000 -0.359) 0.796 28.539 ( 1.889 0.000 0.517) 1.958 28.621 ( -1.391 0.000 3.078) 3.378 28.696 ( 2.259 0.000 -3.592) 4.244 28.824 ( -0.147 0.000 3.151) 3.155 28.875 ( 0.844 0.000 -4.539) 4.617 32.394 ( -1.152 0.000 1.207) 1.669 32.422 ( 0.315 0.000 -1.608) 1.638 32.449 ( -2.949 0.000 1.330) 3.235 32.516 ( 2.961 0.000 -1.272) 3.223 35.423 ( -2.058 0.000 0.372) 2.091 35.458 ( 1.850 0.000 0.236) 1.865 35.461 ( -1.367 0.000 1.263) 1.861 35.499 ( 1.297 0.000 -1.476) 1.965 88.926 ( -2.636 0.000 3.937) 4.738 89.004 ( 1.021 0.000 -3.951) 4.081 89.258 ( 4.264 0.000 12.611) 13.312 89.290 ( -5.334 0.000 -8.805) 10.295 97.681 ( -0.385 0.000 0.456) 0.597 97.687 ( -0.471 0.000 -0.629) 0.786 97.862 ( -3.828 0.000 -2.304) 4.468 97.888 ( 2.974 0.000 3.768) 4.800 98.700 ( -0.175 0.000 -0.096) 0.200 98.701 ( 0.254 0.000 0.079) 0.266 98.733 ( -1.793 0.000 -0.258) 1.812 98.768 ( 2.276 0.000 -0.013) 2.276 99.598 ( -0.737 0.000 -0.189) 0.761 99.614 ( 1.311 0.000 -0.081) 1.314 100.048 ( 0.253 0.000 11.056) 11.059 100.179 ( 0.156 0.000 -12.862) 12.863 ======================= 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| 0.967 ( -16.621 0.000 5.275) 17.439 1.164 ( -19.553 0.000 3.653) 19.891 1.592 ( 8.647 0.000 2.678) 9.052 1.796 ( 6.489 0.000 -5.130) 8.272 1.877 ( -2.616 0.000 -2.841) 3.862 2.004 ( -3.688 0.000 0.207) 3.694 2.014 ( -3.179 0.000 -1.774) 3.640 2.141 ( -13.750 0.000 9.774) 16.870 2.255 ( -0.870 0.000 -4.373) 4.459 2.300 ( 0.741 0.000 2.521) 2.627 2.334 ( 1.382 0.000 5.533) 5.703 2.474 ( 4.062 0.000 -2.844) 4.959 2.540 ( -1.752 0.000 5.131) 5.422 2.655 ( 0.428 0.000 5.770) 5.786 2.657 ( 3.166 0.000 1.132) 3.362 2.731 ( 3.557 0.000 -5.433) 6.494 2.808 ( -2.788 0.000 0.915) 2.935 3.162 ( 0.964 0.000 -0.508) 1.090 3.164 ( 1.368 0.000 4.528) 4.731 3.283 ( -0.270 0.000 -1.509) 1.533 3.299 ( 2.548 0.000 -2.481) 3.556 3.341 ( 5.189 0.000 -4.135) 6.635 3.503 ( -2.742 0.000 -0.815) 2.860 3.684 ( 3.355 0.000 -6.268) 7.109 4.438 ( -3.757 0.000 3.239) 4.961 4.574 ( -6.311 0.000 2.840) 6.921 4.669 ( 2.918 0.000 -1.645) 3.350 4.695 ( 6.473 0.000 -2.011) 6.778 4.877 ( -1.311 0.000 1.513) 2.002 4.977 ( -1.364 0.000 2.412) 2.771 5.045 ( 3.409 0.000 0.915) 3.529 5.152 ( 12.313 0.000 -7.496) 14.416 5.235 ( -0.779 0.000 9.921) 9.951 5.351 ( 4.736 0.000 -6.855) 8.332 5.386 ( -2.950 0.000 -6.959) 7.558 5.498 ( -4.932 0.000 0.328) 4.943 5.596 ( 4.890 0.000 1.389) 5.084 5.650 ( 5.715 0.000 3.995) 6.973 5.724 ( -0.262 0.000 -1.781) 1.800 5.750 ( 6.341 0.000 3.918) 7.454 5.837 ( 7.149 0.000 3.946) 8.166 6.000 ( -0.743 0.000 -7.676) 7.712 6.091 ( -3.031 0.000 3.323) 4.498 6.135 ( -3.269 0.000 0.610) 3.325 6.372 ( -1.209 0.000 -1.317) 1.787 6.476 ( 0.885 0.000 -0.509) 1.021 6.644 ( -3.858 0.000 -3.601) 5.277 6.820 ( 4.105 0.000 -7.973) 8.968 6.978 ( 6.139 0.000 2.750) 6.726 7.051 ( 6.876 0.000 -7.486) 10.164 7.123 ( -0.530 0.000 0.842) 0.995 7.290 ( -0.895 0.000 -2.355) 2.520 7.391 ( 2.560 0.000 5.226) 5.819 7.471 ( 9.643 0.000 7.224) 12.049 8.001 ( 2.487 0.000 1.487) 2.898 8.039 ( 6.188 0.000 7.190) 9.486 8.174 ( 3.087 0.000 14.493) 14.818 8.223 ( 14.626 0.000 -10.396) 17.945 8.717 ( -1.909 0.000 -7.106) 7.358 8.753 ( -1.039 0.000 -3.218) 3.382 8.940 ( -5.213 0.000 5.906) 7.878 8.966 ( -2.056 0.000 0.401) 2.095 9.239 ( -1.887 0.000 2.049) 2.786 9.264 ( 0.728 0.000 -6.410) 6.451 9.566 ( -14.137 0.000 -1.021) 14.174 9.716 ( -3.843 0.000 -4.200) 5.693 9.758 ( -6.369 0.000 5.859) 8.654 10.006 ( 0.269 0.000 -4.896) 4.903 10.477 ( -2.797 0.000 -2.102) 3.499 10.477 ( -2.731 0.000 5.904) 6.505 10.971 ( -0.014 0.000 -9.922) 9.922 11.052 ( -0.677 0.000 12.516) 12.535 20.477 ( -0.888 0.000 0.503) 1.020 20.545 ( 1.841 0.000 -1.134) 2.162 20.849 ( 0.326 0.000 1.088) 1.136 20.865 ( 1.335 0.000 -0.867) 1.592 22.781 ( -0.528 0.000 -2.668) 2.719 22.865 ( 0.984 0.000 2.999) 3.156 23.074 ( -1.604 0.000 -2.569) 3.029 23.171 ( 0.093 0.000 2.257) 2.259 24.694 ( 0.077 0.000 4.554) 4.555 24.696 ( 1.332 0.000 -2.670) 2.984 24.883 ( -0.056 0.000 -1.886) 1.887 24.907 ( -0.639 0.000 2.292) 2.380 25.637 ( 4.116 0.000 -1.550) 4.398 25.709 ( 5.144 0.000 1.784) 5.444 26.019 ( 0.442 0.000 0.270) 0.517 26.077 ( 3.272 0.000 1.481) 3.592 28.337 ( -1.373 0.000 -0.083) 1.376 28.348 ( -0.535 0.000 1.637) 1.723 28.511 ( 1.049 0.000 -0.407) 1.125 28.580 ( 2.242 0.000 0.408) 2.279 28.638 ( -1.119 0.000 3.777) 3.939 28.705 ( 3.109 0.000 -3.167) 4.438 28.829 ( 0.020 0.000 -5.654) 5.654 28.842 ( -1.259 0.000 2.394) 2.704 32.386 ( -2.150 0.000 2.500) 3.297 32.408 ( -0.026 0.000 -1.503) 1.503 32.415 ( -2.387 0.000 0.889) 2.547 32.547 ( 2.494 0.000 -1.394) 2.857 35.396 ( -1.667 0.000 0.592) 1.769 35.453 ( -1.350 0.000 1.515) 2.030 35.493 ( 2.054 0.000 0.100) 2.056 35.503 ( 1.075 0.000 -1.372) 1.743 88.912 ( -3.811 0.000 3.666) 5.289 88.971 ( -0.208 0.000 -3.155) 3.162 89.123 ( -3.386 0.000 -8.640) 9.280 89.491 ( 7.035 0.000 12.901) 14.694 97.667 ( -1.207 0.000 -0.487) 1.302 97.675 ( -1.023 0.000 0.571) 1.172 97.777 ( -3.367 0.000 -2.138) 3.989 97.974 ( 2.852 0.000 2.602) 3.860 98.697 ( -0.213 0.000 -0.271) 0.345 98.703 ( -1.477 0.000 0.238) 1.496 98.708 ( 0.435 0.000 0.065) 0.440 98.805 ( 2.167 0.000 -0.250) 2.182 99.589 ( -0.273 0.000 0.186) 0.330 99.638 ( 1.680 0.000 -0.273) 1.702 100.007 ( -2.878 0.000 -15.485) 15.751 100.143 ( -1.880 0.000 9.242) 9.431 ======================= 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| 0.820 ( -13.865 0.000 16.896) 21.857 0.888 ( -19.715 0.000 8.270) 21.380 1.686 ( -1.236 0.000 -7.834) 7.931 1.746 ( -14.778 0.000 2.809) 15.043 1.806 ( -13.947 0.000 3.652) 14.417 1.826 ( 2.907 0.000 2.951) 4.142 2.024 ( 1.208 0.000 9.143) 9.222 2.113 ( 0.872 0.000 1.845) 2.040 2.222 ( 1.202 0.000 -3.087) 3.313 2.386 ( 0.967 0.000 3.801) 3.922 2.396 ( 4.621 0.000 5.699) 7.337 2.523 ( 3.611 0.000 -2.671) 4.492 2.622 ( 2.368 0.000 7.008) 7.397 2.702 ( -1.866 0.000 4.810) 5.160 2.726 ( 3.102 0.000 -5.407) 6.233 2.746 ( 4.720 0.000 1.909) 5.091 2.809 ( 0.674 0.000 1.422) 1.573 3.182 ( 1.513 0.000 0.035) 1.514 3.223 ( 1.344 0.000 -0.031) 1.344 3.233 ( -1.370 0.000 -9.065) 9.168 3.261 ( 0.609 0.000 -1.941) 2.034 3.381 ( 3.646 0.000 -4.451) 5.754 3.416 ( -4.117 0.000 -4.226) 5.900 3.632 ( -0.412 0.000 -7.993) 8.004 4.429 ( -0.543 0.000 0.865) 1.021 4.479 ( -6.935 0.000 1.953) 7.205 4.706 ( 2.799 0.000 -0.309) 2.816 4.822 ( 9.045 0.000 -0.088) 9.046 4.886 ( 0.495 0.000 0.644) 0.813 4.957 ( -3.719 0.000 2.678) 4.583 5.107 ( 1.907 0.000 1.729) 2.575 5.211 ( -3.758 0.000 -5.473) 6.639 5.256 ( 10.304 0.000 -8.722) 13.500 5.364 ( -0.420 0.000 3.856) 3.879 5.373 ( 5.017 0.000 -4.673) 6.856 5.482 ( 1.900 0.000 5.791) 6.095 5.690 ( 3.464 0.000 2.292) 4.153 5.769 ( 4.370 0.000 1.078) 4.501 5.786 ( 7.855 0.000 -0.935) 7.911 5.839 ( -4.624 0.000 -5.108) 6.891 5.938 ( 8.697 0.000 6.724) 10.993 6.019 ( 6.415 0.000 1.053) 6.501 6.072 ( -3.919 0.000 3.590) 5.315 6.093 ( -1.513 0.000 1.686) 2.265 6.331 ( -2.011 0.000 -1.967) 2.814 6.459 ( -0.340 0.000 -2.877) 2.897 6.521 ( -2.919 0.000 -6.959) 7.546 6.785 ( 3.792 0.000 -10.360) 11.032 7.029 ( 3.751 0.000 -5.694) 6.819 7.116 ( 4.643 0.000 1.798) 4.979 7.172 ( 0.893 0.000 1.427) 1.683 7.236 ( 0.388 0.000 -4.555) 4.572 7.481 ( 2.886 0.000 5.174) 5.925 7.800 ( 16.598 0.000 10.401) 19.588 8.046 ( 1.558 0.000 1.767) 2.356 8.167 ( 5.186 0.000 0.872) 5.259 8.460 ( 4.545 0.000 18.170) 18.730 8.495 ( 21.789 0.000 1.257) 21.825 8.598 ( 0.797 0.000 -8.048) 8.088 8.693 ( -0.832 0.000 -3.671) 3.765 8.909 ( -6.353 0.000 6.283) 8.935 8.933 ( -3.144 0.000 0.783) 3.240 9.191 ( -0.311 0.000 -7.883) 7.889 9.216 ( -3.292 0.000 0.384) 3.314 9.309 ( -13.340 0.000 -0.774) 13.362 9.580 ( -5.653 0.000 -5.701) 8.028 9.708 ( -7.446 0.000 6.582) 9.938 9.920 ( -2.772 0.000 -6.424) 6.996 10.385 ( -5.894 0.000 -1.458) 6.072 10.489 ( -3.937 0.000 5.884) 7.080 10.884 ( 1.032 0.000 -7.362) 7.434 11.131 ( -3.556 0.000 5.702) 6.721 20.473 ( -0.361 0.000 0.859) 0.932 20.559 ( 1.647 0.000 -1.543) 2.257 20.868 ( 0.491 0.000 1.117) 1.220 20.881 ( 1.510 0.000 -0.726) 1.675 22.757 ( 0.321 0.000 -1.536) 1.569 22.896 ( -0.248 0.000 1.470) 1.491 23.037 ( -0.281 0.000 -1.235) 1.267 23.178 ( -1.267 0.000 0.943) 1.580 24.700 ( 1.806 0.000 -1.331) 2.243 24.758 ( 1.560 0.000 4.841) 5.086 24.873 ( 0.660 0.000 -1.026) 1.220 24.911 ( -1.353 0.000 1.531) 2.043 25.713 ( 6.155 0.000 -0.716) 6.197 25.806 ( 4.351 0.000 0.817) 4.427 26.036 ( 0.709 0.000 0.990) 1.217 26.176 ( 6.420 0.000 1.500) 6.593 28.321 ( -0.959 0.000 1.069) 1.436 28.367 ( 1.403 0.000 1.429) 2.003 28.533 ( 2.053 0.000 -0.663) 2.157 28.620 ( 2.025 0.000 0.546) 2.098 28.652 ( -1.694 0.000 2.001) 2.622 28.730 ( 3.477 0.000 -2.504) 4.285 28.759 ( -2.135 0.000 -3.131) 3.790 28.832 ( -2.527 0.000 1.556) 2.968 32.363 ( -3.134 0.000 1.700) 3.566 32.390 ( 0.033 0.000 -1.656) 1.656 32.417 ( 0.148 0.000 3.636) 3.639 32.568 ( 1.844 0.000 -1.553) 2.411 35.383 ( -1.082 0.000 1.237) 1.644 35.450 ( -1.062 0.000 1.879) 2.158 35.498 ( 0.886 0.000 -2.133) 2.310 35.533 ( 2.297 0.000 -0.166) 2.303 88.879 ( -4.306 0.000 2.935) 5.211 88.927 ( -1.638 0.000 -3.053) 3.464 89.012 ( 0.835 0.000 -6.762) 6.813 89.699 ( 4.800 0.000 0.943) 4.892 97.638 ( -1.557 0.000 -0.521) 1.642 97.661 ( -1.287 0.000 0.445) 1.362 97.713 ( -1.952 0.000 -1.295) 2.342 97.991 ( -1.752 0.000 -4.919) 5.221 98.691 ( 0.578 0.000 1.289) 1.412 98.700 ( -0.618 0.000 1.422) 1.551 98.717 ( 0.542 0.000 -0.025) 0.542 98.830 ( 1.475 0.000 -0.791) 1.674 99.594 ( 0.225 0.000 1.059) 1.082 99.660 ( 1.644 0.000 -0.841) 1.847 99.787 ( -4.722 0.000 -9.348) 10.473 100.178 ( -4.352 0.000 6.883) 8.143 ======================= 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| 0.752 ( -11.523 0.000 17.553) 20.997 0.859 ( -8.134 0.000 20.951) 22.475 1.510 ( -0.662 0.000 -16.140) 16.154 1.514 ( -16.909 0.000 9.452) 19.371 1.654 ( -7.713 0.000 1.996) 7.967 1.940 ( 3.782 0.000 3.044) 4.855 2.161 ( 0.471 0.000 4.220) 4.246 2.198 ( 2.453 0.000 12.560) 12.797 2.231 ( 1.928 0.000 3.171) 3.711 2.455 ( 1.375 0.000 4.001) 4.231 2.530 ( 2.368 0.000 -4.151) 4.779 2.540 ( 5.312 0.000 4.511) 6.969 2.688 ( -2.900 0.000 0.696) 2.982 2.731 ( 1.995 0.000 5.440) 5.794 2.731 ( 1.920 0.000 -1.604) 2.502 2.819 ( -0.851 0.000 4.731) 4.807 2.857 ( 5.270 0.000 -1.424) 5.459 3.081 ( -1.680 0.000 -13.622) 13.725 3.202 ( -0.421 0.000 -3.052) 3.081 3.205 ( 0.881 0.000 -0.197) 0.903 3.211 ( -2.084 0.000 -9.048) 9.285 3.343 ( -1.406 0.000 1.987) 2.434 3.360 ( 0.625 0.000 -6.531) 6.561 3.518 ( -2.170 0.000 -7.759) 8.057 4.404 ( -4.467 0.000 1.935) 4.868 4.420 ( -0.253 0.000 -1.110) 1.139 4.767 ( 3.520 0.000 2.215) 4.159 4.888 ( -0.304 0.000 0.355) 0.468 4.907 ( -7.079 0.000 4.707) 8.501 4.961 ( 7.259 0.000 -2.315) 7.619 5.124 ( 3.242 0.000 -1.163) 3.444 5.213 ( 3.331 0.000 2.711) 4.294 5.301 ( 3.659 0.000 -6.081) 7.097 5.396 ( -1.670 0.000 6.947) 7.145 5.411 ( 5.820 0.000 -4.841) 7.570 5.577 ( 0.286 0.000 6.530) 6.536 5.670 ( -2.818 0.000 -6.525) 7.107 5.790 ( 1.074 0.000 3.718) 3.871 5.836 ( 2.722 0.000 0.157) 2.726 5.877 ( 4.581 0.000 -4.290) 6.276 6.022 ( -0.293 0.000 0.388) 0.486 6.026 ( -6.011 0.000 3.303) 6.859 6.093 ( 3.556 0.000 -2.919) 4.600 6.208 ( 1.135 0.000 -1.935) 2.243 6.300 ( 5.214 0.000 2.615) 5.833 6.425 ( 2.954 0.000 -5.444) 6.194 6.446 ( -0.838 0.000 -1.115) 1.395 6.722 ( 1.763 0.000 -10.866) 11.008 7.079 ( 5.590 0.000 -1.483) 5.783 7.094 ( -3.009 0.000 -0.600) 3.069 7.185 ( 0.832 0.000 0.006) 0.832 7.263 ( 1.953 0.000 -0.635) 2.054 7.647 ( 9.405 0.000 7.341) 11.931 8.107 ( 2.306 0.000 3.899) 4.530 8.123 ( 2.053 0.000 8.013) 8.272 8.281 ( 12.854 0.000 1.120) 12.903 8.415 ( -3.874 0.000 -6.510) 7.575 8.656 ( 1.488 0.000 -2.922) 3.279 8.749 ( -1.721 0.000 7.664) 7.855 8.835 ( 4.188 0.000 5.539) 6.944 8.875 ( -4.615 0.000 5.610) 7.265 8.919 ( 1.931 0.000 5.704) 6.022 9.064 ( -6.790 0.000 -2.090) 7.104 9.131 ( 11.700 0.000 -11.322) 16.281 9.235 ( -2.046 0.000 2.215) 3.015 9.441 ( -1.566 0.000 -7.809) 7.965 9.653 ( -8.519 0.000 7.852) 11.586 9.808 ( -0.511 0.000 -7.700) 7.717 10.277 ( -3.380 0.000 -1.561) 3.723 10.445 ( -8.327 0.000 3.274) 8.947 10.858 ( 3.433 0.000 -4.595) 5.736 11.008 ( -13.247 0.000 -0.169) 13.248 20.484 ( 0.047 0.000 1.483) 1.484 20.567 ( 1.353 0.000 -2.047) 2.453 20.886 ( 0.158 0.000 1.047) 1.059 20.897 ( 1.228 0.000 -0.560) 1.349 22.763 ( 1.477 0.000 0.033) 1.477 22.885 ( -1.837 0.000 -0.275) 1.857 23.040 ( 1.176 0.000 0.225) 1.197 23.152 ( -2.048 0.000 -0.478) 2.103 24.727 ( 2.205 0.000 0.134) 2.209 24.823 ( 1.134 0.000 0.835) 1.408 24.882 ( 1.207 0.000 -0.215) 1.226 24.901 ( -1.145 0.000 1.338) 1.761 25.809 ( 5.280 0.000 -0.032) 5.280 25.863 ( 1.887 0.000 0.210) 1.898 26.065 ( 0.934 0.000 2.217) 2.406 26.263 ( 3.085 0.000 -3.612) 4.751 28.330 ( -0.158 0.000 2.442) 2.447 28.432 ( 5.001 0.000 -1.094) 5.120 28.559 ( 2.149 0.000 -1.115) 2.421 28.591 ( -4.499 0.000 -1.349) 4.697 28.664 ( 2.247 0.000 0.994) 2.457 28.734 ( -1.520 0.000 3.958) 4.239 28.763 ( 2.841 0.000 -1.531) 3.227 28.793 ( -3.077 0.000 0.288) 3.090 32.336 ( -2.220 0.000 1.808) 2.863 32.376 ( 0.509 0.000 -1.806) 1.876 32.481 ( 2.061 0.000 3.366) 3.947 32.575 ( 1.120 0.000 -1.699) 2.035 35.387 ( -0.567 0.000 1.991) 2.070 35.458 ( -0.611 0.000 2.310) 2.389 35.486 ( 0.616 0.000 -2.573) 2.645 35.554 ( 1.278 0.000 -2.062) 2.426 88.836 ( -3.955 0.000 2.001) 4.432 88.863 ( -0.647 0.000 -3.747) 3.802 89.015 ( 5.704 0.000 -3.610) 6.750 89.525 ( -18.272 0.000 -11.015) 21.335 97.611 ( -0.770 0.000 -0.517) 0.927 97.641 ( -1.374 0.000 -0.055) 1.376 97.685 ( -0.310 0.000 -0.579) 0.657 97.804 ( -9.957 0.000 -4.984) 11.134 98.705 ( -0.653 0.000 1.645) 1.770 98.725 ( 0.591 0.000 -0.176) 0.616 98.749 ( 3.101 0.000 1.153) 3.309 98.834 ( 0.304 0.000 -1.308) 1.343 99.616 ( -0.091 0.000 1.749) 1.751 99.673 ( 1.320 0.000 -1.498) 1.997 99.785 ( 9.631 0.000 3.309) 10.184 100.141 ( -7.387 0.000 4.258) 8.527 ======================= 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| 1.002 ( -5.225 10.922 17.050) 20.912 1.076 ( -1.775 10.773 17.395) 20.538 1.386 ( 2.957 6.413 -16.354) 17.813 1.447 ( 2.751 6.265 -15.223) 16.690 1.786 ( -3.159 5.596 20.545) 21.527 2.011 ( 2.013 0.977 -2.957) 3.708 2.151 ( 0.172 -4.390 8.116) 9.229 2.240 ( -0.446 -3.149 2.278) 3.911 2.338 ( 1.589 -5.164 4.838) 7.252 2.427 ( -0.039 -4.281 1.306) 4.476 2.547 ( 2.701 1.314 4.739) 5.611 2.614 ( -0.010 -0.699 3.619) 3.686 2.624 ( -3.230 -0.955 -2.250) 4.051 2.738 ( -1.689 -0.779 0.139) 1.866 2.833 ( 2.378 3.651 -1.069) 4.486 2.888 ( -1.012 -0.925 -1.638) 2.136 2.923 ( 1.166 4.131 -4.849) 6.476 2.953 ( 2.121 1.718 -6.776) 7.305 3.088 ( 1.622 -0.754 -1.264) 2.190 3.175 ( -2.155 -1.670 -3.385) 4.347 3.178 ( -0.873 0.886 -0.398) 1.306 3.281 ( -0.617 1.203 -5.579) 5.741 3.383 ( -2.439 2.108 1.221) 3.448 3.450 ( 0.599 1.373 -3.471) 3.780 4.388 ( 2.347 -1.077 -0.596) 2.651 4.393 ( -1.739 0.777 -1.253) 2.280 4.741 ( -2.657 -7.940 6.400) 10.539 4.809 ( 0.126 -5.235 0.422) 5.254 4.921 ( -1.333 2.707 0.664) 3.089 4.968 ( 1.022 0.481 -3.286) 3.475 5.158 ( 3.667 -2.064 1.311) 4.408 5.221 ( -2.289 -0.624 -5.415) 5.912 5.360 ( -0.967 3.444 6.568) 7.479 5.447 ( -5.930 1.077 6.875) 9.143 5.485 ( 0.166 1.223 -3.567) 3.775 5.571 ( 4.657 -4.001 -1.635) 6.354 5.579 ( 2.065 -2.826 3.000) 4.610 5.715 ( -2.485 -6.363 -4.701) 8.292 5.743 ( 2.622 -4.166 5.337) 7.260 5.850 ( -0.273 -1.892 -4.637) 5.015 6.053 ( -1.514 4.086 0.909) 4.452 6.080 ( 2.787 1.438 0.183) 3.141 6.132 ( -0.019 4.217 -3.367) 5.396 6.165 ( -1.954 2.759 -4.580) 5.693 6.383 ( -1.395 0.863 0.837) 1.841 6.407 ( -0.876 -1.319 -1.413) 2.122 6.603 ( 5.455 8.307 2.945) 10.365 6.734 ( -2.505 7.810 -8.696) 11.954 7.096 ( -1.024 0.669 1.710) 2.102 7.133 ( 1.490 1.401 -1.593) 2.592 7.193 ( 3.316 -1.873 3.987) 5.514 7.263 ( -2.824 0.767 -2.588) 3.906 7.882 ( 9.827 -1.649 6.626) 11.966 7.984 ( -12.177 -1.637 -3.193) 12.694 8.194 ( 0.333 0.388 7.463) 7.480 8.297 ( -4.772 1.351 0.147) 4.961 8.516 ( 9.712 -6.547 1.263) 11.781 8.579 ( -4.590 -3.493 -3.171) 6.582 8.715 ( 9.371 -1.405 2.963) 9.928 8.759 ( -10.589 1.240 0.273) 10.665 8.890 ( -3.130 1.067 6.476) 7.271 9.016 ( 0.958 3.963 -2.616) 4.844 9.098 ( -3.868 0.956 5.976) 7.182 9.207 ( -0.932 0.618 1.284) 1.703 9.262 ( 8.103 -3.039 -7.218) 11.269 9.359 ( 1.994 0.048 -8.702) 8.928 9.615 ( -5.706 1.077 7.417) 9.420 9.797 ( 4.682 -0.235 -8.247) 9.486 10.253 ( -5.106 -1.202 1.859) 5.565 10.289 ( 5.678 -0.550 -1.517) 5.903 10.772 ( -8.151 -3.793 4.618) 10.107 10.855 ( 5.973 -4.095 -2.930) 7.812 20.554 ( -0.035 3.309 -0.143) 3.312 20.578 ( 0.279 2.006 -2.129) 2.939 20.907 ( -0.556 1.231 0.879) 1.612 20.922 ( 0.420 1.255 -0.554) 1.435 22.812 ( 2.545 0.499 1.157) 2.840 22.839 ( -2.405 0.207 -1.177) 2.685 23.083 ( 1.988 0.482 0.933) 2.249 23.108 ( -1.926 0.135 -1.273) 2.313 24.738 ( 1.129 -2.423 0.695) 2.762 24.749 ( -1.171 -3.400 -0.170) 3.600 24.914 ( -0.421 1.372 1.185) 1.862 24.933 ( 0.386 1.281 -0.382) 1.391 25.870 ( 1.196 0.174 0.104) 1.213 25.873 ( -0.841 0.216 -0.119) 0.877 26.123 ( 0.610 0.449 3.181) 3.270 26.202 ( -2.370 -0.314 -3.903) 4.577 28.356 ( -0.420 -0.407 3.338) 3.388 28.418 ( -1.350 -1.309 -1.849) 2.637 28.559 ( -0.867 0.736 0.932) 1.470 28.590 ( 1.687 1.247 -1.729) 2.719 28.689 ( -1.620 -1.091 3.099) 3.663 28.721 ( -2.663 -1.884 1.170) 3.466 28.734 ( 3.255 -2.601 0.081) 4.167 28.773 ( 3.074 -1.675 -3.229) 4.762 32.335 ( -1.090 0.696 1.923) 2.318 32.377 ( 1.120 0.595 -1.760) 2.169 32.505 ( 0.115 -1.558 2.658) 3.084 32.559 ( 0.217 -0.998 -2.293) 2.510 35.406 ( -0.297 0.195 2.292) 2.319 35.456 ( 0.154 -0.567 -1.794) 1.888 35.499 ( -0.044 1.463 1.285) 1.948 35.542 ( -0.354 0.539 -2.083) 2.181 88.791 ( -3.017 -0.202 2.142) 3.706 88.844 ( 1.982 0.101 -2.627) 3.292 89.040 ( -12.756 -4.410 3.915) 14.053 89.099 ( 7.171 -2.706 -1.760) 7.864 97.609 ( -0.163 0.188 -0.065) 0.257 97.613 ( 0.073 0.238 -0.398) 0.469 97.676 ( -2.061 -0.429 0.546) 2.175 97.685 ( 1.258 -0.499 -0.257) 1.377 98.695 ( -0.123 -0.399 0.934) 1.024 98.706 ( 0.181 -0.532 0.112) 0.573 98.879 ( -0.724 4.988 0.072) 5.041 98.917 ( 0.295 7.252 -3.768) 8.177 99.644 ( -0.037 1.354 1.831) 2.278 99.686 ( 0.332 1.310 -1.978) 2.396 99.989 ( -4.153 -3.065 1.120) 5.282 100.002 ( 8.063 -3.213 -0.045) 8.680 ======================= 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| 1.109 ( -0.344 4.876 12.287) 13.224 1.262 ( 4.525 9.620 0.966) 10.675 1.340 ( 7.613 11.313 -0.226) 13.638 1.390 ( 9.850 4.884 -12.692) 16.792 1.912 ( -1.800 1.769 6.786) 7.240 2.009 ( 3.386 2.432 -4.121) 5.862 2.218 ( 0.097 -3.931 1.852) 4.346 2.247 ( -1.028 -5.882 0.723) 6.015 2.356 ( -1.085 -4.955 -3.339) 6.072 2.453 ( 3.636 -2.602 -1.285) 4.652 2.526 ( -2.661 2.228 -0.635) 3.529 2.593 ( -0.590 -1.544 4.777) 5.055 2.661 ( -2.617 -0.789 -7.714) 8.184 2.707 ( -1.010 3.119 4.754) 5.775 2.832 ( -0.956 2.133 -0.559) 2.403 2.859 ( 0.711 0.343 1.354) 1.567 2.890 ( -0.500 5.337 -1.850) 5.670 2.929 ( 1.228 -0.781 -2.673) 3.043 3.064 ( -0.655 -3.340 -1.410) 3.684 3.171 ( -1.193 0.352 0.502) 1.341 3.206 ( 0.128 -0.008 -4.353) 4.355 3.223 ( 1.963 2.662 8.057) 8.710 3.384 ( -2.125 1.298 4.559) 5.195 3.430 ( 0.816 1.910 -2.498) 3.249 4.374 ( 0.510 -1.505 -0.427) 1.646 4.430 ( 3.028 -0.333 -0.125) 3.049 4.740 ( -3.867 -6.001 1.814) 7.366 4.792 ( -3.560 -5.790 3.498) 7.644 4.875 ( -2.372 1.593 -1.047) 3.043 4.964 ( -0.366 -0.023 0.010) 0.367 5.138 ( -0.185 -0.220 -4.078) 4.088 5.209 ( -3.022 -1.374 2.726) 4.296 5.283 ( -9.859 1.078 1.365) 10.012 5.386 ( -4.181 2.865 0.225) 5.074 5.475 ( -1.691 -3.805 5.269) 6.715 5.598 ( 0.832 2.880 -5.789) 6.519 5.650 ( 1.822 -4.940 -5.116) 7.342 5.688 ( 0.345 -3.867 5.123) 6.428 5.763 ( -0.914 -3.761 -3.289) 5.079 5.831 ( 1.981 -3.346 0.763) 3.962 6.041 ( 0.086 0.503 1.113) 1.225 6.085 ( -1.262 3.617 -1.717) 4.198 6.129 ( 0.775 3.417 -0.389) 3.525 6.171 ( 4.009 3.409 3.451) 6.293 6.339 ( -6.958 -0.618 -1.126) 7.076 6.349 ( -4.090 2.429 3.161) 5.711 6.581 ( -4.293 4.582 -6.202) 8.826 6.711 ( 2.417 9.906 2.492) 10.497 7.039 ( -9.204 -2.249 -0.214) 9.477 7.135 ( 1.447 1.669 -1.491) 2.665 7.152 ( -0.607 -0.352 0.160) 0.719 7.312 ( 2.097 2.087 -0.352) 2.980 7.720 ( -13.245 -0.881 -1.627) 13.374 8.095 ( 5.143 -3.637 5.871) 8.611 8.205 ( -3.563 2.244 -0.438) 4.233 8.220 ( -8.090 -0.315 6.428) 10.338 8.396 ( -7.684 -3.389 -9.894) 12.978 8.577 ( -0.562 -2.929 -0.406) 3.010 8.657 ( -4.517 -5.742 6.030) 9.473 8.873 ( -5.198 0.736 1.947) 5.599 8.985 ( 11.517 1.372 2.659) 11.900 9.014 ( -5.103 3.972 0.069) 6.467 9.065 ( 6.313 4.815 1.904) 8.164 9.233 ( -0.570 -2.225 -3.946) 4.566 9.284 ( 5.934 1.330 -9.997) 11.701 9.334 ( 5.631 1.465 1.273) 5.956 9.641 ( -0.610 1.334 7.502) 7.644 9.790 ( 4.047 -2.281 -5.901) 7.511 10.275 ( 5.392 1.417 0.158) 5.578 10.415 ( 9.166 -3.824 -1.077) 9.990 10.711 ( -5.722 -2.859 5.153) 8.214 10.956 ( 9.222 -5.958 -2.180) 11.194 20.549 ( -1.013 2.182 0.456) 2.448 20.556 ( -0.691 2.325 -0.817) 2.560 20.898 ( -1.462 1.298 0.765) 2.099 20.916 ( -0.374 1.025 -0.569) 1.230 22.783 ( -2.401 0.728 -1.133) 2.753 22.866 ( 2.261 -0.194 0.968) 2.467 23.063 ( -1.530 0.495 -1.044) 1.917 23.135 ( 2.650 -0.024 0.928) 2.808 24.708 ( -2.870 -2.141 -0.157) 3.584 24.754 ( -0.308 -3.721 0.302) 3.746 24.919 ( -0.107 2.037 0.615) 2.130 24.941 ( 1.135 1.338 -0.530) 1.833 25.819 ( -4.948 0.529 -0.342) 4.988 25.863 ( -2.043 -0.049 -0.014) 2.043 26.118 ( -2.858 0.364 -1.156) 3.104 26.166 ( -1.232 -0.269 3.201) 3.441 28.368 ( -2.280 -0.281 -0.355) 2.324 28.374 ( -1.583 -0.499 2.311) 2.845 28.547 ( -1.361 0.298 0.320) 1.429 28.601 ( 1.350 1.093 -0.569) 1.828 28.667 ( -3.366 -1.600 1.089) 3.882 28.696 ( -0.934 -0.140 0.761) 1.213 28.774 ( 2.142 -2.611 -2.885) 4.441 28.815 ( 5.047 -2.315 -2.039) 5.916 32.342 ( -0.438 0.611 1.591) 1.760 32.386 ( 2.072 0.744 -1.599) 2.721 32.517 ( -1.350 -1.387 0.611) 2.029 32.536 ( -0.080 -0.685 -1.051) 1.256 35.426 ( -0.327 -0.028 2.204) 2.229 35.435 ( 0.017 -0.170 -1.909) 1.917 35.509 ( -0.795 0.794 0.526) 1.241 35.521 ( -0.028 0.900 -0.114) 0.908 88.781 ( -1.036 -0.114 3.141) 3.309 88.871 ( 1.766 -0.808 -0.078) 1.943 88.923 ( -3.796 0.214 2.823) 4.735 89.284 ( 11.702 -6.065 2.419) 13.400 97.607 ( 0.823 0.208 -0.085) 0.853 97.635 ( 1.771 -0.043 -0.035) 1.771 97.668 ( 0.064 -0.330 0.612) 0.698 97.733 ( 4.258 -1.134 0.769) 4.473 98.689 ( -0.651 -0.475 0.028) 0.806 98.721 ( 0.992 -0.496 -0.070) 1.112 98.864 ( -2.159 5.967 1.544) 6.530 98.884 ( -1.084 5.087 -1.217) 5.341 99.652 ( -0.623 1.062 0.255) 1.258 99.678 ( 0.658 1.713 -0.697) 1.962 99.830 ( -8.675 -0.960 -1.902) 8.933 100.175 ( 9.599 -4.874 -2.932) 11.158 ======================= 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| 1.223 ( 11.163 7.758 -7.409) 15.482 1.280 ( 7.869 6.542 -12.027) 15.791 1.475 ( 8.333 4.577 4.633) 10.576 1.585 ( 7.538 6.262 9.498) 13.647 1.900 ( -2.820 0.791 0.483) 2.968 2.029 ( 0.836 2.512 -1.335) 2.965 2.184 ( 1.232 -8.352 -8.388) 11.901 2.221 ( -0.613 -0.763 -2.646) 2.821 2.293 ( 0.278 -3.598 -3.361) 4.932 2.428 ( -3.007 -1.075 -5.332) 6.216 2.489 ( 2.845 4.459 -9.798) 11.135 2.555 ( -0.615 -0.442 0.260) 0.801 2.632 ( -1.191 -0.256 0.827) 1.472 2.704 ( -3.803 3.288 2.383) 5.563 2.789 ( -4.661 4.669 -1.262) 6.717 2.851 ( 2.301 -3.395 -4.110) 5.806 2.893 ( 0.197 2.291 -1.223) 2.604 2.983 ( 3.124 -0.917 8.195) 8.818 3.111 ( -2.941 -0.220 1.223) 3.192 3.135 ( 3.025 -3.634 4.926) 6.828 3.187 ( -1.389 -0.418 0.943) 1.730 3.324 ( -1.703 4.181 6.286) 7.739 3.423 ( 2.656 0.717 1.279) 3.034 3.429 ( -1.806 2.044 6.597) 7.138 4.397 ( 2.688 -3.064 -0.560) 4.115 4.480 ( 2.272 -1.276 0.967) 2.780 4.670 ( -3.429 -4.291 -1.177) 5.618 4.756 ( -6.490 -3.253 3.847) 8.216 4.846 ( -0.404 -1.664 -0.356) 1.749 4.958 ( -0.508 -0.028 1.329) 1.422 5.065 ( -11.519 -1.744 2.780) 11.978 5.134 ( 1.820 -1.061 -1.139) 2.394 5.212 ( -2.310 2.367 0.338) 3.325 5.333 ( -3.509 2.419 1.162) 4.418 5.474 ( -4.056 -4.969 0.077) 6.415 5.517 ( -1.948 -3.094 -4.138) 5.522 5.575 ( -3.449 -3.398 -4.284) 6.465 5.705 ( -4.645 -1.602 2.435) 5.484 5.746 ( 2.685 -0.705 1.359) 3.091 5.876 ( 1.852 -0.070 0.187) 1.863 6.024 ( -5.686 -0.686 -2.324) 6.180 6.032 ( -5.417 1.974 0.329) 5.775 6.152 ( 1.672 0.949 -1.462) 2.415 6.186 ( -5.926 1.643 -0.516) 6.171 6.286 ( 3.802 2.453 4.702) 6.525 6.355 ( -0.184 1.840 6.953) 7.194 6.466 ( -3.738 3.384 -1.831) 5.365 6.737 ( -1.784 7.052 2.484) 7.686 6.902 ( -6.739 -2.558 1.897) 7.453 7.098 ( -5.302 -2.585 -2.410) 6.372 7.182 ( 4.003 2.001 -0.365) 4.490 7.292 ( -1.789 5.231 -0.141) 5.531 7.567 ( -4.467 1.916 -0.088) 4.861 7.979 ( -13.253 -3.952 -7.422) 15.695 8.116 ( -2.727 0.083 -2.611) 3.776 8.222 ( -3.539 -1.304 -5.823) 6.938 8.266 ( -3.978 -1.806 9.561) 10.512 8.538 ( -11.611 0.756 5.173) 12.734 8.592 ( 0.551 -2.475 1.293) 2.846 8.855 ( -1.908 1.074 -0.680) 2.293 8.907 ( -3.772 1.643 -4.604) 6.174 9.090 ( 3.899 -0.332 -3.325) 5.135 9.160 ( 2.594 7.125 -2.412) 7.957 9.226 ( 5.825 2.764 1.461) 6.611 9.359 ( 11.695 1.371 -3.318) 12.233 9.521 ( 10.904 2.847 3.039) 11.673 9.731 ( 2.820 -1.971 4.550) 5.704 9.819 ( 5.038 -2.145 -2.862) 6.178 10.380 ( 5.967 -0.343 -0.200) 5.981 10.520 ( 4.802 -3.228 -1.878) 6.083 10.691 ( -3.993 -2.934 6.569) 8.229 11.090 ( 8.758 -8.612 -2.778) 12.593 20.528 ( -1.013 2.123 -0.388) 2.384 20.543 ( -1.324 1.551 0.970) 2.258 20.877 ( -1.895 1.135 0.693) 2.315 20.900 ( -0.781 0.849 -0.661) 1.330 22.744 ( -1.470 0.829 0.078) 1.690 22.901 ( 1.270 -0.988 0.030) 1.609 23.038 ( -0.603 0.889 -0.334) 1.125 23.182 ( 2.138 -0.578 0.068) 2.216 24.660 ( -2.995 -1.585 0.571) 3.436 24.737 ( -1.377 -4.444 -0.516) 4.681 24.923 ( 0.135 2.966 -0.121) 2.972 24.955 ( 1.416 1.474 -0.838) 2.209 25.719 ( -6.210 1.096 -0.062) 6.306 25.811 ( -3.954 -0.276 -0.135) 3.966 26.067 ( -2.017 0.584 -0.781) 2.240 26.151 ( -4.257 -0.570 2.382) 4.911 28.337 ( -1.076 0.234 0.089) 1.104 28.368 ( -0.822 -0.197 0.895) 1.231 28.525 ( -1.442 0.055 0.261) 1.467 28.618 ( -2.472 -1.135 0.119) 2.723 28.625 ( 0.070 -0.507 1.255) 1.355 28.691 ( -0.457 1.300 0.652) 1.524 28.767 ( 1.092 -2.460 -3.367) 4.311 28.865 ( 3.576 -1.844 -2.253) 4.612 32.355 ( 0.298 0.232 1.056) 1.121 32.411 ( 2.647 0.846 -1.111) 2.993 32.482 ( -0.926 -0.931 -2.296) 2.645 32.531 ( -1.115 -0.042 1.157) 1.607 35.417 ( 0.283 0.042 -1.453) 1.480 35.445 ( -0.232 -0.185 1.876) 1.900 35.494 ( -0.427 0.441 -0.743) 0.964 35.523 ( -0.913 0.933 1.083) 1.696 88.824 ( 1.491 -0.959 3.846) 4.235 88.875 ( -2.028 -1.365 3.491) 4.262 88.960 ( 4.843 1.887 -1.127) 5.318 89.477 ( 5.998 -9.063 3.425) 11.395 97.631 ( 1.870 -0.009 0.007) 1.870 97.662 ( 1.574 -0.320 -0.158) 1.614 97.686 ( 1.167 -0.207 0.772) 1.414 97.832 ( 4.769 -3.144 2.298) 6.157 98.682 ( 0.062 -0.283 -0.145) 0.324 98.730 ( 0.690 -0.124 -0.791) 1.057 98.836 ( -3.386 6.345 1.785) 7.410 98.855 ( -1.944 3.771 0.477) 4.269 99.630 ( -1.547 0.294 -1.465) 2.151 99.678 ( -0.552 1.611 -0.031) 1.703 99.721 ( -1.448 1.815 0.259) 2.336 100.261 ( 5.978 -4.776 -4.764) 9.013 ======================= 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| 1.273 ( 12.010 4.848 -15.233) 19.995 1.383 ( 14.556 7.753 -6.694) 17.799 1.644 ( 1.408 0.923 5.342) 5.601 1.729 ( -0.306 4.393 1.009) 4.518 1.873 ( 2.539 2.532 -0.116) 3.588 1.991 ( -2.424 0.804 -0.480) 2.598 2.084 ( -0.913 -2.488 -7.773) 8.212 2.197 ( 0.772 -1.868 -1.662) 2.617 2.308 ( 0.018 -0.051 0.024) 0.059 2.350 ( -0.187 -1.355 0.489) 1.453 2.447 ( 3.742 2.384 -8.619) 9.694 2.556 ( -5.143 1.253 -5.425) 7.579 2.570 ( 1.333 -0.422 -1.501) 2.051 2.641 ( -4.496 -1.245 1.227) 4.824 2.715 ( -1.950 2.810 -1.500) 3.735 2.803 ( -1.004 -0.658 -6.693) 6.799 2.898 ( 5.094 1.898 -3.309) 6.364 3.067 ( -2.569 -3.637 3.153) 5.456 3.156 ( 2.784 0.396 7.583) 8.088 3.160 ( -1.784 -0.769 1.807) 2.653 3.253 ( 1.035 0.481 5.497) 5.614 3.310 ( -5.180 3.305 4.556) 7.649 3.463 ( 1.230 1.089 4.062) 4.381 3.525 ( 0.965 1.832 6.843) 7.149 4.448 ( 4.532 -3.119 -1.021) 5.595 4.511 ( -1.418 -4.101 2.573) 5.045 4.626 ( -2.513 -1.679 1.690) 3.463 4.668 ( -4.207 -2.464 -1.193) 5.019 4.848 ( 0.940 -2.348 -0.138) 2.533 4.942 ( -5.655 -3.313 2.832) 7.140 4.982 ( -1.592 -0.481 3.084) 3.504 5.104 ( -4.703 1.009 -0.207) 4.814 5.244 ( 3.615 -0.020 2.782) 4.561 5.284 ( -3.711 2.824 1.657) 4.949 5.357 ( -4.234 -5.134 -4.551) 8.062 5.472 ( 2.558 -3.806 -2.583) 5.263 5.529 ( -1.621 -6.359 -0.043) 6.562 5.621 ( -5.455 -0.517 1.359) 5.645 5.817 ( -2.857 1.715 3.541) 4.862 5.825 ( -9.530 -0.374 -1.849) 9.715 5.882 ( -10.031 0.428 0.040) 10.041 5.906 ( 2.016 2.832 -0.959) 3.606 6.141 ( 1.349 -0.943 -1.503) 2.229 6.171 ( 2.823 1.091 -1.280) 3.286 6.385 ( 1.080 6.303 3.868) 7.473 6.405 ( -3.005 -0.115 4.885) 5.736 6.505 ( 6.064 -2.263 4.736) 8.020 6.743 ( -2.300 6.821 5.315) 8.948 6.823 ( -7.316 -3.083 3.681) 8.750 6.967 ( -4.995 -3.388 -2.665) 6.598 7.243 ( 2.923 -0.087 0.094) 2.926 7.272 ( -0.034 4.157 -2.132) 4.672 7.522 ( -1.327 5.159 -1.407) 5.510 7.687 ( -7.193 -1.547 -12.244) 14.285 8.054 ( -2.440 -3.139 -4.800) 6.233 8.090 ( -8.784 1.095 2.088) 9.095 8.154 ( -11.533 4.988 2.630) 12.838 8.551 ( 1.371 1.516 6.013) 6.351 8.578 ( -2.603 1.326 -6.035) 6.705 8.698 ( -1.214 2.301 -3.053) 4.011 8.932 ( 1.557 -2.188 1.411) 3.033 9.125 ( 4.376 1.492 -3.782) 5.973 9.189 ( 1.014 4.359 1.802) 4.825 9.295 ( 3.175 4.427 -1.014) 5.541 9.565 ( 12.600 0.216 0.138) 12.603 9.692 ( 6.213 2.980 1.660) 7.088 9.810 ( 4.302 -4.523 -0.847) 6.299 9.885 ( 3.373 -1.949 0.749) 3.967 10.446 ( 2.487 -1.571 -0.496) 2.983 10.539 ( 0.734 -2.063 -2.186) 3.095 10.724 ( -1.959 -2.455 8.787) 9.331 11.154 ( 4.444 -8.557 -6.203) 11.465 20.513 ( -0.295 1.613 -0.276) 1.663 20.531 ( -1.395 1.124 1.010) 2.056 20.855 ( -1.628 0.861 0.767) 1.995 20.879 ( -0.648 0.670 -0.774) 1.211 22.738 ( -0.357 0.871 1.705) 1.947 22.910 ( 0.363 -0.721 -1.025) 1.304 23.036 ( 0.297 0.271 0.491) 0.635 23.200 ( 0.716 -1.149 -1.409) 1.954 24.625 ( -2.372 -1.653 1.460) 3.239 24.706 ( -1.093 -4.518 -1.263) 4.817 24.922 ( 0.274 3.847 -0.571) 3.899 24.966 ( 1.042 1.593 -1.094) 2.196 25.630 ( -4.368 1.608 0.646) 4.699 25.736 ( -4.354 -0.006 -0.564) 4.390 26.033 ( -1.368 0.307 -0.342) 1.443 26.092 ( -4.067 -0.191 0.420) 4.093 28.332 ( -0.280 0.499 0.870) 1.041 28.372 ( 0.598 0.146 -0.059) 0.618 28.508 ( -0.742 -0.071 0.191) 0.769 28.570 ( -2.681 -1.388 -0.154) 3.023 28.633 ( -1.487 -0.413 1.537) 2.178 28.702 ( 0.527 1.272 0.416) 1.438 28.750 ( 1.097 -2.017 -1.973) 3.027 28.886 ( 1.978 -1.507 -2.375) 3.439 32.373 ( 0.660 -0.151 0.728) 0.995 32.437 ( 0.707 -0.868 -1.501) 1.873 32.457 ( 1.799 1.167 -1.490) 2.612 32.520 ( -1.693 0.513 1.064) 2.064 35.414 ( 0.821 0.111 -0.739) 1.111 35.459 ( -0.129 -0.217 1.343) 1.367 35.478 ( -0.892 0.225 -0.243) 0.951 35.513 ( -0.775 0.892 -0.028) 1.182 88.886 ( -0.548 -1.204 3.061) 3.334 88.902 ( 1.914 -2.506 3.911) 5.024 89.031 ( 4.461 2.585 -0.180) 5.159 89.522 ( -1.635 -8.050 -1.578) 8.364 97.661 ( 1.444 -0.026 0.031) 1.444 97.685 ( 1.323 -0.164 -0.354) 1.379 97.724 ( 1.972 -0.557 1.617) 2.610 97.906 ( 1.282 -4.339 1.126) 4.663 98.690 ( 0.750 0.169 0.177) 0.789 98.731 ( 0.802 0.327 -1.080) 1.385 98.793 ( -3.056 5.439 0.728) 6.282 98.827 ( -2.482 2.940 0.940) 3.961 99.596 ( -0.595 0.143 -0.411) 0.737 99.669 ( -0.540 2.128 -0.437) 2.238 99.769 ( 2.432 1.311 5.868) 6.486 100.277 ( 3.387 -4.412 -6.621) 8.647 ======================= 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| 1.342 ( 11.936 3.064 -10.052) 15.903 1.542 ( -6.629 4.340 -7.697) 11.046 1.565 ( 10.709 4.640 -4.187) 12.400 1.641 ( -8.617 3.145 1.559) 9.305 1.954 ( 5.985 -0.235 -3.496) 6.936 1.963 ( -2.883 2.386 1.300) 3.962 2.072 ( 5.446 -1.427 -0.540) 5.656 2.210 ( -0.389 -2.272 0.525) 2.364 2.289 ( -0.753 -0.121 -2.247) 2.373 2.362 ( -3.259 -1.289 -4.593) 5.777 2.394 ( 0.904 3.306 0.484) 3.461 2.433 ( -2.186 2.451 -0.659) 3.350 2.534 ( -2.796 -0.234 -0.845) 2.931 2.619 ( 0.123 -1.492 0.223) 1.514 2.672 ( -3.632 1.390 0.479) 3.919 2.736 ( 1.749 -1.098 -5.619) 5.986 2.979 ( 5.836 -1.155 -1.250) 6.079 3.043 ( -3.363 -3.147 1.106) 4.737 3.141 ( -0.627 1.243 1.286) 1.895 3.222 ( -5.239 1.349 1.166) 5.534 3.283 ( 3.967 2.349 4.138) 6.195 3.324 ( -2.247 3.653 5.402) 6.898 3.529 ( -1.150 0.896 6.590) 6.749 3.597 ( 4.145 1.402 -0.178) 4.379 4.490 ( -4.260 -4.373 3.667) 7.121 4.518 ( 4.284 -3.604 -1.433) 5.779 4.593 ( -3.357 -1.037 3.577) 5.014 4.636 ( 0.969 -2.244 -1.873) 3.080 4.865 ( -3.884 -2.275 4.561) 6.408 4.904 ( 2.686 -4.963 -3.056) 6.417 4.983 ( -0.538 -0.718 1.733) 1.952 5.033 ( -2.349 1.233 -1.042) 2.850 5.238 ( -2.950 0.930 2.751) 4.139 5.296 ( 1.374 -2.304 -2.852) 3.915 5.367 ( 3.998 -1.470 4.245) 6.014 5.474 ( -2.098 -2.025 -1.211) 3.157 5.509 ( 1.521 -7.234 -0.967) 7.455 5.576 ( -2.178 -0.842 -1.877) 2.996 5.645 ( -7.242 -1.332 1.714) 7.560 5.737 ( -4.675 0.246 -0.243) 4.688 5.837 ( 1.760 3.691 2.611) 4.851 5.964 ( 1.209 2.797 1.289) 3.309 6.147 ( 1.372 -1.239 -1.518) 2.392 6.224 ( 2.337 1.072 -1.087) 2.791 6.355 ( -4.380 -0.467 5.317) 6.905 6.459 ( 0.622 3.795 1.335) 4.070 6.641 ( 5.284 -2.202 3.316) 6.616 6.721 ( -6.063 1.395 5.033) 8.002 6.804 ( -1.333 -1.967 5.577) 6.062 6.887 ( -0.568 -3.459 -4.198) 5.469 7.253 ( 2.585 1.126 -3.218) 4.279 7.276 ( 1.053 -2.200 -0.061) 2.440 7.457 ( -3.398 7.758 -3.807) 9.286 7.507 ( -2.144 3.079 -8.839) 9.602 7.917 ( -7.299 2.695 3.164) 8.399 7.997 ( -4.302 -0.303 -1.891) 4.709 8.089 ( -1.265 6.600 3.271) 7.474 8.404 ( 0.266 5.601 -13.954) 15.038 8.669 ( 1.946 -0.096 5.813) 6.131 8.729 ( 1.117 -0.136 3.271) 3.459 8.956 ( -0.423 -1.450 1.838) 2.379 9.130 ( 2.454 2.341 -6.541) 7.368 9.230 ( -0.376 3.388 4.308) 5.493 9.323 ( 2.118 3.151 -1.913) 4.252 9.729 ( 5.427 -0.110 0.699) 5.473 9.763 ( 0.886 0.152 1.141) 1.452 9.870 ( 2.951 -3.260 -0.080) 4.398 9.916 ( 1.812 -2.243 -2.396) 3.749 10.460 ( -1.059 -0.810 1.188) 1.786 10.521 ( 0.540 -2.231 -2.435) 3.347 10.798 ( -1.779 -2.532 10.419) 10.869 11.116 ( 1.533 -6.692 -9.227) 11.501 20.515 ( 0.769 1.020 -0.228) 1.298 20.518 ( -1.197 1.017 0.707) 1.722 20.842 ( -0.900 0.686 0.905) 1.449 20.865 ( -0.037 0.497 -0.840) 0.977 22.767 ( 0.708 0.997 3.005) 3.244 22.887 ( -0.837 0.348 -2.549) 2.705 23.063 ( 1.408 -0.996 1.952) 2.605 23.176 ( -0.906 -1.520 -2.736) 3.258 24.614 ( -1.362 -1.998 2.158) 3.241 24.678 ( -0.194 -4.132 -1.849) 4.531 24.924 ( 0.244 3.914 0.195) 3.926 24.963 ( 0.202 1.990 -1.489) 2.493 25.597 ( -0.793 1.720 1.413) 2.363 25.665 ( -2.662 0.687 -1.245) 3.018 26.018 ( -0.214 0.006 0.056) 0.222 26.041 ( -1.945 0.007 -0.281) 1.965 28.340 ( -0.466 0.600 1.549) 1.725 28.378 ( 0.403 0.455 -0.681) 0.913 28.509 ( 0.539 -0.261 0.324) 0.681 28.530 ( -1.737 -0.891 -0.285) 1.973 28.621 ( -1.778 -0.005 1.868) 2.579 28.694 ( 0.911 -0.809 -3.068) 3.301 28.778 ( 1.127 -0.585 2.388) 2.704 28.881 ( 0.891 -1.531 -2.955) 3.446 32.389 ( 0.264 -0.297 0.644) 0.757 32.420 ( -0.275 -0.942 -1.222) 1.567 32.489 ( 2.690 0.977 -0.921) 3.006 32.499 ( -1.911 1.091 0.741) 2.322 35.427 ( 0.950 -0.044 0.104) 0.956 35.456 ( -1.449 -0.010 -0.211) 1.465 35.470 ( -0.289 0.369 1.287) 1.369 35.502 ( 0.286 0.564 -0.998) 1.182 88.905 ( -1.363 -1.138 3.499) 3.924 88.964 ( 2.214 -3.375 0.289) 4.047 89.112 ( 2.947 1.925 4.656) 5.837 89.421 ( -4.399 -4.622 -6.285) 8.956 97.678 ( 0.481 0.098 0.259) 0.555 97.695 ( 0.497 0.131 -0.608) 0.795 97.784 ( 2.343 -1.499 2.645) 3.838 97.898 ( -1.809 -3.430 -1.151) 4.045 98.705 ( 0.618 0.701 0.344) 0.996 98.732 ( -0.047 1.212 -0.800) 1.453 98.768 ( 0.171 3.378 0.310) 3.396 98.794 ( -2.190 2.398 0.439) 3.277 99.600 ( 0.663 0.647 0.660) 1.138 99.648 ( -0.946 2.398 -1.038) 2.779 99.897 ( 2.140 -0.743 9.648) 9.910 100.235 ( 1.477 -4.100 -8.895) 9.905 ======================= 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| 1.266 ( -13.619 4.334 -3.529) 14.722 1.448 ( -3.839 4.886 -0.077) 6.214 1.495 ( 0.063 2.359 -0.466) 2.405 1.723 ( 10.475 2.603 -4.554) 11.715 1.927 ( -1.500 0.593 -0.630) 1.731 1.997 ( 3.595 -0.793 -2.868) 4.667 2.110 ( -5.056 -0.034 -3.772) 6.308 2.188 ( 6.081 -1.623 1.386) 6.444 2.241 ( -5.402 -0.749 4.430) 7.026 2.329 ( -0.403 2.229 -3.393) 4.079 2.389 ( -2.450 3.348 -1.212) 4.322 2.422 ( 3.940 1.964 1.300) 4.591 2.563 ( 1.431 -0.596 4.102) 4.385 2.578 ( -4.328 -1.358 -1.066) 4.660 2.629 ( -2.279 -0.487 2.595) 3.488 2.738 ( 3.887 0.191 -3.867) 5.486 2.914 ( -9.810 0.093 1.950) 10.002 3.068 ( 2.701 -2.753 1.004) 3.986 3.163 ( -1.732 -0.083 0.493) 1.802 3.203 ( 4.779 0.972 0.591) 4.913 3.316 ( -2.415 2.159 1.430) 3.542 3.379 ( 3.127 3.890 1.188) 5.130 3.552 ( -1.518 1.986 2.541) 3.565 3.664 ( 5.808 0.600 -3.717) 6.922 4.452 ( -5.135 -3.038 3.896) 7.126 4.560 ( 2.574 -3.553 -0.053) 4.388 4.565 ( -2.788 -3.490 1.169) 4.617 4.667 ( 3.089 -1.348 -1.351) 3.632 4.817 ( -4.568 -5.012 3.521) 7.641 4.949 ( 3.660 -4.246 -2.205) 6.024 5.003 ( -0.062 2.086 0.379) 2.121 5.040 ( 7.400 0.381 -1.806) 7.626 5.213 ( -4.119 0.835 3.477) 5.455 5.328 ( 5.786 -2.017 -3.905) 7.266 5.427 ( -1.639 -1.719 -0.172) 2.381 5.465 ( 3.270 -3.516 1.704) 5.094 5.497 ( -2.634 -2.520 -3.107) 4.790 5.534 ( 3.614 -2.776 0.508) 4.585 5.672 ( 2.455 -0.164 4.356) 5.003 5.691 ( 1.155 0.044 0.287) 1.191 5.860 ( -6.275 2.067 0.864) 6.663 5.988 ( 5.591 1.933 -1.999) 6.244 6.140 ( -4.642 -0.937 0.978) 4.835 6.223 ( 3.186 3.222 -1.832) 4.887 6.401 ( 0.109 1.147 4.626) 4.767 6.454 ( 1.708 0.110 -1.628) 2.362 6.686 ( -3.946 -2.101 2.006) 4.900 6.760 ( 2.858 1.732 5.358) 6.315 6.840 ( 3.724 -3.412 -1.597) 5.297 6.875 ( 5.523 -5.394 -4.272) 8.824 7.258 ( -2.028 -2.860 -3.052) 4.649 7.298 ( 3.044 -3.136 -1.686) 4.684 7.368 ( -2.817 8.478 1.790) 9.112 7.424 ( 0.729 8.635 -2.132) 8.924 7.905 ( -0.959 0.951 5.071) 5.247 7.963 ( 2.349 2.179 0.894) 3.326 8.131 ( -0.134 6.517 6.124) 8.944 8.312 ( 6.193 7.852 -13.115) 16.493 8.731 ( -0.254 -2.265 2.759) 3.579 8.751 ( -0.313 -1.842 -0.877) 2.064 8.973 ( -2.578 1.662 6.012) 6.749 9.071 ( 0.145 3.487 -7.586) 8.350 9.255 ( -1.983 1.709 3.749) 4.573 9.326 ( 1.422 2.280 -3.043) 4.059 9.728 ( -4.657 -1.476 0.731) 4.939 9.779 ( -3.726 -1.256 1.978) 4.401 9.822 ( -3.681 1.053 -1.521) 4.120 9.965 ( 5.259 -3.689 -3.657) 7.392 10.444 ( -3.502 -1.434 3.311) 5.029 10.511 ( 1.001 -0.794 -2.251) 2.588 10.882 ( -2.135 -4.145 11.480) 12.391 11.027 ( 0.341 -5.104 -9.943) 11.182 20.508 ( -0.578 1.402 0.374) 1.562 20.532 ( 1.614 0.708 -0.459) 1.822 20.844 ( -0.068 0.696 0.966) 1.192 20.862 ( 0.749 0.429 -0.825) 1.194 22.819 ( 0.981 0.885 3.184) 3.447 22.838 ( -0.977 0.814 -2.947) 3.210 23.110 ( -0.047 -1.605 1.150) 1.975 23.125 ( -0.168 -1.208 -1.575) 1.992 24.625 ( -0.314 -2.325 2.592) 3.497 24.662 ( 0.818 -3.432 -2.035) 4.072 24.930 ( -0.531 3.041 0.964) 3.234 24.945 ( -0.264 2.609 -1.277) 2.916 25.623 ( 0.877 1.059 0.313) 1.410 25.640 ( 2.506 1.474 -0.218) 2.915 26.022 ( -0.015 0.287 -0.295) 0.412 26.030 ( 1.412 -0.017 0.567) 1.521 28.346 ( -1.018 0.433 1.786) 2.101 28.368 ( -0.804 0.580 -0.559) 1.138 28.506 ( -0.333 -0.391 -0.186) 0.546 28.537 ( 2.153 -0.226 -0.001) 2.164 28.617 ( -1.477 -0.231 2.576) 2.978 28.684 ( 1.992 -1.098 -3.063) 3.815 28.816 ( -0.098 -0.657 2.365) 2.457 28.855 ( 0.439 -1.631 -3.659) 4.030 32.389 ( -1.309 -0.409 0.832) 1.604 32.408 ( -0.035 -0.768 -0.434) 0.883 32.472 ( -1.941 1.557 0.366) 2.515 32.522 ( 2.483 0.485 -1.087) 2.753 35.425 ( -1.849 0.153 0.322) 1.884 35.445 ( 0.107 -0.401 0.595) 0.725 35.481 ( 0.577 0.992 0.742) 1.366 35.502 ( 1.092 0.219 -1.302) 1.714 88.910 ( -2.525 -1.286 3.444) 4.460 88.977 ( 1.015 -2.364 -2.471) 3.567 89.231 ( 1.566 -1.913 9.033) 9.365 89.272 ( -3.563 -1.568 -6.948) 7.964 97.682 ( -0.432 0.159 0.480) 0.665 97.688 ( -0.466 0.202 -0.617) 0.799 97.836 ( -2.958 -2.225 -1.773) 4.104 97.851 ( 1.630 -2.870 2.798) 4.327 98.712 ( -0.741 1.093 0.318) 1.358 98.717 ( -0.449 0.893 -0.120) 1.006 98.772 ( -0.002 3.206 -0.032) 3.206 98.800 ( 2.784 2.744 -0.095) 3.910 99.616 ( -0.775 1.718 -0.300) 1.908 99.630 ( 1.229 1.542 0.071) 1.973 100.024 ( 0.321 -2.129 9.931) 10.162 100.137 ( -0.348 -3.679 -11.466) 12.046 ======================= 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| 1.023 ( -15.338 5.675 4.945) 17.085 1.243 ( -17.455 6.416 5.614) 19.425 1.635 ( 7.748 3.589 2.584) 8.921 1.779 ( 2.044 -1.516 -3.753) 4.535 1.910 ( 1.732 1.908 -3.408) 4.272 1.990 ( -3.043 -0.999 -0.563) 3.252 2.050 ( 1.709 2.470 -3.037) 4.271 2.185 ( -6.397 -0.254 5.277) 8.296 2.239 ( -9.763 3.054 0.822) 10.263 2.279 ( 1.140 -0.977 2.003) 2.504 2.371 ( -1.999 3.263 2.608) 4.630 2.491 ( 4.114 1.597 -0.391) 4.430 2.498 ( -1.715 -2.951 4.320) 5.505 2.638 ( 2.581 -0.860 1.727) 3.222 2.667 ( 2.524 -0.385 3.513) 4.342 2.755 ( 1.507 2.345 -1.626) 3.227 2.836 ( 0.371 1.443 -0.284) 1.517 3.105 ( 1.135 -3.521 0.200) 3.705 3.176 ( 1.652 -0.730 1.278) 2.212 3.258 ( -0.720 0.674 -1.132) 1.502 3.297 ( 2.430 0.106 -0.899) 2.593 3.396 ( -0.747 1.821 -2.018) 2.819 3.540 ( 0.030 3.198 -2.716) 4.196 3.690 ( 2.951 0.499 -5.698) 6.436 4.405 ( -4.197 -2.648 2.608) 5.606 4.532 ( -3.155 -2.665 1.728) 4.476 4.614 ( 2.527 -5.020 -0.415) 5.635 4.692 ( 4.499 -0.888 -1.192) 4.739 4.811 ( -0.393 -4.678 1.572) 4.951 4.995 ( 2.291 -2.126 -0.773) 3.220 5.005 ( 0.862 0.137 1.533) 1.765 5.161 ( 9.037 -0.008 -3.615) 9.734 5.236 ( 3.114 0.863 4.305) 5.383 5.355 ( 1.261 -2.049 -5.377) 5.891 5.365 ( -0.833 0.040 -6.404) 6.458 5.440 ( -2.333 -3.525 0.729) 4.289 5.518 ( 1.317 -5.453 0.965) 5.693 5.634 ( 6.898 -1.058 0.498) 6.997 5.732 ( 3.550 -0.507 3.067) 4.719 5.804 ( 2.309 1.438 4.517) 5.273 5.850 ( 8.028 1.717 2.630) 8.620 5.987 ( -1.898 0.150 -4.572) 4.953 6.092 ( -1.581 1.151 1.969) 2.775 6.193 ( -3.057 5.031 -2.904) 6.564 6.426 ( -1.446 4.507 1.028) 4.844 6.493 ( 1.800 0.039 -0.452) 1.856 6.618 ( -0.518 -2.516 -6.945) 7.405 6.851 ( 3.435 0.655 1.131) 3.675 6.900 ( 6.995 -1.706 -2.700) 7.689 6.954 ( 5.882 -6.040 -4.170) 9.406 7.222 ( 2.721 5.003 -0.396) 5.709 7.275 ( -0.265 -2.431 -3.369) 4.163 7.423 ( 2.941 -2.260 8.558) 9.327 7.476 ( 1.256 6.682 4.311) 8.050 7.966 ( 2.521 -2.269 2.627) 4.290 8.077 ( 6.617 2.666 3.079) 7.769 8.222 ( 3.167 5.503 8.231) 10.395 8.359 ( 11.513 8.817 -4.229) 15.105 8.691 ( -1.738 -2.155 -4.257) 5.078 8.731 ( -1.780 -1.972 -1.676) 3.141 8.962 ( -3.950 1.664 1.191) 4.449 9.015 ( -2.284 4.043 1.437) 4.861 9.239 ( -2.525 0.138 0.407) 2.562 9.309 ( 0.777 3.277 -3.388) 4.778 9.583 ( -12.020 1.431 -1.246) 12.169 9.685 ( -8.412 -3.908 3.960) 10.085 9.780 ( -1.304 3.035 -2.693) 4.262 9.970 ( 0.211 -3.388 -4.075) 5.303 10.419 ( -4.012 -3.305 3.520) 6.278 10.497 ( -1.191 1.172 -0.293) 1.696 10.922 ( -0.641 -4.906 -7.736) 9.183 10.966 ( -2.561 -6.724 9.593) 11.991 20.511 ( 0.821 2.466 0.019) 2.599 20.554 ( 1.845 0.750 -0.982) 2.220 20.859 ( 0.553 0.830 0.891) 1.337 20.872 ( 1.391 0.584 -0.621) 1.631 22.787 ( -0.765 0.612 -2.567) 2.748 22.871 ( 0.699 0.413 2.536) 2.663 23.065 ( -1.048 -0.684 -2.178) 2.512 23.160 ( 0.474 -1.052 2.127) 2.420 24.655 ( 0.761 -2.641 1.702) 3.233 24.664 ( 1.366 -2.596 -0.527) 2.981 24.917 ( -0.880 2.556 -0.140) 2.707 24.939 ( -0.769 2.337 0.985) 2.650 25.650 ( 3.809 1.222 -1.065) 4.140 25.717 ( 4.778 0.590 1.061) 4.930 26.030 ( 1.185 0.788 -0.150) 1.431 26.081 ( 3.711 0.291 1.297) 3.942 28.339 ( -1.556 0.215 0.519) 1.654 28.352 ( -0.959 0.323 1.337) 1.676 28.512 ( 1.461 0.158 -0.607) 1.589 28.577 ( 2.564 -0.291 -0.131) 2.584 28.626 ( -1.104 -0.809 3.064) 3.355 28.695 ( 2.326 -1.192 -1.941) 3.256 28.794 ( -1.239 -1.744 -3.537) 4.133 28.844 ( -0.624 -0.664 0.797) 1.210 32.372 ( -1.774 -0.597 1.107) 2.175 32.403 ( -0.865 -0.460 0.806) 1.268 32.444 ( -1.507 1.951 -0.263) 2.479 32.548 ( 2.136 0.003 -1.248) 2.474 35.400 ( -1.559 0.310 0.538) 1.678 35.448 ( -0.688 -0.298 1.141) 1.365 35.502 ( 1.410 0.441 -1.138) 1.865 35.512 ( 1.453 0.838 0.054) 1.678 88.893 ( -3.468 -1.516 2.740) 4.673 88.956 ( 0.006 -1.543 -2.628) 3.048 89.123 ( -3.644 0.061 -6.921) 7.822 89.387 ( 2.044 -7.795 10.917) 13.569 97.668 ( -1.225 0.134 -0.515) 1.335 97.674 ( -1.143 0.053 0.496) 1.248 97.763 ( -2.976 -1.174 -1.873) 3.707 97.897 ( 0.005 -5.286 2.223) 5.734 98.697 ( -0.796 0.180 -0.531) 0.974 98.706 ( -1.147 0.622 1.033) 1.664 98.802 ( 3.288 5.389 0.011) 6.313 98.849 ( 3.629 4.248 -0.838) 5.650 99.597 ( -0.418 1.063 -0.448) 1.227 99.660 ( 1.514 1.852 0.356) 2.418 99.978 ( -2.937 -2.338 -13.011) 13.542 100.111 ( -1.736 -2.905 8.407) 9.063 ======================= 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| 0.904 ( -11.213 8.716 15.483) 21.010 1.036 ( -15.889 11.070 9.441) 21.544 1.664 ( -3.783 -0.916 -5.089) 6.407 1.772 ( -2.113 2.666 -3.933) 5.200 1.890 ( 0.036 3.583 -3.793) 5.218 1.937 ( -17.765 9.988 12.318) 23.814 1.979 ( 0.795 -2.321 4.807) 5.397 2.119 ( 0.608 -0.872 2.025) 2.287 2.200 ( 1.194 -2.308 0.600) 2.666 2.326 ( 2.426 -2.484 1.922) 3.968 2.378 ( -0.616 -0.048 3.363) 3.419 2.562 ( 2.289 -0.010 3.082) 3.840 2.586 ( 3.941 0.186 3.915) 5.558 2.686 ( 2.035 -2.670 1.630) 3.732 2.740 ( 2.411 2.298 -0.188) 3.337 2.791 ( 1.017 2.333 5.188) 5.778 2.869 ( 4.165 3.194 -2.580) 5.849 3.130 ( 2.105 -2.780 -0.446) 3.515 3.190 ( -1.395 -1.107 -6.035) 6.292 3.204 ( 0.752 -2.582 -1.269) 2.974 3.300 ( -1.610 0.426 -6.447) 6.658 3.362 ( 1.166 0.344 1.043) 1.602 3.487 ( -0.928 4.368 -5.966) 7.451 3.636 ( -0.863 0.200 -7.555) 7.607 4.376 ( -1.764 -3.523 1.080) 4.086 4.494 ( -2.317 0.737 0.033) 2.431 4.642 ( 1.897 -5.817 0.642) 6.152 4.795 ( 3.717 -4.326 -0.262) 5.710 4.824 ( 2.936 -2.543 1.213) 4.069 4.980 ( -0.471 1.964 0.051) 2.020 5.097 ( 4.850 -0.857 0.878) 5.003 5.191 ( -2.008 -1.128 -5.103) 5.599 5.269 ( 5.318 0.337 -4.902) 7.240 5.343 ( 2.281 0.311 0.426) 2.341 5.415 ( 1.866 0.849 0.638) 2.147 5.432 ( 5.998 -4.837 3.237) 8.357 5.540 ( 0.198 -5.465 0.742) 5.518 5.748 ( 7.532 -2.653 -2.031) 8.240 5.829 ( -3.317 -1.830 3.327) 5.042 5.847 ( -3.411 0.908 -3.450) 4.936 5.927 ( 8.723 -0.328 4.819) 9.971 6.050 ( 5.524 0.493 0.323) 5.555 6.120 ( -0.134 3.452 -0.062) 3.455 6.139 ( 3.725 7.225 3.765) 8.958 6.372 ( -3.568 3.489 -2.491) 5.577 6.477 ( -1.321 -0.742 -1.205) 1.936 6.536 ( 0.939 1.531 -8.863) 9.043 6.851 ( 2.635 3.432 -7.241) 8.436 6.975 ( 3.708 -1.720 -3.939) 5.676 7.034 ( 6.899 -3.062 2.369) 7.911 7.203 ( -2.683 1.081 -2.198) 3.633 7.311 ( 4.486 4.609 -1.603) 6.628 7.517 ( 1.104 2.298 4.195) 4.908 7.707 ( 13.709 -6.017 14.076) 20.549 8.024 ( 1.165 -1.530 3.374) 3.884 8.192 ( 5.405 1.801 -0.361) 5.708 8.409 ( 7.049 -0.026 2.956) 7.644 8.574 ( 7.455 2.874 7.266) 10.800 8.640 ( 5.666 0.786 -4.622) 7.354 8.669 ( -1.250 -1.192 -0.419) 1.777 8.901 ( -4.445 -0.068 0.381) 4.462 8.992 ( -4.224 4.789 4.308) 7.703 9.192 ( -1.641 -0.815 -2.363) 2.990 9.279 ( -0.066 4.990 -4.205) 6.526 9.355 ( -12.156 3.452 -1.254) 12.699 9.576 ( -8.204 -2.077 0.952) 8.516 9.713 ( -3.789 1.819 -1.133) 4.353 9.902 ( -1.524 -1.537 -5.474) 5.887 10.372 ( -4.977 -2.287 1.247) 5.617 10.457 ( -5.428 -0.629 2.712) 6.100 10.840 ( 0.630 -4.317 -6.640) 7.945 10.989 ( -6.280 -10.321 6.685) 13.807 20.535 ( 2.450 4.025 -0.990) 4.815 20.570 ( 1.600 0.904 -1.352) 2.282 20.879 ( 0.748 0.940 0.826) 1.458 20.893 ( 1.644 1.011 -0.378) 1.967 22.761 ( 0.205 0.514 -1.335) 1.445 22.891 ( -0.483 -0.590 1.002) 1.259 23.043 ( 0.278 0.647 -0.860) 1.112 23.173 ( -0.926 -0.593 0.927) 1.438 24.676 ( 1.969 -1.864 -0.890) 2.854 24.704 ( 1.268 -3.392 2.662) 4.494 24.911 ( -0.135 2.271 0.717) 2.386 24.932 ( -1.456 1.661 1.122) 2.478 25.724 ( 5.789 1.026 -0.572) 5.907 25.802 ( 4.117 -0.174 0.577) 4.161 26.053 ( 1.423 1.264 0.285) 1.924 26.178 ( 6.180 -0.185 0.500) 6.203 28.323 ( -1.147 0.175 1.201) 1.670 28.363 ( 0.691 -0.398 1.474) 1.676 28.537 ( 2.322 0.407 -0.967) 2.548 28.617 ( 2.307 -0.299 0.076) 2.327 28.639 ( -1.144 -1.029 1.883) 2.432 28.704 ( -1.635 -3.036 0.169) 3.452 28.738 ( 0.943 -0.028 -3.245) 3.379 28.827 ( -2.467 -0.788 0.862) 2.730 32.354 ( -1.808 -0.308 1.153) 2.167 32.397 ( -1.339 -0.221 1.162) 1.786 32.429 ( -0.014 1.465 0.862) 1.700 32.566 ( 1.683 -0.371 -1.515) 2.295 35.387 ( -1.002 0.381 1.132) 1.559 35.451 ( -0.276 -0.102 1.068) 1.108 35.503 ( 0.786 0.535 -1.673) 1.924 35.544 ( 2.026 0.734 -0.270) 2.172 88.857 ( -3.453 -1.516 1.593) 4.093 88.926 ( -0.915 -0.737 -1.990) 2.311 89.012 ( -1.007 0.294 -5.582) 5.680 89.481 ( -3.500 -15.154 5.144) 16.381 97.638 ( -1.525 0.104 -0.548) 1.624 97.657 ( -1.387 -0.194 0.332) 1.440 97.706 ( -1.838 -0.579 -1.094) 2.216 97.875 ( -4.176 -6.685 -0.862) 7.930 98.681 ( -0.532 -0.060 -0.125) 0.550 98.704 ( -0.682 0.313 1.282) 1.485 98.860 ( 2.997 4.222 -0.439) 5.196 98.908 ( 6.292 9.154 -3.412) 11.620 99.600 ( 0.713 0.903 0.876) 1.446 99.683 ( 1.192 1.551 -0.361) 1.990 99.793 ( -3.974 0.643 -7.911) 8.877 100.141 ( -4.115 -3.347 6.209) 8.166 ======================= 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| 0.927 ( -7.457 14.091 14.071) 21.264 0.982 ( -7.117 10.666 17.573) 21.754 1.536 ( -0.121 2.479 -11.023) 11.299 1.579 ( -11.541 5.325 -0.848) 12.738 1.745 ( -10.405 8.014 5.803) 14.358 1.975 ( 2.539 1.342 3.183) 4.287 2.062 ( 1.370 -4.079 5.205) 6.753 2.220 ( 3.446 -2.530 7.091) 8.280 2.226 ( -0.203 -2.914 2.971) 4.167 2.405 ( -0.352 -2.194 4.229) 4.778 2.417 ( 3.874 -0.580 4.211) 5.751 2.595 ( 0.697 -2.360 -0.660) 2.548 2.676 ( 1.467 -0.386 2.482) 2.909 2.737 ( -1.391 5.871 0.226) 6.038 2.778 ( 2.272 -2.149 6.344) 7.073 2.865 ( 2.528 1.055 2.031) 3.411 2.897 ( 3.133 4.610 -3.241) 6.448 3.062 ( -1.178 -1.385 -12.287) 12.421 3.153 ( 1.141 -2.596 -2.878) 4.040 3.180 ( -0.990 -2.553 -6.119) 6.704 3.219 ( 0.913 0.231 -1.251) 1.566 3.366 ( -3.694 2.270 -2.261) 4.890 3.414 ( 1.369 3.715 -3.945) 5.589 3.520 ( -2.548 0.103 -7.212) 7.650 4.368 ( 0.288 -2.793 0.017) 2.808 4.448 ( -2.054 2.314 -2.193) 3.792 4.698 ( 1.623 -7.224 3.454) 8.170 4.795 ( -1.317 -4.740 2.006) 5.313 4.904 ( 2.803 -2.131 -0.007) 3.521 4.984 ( 1.409 2.884 -2.090) 3.830 5.109 ( 0.866 -0.512 -1.029) 1.439 5.240 ( 6.442 2.346 3.064) 7.510 5.288 ( 2.220 -1.060 -5.511) 6.035 5.391 ( 1.982 0.351 4.813) 5.217 5.471 ( 2.401 1.897 1.439) 3.381 5.539 ( -1.315 -3.653 2.539) 4.639 5.572 ( 3.741 -6.929 1.005) 7.939 5.698 ( -3.953 -2.014 -1.530) 4.693 5.801 ( -2.514 -5.336 -1.771) 6.159 5.851 ( 4.490 -1.002 -2.184) 5.093 6.038 ( 0.321 3.737 0.242) 3.759 6.090 ( 0.106 3.082 -1.507) 3.433 6.130 ( 2.603 0.982 1.488) 3.155 6.266 ( -3.229 2.972 -4.713) 6.440 6.316 ( 7.634 2.597 2.285) 8.381 6.449 ( 0.485 1.193 -6.060) 6.195 6.500 ( 2.453 4.005 1.381) 4.895 6.823 ( 2.166 6.189 -7.068) 9.641 7.034 ( 6.649 -3.092 0.374) 7.342 7.120 ( -1.108 0.876 0.617) 1.541 7.137 ( -0.145 0.205 -0.468) 0.531 7.330 ( -0.111 4.108 -2.192) 4.658 7.649 ( 8.422 0.206 6.025) 10.357 8.064 ( 5.805 -4.190 11.594) 13.626 8.095 ( 1.926 -0.411 5.727) 6.056 8.261 ( 6.780 -1.325 -1.397) 7.048 8.395 ( 0.618 -1.305 -6.905) 7.055 8.602 ( 0.280 -3.544 -2.399) 4.289 8.714 ( -2.822 -2.993 3.776) 5.584 8.835 ( 1.811 -0.102 4.812) 5.142 8.857 ( -1.464 0.107 7.173) 7.322 9.009 ( 0.856 5.980 7.282) 9.461 9.098 ( -5.921 1.646 -4.178) 7.431 9.192 ( 2.241 1.943 -5.243) 6.024 9.265 ( 0.619 3.100 -4.015) 5.110 9.442 ( -4.235 -0.234 -4.906) 6.485 9.649 ( -5.008 -0.369 3.299) 6.008 9.826 ( 1.116 1.338 -7.160) 7.369 10.292 ( -3.446 0.930 -1.210) 3.769 10.366 ( -9.581 -4.841 3.498) 11.291 10.813 ( 2.790 -4.224 -3.863) 6.368 10.894 ( -10.081 -7.798 3.194) 13.139 20.554 ( 1.327 4.284 -1.638) 4.774 20.583 ( 1.766 1.451 -1.838) 2.933 20.898 ( 0.334 1.077 0.927) 1.459 20.914 ( 1.298 1.337 -0.502) 1.930 22.769 ( 1.554 0.658 0.182) 1.697 22.879 ( -1.472 -0.592 -0.204) 1.599 23.051 ( 1.127 1.004 0.086) 1.512 23.151 ( -1.879 -0.188 -0.448) 1.941 24.705 ( 1.992 -1.711 0.046) 2.627 24.747 ( 0.894 -4.156 1.248) 4.431 24.916 ( -1.099 1.465 0.924) 2.051 24.926 ( 0.181 1.530 0.747) 1.712 25.814 ( 4.940 0.540 -0.029) 4.969 25.860 ( 2.161 -0.107 0.249) 2.178 26.083 ( 1.137 1.295 1.353) 2.191 26.249 ( 2.890 -1.373 -3.533) 4.767 28.330 ( -0.350 -0.047 2.389) 2.415 28.411 ( 3.488 -1.705 -0.242) 3.890 28.562 ( 1.602 0.341 -1.081) 1.963 28.599 ( -2.802 0.672 -0.700) 2.965 28.658 ( 2.235 -0.446 0.701) 2.384 28.689 ( -2.141 -2.882 4.561) 5.804 28.749 ( 1.621 -1.186 -1.174) 2.327 28.784 ( -2.684 -0.948 -0.419) 2.877 32.339 ( -1.661 0.371 1.635) 2.360 32.384 ( -0.035 0.520 -1.078) 1.197 32.463 ( 0.924 -0.862 3.144) 3.389 32.571 ( 1.052 -0.700 -1.909) 2.290 35.390 ( -0.515 0.339 1.807) 1.909 35.460 ( 0.230 -0.314 0.305) 0.494 35.496 ( 0.307 1.109 -1.105) 1.596 35.561 ( 0.977 0.389 -1.772) 2.061 88.819 ( -2.623 -1.003 1.078) 3.008 88.874 ( -1.790 0.515 -2.480) 3.102 88.996 ( 4.510 -1.523 -3.151) 5.709 89.327 ( -16.472 -13.234 -0.788) 21.144 97.613 ( -0.672 0.229 -0.487) 0.861 97.636 ( -1.377 -0.283 -0.034) 1.406 97.679 ( -0.391 -0.471 -0.483) 0.780 97.757 ( -6.702 -2.796 -1.392) 7.394 98.681 ( 0.293 -0.461 0.525) 0.758 98.707 ( -0.678 0.073 1.096) 1.290 98.883 ( 0.852 3.943 -0.818) 4.116 98.945 ( 3.792 9.857 -6.679) 12.497 99.626 ( 0.107 1.066 1.373) 1.741 99.698 ( 0.646 2.180 -1.470) 2.707 99.779 ( 8.027 -0.480 2.826) 8.523 100.103 ( -6.826 -3.366 3.655) 8.443 ======================= 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| 1.288 ( -7.846 14.349 10.631) 19.506 1.355 ( 2.669 14.264 8.502) 16.819 1.591 ( 3.375 9.226 -7.666) 12.461 1.620 ( 2.294 10.609 -7.458) 13.169 1.864 ( -4.035 -1.594 5.840) 7.276 1.921 ( 1.104 -7.302 -0.985) 7.450 2.049 ( 0.613 -5.045 7.508) 9.067 2.151 ( -0.142 -4.908 2.310) 5.426 2.240 ( 5.075 -3.153 6.680) 8.962 2.415 ( -3.684 2.301 -1.665) 4.651 2.555 ( -2.590 -2.545 4.019) 5.416 2.570 ( -0.319 -0.598 0.404) 0.790 2.664 ( 2.411 3.230 5.830) 7.088 2.714 ( -3.341 -0.858 -0.096) 3.451 2.828 ( -0.196 -2.386 -2.038) 3.144 2.898 ( 1.033 -3.269 -4.859) 5.947 2.929 ( -0.817 2.242 -1.627) 2.888 3.030 ( 5.288 3.927 -5.533) 8.602 3.058 ( 0.535 -2.664 5.142) 5.816 3.140 ( 3.521 -0.075 -0.862) 3.626 3.236 ( -4.017 3.062 -6.016) 7.855 3.304 ( -1.131 0.562 -7.051) 7.163 3.428 ( -2.922 2.241 1.474) 3.966 3.484 ( 0.993 1.120 -2.615) 3.013 4.363 ( 1.590 -0.095 2.063) 2.607 4.431 ( -0.909 1.763 -4.397) 4.824 4.561 ( -0.045 -7.244 4.972) 8.786 4.660 ( -0.655 -7.072 -3.296) 7.830 5.000 ( 2.866 4.668 1.360) 5.644 5.038 ( -1.067 3.967 -2.086) 4.608 5.137 ( 1.274 0.203 2.030) 2.405 5.205 ( -1.774 -0.812 -4.342) 4.760 5.372 ( -5.420 -2.247 6.114) 8.474 5.447 ( -5.536 -1.516 0.388) 5.753 5.453 ( 2.369 -0.330 6.006) 6.464 5.506 ( 1.886 -3.300 -0.136) 3.803 5.565 ( 3.469 -0.107 2.393) 4.215 5.637 ( -0.589 -2.097 -2.585) 3.381 5.691 ( 2.754 0.415 1.350) 3.095 5.808 ( 0.350 -2.286 -6.954) 7.328 6.087 ( 2.365 0.842 0.619) 2.586 6.124 ( -1.435 1.667 -1.010) 2.420 6.202 ( 1.601 0.400 -0.675) 1.783 6.208 ( -0.986 0.496 -1.870) 2.172 6.401 ( -1.719 3.325 1.929) 4.211 6.486 ( -1.366 8.899 -5.926) 10.778 6.683 ( 6.032 -1.915 8.551) 10.638 6.862 ( -6.608 2.375 -8.405) 10.952 7.081 ( 0.994 -1.099 2.210) 2.661 7.111 ( 3.761 -3.639 0.430) 5.251 7.208 ( 2.102 2.982 0.936) 3.767 7.281 ( -6.282 0.564 -4.540) 7.771 7.894 ( 8.617 3.231 5.545) 10.744 7.987 ( -8.876 1.862 -2.572) 9.427 8.194 ( -1.540 -1.999 4.093) 4.809 8.297 ( -3.360 -3.382 -3.702) 6.036 8.379 ( 8.293 -1.348 9.651) 12.796 8.586 ( -7.072 3.947 -6.724) 10.526 8.647 ( 11.434 -4.756 5.917) 13.725 8.770 ( -10.394 -0.295 -2.034) 10.595 8.894 ( -2.220 -0.389 7.844) 8.161 9.028 ( 4.845 -4.568 -3.414) 7.483 9.123 ( -2.778 1.239 0.616) 3.103 9.169 ( -2.681 -2.126 -2.162) 4.047 9.280 ( 2.959 4.511 3.301) 6.324 9.389 ( 1.292 2.019 -3.560) 4.292 9.613 ( -0.706 -0.878 2.667) 2.895 9.737 ( 0.584 -4.725 -6.337) 7.926 10.291 ( 0.573 4.047 0.036) 4.087 10.317 ( 1.656 3.059 -2.108) 4.067 10.678 ( -4.476 -4.290 3.217) 6.985 10.740 ( 4.107 -6.052 -2.387) 7.694 20.607 ( -0.107 1.743 -0.481) 1.811 20.622 ( 0.374 1.408 -2.044) 2.510 20.937 ( -0.283 1.339 0.683) 1.529 20.949 ( 0.136 0.950 -0.398) 1.039 22.826 ( 1.743 0.673 0.754) 2.015 22.842 ( -1.257 0.022 -0.632) 1.407 23.096 ( 1.048 0.616 0.349) 1.265 23.110 ( -1.252 0.003 -0.901) 1.542 24.690 ( -0.416 -1.851 0.408) 1.941 24.691 ( 0.158 -1.706 0.244) 1.730 24.940 ( -0.311 0.888 1.019) 1.387 24.950 ( 0.295 0.385 0.255) 0.548 25.876 ( 0.808 0.366 0.021) 0.887 25.879 ( -0.446 0.301 -0.199) 0.573 26.134 ( 0.029 0.669 1.519) 1.661 26.183 ( -0.792 -1.328 -2.806) 3.204 28.350 ( -0.459 -0.078 2.505) 2.548 28.384 ( -0.417 -1.592 -0.285) 1.670 28.580 ( -1.579 1.227 1.743) 2.653 28.622 ( 1.200 1.217 -1.130) 2.049 28.652 ( -0.944 -1.256 2.514) 2.965 28.684 ( 0.433 -0.965 0.735) 1.288 28.697 ( -0.140 -1.396 -0.340) 1.444 28.730 ( 2.287 -2.203 -3.420) 4.668 32.357 ( -0.846 1.201 1.948) 2.440 32.390 ( 0.711 0.324 -0.614) 0.994 32.480 ( 0.008 -0.461 1.698) 1.759 32.528 ( 0.321 -1.736 -2.279) 2.882 35.413 ( -0.195 0.454 1.563) 1.640 35.441 ( 0.049 -0.749 -0.795) 1.093 35.529 ( 0.117 1.222 0.271) 1.257 35.551 ( -0.278 0.212 -1.424) 1.466 88.795 ( -2.765 0.744 2.672) 3.917 88.844 ( 0.345 -0.332 -1.175) 1.269 88.963 ( -5.464 -2.015 3.068) 6.582 89.028 ( 5.134 -3.462 -2.385) 6.635 97.617 ( -0.596 0.510 0.001) 0.785 97.621 ( 0.661 0.478 -0.341) 0.884 97.664 ( -1.117 -0.616 0.340) 1.320 97.671 ( 0.726 -0.768 -0.248) 1.085 98.699 ( 0.368 0.555 0.794) 1.036 98.707 ( -0.340 0.324 0.236) 0.525 98.982 ( -0.278 4.162 0.142) 4.173 99.033 ( -0.247 2.910 -4.683) 5.519 99.691 ( 0.939 3.001 1.666) 3.559 99.728 ( -0.925 2.429 -1.601) 3.053 99.904 ( 4.716 -4.188 1.632) 6.515 99.924 ( -2.742 -3.900 -0.358) 4.781 ======================= 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| 1.298 ( -2.130 11.824 9.347) 15.223 1.526 ( 6.809 12.779 7.001) 16.084 1.541 ( 3.873 10.031 -12.126) 16.207 1.615 ( 4.896 11.714 -5.126) 13.692 1.864 ( -1.959 -5.978 3.481) 7.190 1.963 ( 3.307 -6.941 -0.186) 7.691 2.123 ( 0.191 -6.566 4.122) 7.755 2.126 ( 0.148 -4.882 -5.769) 7.559 2.323 ( 0.309 2.711 -7.942) 8.397 2.432 ( 4.131 1.018 7.201) 8.364 2.545 ( -1.654 -0.093 1.476) 2.219 2.577 ( 0.557 -1.812 3.824) 4.268 2.661 ( -2.820 0.565 -0.870) 3.004 2.714 ( -1.434 -2.514 0.649) 2.967 2.834 ( 0.807 -1.482 3.874) 4.225 2.856 ( 1.168 -1.824 -2.388) 3.224 2.913 ( -2.441 1.875 0.898) 3.206 3.003 ( -5.874 -0.167 -2.082) 6.234 3.027 ( 2.852 5.606 -8.180) 10.319 3.197 ( 0.361 -1.071 -8.206) 8.284 3.204 ( -0.330 1.654 4.227) 4.551 3.264 ( 4.338 0.741 7.932) 9.070 3.416 ( -3.166 1.873 3.069) 4.791 3.469 ( 0.374 1.088 -1.093) 1.586 4.357 ( -0.870 0.559 -1.700) 1.989 4.442 ( 2.591 1.641 0.807) 3.172 4.570 ( -2.632 -8.331 -0.481) 8.750 4.640 ( 0.260 -6.901 1.666) 7.104 4.955 ( -4.700 4.943 -2.256) 7.185 5.015 ( -1.473 3.792 0.289) 4.079 5.118 ( -1.654 -1.611 -2.197) 3.187 5.179 ( -4.935 -1.707 3.028) 6.036 5.300 ( -8.298 0.427 5.057) 9.727 5.379 ( -5.541 -2.333 0.674) 6.050 5.429 ( -2.658 0.101 1.141) 2.895 5.517 ( -0.516 -5.566 -1.896) 5.902 5.656 ( 0.758 0.974 0.365) 1.287 5.680 ( 4.306 1.851 -1.923) 5.066 5.705 ( 1.577 -1.533 -5.554) 5.973 5.759 ( 2.221 -3.627 2.184) 4.780 6.068 ( -1.097 2.015 -1.860) 2.954 6.139 ( -0.721 1.152 -0.223) 1.377 6.180 ( -0.907 0.179 -1.217) 1.528 6.214 ( 1.156 0.376 1.066) 1.617 6.371 ( -6.419 5.657 4.101) 9.488 6.451 ( 0.372 7.499 0.087) 7.509 6.634 ( -8.563 -0.752 -5.470) 10.189 6.845 ( 1.630 -1.703 7.366) 7.734 6.985 ( -10.303 0.492 -4.066) 11.088 7.133 ( 2.073 -2.962 -1.804) 4.040 7.180 ( -1.186 3.422 0.794) 3.708 7.330 ( 4.511 -0.900 3.294) 5.658 7.758 ( -11.144 5.387 -2.849) 12.702 8.047 ( 0.428 -1.122 2.235) 2.537 8.173 ( -6.897 -4.913 -0.066) 8.468 8.218 ( -4.114 -2.711 4.189) 6.467 8.383 ( -3.767 4.707 -9.174) 10.977 8.526 ( -0.821 0.228 3.649) 3.747 8.577 ( -6.588 -2.603 3.434) 7.872 8.848 ( -1.822 -6.391 5.599) 8.690 8.966 ( 5.409 0.446 -2.812) 6.113 9.048 ( 3.410 -1.230 -7.054) 7.931 9.140 ( 4.140 3.654 7.875) 9.618 9.224 ( 7.745 -0.316 2.760) 8.228 9.372 ( 6.005 5.491 -6.476) 10.399 9.392 ( 5.236 4.701 0.541) 7.057 9.645 ( 0.201 -1.471 2.626) 3.017 9.703 ( 2.129 -5.773 -2.770) 6.747 10.316 ( 3.086 2.430 -0.836) 4.017 10.383 ( 7.374 1.123 -1.477) 7.603 10.639 ( -3.978 -2.920 2.893) 5.720 10.801 ( 6.046 -7.822 -2.505) 10.199 20.593 ( -1.342 1.669 0.294) 2.162 20.600 ( -1.047 1.485 -0.708) 1.950 20.929 ( -1.396 1.328 0.525) 1.997 20.939 ( -0.771 0.879 -0.317) 1.211 22.805 ( -1.778 1.261 -0.952) 2.378 22.856 ( 1.056 -0.783 0.250) 1.338 23.081 ( -0.892 1.152 -0.310) 1.490 23.129 ( 1.791 -0.623 0.603) 1.990 24.667 ( -2.302 -1.375 0.271) 2.695 24.686 ( -1.252 -2.404 0.148) 2.714 24.952 ( 0.825 1.115 0.376) 1.437 24.964 ( 1.420 0.675 -0.328) 1.606 25.835 ( -4.157 0.912 -0.307) 4.267 25.861 ( -2.455 -0.176 -0.144) 2.466 26.125 ( -2.320 0.359 -0.175) 2.354 26.154 ( -1.280 -0.821 1.119) 1.888 28.359 ( -1.280 -0.361 1.104) 1.728 28.364 ( -1.031 -0.416 0.352) 1.166 28.560 ( -2.219 1.002 0.762) 2.552 28.622 ( -1.471 -0.633 0.910) 1.842 28.632 ( -1.524 0.028 -0.105) 1.528 28.694 ( 1.353 -0.196 -0.501) 1.456 28.715 ( 1.915 -2.115 -1.624) 3.283 28.765 ( 4.248 -2.189 -1.389) 4.977 32.362 ( -0.494 1.264 1.187) 1.803 32.401 ( 1.603 0.384 -0.927) 1.891 32.488 ( -0.805 -0.885 0.428) 1.271 32.515 ( 0.691 -1.196 -0.950) 1.677 35.426 ( -0.193 0.025 1.207) 1.223 35.431 ( 0.004 -0.185 -0.888) 0.907 35.528 ( -0.774 0.826 -0.300) 1.172 35.537 ( -0.234 0.508 0.414) 0.696 88.784 ( -1.440 0.499 2.631) 3.040 88.841 ( -1.895 -1.776 2.203) 3.406 88.949 ( 2.734 2.346 -0.233) 3.610 89.142 ( 8.983 -6.407 -0.792) 11.062 97.616 ( 0.535 0.577 0.058) 0.789 97.636 ( 1.185 -0.005 -0.141) 1.193 97.662 ( 0.640 -0.015 0.327) 0.719 97.704 ( 2.947 -1.494 0.237) 3.312 98.696 ( -0.452 0.809 -0.179) 0.944 98.718 ( 0.697 0.011 0.167) 0.716 98.973 ( -2.323 3.637 1.497) 4.567 98.980 ( -1.943 3.305 -0.948) 3.949 99.682 ( -1.506 1.702 -0.945) 2.462 99.728 ( -0.525 1.979 0.669) 2.154 99.816 ( -3.522 0.716 -1.406) 3.859 100.043 ( 7.276 -6.833 -0.977) 10.029 ======================= 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| 1.414 ( 6.365 9.105 3.619) 11.684 1.473 ( 4.982 10.449 -13.423) 17.725 1.624 ( 4.651 6.833 -4.150) 9.249 1.736 ( 6.683 7.628 6.137) 11.853 1.883 ( -0.489 -2.317 3.678) 4.374 1.994 ( 2.786 -8.590 -5.014) 10.329 2.038 ( 0.211 -2.083 -6.034) 6.387 2.175 ( 1.586 -4.305 -0.921) 4.680 2.294 ( 3.266 4.162 -1.630) 5.536 2.434 ( -3.349 2.276 -2.372) 4.693 2.530 ( -1.489 0.266 0.863) 1.741 2.585 ( -1.017 3.309 -6.437) 7.309 2.647 ( -1.002 -0.892 0.649) 1.490 2.675 ( -1.184 -5.735 -2.524) 6.377 2.818 ( -4.511 -3.057 -0.702) 5.494 2.850 ( -2.565 1.515 -2.684) 4.010 2.911 ( 2.788 2.650 1.760) 4.230 3.001 ( 2.340 2.582 4.506) 5.696 3.048 ( 4.181 -2.677 7.268) 8.802 3.121 ( -1.571 -0.785 -3.819) 4.203 3.213 ( -2.190 3.064 0.793) 3.849 3.380 ( -4.305 -1.638 4.009) 6.107 3.433 ( 3.658 2.906 7.644) 8.959 3.483 ( 0.326 2.005 2.613) 3.310 4.347 ( 1.843 -0.888 -1.661) 2.635 4.457 ( -2.612 -1.304 1.002) 3.086 4.540 ( 1.597 -5.465 -1.459) 5.877 4.647 ( -2.743 -5.900 2.427) 6.944 4.870 ( -2.591 3.618 -2.025) 4.889 4.992 ( -1.336 2.450 1.066) 2.987 5.038 ( -11.561 -1.068 2.574) 11.892 5.098 ( -0.006 -2.186 -0.241) 2.199 5.255 ( -3.335 0.269 2.232) 4.022 5.310 ( -4.095 -4.311 1.871) 6.233 5.378 ( -3.563 -0.283 -1.134) 3.750 5.445 ( -5.859 -4.437 -1.675) 7.538 5.555 ( -3.415 1.586 -4.640) 5.976 5.667 ( -2.811 -1.464 -1.850) 3.670 5.775 ( 4.598 2.211 2.722) 5.783 5.858 ( 5.192 -1.339 0.570) 5.392 5.992 ( -8.555 -1.483 -2.664) 9.082 6.046 ( -9.714 -1.372 -1.812) 9.976 6.156 ( 1.258 0.705 -0.480) 1.520 6.238 ( 1.679 -1.815 3.501) 4.286 6.332 ( -5.477 7.245 6.947) 11.435 6.474 ( 1.305 6.478 1.981) 6.898 6.499 ( -4.887 -0.065 -1.135) 5.018 6.779 ( -8.082 -3.555 0.255) 8.833 6.924 ( -0.461 3.785 3.990) 5.518 7.126 ( -6.034 4.058 -1.079) 7.351 7.175 ( 2.823 -1.664 -0.785) 3.370 7.374 ( -0.426 1.168 -0.633) 1.395 7.623 ( -2.224 3.889 -1.243) 4.649 7.884 ( -8.321 -4.676 -10.068) 13.874 8.069 ( -4.989 -2.553 -2.136) 5.997 8.163 ( -6.070 -3.337 2.037) 7.221 8.370 ( 0.608 7.964 4.612) 9.223 8.510 ( -7.378 -1.083 5.807) 9.451 8.557 ( 2.343 -0.915 1.352) 2.855 8.813 ( -4.938 -6.260 -0.381) 7.982 8.957 ( 0.185 2.982 -3.542) 4.634 9.061 ( 4.961 -0.684 -3.301) 5.998 9.295 ( 3.975 5.289 1.360) 6.754 9.373 ( 5.151 8.413 -2.018) 10.069 9.395 ( 9.698 1.563 -2.138) 10.053 9.581 ( 11.382 2.373 3.488) 12.139 9.664 ( 3.478 -4.433 -3.449) 6.606 9.749 ( 1.385 -4.477 3.748) 6.001 10.365 ( 3.589 0.414 -0.744) 3.688 10.501 ( 7.197 0.420 -0.232) 7.213 10.610 ( -3.493 -2.763 3.575) 5.711 10.878 ( 6.793 -10.123 -3.657) 12.727 20.570 ( -1.913 1.487 0.542) 2.484 20.576 ( -1.574 1.242 0.290) 2.026 20.905 ( -1.938 1.228 0.299) 2.313 20.918 ( -1.281 0.693 -0.304) 1.488 22.773 ( -1.157 1.834 -0.132) 2.173 22.868 ( 0.496 -2.040 -0.126) 2.103 23.070 ( -0.445 2.000 -0.076) 2.051 23.160 ( 1.226 -1.567 0.006) 1.990 24.627 ( -2.805 -1.148 0.519) 3.075 24.657 ( -1.994 -2.816 -0.136) 3.453 24.972 ( 1.396 1.629 -0.362) 2.176 24.985 ( 1.698 1.064 -0.754) 2.141 25.750 ( -5.321 1.680 -0.058) 5.580 25.803 ( -4.055 -0.555 -0.206) 4.098 26.082 ( -2.471 0.792 -0.196) 2.602 26.131 ( -3.479 -1.271 1.582) 4.027 28.344 ( -0.623 0.400 0.298) 0.798 28.362 ( -0.229 -0.346 0.661) 0.780 28.531 ( -1.855 0.560 0.322) 1.964 28.582 ( -3.114 -1.680 0.563) 3.582 28.630 ( 0.011 0.660 0.237) 0.701 28.704 ( 1.344 -2.188 -2.145) 3.346 28.726 ( 1.050 1.149 -0.571) 1.657 28.816 ( 3.188 -2.481 -1.175) 4.207 32.367 ( 0.150 0.941 0.373) 1.023 32.417 ( 1.138 -0.634 -0.938) 1.605 32.476 ( 0.303 0.648 -0.852) 1.113 32.522 ( 0.104 -0.793 0.483) 0.934 35.420 ( 0.209 0.280 -0.849) 0.918 35.438 ( 0.083 -0.427 0.816) 0.925 35.511 ( -0.894 0.998 -0.091) 1.343 35.536 ( -0.916 0.177 0.803) 1.231 88.807 ( 0.637 -0.445 2.667) 2.778 88.840 ( -1.244 -1.687 2.834) 3.525 89.018 ( 5.389 3.565 -0.834) 6.516 89.274 ( 7.035 -8.765 -0.806) 11.268 97.635 ( 1.481 0.401 0.214) 1.549 97.656 ( 1.282 -0.359 0.099) 1.335 97.686 ( 1.642 0.467 0.247) 1.725 97.765 ( 3.443 -2.917 0.523) 4.542 98.691 ( 0.295 0.902 -0.229) 0.977 98.727 ( 0.646 -0.330 -0.510) 0.887 98.929 ( -3.079 3.222 0.348) 4.470 98.952 ( -4.131 3.224 3.033) 6.055 99.647 ( -1.933 1.077 -0.847) 2.369 99.685 ( -2.057 -0.387 0.133) 2.097 99.810 ( 1.732 5.911 -0.106) 6.160 100.125 ( 5.029 -7.462 -2.911) 9.457 ======================= 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| 1.422 ( 7.597 8.119 -14.146) 17.993 1.542 ( 8.932 5.379 -4.458) 11.340 1.688 ( 2.689 3.117 0.954) 4.226 1.849 ( 2.757 3.791 1.318) 4.869 1.908 ( -0.041 2.029 -1.664) 2.624 1.963 ( 2.636 -2.171 -4.137) 5.364 2.021 ( 1.318 -3.096 -3.817) 5.089 2.169 ( 1.867 -1.187 -1.241) 2.536 2.331 ( -3.110 1.447 -2.038) 3.990 2.362 ( -0.196 2.417 2.850) 3.742 2.483 ( -4.697 0.086 -5.023) 6.878 2.527 ( 1.038 0.064 0.051) 1.041 2.589 ( -2.078 0.026 -2.710) 3.415 2.652 ( 2.075 0.414 -2.524) 3.293 2.697 ( -6.251 -3.053 -3.102) 7.617 2.804 ( -2.677 0.106 -0.624) 2.751 2.938 ( 4.360 2.345 -4.689) 6.819 3.031 ( -2.148 -1.039 -1.485) 2.810 3.151 ( 0.427 1.249 5.979) 6.123 3.190 ( 1.635 2.140 4.004) 4.826 3.236 ( 2.572 -1.652 8.656) 9.180 3.336 ( -3.610 -1.270 3.125) 4.941 3.520 ( 0.365 3.371 3.555) 4.913 3.560 ( 1.252 1.457 6.888) 7.151 4.380 ( 3.342 -2.690 -0.750) 4.355 4.416 ( -2.956 -3.949 1.236) 5.086 4.563 ( 1.977 -2.948 -0.896) 3.661 4.604 ( -4.564 -3.638 1.930) 6.147 4.820 ( 0.396 0.608 -3.936) 4.002 4.901 ( -7.811 -0.940 2.787) 8.347 4.998 ( -0.597 1.583 2.092) 2.691 5.102 ( -1.894 -1.310 0.475) 2.352 5.223 ( -1.910 -2.317 0.680) 3.078 5.243 ( -4.489 -3.482 0.457) 5.699 5.332 ( -3.238 0.200 2.408) 4.040 5.358 ( -0.226 -4.134 -0.959) 4.249 5.480 ( -1.835 0.592 -1.447) 2.410 5.590 ( -4.347 -2.133 0.033) 4.842 5.763 ( -9.404 -2.007 -1.781) 9.779 5.820 ( -9.301 -2.689 0.509) 9.695 5.918 ( 0.160 2.014 3.725) 4.238 5.946 ( 5.324 0.483 -2.604) 5.946 6.168 ( -4.323 3.167 0.458) 5.378 6.260 ( -0.034 6.833 3.071) 7.492 6.363 ( -3.325 -3.562 5.851) 7.614 6.455 ( 2.352 -1.610 2.468) 3.770 6.528 ( 1.822 4.926 1.978) 5.612 6.702 ( -4.575 -4.466 2.741) 6.956 6.929 ( -2.711 1.951 0.675) 3.407 6.973 ( -7.667 8.373 -1.270) 11.424 7.197 ( 0.660 -3.523 -1.508) 3.889 7.323 ( -2.096 -1.106 -5.308) 5.813 7.596 ( 2.229 2.788 -5.522) 6.575 7.712 ( -0.452 2.860 -6.363) 6.991 7.973 ( -3.820 -2.678 -1.800) 5.000 8.082 ( -5.814 -2.165 0.809) 6.256 8.324 ( -9.621 8.826 6.674) 14.663 8.566 ( 3.702 0.180 4.880) 6.129 8.587 ( -1.394 -0.471 -1.075) 1.822 8.708 ( -1.308 -2.266 -3.528) 4.392 8.955 ( 1.623 4.185 -0.553) 4.523 9.114 ( 3.881 -1.414 -1.187) 4.298 9.314 ( 0.354 6.372 -0.757) 6.427 9.413 ( 4.076 5.019 -5.000) 8.174 9.574 ( 9.055 0.192 2.894) 9.508 9.700 ( 5.682 -5.305 -3.731) 8.622 9.749 ( 2.758 1.521 2.999) 4.350 9.812 ( 3.269 -3.871 1.541) 5.296 10.415 ( 2.986 0.446 -0.137) 3.022 10.563 ( -0.067 4.039 -1.061) 4.176 10.634 ( 0.792 -5.605 6.382) 8.530 10.933 ( 5.201 -11.058 -5.519) 13.408 20.546 ( -1.315 1.274 0.336) 1.862 20.555 ( -1.517 0.904 0.594) 1.862 20.877 ( -1.657 1.063 0.319) 1.994 20.893 ( -1.127 0.465 -0.468) 1.306 22.769 ( -0.002 2.020 1.364) 2.438 22.878 ( 0.697 -2.261 0.135) 2.370 23.059 ( -0.577 1.881 -0.476) 2.025 23.163 ( -0.046 -2.233 -1.324) 2.597 24.591 ( -2.302 -1.207 0.887) 2.746 24.623 ( -1.599 -2.939 -0.330) 3.362 24.988 ( 1.262 2.219 -0.857) 2.692 25.001 ( 1.239 1.367 -0.905) 2.055 25.673 ( -3.828 2.143 0.421) 4.408 25.733 ( -3.801 -0.427 -0.279) 3.835 26.043 ( -2.095 0.589 0.058) 2.177 26.080 ( -3.571 -0.866 0.555) 3.716 28.347 ( -0.052 0.798 1.043) 1.314 28.373 ( 0.732 -0.155 0.376) 0.837 28.509 ( -0.953 0.179 0.012) 0.969 28.540 ( -2.375 -1.278 0.151) 2.701 28.629 ( -0.663 0.241 0.529) 0.882 28.691 ( 0.343 -2.264 -2.698) 3.539 28.745 ( 1.245 1.733 0.521) 2.197 28.842 ( 1.604 -2.425 -1.417) 3.235 32.376 ( 0.503 0.448 0.134) 0.686 32.414 ( -0.042 -1.149 -0.973) 1.506 32.488 ( 1.681 1.441 -0.528) 2.276 32.525 ( -0.365 -0.126 0.391) 0.550 35.420 ( 0.611 0.450 -0.410) 0.862 35.447 ( 0.335 -0.675 0.242) 0.792 35.496 ( -1.148 1.048 0.395) 1.604 35.524 ( -1.044 0.068 0.197) 1.065 88.852 ( 1.237 -1.488 2.366) 3.056 88.858 ( -0.392 -1.481 3.037) 3.401 89.095 ( 4.487 3.536 -0.413) 5.728 89.337 ( 2.650 -8.141 -2.833) 9.018 97.663 ( 1.358 0.304 0.339) 1.432 97.682 ( 1.555 -0.186 0.314) 1.597 97.716 ( 1.507 0.254 0.471) 1.599 97.814 ( 1.862 -3.886 -0.118) 4.310 98.702 ( 1.097 0.900 0.086) 1.422 98.734 ( 1.158 -0.146 -0.669) 1.346 98.880 ( -3.482 2.910 0.657) 4.585 98.903 ( -4.724 2.827 2.060) 5.878 99.617 ( -0.738 1.679 0.505) 1.902 99.687 ( 0.101 -0.573 1.659) 1.759 99.842 ( 1.635 5.463 1.003) 5.790 100.149 ( 2.794 -7.195 -4.796) 9.087 ======================= 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| 1.438 ( 8.005 5.562 -7.250) 12.148 1.612 ( -1.657 -0.199 -1.071) 1.983 1.667 ( 2.224 6.068 -7.121) 9.617 1.754 ( -3.861 6.006 -8.158) 10.841 1.943 ( 4.664 -0.748 -1.568) 4.977 2.006 ( -0.240 -0.126 2.151) 2.168 2.029 ( 4.026 -0.591 -2.173) 4.614 2.162 ( 0.041 -3.430 -4.492) 5.652 2.296 ( 1.112 1.504 -0.889) 2.071 2.345 ( -5.151 1.390 0.298) 5.343 2.399 ( -0.593 -1.621 2.904) 3.379 2.518 ( -1.636 2.282 -1.647) 3.255 2.551 ( -2.931 0.459 0.173) 2.972 2.599 ( 0.569 -0.827 -0.989) 1.409 2.679 ( 3.080 -0.737 -2.114) 3.807 2.724 ( -5.201 2.192 -0.999) 5.731 2.973 ( 2.456 0.089 -1.495) 2.876 2.998 ( -0.606 -0.953 -0.395) 1.196 3.153 ( -0.370 0.210 1.884) 1.931 3.221 ( -5.203 -1.467 1.397) 5.583 3.340 ( 4.583 2.621 5.925) 7.936 3.389 ( -1.458 1.750 6.503) 6.890 3.572 ( 1.083 2.824 3.788) 4.847 3.626 ( 2.125 0.934 1.191) 2.609 4.387 ( -2.611 -3.921 2.771) 5.465 4.428 ( 2.767 -4.236 -1.352) 5.237 4.564 ( -3.894 -1.742 3.469) 5.498 4.578 ( 1.826 -2.690 -1.493) 3.578 4.808 ( 1.983 -3.047 -3.464) 5.022 4.817 ( -4.931 -1.969 1.404) 5.492 4.994 ( -1.162 1.553 1.172) 2.266 5.050 ( -0.987 0.284 -1.727) 2.009 5.195 ( 1.063 -1.994 2.050) 3.051 5.290 ( 2.625 -2.926 1.227) 4.118 5.304 ( -1.977 -1.678 2.282) 3.455 5.373 ( -0.128 -4.283 0.882) 4.375 5.451 ( -0.141 -0.018 0.128) 0.192 5.535 ( -3.020 -2.640 -0.459) 4.037 5.636 ( -3.977 0.729 1.207) 4.220 5.712 ( -2.552 -1.968 -0.408) 3.249 5.947 ( -1.327 5.996 2.205) 6.525 6.008 ( 2.673 1.463 -0.030) 3.048 6.107 ( 0.428 -2.255 -0.011) 2.295 6.232 ( -9.321 -3.126 0.651) 9.853 6.370 ( 2.893 4.837 5.498) 7.873 6.543 ( -1.253 3.080 -0.861) 3.435 6.598 ( 5.438 -2.062 3.997) 7.057 6.674 ( -1.460 -4.350 3.472) 5.754 6.847 ( -2.858 3.531 -2.097) 5.004 6.898 ( -3.151 4.616 -0.679) 5.630 7.167 ( -0.980 -4.997 -2.383) 5.622 7.232 ( -0.016 -4.443 -6.564) 7.926 7.598 ( 3.701 6.888 -3.565) 8.594 7.665 ( -1.435 7.861 -3.319) 8.653 7.922 ( -0.763 -1.324 0.155) 1.537 7.989 ( -4.192 -1.212 -0.973) 4.471 8.275 ( -5.184 8.858 7.347) 12.622 8.501 ( -0.454 1.571 -7.228) 7.411 8.655 ( 1.603 -0.397 3.000) 3.425 8.714 ( 1.406 -1.161 -0.365) 1.859 8.990 ( 0.605 4.378 3.725) 5.780 9.151 ( 2.555 -0.424 -2.705) 3.745 9.309 ( -1.456 4.066 1.475) 4.564 9.400 ( 1.185 2.586 -5.024) 5.773 9.728 ( 4.102 -1.492 2.630) 5.096 9.746 ( -1.189 -1.509 2.379) 3.058 9.785 ( 5.724 -2.787 -2.874) 6.985 9.852 ( 0.453 -3.025 -1.527) 3.418 10.461 ( 1.372 1.837 1.457) 2.716 10.534 ( -1.325 3.594 -1.047) 3.971 10.712 ( -0.355 -4.953 6.808) 8.427 10.929 ( 2.540 -10.073 -7.060) 12.561 20.537 ( -0.004 0.918 0.085) 0.922 20.540 ( -0.893 0.839 0.427) 1.297 20.860 ( -0.781 0.878 0.468) 1.265 20.875 ( -0.366 0.330 -0.564) 0.749 22.800 ( 0.950 2.009 2.600) 3.420 22.885 ( 0.067 -0.868 -0.721) 1.131 23.051 ( 0.197 0.260 0.331) 0.465 23.131 ( -1.114 -2.439 -2.519) 3.679 24.573 ( -1.124 -1.396 1.199) 2.156 24.601 ( -0.551 -2.800 -0.527) 2.902 24.994 ( 0.410 2.400 -0.550) 2.496 25.005 ( 0.400 1.620 -0.945) 1.917 25.640 ( -0.864 1.997 0.886) 2.349 25.679 ( -1.929 0.350 -0.609) 2.053 26.020 ( -0.689 0.203 0.252) 0.762 26.037 ( -1.691 -0.391 -0.085) 1.738 28.358 ( -0.653 0.980 1.832) 2.178 28.386 ( 0.164 0.113 0.286) 0.349 28.503 ( -0.008 -0.269 -0.037) 0.271 28.512 ( -0.211 -0.643 -0.674) 0.955 28.622 ( -1.055 0.176 0.920) 1.410 28.666 ( 0.272 -1.632 -2.512) 3.007 28.775 ( 1.172 0.511 1.210) 1.760 28.840 ( 0.374 -2.099 -1.897) 2.854 32.385 ( 0.285 -0.007 0.236) 0.370 32.401 ( -0.469 -0.736 -0.486) 0.999 32.511 ( 1.614 0.892 -0.517) 1.915 32.519 ( -0.628 0.627 0.094) 0.892 35.430 ( 0.541 0.328 0.217) 0.669 35.449 ( -0.402 -0.438 -0.161) 0.616 35.486 ( -0.390 0.899 0.695) 1.201 35.510 ( -0.339 0.028 -0.500) 0.605 88.877 ( -0.926 -1.166 2.853) 3.218 88.897 ( 1.002 -2.469 1.679) 3.149 89.155 ( 2.327 2.239 1.243) 3.460 89.310 ( -0.675 -5.094 -4.657) 6.935 97.684 ( 0.561 0.531 0.544) 0.944 97.703 ( 0.676 0.595 -0.309) 0.952 97.749 ( 1.280 -1.301 1.517) 2.373 97.819 ( -0.345 -3.534 -1.128) 3.726 98.726 ( 1.198 1.103 0.422) 1.682 98.750 ( 0.951 0.372 -0.521) 1.147 98.837 ( -1.578 2.489 0.361) 2.969 98.851 ( -3.042 2.240 0.795) 3.861 99.632 ( 0.777 2.261 1.833) 3.013 99.697 ( -0.417 1.367 0.077) 1.432 99.894 ( 1.335 1.394 4.368) 4.776 100.117 ( 0.791 -6.468 -6.603) 9.277 ======================= 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| 1.394 ( -11.605 7.009 -2.138) 13.725 1.546 ( -9.063 2.173 3.667) 10.016 1.577 ( 6.535 5.684 -3.394) 9.302 1.751 ( 5.000 -0.958 -6.813) 8.505 1.954 ( -2.079 1.431 -1.894) 3.155 1.988 ( 3.108 0.784 0.661) 3.273 2.093 ( -0.667 -2.088 -4.755) 5.236 2.111 ( 3.041 -4.206 -0.603) 5.226 2.259 ( -4.581 3.169 3.121) 6.385 2.355 ( 2.989 0.676 -1.135) 3.268 2.438 ( 0.480 0.437 3.640) 3.698 2.466 ( 0.587 -0.614 -1.312) 1.563 2.565 ( -0.367 1.049 1.273) 1.690 2.590 ( 0.864 -0.404 -0.833) 1.267 2.633 ( -4.911 3.579 0.883) 6.140 2.734 ( 5.358 0.156 -1.110) 5.474 2.925 ( -6.661 1.185 1.394) 6.908 3.015 ( 1.597 -1.921 -0.767) 2.613 3.161 ( -2.363 -0.241 1.823) 2.994 3.205 ( 2.915 -0.990 1.628) 3.482 3.375 ( -4.254 2.976 2.475) 5.752 3.439 ( 0.049 1.269 2.583) 2.878 3.609 ( 1.054 3.068 0.149) 3.248 3.679 ( 4.756 0.465 -2.616) 5.448 4.382 ( -2.014 -2.551 2.517) 4.110 4.451 ( 2.864 -5.056 -2.251) 6.231 4.522 ( -4.586 -1.156 3.027) 5.615 4.606 ( 1.772 -3.839 -0.189) 4.232 4.739 ( -4.193 -1.792 2.514) 5.207 4.838 ( 2.716 -5.304 -0.919) 6.029 5.032 ( 3.738 1.156 -0.940) 4.024 5.058 ( 6.582 0.826 -3.364) 7.438 5.233 ( -3.230 0.821 0.162) 3.337 5.288 ( 4.798 -1.196 0.708) 4.995 5.352 ( -0.610 -5.020 -1.337) 5.231 5.370 ( 1.467 -3.474 0.937) 3.886 5.477 ( -0.935 -0.113 -1.561) 1.823 5.493 ( 2.812 -0.939 1.717) 3.426 5.663 ( 2.309 -0.127 3.483) 4.181 5.684 ( 1.230 -0.623 -1.851) 2.307 5.918 ( -5.783 3.103 2.222) 6.929 6.059 ( 7.541 4.129 -1.771) 8.778 6.084 ( -6.936 -3.890 1.780) 8.149 6.239 ( 10.688 -2.329 0.522) 10.952 6.473 ( -2.385 3.112 -1.475) 4.189 6.475 ( 1.074 4.750 3.352) 5.912 6.631 ( -4.649 -2.632 2.542) 5.916 6.727 ( 2.308 -5.401 -1.829) 6.152 6.849 ( 1.238 1.725 -1.959) 2.889 6.856 ( 4.949 5.091 1.715) 7.304 7.143 ( -0.608 -5.961 0.536) 6.016 7.192 ( 2.056 -5.835 -4.141) 7.444 7.579 ( -4.478 8.931 -1.909) 10.172 7.622 ( 0.458 8.432 -0.093) 8.445 7.904 ( -1.401 0.060 1.765) 2.254 8.004 ( 6.866 -0.189 -2.022) 7.160 8.296 ( -2.872 7.820 8.814) 12.128 8.456 ( 4.722 3.687 -7.286) 9.433 8.686 ( -0.809 -1.288 1.457) 2.106 8.709 ( -0.246 -1.735 -2.020) 2.674 9.040 ( -1.860 4.153 6.003) 7.533 9.131 ( 1.034 1.604 -6.171) 6.460 9.294 ( -3.578 1.917 3.052) 5.079 9.365 ( -0.259 0.533 -2.026) 2.111 9.684 ( -6.787 -1.895 2.774) 7.573 9.757 ( -5.713 -1.191 0.523) 5.860 9.837 ( 3.326 -0.047 -3.531) 4.851 9.862 ( 4.610 -4.636 -2.013) 6.841 10.454 ( -4.464 3.127 2.301) 5.917 10.533 ( 2.463 3.182 -1.279) 4.222 10.761 ( -2.900 -6.588 7.251) 10.217 10.877 ( 0.783 -8.357 -7.250) 11.091 20.537 ( 0.348 1.143 0.104) 1.199 20.548 ( 1.258 0.603 -0.210) 1.411 20.862 ( 0.262 0.792 0.582) 1.017 20.871 ( 0.633 0.366 -0.503) 0.888 22.844 ( 0.340 1.364 2.055) 2.490 22.859 ( -0.567 0.987 -1.818) 2.145 23.073 ( -0.072 -1.510 0.686) 1.660 23.090 ( 0.545 -1.818 -1.206) 2.248 24.579 ( 0.197 -1.615 1.303) 2.085 24.595 ( 0.716 -2.441 -0.682) 2.633 24.989 ( -0.898 2.132 0.128) 2.317 24.997 ( -0.363 1.818 -0.500) 1.920 25.654 ( 0.800 1.478 0.269) 1.702 25.669 ( 2.225 0.984 -0.296) 2.451 26.025 ( 0.592 0.059 -0.152) 0.614 26.030 ( 1.503 -0.038 0.386) 1.552 28.359 ( -1.654 0.760 2.022) 2.721 28.379 ( -1.497 0.264 0.501) 1.601 28.501 ( 0.982 0.101 -0.743) 1.236 28.529 ( 2.614 -0.585 -1.055) 2.879 28.615 ( -1.307 0.080 1.534) 2.017 28.653 ( 0.865 -1.606 -1.620) 2.440 28.801 ( 0.028 -0.526 0.833) 0.986 28.819 ( 0.064 -1.473 -1.930) 2.429 32.382 ( -1.127 -0.113 0.468) 1.226 32.394 ( -0.112 -0.564 0.060) 0.578 32.505 ( -0.974 1.322 -0.060) 1.643 32.530 ( 1.422 0.157 -0.758) 1.619 35.430 ( -1.393 0.298 0.279) 1.452 35.440 ( -0.231 -0.152 0.475) 0.550 35.498 ( 0.935 0.599 0.359) 1.167 35.507 ( 0.905 0.129 -0.821) 1.229 88.882 ( -2.005 -1.052 2.452) 3.338 88.917 ( 0.179 -2.714 0.095) 2.721 89.200 ( -0.626 -0.754 3.660) 3.789 89.232 ( -1.981 -1.867 -4.381) 5.158 97.691 ( -0.535 0.735 0.596) 1.087 97.698 ( -0.516 0.763 -0.611) 1.105 97.780 ( -1.040 -2.605 0.559) 2.860 97.789 ( -0.397 -2.618 -0.121) 2.651 98.736 ( -1.349 0.925 -0.155) 1.642 98.737 ( -1.080 0.839 0.265) 1.393 98.839 ( 1.462 2.590 0.230) 2.983 98.859 ( 3.552 2.025 0.088) 4.089 99.668 ( 0.107 2.812 0.883) 2.949 99.678 ( 0.211 2.668 -0.700) 2.766 99.969 ( 0.265 -2.509 6.411) 6.890 100.038 ( -0.977 -5.009 -7.823) 9.341 ======================= 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| 1.202 ( -10.864 10.082 4.182) 15.400 1.396 ( -12.596 6.514 6.490) 15.595 1.666 ( -0.694 -2.171 1.003) 2.490 1.783 ( 5.243 1.301 3.943) 6.688 1.898 ( -2.639 -1.007 -2.131) 3.539 1.993 ( 0.352 1.022 -5.393) 5.501 2.065 ( -1.527 -1.895 -3.886) 4.585 2.137 ( 2.493 -2.513 2.039) 4.086 2.271 ( 1.993 3.314 2.505) 4.608 2.387 ( 0.283 1.639 1.596) 2.305 2.427 ( -0.820 1.920 -1.036) 2.331 2.483 ( -10.419 5.337 4.451) 12.524 2.541 ( 3.748 2.079 1.234) 4.460 2.625 ( 0.521 -0.920 1.142) 1.556 2.629 ( 3.617 -1.862 1.987) 4.527 2.819 ( 5.752 0.389 -0.674) 5.805 2.837 ( -4.159 1.504 1.815) 4.780 3.026 ( 0.429 -4.272 -0.222) 4.299 3.165 ( 0.827 1.200 1.235) 1.910 3.284 ( 2.865 -0.199 1.658) 3.316 3.312 ( -2.109 1.742 -2.175) 3.495 3.400 ( -4.475 -1.131 -2.048) 5.050 3.617 ( 1.642 3.525 -3.675) 5.351 3.699 ( 1.750 0.065 -4.572) 4.896 4.353 ( -3.579 -1.533 1.331) 4.115 4.469 ( 2.313 -6.095 -2.814) 7.100 4.505 ( -1.704 -0.777 3.121) 3.640 4.637 ( 3.060 -4.589 -0.508) 5.539 4.745 ( 1.210 -0.025 2.620) 2.886 4.906 ( 5.533 -4.868 2.115) 7.667 5.043 ( -0.264 2.299 -1.770) 2.914 5.152 ( 5.113 -0.964 -2.116) 5.616 5.246 ( 5.333 -0.958 -1.306) 5.573 5.273 ( -0.140 -3.661 -2.640) 4.516 5.372 ( 0.267 -1.533 -1.244) 1.992 5.382 ( 2.543 0.282 -3.711) 4.508 5.464 ( 1.603 0.311 -0.173) 1.642 5.576 ( 3.700 -3.262 2.016) 5.329 5.728 ( 5.455 -0.064 0.186) 5.458 5.778 ( 5.801 -2.028 4.821) 7.811 5.896 ( 0.510 1.811 1.845) 2.635 5.978 ( -5.372 -1.696 -1.102) 5.740 6.180 ( 7.759 6.758 -0.842) 10.323 6.331 ( -3.289 7.042 -2.983) 8.325 6.462 ( 5.487 -2.574 -0.770) 6.110 6.527 ( -4.991 -0.695 -1.791) 5.348 6.550 ( 3.926 0.955 -2.228) 4.614 6.747 ( 3.811 -6.320 -0.380) 7.390 6.894 ( 4.310 1.678 0.940) 4.719 6.991 ( 7.529 4.771 0.229) 8.916 7.192 ( 2.279 -6.119 3.853) 7.582 7.198 ( 4.625 -4.045 -0.975) 6.221 7.496 ( -4.144 7.014 1.085) 8.218 7.614 ( -2.455 4.611 2.747) 5.902 7.942 ( 3.244 1.101 0.885) 3.538 8.110 ( 7.254 -0.822 -1.435) 7.440 8.370 ( 1.325 7.322 8.108) 11.005 8.510 ( 6.981 3.794 -1.151) 8.028 8.650 ( -1.409 -1.048 -3.388) 3.816 8.681 ( -1.883 -2.076 -0.953) 2.960 9.013 ( -3.394 3.164 -2.247) 5.156 9.095 ( -1.098 2.242 -0.136) 2.500 9.250 ( -5.539 1.168 3.113) 6.460 9.355 ( -1.115 -0.029 1.791) 2.110 9.591 ( -7.874 -2.497 3.119) 8.830 9.619 ( -9.290 0.613 -1.372) 9.411 9.834 ( -0.645 0.657 -3.101) 3.234 9.880 ( 1.681 -3.894 -3.595) 5.560 10.397 ( -4.598 2.689 1.763) 5.611 10.551 ( 0.241 4.027 -0.503) 4.066 10.749 ( -4.376 -9.749 1.392) 10.776 10.825 ( -1.097 -6.727 -1.185) 6.918 20.556 ( 2.006 1.474 -0.369) 2.517 20.571 ( 2.081 0.656 -0.734) 2.302 20.879 ( 1.041 0.860 0.392) 1.406 20.886 ( 1.468 0.565 -0.064) 1.575 22.811 ( -0.999 1.557 -2.203) 2.877 22.873 ( -0.242 -0.477 0.853) 1.007 23.058 ( 0.420 0.366 -0.712) 0.904 23.127 ( 1.163 -1.942 1.779) 2.879 24.604 ( 1.321 -1.763 0.829) 2.354 24.610 ( 1.677 -2.030 -0.227) 2.643 24.970 ( -1.597 2.034 0.577) 2.650 24.984 ( -1.274 1.485 0.470) 2.012 25.685 ( 3.523 1.800 -0.556) 3.995 25.727 ( 4.112 0.130 0.204) 4.119 26.046 ( 2.072 0.738 -0.267) 2.216 26.081 ( 3.856 -0.458 0.521) 3.918 28.346 ( -2.031 0.429 1.230) 2.413 28.358 ( -1.820 0.089 1.374) 2.282 28.520 ( 2.440 0.667 -1.246) 2.820 28.565 ( 3.232 -0.890 -1.531) 3.685 28.614 ( -1.134 -0.165 2.237) 2.513 28.655 ( 0.233 -2.047 -0.210) 2.071 28.776 ( -0.816 0.039 -2.183) 2.331 28.818 ( -0.609 -1.472 0.590) 1.699 32.367 ( -1.392 0.157 0.816) 1.622 32.390 ( -0.855 -0.678 0.799) 1.353 32.486 ( -0.929 1.897 -0.371) 2.145 32.543 ( 1.151 -0.600 -0.967) 1.619 35.410 ( -1.277 0.630 0.456) 1.495 35.440 ( -0.487 -0.541 0.671) 0.990 35.513 ( 1.252 0.603 -0.930) 1.672 35.526 ( 1.647 0.330 0.096) 1.683 88.863 ( -2.686 -0.906 1.583) 3.247 88.908 ( -0.472 -2.572 -1.040) 2.814 89.130 ( -3.841 0.667 -3.392) 5.168 89.236 ( -2.748 -5.380 5.560) 8.210 97.674 ( -1.326 0.470 -0.501) 1.493 97.681 ( -1.454 0.611 0.257) 1.598 97.735 ( -2.109 -1.144 -1.106) 2.642 97.797 ( -1.389 -3.807 1.445) 4.302 98.707 ( -1.346 0.618 -0.353) 1.523 98.719 ( -1.466 0.372 0.658) 1.650 98.890 ( 3.871 3.395 -0.096) 5.150 98.939 ( 6.314 2.510 -0.823) 6.844 99.641 ( -0.466 2.923 -1.554) 3.343 99.704 ( 0.784 1.727 0.429) 1.945 99.927 ( -2.438 -1.764 -7.083) 7.695 100.027 ( -1.427 -4.536 6.026) 7.676 ======================= 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 ( -5.514 13.086 12.845) 19.148 1.289 ( -10.250 11.182 9.752) 18.033 1.639 ( -3.862 -1.979 2.081) 4.813 1.835 ( -1.153 -0.878 -1.657) 2.201 1.899 ( 0.273 -2.393 0.044) 2.409 1.940 ( 0.097 1.901 -2.325) 3.004 2.004 ( -0.346 -4.133 -3.319) 5.312 2.145 ( -0.805 -1.752 0.722) 2.059 2.252 ( -14.784 12.556 4.190) 19.844 2.369 ( 4.133 5.510 3.495) 7.723 2.412 ( -1.372 3.443 3.677) 5.221 2.503 ( 2.291 -3.050 5.981) 7.094 2.619 ( 0.209 -2.067 -1.200) 2.399 2.635 ( 4.737 0.760 2.141) 5.254 2.741 ( 3.029 -4.055 5.076) 7.168 2.826 ( 0.713 1.154 0.740) 1.546 2.892 ( 2.771 -0.987 -0.403) 2.969 3.034 ( 1.096 -5.403 0.680) 5.555 3.195 ( -2.503 1.248 -5.175) 5.882 3.217 ( 2.859 4.168 -1.482) 5.267 3.271 ( -4.075 -1.840 -7.636) 8.849 3.381 ( 3.915 -0.248 1.519) 4.207 3.573 ( -1.160 3.332 -5.569) 6.593 3.637 ( -1.744 -0.026 -6.535) 6.764 4.316 ( -1.818 -1.355 0.927) 2.450 4.477 ( 0.852 -7.900 0.145) 7.947 4.517 ( 1.001 1.330 -0.501) 1.738 4.674 ( 1.757 -5.711 -0.758) 6.023 4.823 ( 3.979 2.111 2.349) 5.080 5.028 ( 0.917 0.666 -1.124) 1.596 5.047 ( 7.294 -2.672 1.058) 7.840 5.159 ( 3.064 -1.772 -3.444) 4.939 5.286 ( 3.485 -0.235 1.530) 3.813 5.323 ( -0.649 -0.040 -1.273) 1.429 5.345 ( 2.992 -1.028 -2.177) 3.840 5.435 ( 5.868 -0.856 0.274) 5.936 5.494 ( 1.474 0.689 0.696) 1.770 5.646 ( 2.559 -5.390 0.714) 6.009 5.821 ( -2.816 0.635 2.778) 4.006 5.858 ( -4.761 0.089 -2.722) 5.485 5.901 ( 9.027 -0.696 4.134) 9.953 6.021 ( 8.809 -3.409 1.218) 9.524 6.208 ( -2.174 4.081 -3.809) 5.991 6.287 ( -0.834 3.449 -1.043) 3.699 6.436 ( 0.650 2.821 -2.506) 3.828 6.487 ( -0.486 1.600 1.141) 2.025 6.571 ( 4.111 3.255 -7.611) 9.243 6.823 ( 5.803 -4.117 -3.039) 7.737 6.986 ( 3.857 2.264 0.689) 4.525 7.102 ( 7.098 7.016 -0.560) 9.996 7.187 ( -0.574 -2.847 -1.918) 3.480 7.376 ( 7.456 -0.871 -1.143) 7.594 7.522 ( 3.165 0.024 8.630) 9.192 7.646 ( 2.976 -0.272 8.500) 9.010 8.007 ( 3.038 1.255 2.039) 3.868 8.204 ( 6.389 -1.897 -1.761) 6.894 8.465 ( -1.250 4.168 -0.238) 4.357 8.585 ( 1.216 -0.786 4.732) 4.949 8.613 ( -2.315 -1.234 -3.798) 4.616 8.682 ( 7.899 0.785 2.153) 8.225 8.931 ( -3.382 2.863 -1.686) 4.741 9.071 ( -0.655 0.386 -1.218) 1.436 9.184 ( -7.462 1.850 5.170) 9.265 9.351 ( -2.228 0.170 1.881) 2.921 9.436 ( -10.230 3.827 -1.752) 11.062 9.499 ( -7.686 -2.831 4.043) 9.135 9.746 ( -3.550 0.015 -5.852) 6.845 9.854 ( 0.360 -3.592 -4.388) 5.682 10.343 ( -3.879 2.406 1.309) 4.749 10.502 ( -5.821 3.702 -0.767) 6.941 10.694 ( -0.524 -8.396 -1.959) 8.637 10.793 ( -3.987 -7.494 2.281) 8.790 20.589 ( 2.388 1.151 -0.936) 2.811 20.599 ( 2.877 1.329 -1.709) 3.601 20.902 ( 1.261 1.070 0.400) 1.702 20.915 ( 1.792 0.765 0.109) 1.951 22.784 ( 0.114 1.647 -1.118) 1.994 22.868 ( -0.567 -1.613 0.002) 1.710 23.069 ( 0.894 1.718 -0.047) 1.937 23.150 ( -0.125 -1.501 0.819) 1.714 24.637 ( 2.207 -1.500 -0.249) 2.680 24.644 ( 1.690 -2.007 0.982) 2.801 24.953 ( -1.506 1.540 1.152) 2.443 24.965 ( -1.848 1.102 0.935) 2.346 25.754 ( 5.127 1.617 -0.425) 5.393 25.799 ( 4.206 -0.264 0.082) 4.215 26.081 ( 2.248 1.383 -0.184) 2.646 26.158 ( 4.784 -1.685 -0.507) 5.097 28.329 ( -1.449 0.387 1.438) 2.078 28.352 ( -0.612 -0.577 1.552) 1.766 28.551 ( 2.837 0.898 -1.519) 3.341 28.602 ( 2.966 -1.191 -1.156) 3.399 28.622 ( -0.850 -0.299 1.928) 2.128 28.649 ( -1.727 -1.801 1.476) 2.899 28.745 ( -0.253 0.612 -1.882) 1.995 28.799 ( -2.154 -1.618 0.201) 2.702 32.356 ( -1.221 0.423 1.184) 1.752 32.385 ( -1.215 -0.697 1.684) 2.190 32.469 ( -0.454 2.074 -0.470) 2.175 32.548 ( 0.886 -1.294 -1.328) 2.055 35.400 ( -0.791 0.785 0.872) 1.415 35.441 ( -0.060 -0.844 0.397) 0.934 35.522 ( 0.970 1.089 -0.950) 1.740 35.553 ( 1.597 -0.008 -0.449) 1.659 88.832 ( -2.429 -0.539 0.851) 2.630 88.888 ( -0.330 -2.444 -1.182) 2.735 89.033 ( -3.746 1.665 -2.514) 4.808 89.214 ( -7.120 -8.757 4.786) 12.259 97.644 ( -1.403 0.461 -0.571) 1.584 97.656 ( -1.551 0.103 0.101) 1.558 97.695 ( -1.674 -0.237 -0.558) 1.780 97.767 ( -3.340 -3.607 0.462) 4.937 98.687 ( -0.711 0.606 0.035) 0.935 98.709 ( -0.775 -0.025 0.925) 1.207 98.947 ( 3.370 4.070 -0.938) 5.367 99.035 ( 7.253 2.080 -3.675) 8.393 99.637 ( 1.265 2.314 -0.044) 2.638 99.703 ( 0.128 0.020 -1.332) 1.338 99.829 ( -2.376 3.085 -2.812) 4.802 100.044 ( -3.408 -5.417 4.408) 7.771 ======================= 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| 1.251 ( -2.260 14.786 13.263) 19.991 1.272 ( -4.855 14.503 10.588) 18.601 1.595 ( -1.562 2.267 0.815) 2.871 1.730 ( -4.064 8.004 -9.997) 13.436 1.893 ( -1.222 -6.733 3.803) 7.829 1.927 ( -2.623 2.994 1.793) 4.366 1.978 ( 0.146 -5.009 0.078) 5.012 2.122 ( -4.758 0.547 5.449) 7.254 2.170 ( 0.551 -3.024 1.508) 3.424 2.444 ( 0.236 5.277 1.826) 5.589 2.482 ( 0.525 4.189 10.818) 11.613 2.574 ( 1.113 0.751 0.402) 1.402 2.607 ( -1.545 -5.410 1.930) 5.949 2.729 ( 1.994 -1.767 2.194) 3.451 2.808 ( 0.941 -3.428 2.783) 4.515 2.881 ( 3.419 -1.410 1.424) 3.963 2.917 ( 1.243 1.241 1.407) 2.250 3.054 ( -0.986 0.456 -10.731) 10.786 3.083 ( 3.142 -1.584 -0.899) 3.632 3.125 ( -2.384 -2.525 -7.845) 8.579 3.278 ( 3.469 4.703 -0.802) 5.899 3.411 ( -2.454 0.902 -3.531) 4.393 3.488 ( 0.679 2.587 -4.283) 5.049 3.521 ( -3.534 0.281 -6.039) 7.003 4.320 ( 0.846 -0.926 1.244) 1.767 4.495 ( -1.755 -3.398 -0.008) 3.825 4.514 ( 2.058 -2.770 -1.129) 3.631 4.685 ( 0.593 -5.594 -1.065) 5.725 4.911 ( 4.246 2.765 2.207) 5.527 5.039 ( 1.979 1.243 -1.453) 2.751 5.107 ( 1.989 0.551 -1.520) 2.563 5.249 ( 5.952 -0.834 -2.753) 6.611 5.323 ( 2.468 3.318 0.091) 4.136 5.358 ( 0.202 -4.165 5.744) 7.098 5.402 ( 6.284 -1.671 1.379) 6.647 5.496 ( 0.140 -2.381 1.000) 2.586 5.545 ( -2.027 1.430 5.798) 6.306 5.637 ( -1.496 -2.726 -1.122) 3.306 5.746 ( -4.079 -0.373 -2.740) 4.928 5.822 ( 3.145 -1.902 -3.190) 4.867 6.065 ( 3.112 -0.541 0.327) 3.175 6.126 ( 2.071 0.672 0.605) 2.260 6.157 ( 1.498 0.070 -0.351) 1.540 6.249 ( -0.824 -2.011 -1.221) 2.493 6.419 ( -0.473 2.949 -0.716) 3.071 6.523 ( 2.121 -0.233 3.823) 4.378 6.559 ( 2.739 9.598 -7.148) 12.276 6.920 ( 7.566 1.520 0.743) 7.753 7.001 ( 2.308 0.464 -5.348) 5.843 7.127 ( -3.105 -2.265 -2.304) 4.481 7.191 ( 2.230 5.763 0.186) 6.182 7.393 ( -1.057 0.820 -3.286) 3.548 7.681 ( 8.258 2.945 5.493) 10.346 7.932 ( 10.655 -7.260 10.538) 16.652 8.116 ( 6.523 1.450 6.583) 9.380 8.277 ( -0.505 2.729 -1.350) 3.086 8.346 ( -0.325 -2.863 -6.602) 7.203 8.523 ( -2.800 -4.240 -0.337) 5.092 8.694 ( 1.328 2.527 0.153) 2.859 8.823 ( 1.526 -0.818 6.897) 7.111 8.875 ( -4.227 1.005 4.654) 6.366 9.043 ( 1.738 -5.166 -8.269) 9.903 9.138 ( -5.314 4.718 8.380) 10.988 9.273 ( -5.647 5.095 -1.366) 7.727 9.291 ( -5.798 -1.155 -1.825) 6.188 9.426 ( -4.831 -0.969 2.040) 5.333 9.635 ( -1.691 -0.247 -4.284) 4.612 9.801 ( -0.381 -4.644 -5.410) 7.140 10.300 ( -2.225 3.114 0.560) 3.868 10.378 ( -6.066 3.344 -1.205) 7.031 10.690 ( 0.893 -5.960 -0.280) 6.033 10.745 ( -3.469 -6.239 1.046) 7.215 20.606 ( 1.126 1.450 -1.060) 2.119 20.624 ( 2.468 1.307 -2.572) 3.797 20.925 ( 0.744 1.262 0.617) 1.590 20.941 ( 1.267 0.883 -0.221) 1.560 22.792 ( 1.364 1.464 0.180) 2.009 22.859 ( -0.541 -1.272 -0.049) 1.383 23.080 ( 0.718 1.636 -0.161) 1.794 23.140 ( -1.225 -0.831 -0.363) 1.524 24.670 ( 1.771 -1.324 0.009) 2.211 24.679 ( 1.119 -2.076 0.804) 2.492 24.943 ( -1.266 0.961 1.034) 1.896 24.948 ( -1.072 0.637 1.115) 1.673 25.832 ( 4.175 1.017 -0.120) 4.299 25.859 ( 2.724 -0.064 -0.003) 2.725 26.113 ( 1.378 1.504 0.306) 2.063 26.205 ( 2.291 -2.555 -2.497) 4.244 28.331 ( -0.570 0.278 2.133) 2.225 28.372 ( 1.049 -1.663 1.006) 2.209 28.577 ( 1.234 1.004 -0.387) 1.637 28.615 ( -0.340 0.603 0.173) 0.714 28.639 ( -0.299 -1.527 2.135) 2.642 28.648 ( 1.104 -0.584 0.866) 1.519 28.724 ( -0.483 -0.754 -1.287) 1.568 28.756 ( -2.160 -1.492 -0.955) 2.794 32.352 ( -1.006 0.825 1.641) 2.094 32.387 ( -0.539 -0.383 1.128) 1.307 32.465 ( 0.119 1.123 0.452) 1.217 32.543 ( 0.550 -1.755 -1.820) 2.587 35.402 ( -0.374 0.732 1.308) 1.545 35.444 ( 0.203 -1.009 -0.151) 1.040 35.526 ( 0.544 1.423 -0.611) 1.641 35.564 ( 0.680 -0.180 -1.251) 1.435 88.808 ( -1.622 0.142 1.110) 1.970 88.869 ( -0.976 -1.333 -0.996) 1.929 88.971 ( -0.139 -0.060 -1.663) 1.670 89.104 ( -9.812 -7.013 2.566) 12.330 97.622 ( -0.489 0.615 -0.450) 0.906 97.635 ( -1.188 0.107 0.027) 1.193 97.669 ( -0.712 -0.335 -0.324) 0.851 97.708 ( -3.521 -1.880 -0.021) 3.992 98.686 ( 0.119 0.663 0.554) 0.872 98.709 ( -0.526 -0.034 0.893) 1.037 98.978 ( 1.677 4.399 -1.182) 4.854 99.072 ( 3.487 1.953 -6.545) 7.669 99.662 ( 0.836 2.108 0.542) 2.332 99.735 ( 3.541 -0.212 0.549) 3.590 99.792 ( 0.611 3.050 0.370) 3.132 100.007 ( -5.269 -5.300 2.255) 7.806 ======================= 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| 1.590 ( -2.606 -9.981 5.239) 11.570 1.590 ( -2.606 9.981 5.239) 11.570 1.627 ( 0.444 -5.817 4.829) 7.573 1.627 ( 0.444 5.817 4.829) 7.573 1.873 ( 2.203 -3.289 -4.687) 6.135 1.873 ( 2.203 3.289 -4.687) 6.135 1.992 ( 0.890 -5.819 -0.610) 5.918 1.992 ( 0.890 5.819 -0.610) 5.918 2.315 ( -1.126 -8.430 7.908) 11.613 2.315 ( -1.126 8.430 7.908) 11.613 2.566 ( -1.558 -1.428 -1.504) 2.594 2.566 ( -1.558 1.428 -1.504) 2.594 2.701 ( -0.445 -0.269 0.781) 0.939 2.701 ( -0.445 0.269 0.781) 0.939 2.828 ( 0.850 -2.632 -1.276) 3.046 2.828 ( 0.850 2.632 -1.276) 3.046 2.981 ( -1.359 -3.481 3.586) 5.179 2.981 ( -1.359 3.481 3.586) 5.179 3.117 ( 5.553 -3.002 -1.573) 6.506 3.117 ( 5.553 3.002 -1.573) 6.506 3.291 ( -3.110 -1.791 -8.069) 8.831 3.291 ( -3.110 1.791 -8.069) 8.831 3.477 ( -0.644 -1.768 -0.569) 1.966 3.477 ( -0.644 1.768 -0.569) 1.966 4.399 ( 0.723 -3.421 3.370) 4.856 4.399 ( 0.723 3.421 3.370) 4.856 4.536 ( -0.459 -4.073 -4.046) 5.759 4.536 ( -0.459 4.073 -4.046) 5.759 5.075 ( 2.470 -1.296 0.742) 2.887 5.075 ( 2.470 1.296 0.742) 2.887 5.172 ( -1.225 -2.576 -1.906) 3.431 5.172 ( -1.225 2.576 -1.906) 3.431 5.377 ( -3.807 -3.567 5.285) 7.427 5.377 ( -3.807 3.567 5.285) 7.427 5.459 ( -1.259 -0.887 -0.260) 1.562 5.459 ( -1.259 0.887 -0.260) 1.562 5.582 ( 2.305 -2.197 3.986) 5.101 5.582 ( 2.305 2.197 3.986) 5.101 5.748 ( 1.541 -3.239 -6.487) 7.413 5.748 ( 1.541 3.239 -6.487) 7.413 6.124 ( 1.700 -1.827 1.081) 2.720 6.124 ( 1.700 1.827 1.081) 2.720 6.194 ( 0.089 -0.520 -1.446) 1.539 6.194 ( 0.089 0.520 -1.446) 1.539 6.534 ( 1.404 -7.037 7.090) 10.087 6.534 ( 1.404 7.037 7.090) 10.087 6.752 ( -4.319 -10.598 -8.407) 14.200 6.752 ( -4.319 10.598 -8.407) 14.200 7.074 ( 2.358 -0.826 1.690) 3.016 7.074 ( 2.358 0.826 1.690) 3.016 7.266 ( -2.761 -1.918 -3.104) 4.576 7.266 ( -2.761 1.918 -3.104) 4.576 7.990 ( 4.465 -3.901 4.793) 7.624 7.990 ( 4.465 3.901 4.793) 7.624 8.175 ( -4.895 -3.834 -4.564) 7.713 8.175 ( -4.895 3.834 -4.564) 7.713 8.492 ( 6.366 -7.733 10.938) 14.831 8.492 ( 6.366 7.733 10.938) 14.831 8.720 ( -9.471 -5.239 -8.358) 13.675 8.720 ( -9.471 5.239 -8.358) 13.675 8.912 ( 4.495 -3.309 4.255) 7.019 8.912 ( 4.495 3.309 4.255) 7.019 9.145 ( -2.848 -0.904 -0.669) 3.062 9.145 ( -2.848 0.904 -0.669) 3.062 9.379 ( 1.567 -3.512 3.135) 4.962 9.379 ( 1.567 3.512 3.135) 4.962 9.637 ( 0.607 -3.668 -4.371) 5.738 9.637 ( 0.607 3.668 -4.371) 5.738 10.361 ( 0.362 -0.803 -1.106) 1.414 10.361 ( 0.362 0.803 -1.106) 1.414 10.638 ( 0.506 -1.923 -0.106) 1.992 10.638 ( 0.506 1.923 -0.106) 1.992 20.631 ( 0.118 -0.469 -1.043) 1.149 20.631 ( 0.118 0.469 -1.043) 1.149 20.956 ( -0.064 -0.336 0.165) 0.380 20.956 ( -0.064 0.336 0.165) 0.380 22.838 ( 0.323 -0.388 0.098) 0.514 22.838 ( 0.323 0.388 0.098) 0.514 23.106 ( -0.170 -0.343 -0.332) 0.507 23.106 ( -0.170 0.343 -0.332) 0.507 24.671 ( -0.170 -0.069 0.259) 0.317 24.671 ( -0.170 0.069 0.259) 0.317 24.951 ( 0.001 -0.218 0.693) 0.726 24.951 ( 0.001 0.218 0.693) 0.726 25.882 ( 0.149 -0.079 -0.129) 0.212 25.882 ( 0.149 0.079 -0.129) 0.212 26.154 ( -0.186 -1.213 -0.653) 1.390 26.154 ( -0.186 1.213 -0.653) 1.390 28.357 ( -0.325 -0.830 1.259) 1.543 28.357 ( -0.325 0.830 1.259) 1.543 28.608 ( -1.976 -1.276 2.628) 3.527 28.608 ( -1.976 1.276 2.628) 3.527 28.673 ( 3.206 -0.815 -0.791) 3.401 28.673 ( 3.206 0.815 -0.791) 3.401 28.684 ( -0.831 -1.496 -2.069) 2.685 28.684 ( -0.831 1.496 -2.069) 2.685 32.382 ( -0.248 -0.984 1.481) 1.795 32.382 ( -0.248 0.984 1.481) 1.795 32.492 ( 0.323 -1.389 -1.142) 1.827 32.492 ( 0.323 1.389 -1.142) 1.827 35.425 ( -0.077 -0.689 0.458) 0.831 35.425 ( -0.077 0.689 0.458) 0.831 35.548 ( -0.040 -0.517 -0.610) 0.801 35.548 ( -0.040 0.517 -0.610) 0.801 88.822 ( -2.384 -1.514 2.157) 3.554 88.822 ( -2.384 1.514 2.157) 3.554 88.966 ( 1.597 -1.964 -1.221) 2.810 88.966 ( 1.597 1.964 -1.221) 2.810 97.627 ( -0.139 -0.172 -0.024) 0.223 97.627 ( -0.139 0.172 -0.024) 0.223 97.657 ( 0.048 -0.238 -0.105) 0.264 97.657 ( 0.048 0.238 -0.105) 0.264 98.709 ( 0.045 -0.208 0.592) 0.629 98.709 ( 0.045 0.208 0.592) 0.629 99.045 ( -0.215 -1.443 -2.112) 2.567 99.045 ( -0.215 1.443 -2.112) 2.567 99.754 ( 0.673 -1.625 0.608) 1.861 99.754 ( 0.673 1.625 0.608) 1.861 99.855 ( -0.092 -1.273 -0.001) 1.276 99.855 ( -0.092 1.273 -0.001) 1.276 ======================= 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| 1.570 ( -2.493 -12.010 3.876) 12.864 1.570 ( -2.493 12.010 3.876) 12.864 1.723 ( 4.533 -4.979 -0.643) 6.764 1.723 ( 4.533 4.979 -0.643) 6.764 1.852 ( 2.010 -1.503 -3.152) 4.029 1.852 ( 2.010 1.503 -3.152) 4.029 2.009 ( 2.224 -2.699 -1.483) 3.798 2.009 ( 2.224 2.699 -1.483) 3.798 2.424 ( 4.723 -5.095 0.214) 6.951 2.424 ( 4.723 5.095 0.214) 6.951 2.521 ( -2.430 -2.198 3.306) 4.655 2.521 ( -2.430 2.198 3.306) 4.655 2.679 ( -2.755 -1.064 0.384) 2.978 2.679 ( -2.755 1.064 0.384) 2.978 2.817 ( 1.337 -0.619 0.191) 1.485 2.817 ( 1.337 0.619 0.191) 1.485 2.980 ( -4.396 -2.827 0.954) 5.313 2.980 ( -4.396 2.827 0.954) 5.313 3.139 ( 1.707 -4.339 -9.315) 10.417 3.139 ( 1.707 4.339 -9.315) 10.417 3.247 ( 1.953 -2.082 5.968) 6.615 3.247 ( 1.953 2.082 5.968) 6.615 3.461 ( -1.345 -1.741 1.126) 2.471 3.461 ( -1.345 1.741 1.126) 2.471 4.414 ( -0.816 -4.779 -1.370) 5.038 4.414 ( -0.816 4.779 -1.370) 5.038 4.516 ( 0.569 -4.354 1.000) 4.503 4.516 ( 0.569 4.354 1.000) 4.503 5.050 ( -2.771 -2.998 -2.922) 5.021 5.050 ( -2.771 2.998 -2.922) 5.021 5.122 ( -4.906 -3.554 1.886) 6.345 5.122 ( -4.906 3.554 1.886) 6.345 5.320 ( -7.451 -2.671 3.603) 8.696 5.320 ( -7.451 2.671 3.603) 8.696 5.448 ( -1.198 -2.014 0.246) 2.356 5.448 ( -1.198 2.014 0.246) 2.356 5.684 ( 0.025 -1.687 -2.529) 3.040 5.684 ( 0.025 1.687 -2.529) 3.040 5.699 ( 5.508 -1.031 -0.139) 5.605 5.699 ( 5.508 1.031 -0.139) 5.605 6.120 ( -1.325 -2.418 -2.317) 3.602 6.120 ( -1.325 2.418 -2.317) 3.602 6.193 ( -0.304 -1.370 -0.896) 1.665 6.193 ( -0.304 1.370 -0.896) 1.665 6.539 ( -6.389 -7.484 -1.548) 9.961 6.539 ( -6.389 7.484 -1.548) 9.961 6.660 ( -2.458 -11.319 5.765) 12.938 6.660 ( -2.458 11.319 5.765) 12.938 7.056 ( -2.165 -3.756 -2.218) 4.869 7.056 ( -2.165 3.756 -2.218) 4.869 7.270 ( 1.829 -4.197 3.210) 5.592 7.270 ( 1.829 4.197 3.210) 5.592 7.929 ( -7.704 -9.180 -5.106) 13.026 7.929 ( -7.704 9.180 -5.106) 13.026 8.146 ( -2.711 -2.982 4.109) 5.755 8.146 ( -2.711 2.982 4.109) 5.755 8.492 ( -3.544 -4.181 -5.780) 7.965 8.492 ( -3.544 4.181 -5.780) 7.965 8.655 ( -3.275 -9.227 9.226) 13.453 8.655 ( -3.275 9.227 9.226) 13.453 9.006 ( 5.529 -2.370 -5.266) 7.994 9.006 ( 5.529 2.370 -5.266) 7.994 9.201 ( 7.922 -1.901 5.158) 9.642 9.201 ( 7.922 1.901 5.158) 9.642 9.467 ( 7.334 -1.582 -1.544) 7.660 9.467 ( 7.334 1.582 -1.544) 7.660 9.604 ( -0.593 -0.420 -1.248) 1.444 9.604 ( -0.593 0.420 -1.248) 1.444 10.380 ( 2.569 -2.539 -0.351) 3.629 10.380 ( 2.569 2.539 -0.351) 3.629 10.652 ( 1.872 -4.896 -0.837) 5.308 10.652 ( 1.872 4.896 -0.837) 5.308 20.614 ( -1.274 -0.201 -0.187) 1.303 20.614 ( -1.274 0.201 -0.187) 1.303 20.947 ( -1.137 -0.237 0.091) 1.166 20.947 ( -1.137 0.237 0.091) 1.166 22.834 ( -0.528 -1.279 -0.465) 1.459 22.834 ( -0.528 1.279 -0.465) 1.459 23.108 ( 0.421 -1.228 0.239) 1.320 23.108 ( 0.421 1.228 0.239) 1.320 24.656 ( -1.895 -0.389 0.257) 1.951 24.656 ( -1.895 0.389 0.257) 1.951 24.968 ( 1.403 -0.307 0.018) 1.437 24.968 ( 1.403 0.307 0.018) 1.437 25.853 ( -3.220 -0.650 -0.205) 3.291 25.853 ( -3.220 0.650 -0.205) 3.291 26.136 ( -1.665 -0.705 0.238) 1.824 26.136 ( -1.665 0.705 0.238) 1.824 28.357 ( -0.768 -0.152 0.639) 1.010 28.357 ( -0.768 0.152 0.639) 1.010 28.588 ( -2.948 -1.531 1.420) 3.612 28.588 ( -2.948 1.531 1.420) 3.612 28.660 ( 0.350 -1.725 -1.257) 2.163 28.660 ( 0.350 1.725 -1.257) 2.163 28.724 ( 3.492 -1.594 -0.895) 3.941 28.724 ( 3.492 1.594 -0.895) 3.941 32.391 ( 0.015 -1.194 0.473) 1.284 32.391 ( 0.015 1.194 0.473) 1.284 32.490 ( 0.631 -0.915 -0.577) 1.252 32.490 ( 0.631 0.915 -0.577) 1.252 35.427 ( -0.062 -0.119 0.159) 0.208 35.427 ( -0.062 0.119 0.159) 0.208 35.540 ( -0.532 -0.248 0.011) 0.588 35.540 ( -0.532 0.248 0.011) 0.588 88.805 ( -2.059 -1.447 2.437) 3.503 88.805 ( -2.059 1.447 2.437) 3.503 89.023 ( 6.120 -4.534 -1.288) 7.725 89.023 ( 6.120 4.534 -1.288) 7.725 97.629 ( 0.476 -0.585 0.125) 0.764 97.629 ( 0.476 0.585 0.125) 0.764 97.674 ( 1.859 -1.125 0.010) 2.173 97.674 ( 1.859 1.125 0.010) 2.173 98.713 ( 0.035 -0.593 -0.054) 0.596 98.713 ( 0.035 0.593 -0.054) 0.596 99.014 ( -2.218 -0.184 0.256) 2.240 99.014 ( -2.218 0.184 0.256) 2.240 99.721 ( -3.083 -1.724 -0.673) 3.595 99.721 ( -3.083 1.724 -0.673) 3.595 99.900 ( 4.089 -6.085 -0.143) 7.332 99.900 ( 4.089 6.085 -0.143) 7.332 ======================= 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| 1.587 ( 2.222 -5.133 -2.449) 6.106 1.587 ( 2.222 5.133 -2.449) 6.106 1.731 ( 1.543 -8.317 -2.605) 8.851 1.731 ( 1.543 8.317 -2.605) 8.851 1.905 ( 6.045 -1.383 -3.327) 7.038 1.905 ( 6.045 1.383 -3.327) 7.038 2.038 ( 3.304 -5.926 -0.672) 6.818 2.038 ( 3.304 5.926 -0.672) 6.818 2.435 ( -3.113 -6.820 1.766) 7.702 2.435 ( -3.113 6.820 1.766) 7.702 2.542 ( 2.837 -0.383 -3.634) 4.626 2.542 ( 2.837 0.383 -3.634) 4.626 2.631 ( -3.967 -1.183 1.486) 4.398 2.631 ( -3.967 1.183 1.486) 4.398 2.804 ( -1.901 -2.806 -4.594) 5.709 2.804 ( -1.901 2.806 -4.594) 5.709 3.002 ( 3.364 -2.689 8.307) 9.357 3.002 ( 3.364 2.689 8.307) 9.357 3.067 ( -0.435 -3.796 -4.853) 6.176 3.067 ( -0.435 3.796 -4.853) 6.176 3.304 ( -2.655 -4.585 2.903) 6.042 3.304 ( -2.655 4.585 2.903) 6.042 3.491 ( 1.374 -1.464 5.112) 5.492 3.491 ( 1.374 1.464 5.112) 5.492 4.377 ( -0.464 -3.777 -2.264) 4.428 4.377 ( -0.464 3.777 -2.264) 4.428 4.539 ( -0.442 -3.596 1.859) 4.072 4.539 ( -0.442 3.596 1.859) 4.072 4.967 ( -4.308 -4.456 -1.801) 6.454 4.967 ( -4.308 4.456 -1.801) 6.454 5.058 ( -4.052 -2.024 1.589) 4.800 5.058 ( -4.052 2.024 1.589) 4.800 5.246 ( -4.473 -1.777 2.277) 5.325 5.246 ( -4.473 1.777 2.277) 5.325 5.390 ( -5.208 -1.445 -0.238) 5.410 5.390 ( -5.208 1.445 -0.238) 5.410 5.616 ( -2.833 -3.352 -3.416) 5.561 5.616 ( -2.833 3.352 -3.416) 5.561 5.822 ( 5.418 -1.993 1.343) 5.927 5.822 ( 5.418 1.993 1.343) 5.927 5.996 ( -10.191 -2.055 -3.359) 10.925 5.996 ( -10.191 2.055 -3.359) 10.925 6.189 ( 2.063 -2.150 2.467) 3.868 6.189 ( 2.063 2.150 2.467) 3.868 6.463 ( -4.834 -3.299 2.543) 6.381 6.463 ( -4.834 3.299 2.543) 6.381 6.636 ( -4.410 -8.357 2.179) 9.697 6.636 ( -4.410 8.357 2.179) 9.697 7.039 ( -0.407 -6.396 1.369) 6.553 7.039 ( -0.407 6.396 1.369) 6.553 7.302 ( -1.638 -6.977 0.179) 7.168 7.302 ( -1.638 6.977 0.179) 7.168 7.752 ( -3.410 -7.317 -7.730) 11.177 7.752 ( -3.410 7.317 -7.730) 11.177 8.080 ( -6.357 -3.347 1.255) 7.293 8.080 ( -6.357 3.347 1.255) 7.293 8.490 ( 2.070 -2.364 2.546) 4.044 8.490 ( 2.070 2.364 2.546) 4.044 8.633 ( -5.989 -8.663 4.098) 11.301 8.633 ( -5.989 8.663 4.098) 11.301 9.026 ( 4.362 -2.801 -4.657) 6.969 9.026 ( 4.362 2.801 -4.657) 6.969 9.391 ( 6.952 -2.527 2.192) 7.715 9.391 ( 6.952 2.527 2.192) 7.715 9.536 ( 5.831 -6.688 -7.162) 11.402 9.536 ( 5.831 6.688 -7.162) 11.402 9.647 ( 4.233 -4.046 5.143) 7.793 9.647 ( 4.233 4.046 5.143) 7.793 10.431 ( 2.651 -4.950 1.472) 5.805 10.431 ( 2.651 4.950 1.472) 5.805 10.681 ( 3.303 -7.634 -1.974) 8.548 10.681 ( 3.303 7.634 -1.974) 8.548 20.588 ( -1.886 -0.161 0.380) 1.931 20.588 ( -1.886 0.161 0.380) 1.931 20.923 ( -1.714 -0.355 -0.029) 1.750 20.923 ( -1.714 0.355 -0.029) 1.750 22.819 ( -0.476 -2.350 -0.172) 2.404 22.819 ( -0.476 2.350 -0.172) 2.404 23.117 ( 0.236 -2.237 -0.009) 2.250 23.117 ( 0.236 2.237 -0.009) 2.250 24.620 ( -2.527 -0.624 0.269) 2.616 24.620 ( -2.527 0.624 0.269) 2.616 24.994 ( 1.901 -0.338 -0.571) 2.014 24.994 ( 1.901 0.338 -0.571) 2.014 25.783 ( -4.535 -1.281 -0.101) 4.714 25.783 ( -4.535 1.281 -0.101) 4.714 26.103 ( -2.853 -1.175 0.579) 3.140 26.103 ( -2.853 1.175 0.579) 3.140 28.353 ( -0.177 -0.447 0.478) 0.678 28.353 ( -0.177 0.447 0.478) 0.678 28.551 ( -2.552 -1.224 0.488) 2.872 28.551 ( -2.552 1.224 0.488) 2.872 28.656 ( 0.394 -1.816 -1.055) 2.136 28.656 ( 0.394 1.816 -1.055) 2.136 28.765 ( 2.424 -2.155 -0.648) 3.308 28.765 ( 2.424 2.155 -0.648) 3.308 32.393 ( 0.134 -1.317 -0.311) 1.360 32.393 ( 0.134 1.317 -0.311) 1.360 32.500 ( 0.874 -1.226 -0.097) 1.509 32.500 ( 0.874 1.226 -0.097) 1.509 35.428 ( 0.181 -0.443 -0.094) 0.487 35.428 ( 0.181 0.443 -0.094) 0.487 35.530 ( -0.966 -0.654 0.396) 1.232 35.530 ( -0.966 0.654 0.396) 1.232 88.811 ( -0.371 -0.876 2.418) 2.598 88.811 ( -0.371 0.876 2.418) 2.598 89.118 ( 6.364 -5.859 -1.394) 8.762 89.118 ( 6.364 5.859 -1.394) 8.762 97.646 ( 1.196 -0.537 0.297) 1.344 97.646 ( 1.196 0.537 0.297) 1.344 97.712 ( 2.363 -1.913 0.036) 3.040 97.712 ( 2.363 1.913 0.036) 3.040 98.713 ( 0.440 -0.947 -0.418) 1.125 98.713 ( 0.440 0.947 -0.418) 1.125 98.975 ( -3.769 -0.799 1.657) 4.193 98.975 ( -3.769 0.799 1.657) 4.193 99.670 ( -2.079 -0.970 -0.126) 2.297 99.670 ( -2.079 0.970 -0.126) 2.297 99.959 ( 3.535 -7.658 -1.234) 8.524 99.959 ( 3.535 7.658 -1.234) 8.524 ======================= 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 ( 4.100 -3.628 -9.509) 10.973 1.566 ( 4.100 3.628 -9.509) 10.973 1.775 ( 3.634 -5.008 0.625) 6.219 1.775 ( 3.634 5.008 0.625) 6.219 1.956 ( 5.210 -2.067 -4.456) 7.160 1.956 ( 5.210 2.067 -4.456) 7.160 2.075 ( 1.221 -7.623 -1.931) 7.958 2.075 ( 1.221 7.623 -1.931) 7.958 2.374 ( -4.827 -1.838 1.402) 5.352 2.374 ( -4.827 1.838 1.402) 5.352 2.526 ( -0.238 -3.486 -3.590) 5.010 2.526 ( -0.238 3.486 -3.590) 5.010 2.575 ( -4.012 -2.092 1.052) 4.645 2.575 ( -4.012 2.092 1.052) 4.645 2.757 ( 0.534 -4.669 -2.163) 5.174 2.757 ( 0.534 4.669 -2.163) 5.174 2.991 ( 0.392 -2.374 -4.480) 5.085 2.991 ( 0.392 2.374 -4.480) 5.085 3.195 ( 1.605 -2.144 9.020) 9.409 3.195 ( 1.605 2.144 9.020) 9.409 3.266 ( -1.139 -4.441 2.474) 5.210 3.266 ( -1.139 4.441 2.474) 5.210 3.571 ( 0.836 -0.885 5.104) 5.247 3.571 ( 0.836 0.885 5.104) 5.247 4.358 ( -0.271 -1.064 -0.268) 1.131 4.358 ( -0.271 1.065 -0.268) 1.131 4.542 ( -0.407 -1.230 0.632) 1.441 4.542 ( -0.407 1.230 0.632) 1.441 4.864 ( -4.742 -2.592 -2.097) 5.796 4.864 ( -4.742 2.592 -2.097) 5.796 5.050 ( 0.754 -3.097 0.956) 3.328 5.050 ( 0.754 3.097 0.956) 3.328 5.195 ( -5.269 -0.835 1.683) 5.594 5.195 ( -5.269 0.835 1.683) 5.594 5.322 ( -2.544 -0.691 2.301) 3.499 5.322 ( -2.544 0.691 2.301) 3.499 5.530 ( -3.512 -3.242 -1.930) 5.155 5.530 ( -3.512 3.242 -1.930) 5.155 5.763 ( -9.560 -1.861 -0.165) 9.741 5.763 ( -9.560 1.861 -0.165) 9.741 5.943 ( 4.752 -0.554 0.100) 4.785 5.943 ( 4.752 0.554 0.100) 4.785 6.262 ( -3.499 -4.962 3.687) 7.104 6.262 ( -3.499 4.962 3.687) 7.104 6.400 ( -1.600 -4.365 3.482) 5.809 6.400 ( -1.600 4.365 3.482) 5.809 6.608 ( -1.434 -3.851 1.047) 4.240 6.608 ( -1.434 3.851 1.047) 4.240 7.019 ( -3.797 -5.074 0.513) 6.358 7.019 ( -3.797 5.074 0.513) 6.358 7.222 ( -2.785 -6.534 -5.796) 9.167 7.222 ( -2.785 6.534 -5.796) 9.167 7.690 ( 3.854 -4.603 -5.378) 8.060 7.690 ( 3.854 4.603 -5.378) 8.060 7.999 ( -5.342 -4.418 1.403) 7.073 7.999 ( -5.342 4.418 1.403) 7.073 8.494 ( -6.004 -6.401 3.711) 9.528 8.494 ( -6.004 6.401 3.711) 9.528 8.631 ( 2.726 -3.758 1.100) 4.771 8.631 ( 2.726 3.758 1.100) 4.771 9.058 ( 3.725 -4.133 -2.170) 5.972 9.058 ( 3.725 4.133 -2.170) 5.972 9.438 ( 1.151 -3.789 -3.938) 5.584 9.438 ( 1.151 3.789 -3.938) 5.584 9.597 ( 5.765 -3.563 0.560) 6.800 9.597 ( 5.765 3.563 0.560) 6.800 9.763 ( 3.890 -0.863 1.487) 4.253 9.763 ( 3.890 0.863 1.487) 4.253 10.493 ( 1.660 -6.090 3.234) 7.093 10.493 ( 1.660 6.090 3.234) 7.093 10.712 ( 3.287 -8.943 -3.071) 10.010 10.712 ( 3.287 8.943 -3.071) 10.010 20.563 ( -1.571 -0.209 0.445) 1.646 20.563 ( -1.571 0.209 0.445) 1.646 20.894 ( -1.501 -0.436 -0.114) 1.567 20.894 ( -1.501 0.436 -0.114) 1.567 22.822 ( 0.390 -2.705 0.920) 2.884 22.822 ( 0.390 2.705 0.920) 2.884 23.109 ( -0.599 -2.620 -1.064) 2.890 23.109 ( -0.599 2.620 -1.064) 2.890 24.584 ( -2.039 -0.700 0.344) 2.183 24.584 ( -2.039 0.700 0.344) 2.183 25.015 ( 1.495 -0.268 -0.886) 1.758 25.015 ( 1.495 0.268 -0.886) 1.758 25.713 ( -3.611 -1.445 0.106) 3.891 25.713 ( -3.611 1.445 0.106) 3.891 26.059 ( -2.805 -0.950 0.376) 2.986 26.059 ( -2.805 0.950 0.376) 2.986 28.363 ( 0.389 -0.684 0.920) 1.210 28.363 ( 0.389 0.684 0.920) 1.210 28.518 ( -1.538 -0.707 -0.044) 1.694 28.518 ( -1.538 0.707 -0.044) 1.694 28.648 ( -0.085 -1.530 -1.004) 1.832 28.648 ( -0.085 1.530 -1.004) 1.832 28.789 ( 1.315 -2.329 -0.562) 2.733 28.789 ( 1.315 2.329 -0.562) 2.733 32.391 ( 0.135 -0.936 -0.369) 1.015 32.391 ( 0.135 0.936 -0.369) 1.015 32.514 ( 0.825 -0.904 -0.075) 1.227 32.514 ( 0.825 0.904 -0.075) 1.227 35.433 ( 0.471 -0.660 -0.110) 0.819 35.433 ( 0.471 0.660 -0.110) 0.819 35.516 ( -1.134 -0.742 0.328) 1.394 35.516 ( -1.134 0.742 0.328) 1.394 88.838 ( 0.320 -0.222 2.437) 2.468 88.838 ( 0.320 0.222 2.437) 2.468 89.190 ( 4.225 -5.505 -1.872) 7.187 89.190 ( 4.225 5.505 -1.872) 7.187 97.673 ( 1.388 -0.549 0.609) 1.612 97.673 ( 1.388 0.549 0.609) 1.612 97.745 ( 1.639 -2.388 -0.272) 2.909 97.745 ( 1.639 2.388 -0.272) 2.909 98.723 ( 1.249 -0.863 -0.248) 1.538 98.723 ( 1.249 0.863 -0.248) 1.538 98.923 ( -4.375 -0.824 1.389) 4.664 98.923 ( -4.375 0.824 1.389) 4.664 99.658 ( -0.352 -1.849 1.603) 2.472 99.658 ( -0.352 1.849 1.603) 2.472 99.986 ( 2.046 -7.550 -2.391) 8.180 99.986 ( 2.046 7.550 -2.391) 8.180 ======================= 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| 1.555 ( 3.160 -4.636 -3.820) 6.787 1.555 ( 3.160 4.636 -3.820) 6.787 1.784 ( 0.255 -3.787 -8.962) 9.733 1.784 ( 0.255 3.787 -8.962) 9.733 1.965 ( 0.316 -2.640 0.516) 2.708 1.965 ( 0.316 2.640 0.516) 2.708 2.068 ( 2.470 -3.642 -3.864) 5.857 2.068 ( 2.470 3.642 -3.864) 5.857 2.343 ( -0.278 -2.532 1.688) 3.056 2.343 ( -0.278 2.532 1.688) 3.056 2.452 ( -5.287 -6.502 -0.567) 8.399 2.452 ( -5.287 6.502 -0.567) 8.399 2.564 ( 1.443 -1.736 0.171) 2.264 2.564 ( 1.443 1.736 0.171) 2.264 2.733 ( -1.209 -2.035 -1.321) 2.711 2.733 ( -1.209 2.035 -1.321) 2.711 2.983 ( 1.055 -0.804 -0.747) 1.522 2.983 ( 1.055 0.804 -0.746) 1.522 3.175 ( -3.486 -2.124 1.566) 4.372 3.175 ( -3.486 2.124 1.566) 4.372 3.389 ( 2.311 -1.565 6.933) 7.474 3.389 ( 2.311 1.565 6.933) 7.474 3.623 ( 1.330 -1.399 1.961) 2.752 3.623 ( 1.330 1.399 1.961) 2.752 4.359 ( -0.197 -1.455 1.054) 1.808 4.359 ( -0.197 1.455 1.054) 1.808 4.542 ( -0.478 -0.310 0.368) 0.678 4.542 ( -0.478 0.310 0.368) 0.678 4.786 ( -2.239 -0.657 -1.823) 2.961 4.786 ( -2.239 0.657 -1.823) 2.961 5.034 ( -1.305 -1.725 -1.164) 2.456 5.034 ( -1.305 1.725 -1.164) 2.456 5.203 ( 3.413 -2.815 3.405) 5.583 5.203 ( 3.413 2.815 3.405) 5.583 5.311 ( -2.763 -1.485 1.619) 3.530 5.311 ( -2.763 1.485 1.619) 3.530 5.479 ( -1.563 -2.239 0.444) 2.767 5.479 ( -1.563 2.239 0.444) 2.767 5.668 ( -1.776 -1.983 0.076) 2.663 5.668 ( -1.776 1.983 0.076) 2.663 6.031 ( 5.259 -0.596 0.720) 5.341 6.031 ( 5.259 0.596 0.720) 5.341 6.120 ( -10.771 -5.308 0.805) 12.035 6.120 ( -10.771 5.308 0.805) 12.035 6.512 ( 4.666 -6.518 4.169) 9.036 6.512 ( 4.666 6.518 4.169) 9.036 6.593 ( -1.464 -2.266 1.349) 3.016 6.593 ( -1.464 2.266 1.349) 3.016 6.941 ( -3.695 -3.066 -1.896) 5.163 6.941 ( -3.695 3.066 -1.896) 5.163 7.128 ( -0.689 -3.298 -5.826) 6.730 7.128 ( -0.689 3.298 -5.826) 6.730 7.727 ( 3.928 -3.366 -2.435) 5.717 7.727 ( 3.928 3.366 -2.435) 5.717 7.930 ( -3.374 -3.215 0.496) 4.687 7.930 ( -3.374 3.215 0.496) 4.687 8.440 ( -3.409 -6.199 2.274) 7.431 8.440 ( -3.409 6.199 2.274) 7.431 8.679 ( 1.602 -1.978 0.057) 2.545 8.679 ( 1.602 1.978 0.057) 2.545 9.099 ( 2.280 -4.478 0.225) 5.030 9.099 ( 2.280 4.478 0.225) 5.030 9.395 ( -1.233 -3.020 -3.187) 4.560 9.395 ( -1.233 3.020 -3.187) 4.560 9.696 ( 2.694 -0.554 2.811) 3.932 9.696 ( 2.694 0.554 2.811) 3.932 9.800 ( 1.843 -1.949 -2.090) 3.401 9.800 ( 1.843 1.949 -2.090) 3.401 10.545 ( -0.181 -4.811 3.789) 6.127 10.545 ( -0.181 4.811 3.789) 6.127 10.720 ( 1.936 -8.099 -3.548) 9.052 10.720 ( 1.936 8.099 -3.548) 9.052 20.549 ( -0.523 -0.068 0.247) 0.582 20.549 ( -0.523 0.068 0.247) 0.582 20.875 ( -0.620 -0.377 -0.089) 0.731 20.875 ( -0.620 0.377 -0.089) 0.731 22.848 ( 0.884 -2.279 1.562) 2.901 22.848 ( 0.884 2.279 1.562) 2.901 23.079 ( -0.912 -2.174 -1.704) 2.909 23.079 ( -0.912 2.174 -1.704) 2.909 24.564 ( -0.848 -0.603 0.385) 1.110 24.564 ( -0.848 0.603 0.385) 1.110 25.022 ( 0.462 -0.187 -0.767) 0.915 25.022 ( 0.462 0.187 -0.767) 0.915 25.673 ( -1.257 -0.927 0.170) 1.571 25.673 ( -1.257 0.927 0.170) 1.571 26.027 ( -1.203 -0.453 0.160) 1.295 26.027 ( -1.203 0.453 0.160) 1.295 28.378 ( -0.499 -0.789 1.596) 1.849 28.378 ( -0.499 0.789 1.596) 1.849 28.502 ( 0.355 -0.255 -0.890) 0.992 28.502 ( 0.355 0.255 -0.890) 0.992 28.635 ( -0.385 -1.114 -0.604) 1.324 28.635 ( -0.385 1.114 -0.604) 1.324 28.799 ( 0.578 -1.605 -0.528) 1.786 28.799 ( 0.578 1.605 -0.528) 1.786 32.389 ( -0.112 -0.388 -0.084) 0.412 32.389 ( -0.112 0.388 -0.084) 0.412 32.523 ( 0.525 -0.201 -0.235) 0.609 32.523 ( 0.525 0.201 -0.235) 0.609 35.439 ( 0.163 -0.484 0.107) 0.521 35.439 ( 0.163 0.484 0.107) 0.521 35.503 ( -0.470 -0.598 0.029) 0.761 35.503 ( -0.470 0.598 0.029) 0.761 88.866 ( -0.101 -0.377 2.222) 2.256 88.866 ( -0.101 0.377 2.222) 2.256 89.216 ( 1.386 -3.545 -1.869) 4.240 89.216 ( 1.386 3.545 -1.869) 4.240 97.700 ( 0.829 -0.872 0.852) 1.474 97.700 ( 0.829 0.872 0.852) 1.474 97.757 ( 0.298 -2.060 -0.615) 2.170 97.757 ( 0.298 2.060 -0.615) 2.170 98.746 ( 1.332 -0.664 0.063) 1.490 98.746 ( 1.332 0.664 0.063) 1.490 98.870 ( -2.652 -0.445 0.574) 2.749 98.870 ( -2.652 0.445 0.574) 2.749 99.685 ( 0.539 -2.131 2.486) 3.318 99.685 ( 0.539 2.131 2.486) 3.318 99.978 ( 0.502 -5.917 -2.789) 6.560 99.978 ( 0.502 5.917 -2.789) 6.560 ======================= 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| 1.527 ( -7.562 -4.243 0.777) 8.706 1.527 ( -7.562 4.243 0.777) 8.706 1.688 ( 2.101 -4.317 -4.785) 6.779 1.688 ( 2.101 4.317 -4.785) 6.779 1.992 ( 0.033 -2.646 0.719) 2.742 1.992 ( 0.033 2.646 0.719) 2.742 2.055 ( 2.191 -1.885 -4.288) 5.171 2.055 ( 2.191 1.885 -4.288) 5.171 2.357 ( -3.168 -3.954 0.980) 5.161 2.357 ( -3.168 3.954 0.980) 5.161 2.419 ( 3.666 -1.403 2.101) 4.453 2.419 ( 3.666 1.403 2.101) 4.453 2.577 ( -0.255 -0.321 -0.743) 0.849 2.577 ( -0.255 0.321 -0.743) 0.849 2.718 ( 0.836 -2.604 -0.055) 2.735 2.718 ( 0.836 2.604 -0.055) 2.735 2.972 ( -2.582 -2.555 0.430) 3.658 2.972 ( -2.582 2.555 0.430) 3.658 3.170 ( 1.015 -1.539 1.648) 2.473 3.170 ( 1.015 1.539 1.648) 2.473 3.430 ( -3.540 -1.836 3.099) 5.050 3.430 ( -3.540 1.836 3.099) 5.050 3.667 ( 3.262 -1.817 -1.492) 4.021 3.667 ( 3.262 1.817 -1.492) 4.021 4.371 ( 0.351 -1.825 0.347) 1.890 4.371 ( 0.351 1.825 0.347) 1.890 4.532 ( -1.014 -2.292 0.772) 2.622 4.532 ( -1.014 2.292 0.772) 2.622 4.749 ( -1.115 -2.592 1.224) 3.075 4.749 ( -1.115 2.592 1.224) 3.076 5.058 ( 6.141 -0.897 -2.852) 6.830 5.058 ( 6.141 0.897 -2.852) 6.830 5.258 ( -3.121 -2.096 -0.947) 3.877 5.258 ( -3.121 2.096 -0.947) 3.877 5.310 ( 4.334 -1.868 1.579) 4.976 5.310 ( 4.334 1.868 1.579) 4.976 5.480 ( 1.130 -0.378 0.562) 1.317 5.480 ( 1.130 0.378 0.562) 1.317 5.670 ( 1.389 -0.618 -0.419) 1.577 5.670 ( 1.389 0.618 -0.419) 1.577 5.993 ( -6.209 -3.950 2.883) 7.903 5.993 ( -6.209 3.950 2.883) 7.903 6.157 ( 10.256 -4.565 -0.739) 11.250 6.157 ( 10.256 4.565 -0.739) 11.250 6.540 ( -2.783 -2.043 0.741) 3.530 6.540 ( -2.783 2.043 0.741) 3.530 6.618 ( 0.242 -4.087 0.767) 4.165 6.618 ( 0.242 4.087 0.767) 4.165 6.907 ( 2.287 -1.895 0.131) 2.973 6.907 ( 2.287 1.895 0.131) 2.973 7.085 ( 0.890 -2.498 -2.318) 3.522 7.085 ( 0.890 2.498 -2.318) 3.522 7.707 ( -4.132 -1.861 -0.749) 4.594 7.707 ( -4.132 1.861 -0.749) 4.594 7.945 ( 4.908 -4.015 -0.704) 6.380 7.945 ( 4.908 4.015 -0.704) 6.380 8.438 ( 0.124 -4.716 2.649) 5.410 8.438 ( 0.124 4.716 2.649) 5.410 8.683 ( -0.238 -0.684 -1.134) 1.345 8.683 ( -0.238 0.684 -1.134) 1.345 9.122 ( -0.062 -2.587 -0.258) 2.600 9.122 ( -0.062 2.587 -0.258) 2.600 9.341 ( -3.236 -2.284 0.510) 3.994 9.341 ( -3.236 2.284 0.510) 3.994 9.692 ( -5.478 -3.062 1.779) 6.523 9.692 ( -5.478 3.062 1.779) 6.523 9.828 ( 4.230 -0.561 -3.153) 5.305 9.828 ( 4.230 0.561 -3.153) 5.305 10.560 ( -2.477 -4.841 3.085) 6.252 10.560 ( -2.477 4.841 3.085) 6.252 10.705 ( 0.571 -5.700 -2.892) 6.417 10.705 ( 0.571 5.700 -2.892) 6.417 20.552 ( 0.863 -0.228 -0.052) 0.894 20.552 ( 0.863 0.228 -0.052) 0.894 20.873 ( 0.500 -0.225 0.021) 0.549 20.873 ( 0.500 0.225 0.021) 0.549 22.867 ( -0.223 -0.455 0.215) 0.550 22.867 ( -0.223 0.455 0.215) 0.550 23.060 ( 0.463 -0.521 -0.371) 0.790 23.060 ( 0.463 0.521 -0.371) 0.790 24.565 ( 0.530 -0.353 0.302) 0.705 24.565 ( 0.530 0.353 0.302) 0.705 25.015 ( -0.721 -0.211 -0.174) 0.772 25.015 ( -0.721 0.211 -0.174) 0.772 25.676 ( 1.437 -0.424 -0.035) 1.498 25.676 ( 1.437 0.424 -0.035) 1.498 26.028 ( 1.162 -0.153 0.100) 1.176 26.028 ( 1.162 0.153 0.100) 1.176 28.375 ( -2.032 -0.573 1.779) 2.761 28.375 ( -2.032 0.573 1.779) 2.761 28.513 ( 2.415 -0.812 -1.669) 3.046 28.513 ( 2.415 0.812 -1.669) 3.046 28.625 ( -0.536 -0.908 0.235) 1.081 28.625 ( -0.536 0.908 0.235) 1.081 28.799 ( 0.067 -0.369 -0.514) 0.636 28.799 ( 0.067 0.369 -0.514) 0.636 32.384 ( -0.588 -0.283 0.275) 0.708 32.384 ( -0.588 0.283 0.275) 0.708 32.526 ( 0.188 -0.612 -0.413) 0.762 32.526 ( 0.188 0.612 -0.413) 0.762 35.436 ( -0.797 -0.248 0.343) 0.902 35.436 ( -0.797 0.248 0.343) 0.902 35.506 ( 0.954 -0.170 -0.210) 0.991 35.506 ( 0.954 0.170 -0.210) 0.991 88.877 ( -1.047 -0.815 1.504) 2.005 88.877 ( -1.047 0.815 1.504) 2.005 89.201 ( -1.269 -0.856 -0.849) 1.750 89.201 ( -1.269 0.856 -0.849) 1.750 97.710 ( -0.672 -0.472 0.267) 0.864 97.710 ( -0.672 0.472 0.267) 0.864 97.748 ( -0.546 -0.548 -0.125) 0.783 97.748 ( -0.546 0.548 -0.125) 0.783 98.747 ( -1.428 -0.027 0.019) 1.429 98.747 ( -1.428 0.027 0.019) 1.429 98.874 ( 2.818 -0.579 0.231) 2.886 98.874 ( 2.818 0.579 0.231) 2.886 99.712 ( 0.245 -0.447 0.715) 0.879 99.712 ( 0.245 0.447 0.715) 0.879 99.953 ( -0.586 -1.927 -1.213) 2.351 99.953 ( -0.586 1.927 -1.213) 2.351 ======================= 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| 1.403 ( -7.511 -6.893 3.640) 10.825 1.403 ( -7.511 6.893 3.640) 10.825 1.693 ( -3.536 -6.018 4.410) 8.256 1.693 ( -3.536 6.018 4.410) 8.256 1.976 ( -0.767 -4.267 -2.483) 4.996 1.976 ( -0.767 4.267 -2.483) 4.996 2.057 ( 2.091 -2.979 -1.834) 4.075 2.057 ( 2.091 2.979 -1.834) 4.075 2.360 ( 1.555 -3.323 2.466) 4.420 2.360 ( 1.555 3.323 2.466) 4.420 2.495 ( 1.562 -4.739 0.653) 5.032 2.495 ( 1.562 4.739 0.653) 5.032 2.575 ( 2.456 -1.391 0.338) 2.843 2.575 ( 2.456 1.391 0.338) 2.843 2.725 ( -2.577 -6.807 1.094) 7.360 2.725 ( -2.577 6.807 1.094) 7.360 2.927 ( -2.053 -4.481 0.871) 5.006 2.927 ( -2.053 4.481 0.871) 5.006 3.232 ( 3.812 -3.913 1.816) 5.757 3.232 ( 3.812 3.913 1.816) 5.757 3.360 ( -4.603 -2.295 -2.532) 5.733 3.360 ( -4.603 2.295 -2.532) 5.733 3.680 ( 1.275 -2.055 -3.753) 4.464 3.680 ( 1.275 2.055 -3.753) 4.464 4.362 ( -1.373 -2.786 -0.203) 3.113 4.362 ( -1.373 2.786 -0.203) 3.113 4.539 ( 1.328 -3.500 0.191) 3.749 4.539 ( 1.328 3.500 0.191) 3.749 4.800 ( 4.209 -4.428 3.285) 6.936 4.800 ( 4.209 4.428 3.285) 6.936 5.104 ( 1.043 -3.168 -3.142) 4.582 5.104 ( 1.043 3.168 -3.142) 4.582 5.229 ( 3.590 -0.719 -0.873) 3.763 5.229 ( 3.590 0.719 -0.873) 3.763 5.373 ( 2.997 -0.773 -2.335) 3.877 5.373 ( 2.997 0.773 -2.335) 3.877 5.507 ( 1.635 -3.019 -0.002) 3.433 5.507 ( 1.635 3.019 -0.002) 3.433 5.741 ( 7.076 -1.299 1.808) 7.418 5.741 ( 7.076 1.299 1.808) 7.418 5.935 ( -4.225 -1.984 0.990) 4.772 5.935 ( -4.225 1.984 0.990) 4.772 6.341 ( 10.169 -7.427 -2.760) 12.892 6.341 ( 10.169 7.427 -2.760) 12.892 6.461 ( -3.802 -4.068 -1.599) 5.793 6.461 ( -3.802 4.068 -1.599) 5.793 6.626 ( 1.778 -4.457 -0.059) 4.798 6.626 ( 1.778 4.457 -0.059) 4.798 6.999 ( 5.217 -6.071 2.760) 8.467 6.999 ( 5.217 6.071 2.760) 8.467 7.119 ( 4.113 -2.500 1.702) 5.106 7.119 ( 4.113 2.500 1.702) 5.106 7.622 ( -4.781 -3.643 0.314) 6.019 7.622 ( -4.781 3.643 0.314) 6.019 8.028 ( 5.558 -5.666 -1.196) 8.026 8.028 ( 5.558 5.666 -1.196) 8.026 8.501 ( 2.802 -4.068 4.258) 6.521 8.501 ( 2.802 4.068 4.258) 6.521 8.652 ( -1.045 -0.810 -2.695) 3.002 8.652 ( -1.045 0.810 -2.695) 3.002 9.085 ( -1.928 -2.783 -3.068) 4.569 9.085 ( -1.928 2.783 -3.068) 4.569 9.303 ( -5.870 -3.538 6.385) 9.368 9.303 ( -5.870 3.538 6.385) 9.368 9.598 ( -6.273 -2.277 -0.132) 6.675 9.598 ( -6.273 2.277 -0.132) 6.675 9.832 ( 0.070 -0.987 -3.384) 3.526 9.832 ( 0.070 0.987 -3.384) 3.526 10.533 ( -3.302 -8.689 0.938) 9.343 10.533 ( -3.302 8.689 0.938) 9.343 10.678 ( -1.162 -6.377 -1.218) 6.596 10.678 ( -1.162 6.377 -1.218) 6.596 20.575 ( 2.126 -0.364 -0.514) 2.218 20.575 ( 2.126 0.364 -0.514) 2.218 20.891 ( 1.375 -0.179 0.175) 1.398 20.891 ( 1.375 0.179 0.175) 1.398 22.848 ( -0.947 -1.693 -1.175) 2.268 22.848 ( -0.947 1.693 -1.175) 2.268 23.084 ( 1.382 -1.850 0.987) 2.512 23.084 ( 1.382 1.850 0.987) 2.512 24.586 ( 1.657 -0.133 0.206) 1.675 24.586 ( 1.657 0.133 0.206) 1.675 24.997 ( -1.664 -0.332 0.556) 1.785 24.997 ( -1.664 0.332 0.556) 1.785 25.718 ( 3.648 -1.036 -0.244) 3.800 25.718 ( 3.648 1.036 -0.244) 3.800 26.064 ( 3.013 -0.914 -0.037) 3.149 26.064 ( 3.013 0.914 -0.037) 3.149 28.355 ( -2.279 -0.328 1.528) 2.763 28.355 ( -2.279 0.328 1.528) 2.763 28.541 ( 3.214 -1.173 -1.983) 3.954 28.541 ( 3.214 1.173 -1.983) 3.954 28.622 ( -0.758 -0.944 1.242) 1.734 28.622 ( -0.758 0.944 1.242) 1.734 28.789 ( -0.593 -1.077 -0.539) 1.342 28.789 ( -0.593 1.077 -0.539) 1.342 32.376 ( -1.029 -0.604 0.771) 1.421 32.376 ( -1.029 0.604 0.771) 1.421 32.522 ( -0.004 -1.354 -0.654) 1.503 32.522 ( -0.004 1.354 -0.654) 1.503 35.425 ( -0.864 -0.746 0.456) 1.229 35.425 ( -0.864 0.746 0.456) 1.229 35.525 ( 1.489 -0.397 -0.357) 1.581 35.525 ( 1.489 0.397 -0.357) 1.581 88.865 ( -1.664 -1.139 0.587) 2.100 88.865 ( -1.664 1.139 0.587) 2.100 89.158 ( -3.700 -2.203 0.439) 4.328 89.158 ( -3.700 2.203 0.439) 4.328 97.686 ( -1.684 -0.473 -0.461) 1.809 97.686 ( -1.684 0.473 -0.461) 1.809 97.736 ( -1.364 -1.680 0.465) 2.214 97.736 ( -1.364 1.680 0.465) 2.214 98.719 ( -1.585 -0.361 0.083) 1.628 98.719 ( -1.585 0.361 0.083) 1.628 98.946 ( 5.315 -1.514 -0.451) 5.545 98.946 ( 5.315 1.514 -0.451) 5.545 99.703 ( -0.260 -2.074 -1.885) 2.815 99.703 ( -0.260 2.074 -1.885) 2.815 99.938 ( -1.421 -3.018 1.282) 3.574 99.938 ( -1.421 3.018 1.282) 3.574 ======================= 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 ( -3.198 -5.775 10.004) 11.986 1.387 ( -3.198 5.775 10.004) 11.986 1.668 ( -5.514 -8.241 6.107) 11.645 1.668 ( -5.514 8.241 6.107) 11.645 1.919 ( -0.162 -3.248 -5.160) 6.100 1.919 ( -0.162 3.248 -5.160) 6.100 2.063 ( -0.622 -5.993 -1.728) 6.268 2.063 ( -0.622 5.993 -1.728) 6.268 2.422 ( -0.472 -3.715 3.502) 5.127 2.422 ( -0.472 3.715 3.502) 5.127 2.502 ( 0.647 -2.476 0.019) 2.559 2.502 ( 0.647 2.476 0.019) 2.559 2.649 ( 2.829 -1.662 0.322) 3.297 2.649 ( 2.829 1.662 0.322) 3.297 2.663 ( -4.141 -7.467 5.440) 10.125 2.663 ( -4.141 7.467 5.440) 10.125 2.953 ( 2.576 -3.686 2.116) 4.970 2.953 ( 2.576 3.686 2.116) 4.970 3.229 ( -3.844 -1.768 -7.099) 8.264 3.229 ( -3.844 1.768 -7.099) 8.264 3.326 ( 4.868 -4.516 -0.176) 6.642 3.326 ( 4.868 4.516 -0.176) 6.642 3.625 ( -1.859 -1.451 -5.355) 5.851 3.625 ( -1.859 1.451 -5.355) 5.851 4.342 ( -1.034 -3.957 0.886) 4.185 4.342 ( -1.034 3.957 0.886) 4.185 4.570 ( 2.494 -3.666 -1.237) 4.604 4.570 ( 2.494 3.666 -1.237) 4.604 4.912 ( 3.631 -5.815 2.776) 7.396 4.912 ( 3.631 5.815 2.776) 7.396 5.105 ( 4.963 -3.263 -1.783) 6.202 5.105 ( 4.963 3.263 -1.783) 6.202 5.298 ( 2.877 -2.008 -1.439) 3.792 5.298 ( 2.877 2.008 -1.439) 3.792 5.385 ( 3.224 -3.124 -1.120) 4.627 5.385 ( 3.224 3.124 -1.120) 4.627 5.547 ( 1.589 -3.687 2.219) 4.588 5.547 ( 1.589 3.687 2.219) 4.588 5.842 ( -4.175 -1.213 0.977) 4.456 5.842 ( -4.175 1.213 0.977) 4.456 5.936 ( 9.119 -3.557 1.041) 9.844 5.936 ( 9.119 3.557 1.041) 9.844 6.281 ( -4.368 -2.510 -5.137) 7.195 6.281 ( -4.368 2.510 -5.137) 7.195 6.487 ( 0.859 -1.433 -0.181) 1.681 6.487 ( 0.859 1.433 -0.181) 1.681 6.700 ( 8.753 -7.052 -2.955) 11.622 6.700 ( 8.753 7.052 -2.955) 11.622 7.083 ( 2.609 -5.705 -1.309) 6.409 7.083 ( 2.609 5.705 -1.309) 6.409 7.262 ( 7.977 -7.206 3.404) 11.276 7.262 ( 7.977 7.206 3.404) 11.276 7.594 ( 0.063 -4.369 4.956) 6.607 7.594 ( 0.063 4.369 4.956) 6.607 8.102 ( 5.125 -6.337 -0.959) 8.206 8.102 ( 5.125 6.337 -0.959) 8.206 8.542 ( -5.682 -2.937 1.051) 6.482 8.542 ( -5.682 2.937 1.051) 6.482 8.653 ( 6.788 -3.224 -0.249) 7.519 8.653 ( 6.788 3.224 -0.249) 7.519 9.013 ( -2.275 -4.178 -3.504) 5.908 9.013 ( -2.275 4.178 -3.504) 5.908 9.274 ( -8.028 -5.278 9.597) 13.580 9.274 ( -8.028 5.278 9.597) 13.580 9.488 ( -6.604 -0.468 -0.678) 6.655 9.488 ( -6.604 0.468 -0.678) 6.655 9.765 ( -2.321 -3.073 -4.779) 6.137 9.765 ( -2.321 3.073 -4.779) 6.137 10.471 ( -3.675 -7.662 -1.435) 8.618 10.471 ( -3.675 7.662 -1.435) 8.618 10.649 ( -1.565 -5.591 0.358) 5.817 10.649 ( -1.565 5.591 0.358) 5.817 20.607 ( 2.569 -0.391 -1.144) 2.839 20.607 ( 2.569 0.391 -1.144) 2.839 20.919 ( 1.626 -0.358 0.285) 1.689 20.919 ( 1.626 0.358 0.285) 1.689 22.826 ( -0.196 -2.096 -0.745) 2.233 22.826 ( -0.196 2.096 -0.745) 2.233 23.111 ( 0.669 -2.051 0.528) 2.221 23.111 ( 0.669 2.051 0.528) 2.221 24.621 ( 2.146 -0.136 0.210) 2.161 24.621 ( 2.146 0.136 0.210) 2.161 24.974 ( -2.040 -0.306 1.035) 2.308 24.974 ( -2.040 0.306 1.035) 2.308 25.785 ( 4.562 -1.100 -0.256) 4.700 25.785 ( 4.562 1.100 -0.256) 4.700 26.116 ( 3.260 -1.892 -0.497) 3.802 26.116 ( 3.260 1.892 -0.497) 3.802 28.339 ( -1.382 -0.566 1.562) 2.161 28.339 ( -1.382 0.566 1.562) 2.161 28.574 ( 3.016 -1.253 -1.602) 3.638 28.574 ( 3.016 1.253 -1.602) 3.638 28.625 ( -0.828 -0.569 1.708) 1.982 28.625 ( -0.828 0.569 1.708) 1.982 28.766 ( -1.455 -1.353 -0.685) 2.102 28.766 ( -1.455 1.353 -0.685) 2.102 32.369 ( -1.087 -0.751 1.411) 1.933 32.369 ( -1.087 0.751 1.411) 1.933 32.513 ( -0.012 -1.898 -0.980) 2.137 32.513 ( -0.012 1.898 -0.980) 2.137 35.420 ( -0.444 -1.025 0.543) 1.242 35.420 ( -0.444 1.025 0.543) 1.242 35.544 ( 1.275 -0.816 -0.628) 1.639 35.544 ( 1.275 0.816 -0.628) 1.639 88.842 ( -1.358 -1.469 0.190) 2.010 88.842 ( -1.358 1.469 0.190) 2.010 89.088 ( -5.503 -3.701 0.810) 6.681 89.088 ( -5.503 3.701 0.810) 6.681 97.654 ( -1.432 -0.370 -0.399) 1.532 97.654 ( -1.432 0.370 -0.399) 1.532 97.710 ( -2.165 -1.756 0.208) 2.795 97.710 ( -2.165 1.756 0.208) 2.795 98.702 ( -0.778 -0.598 0.457) 1.083 98.702 ( -0.778 0.598 0.457) 1.083 99.023 ( 5.025 -2.561 -2.094) 6.017 99.023 ( 5.025 2.561 -2.094) 6.017 99.683 ( 0.643 -1.704 -1.376) 2.282 99.683 ( 0.643 1.704 -1.376) 2.282 99.924 ( -2.498 -5.372 1.696) 6.163 99.924 ( -2.498 5.372 1.696) 6.163 ======================= 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| 1.485 ( 0.679 -1.554 10.698) 10.832 1.485 ( 0.679 1.554 10.698) 10.832 1.646 ( -5.230 -8.323 6.051) 11.543 1.646 ( -5.230 8.323 6.051) 11.543 1.882 ( 2.239 -3.381 -5.024) 6.456 1.882 ( 2.239 3.381 -5.024) 6.456 2.008 ( -1.685 -8.395 -2.259) 8.856 2.008 ( -1.685 8.395 -2.259) 8.856 2.348 ( -7.918 -12.136 2.370) 14.683 2.348 ( -7.918 12.136 2.370) 14.683 2.562 ( 2.389 -1.754 1.353) 3.258 2.562 ( 2.389 1.754 1.353) 3.258 2.674 ( 0.820 -6.389 3.266) 7.222 2.674 ( 0.820 6.389 3.266) 7.222 2.745 ( 2.063 -1.660 6.878) 7.370 2.745 ( 2.063 1.660 6.878) 7.370 3.027 ( 2.725 -4.074 0.876) 4.979 3.027 ( 2.725 4.074 0.876) 4.979 3.082 ( -1.535 -1.095 -9.238) 9.428 3.082 ( -1.535 1.095 -9.238) 9.428 3.377 ( 2.087 -3.709 -3.367) 5.426 3.377 ( 2.087 3.709 -3.367) 5.426 3.523 ( -2.653 -0.786 -4.810) 5.549 3.523 ( -2.653 0.786 -4.810) 5.549 4.354 ( 0.302 -4.403 2.620) 5.132 4.354 ( 0.302 4.403 2.620) 5.132 4.577 ( 0.933 -4.155 -3.310) 5.394 4.577 ( 0.933 4.155 -3.310) 5.394 4.991 ( 3.713 -4.044 2.602) 6.075 4.991 ( 3.713 4.044 2.602) 6.075 5.182 ( 4.239 -4.973 -3.304) 7.322 5.182 ( 4.239 4.973 -3.304) 7.322 5.337 ( 3.997 -1.958 1.164) 4.601 5.337 ( 3.997 1.958 1.164) 4.601 5.429 ( 0.793 -3.719 1.897) 4.249 5.429 ( 0.793 3.719 1.897) 4.249 5.586 ( -2.901 -2.477 4.017) 5.540 5.586 ( -2.901 2.477 4.017) 5.540 5.771 ( 0.011 -2.415 -3.656) 4.382 5.771 ( 0.011 2.415 -3.656) 4.382 6.080 ( 3.537 -2.426 1.944) 4.709 6.080 ( 3.537 2.426 1.944) 4.709 6.198 ( 0.105 -2.799 -2.085) 3.492 6.198 ( 0.105 2.799 -2.085) 3.492 6.478 ( -1.467 -2.747 2.488) 3.986 6.478 ( -1.467 2.747 2.488) 3.986 6.807 ( 7.580 -10.485 -5.380) 14.012 6.807 ( 7.580 10.485 -5.380) 14.012 7.058 ( -0.898 -3.444 -3.275) 4.837 7.058 ( -0.898 3.444 -3.275) 4.837 7.336 ( -0.077 -6.001 -2.209) 6.395 7.336 ( -0.077 6.001 -2.209) 6.395 7.777 ( 10.131 -6.313 8.863) 14.868 7.777 ( 10.131 6.313 8.863) 14.868 8.199 ( 7.259 -6.022 -0.338) 9.438 8.199 ( 7.259 6.022 -0.338) 9.438 8.417 ( -7.314 -5.531 0.009) 9.170 8.417 ( -7.314 5.531 0.009) 9.170 8.785 ( 5.786 -3.632 3.263) 7.571 8.785 ( 5.786 3.632 3.263) 7.571 8.920 ( -5.620 -4.346 -3.387) 7.871 8.920 ( -5.620 4.346 -3.387) 7.871 9.229 ( -7.456 -3.803 4.644) 9.572 9.229 ( -7.456 3.803 4.644) 9.572 9.378 ( -5.585 -3.913 1.830) 7.061 9.378 ( -5.585 3.913 1.830) 7.061 9.683 ( -0.329 -4.767 -5.463) 7.258 9.683 ( -0.329 4.767 -5.463) 7.258 10.396 ( -2.718 -3.309 -1.639) 4.586 10.396 ( -2.718 3.309 -1.639) 4.586 10.636 ( -0.524 -2.469 0.438) 2.561 10.636 ( -0.524 2.469 0.438) 2.561 20.629 ( 1.720 -0.587 -1.478) 2.342 20.629 ( 1.720 0.587 -1.478) 2.342 20.945 ( 1.053 -0.449 0.249) 1.171 20.945 ( 1.053 0.449 0.249) 1.171 22.827 ( 0.569 -1.648 0.076) 1.745 22.827 ( 0.569 1.648 0.076) 1.745 23.115 ( -0.191 -1.488 -0.300) 1.530 23.115 ( -0.191 1.488 -0.300) 1.530 24.656 ( 1.559 -0.148 0.246) 1.586 24.656 ( 1.559 0.148 0.246) 1.586 24.955 ( -1.480 -0.087 1.099) 1.845 24.955 ( -1.480 0.087 1.099) 1.845 25.852 ( 3.369 -0.684 -0.153) 3.441 25.852 ( 3.369 0.684 -0.153) 3.441 26.151 ( 1.734 -2.196 -0.979) 2.964 26.151 ( 1.734 2.196 -0.979) 2.964 28.344 ( -0.246 -0.938 1.677) 1.937 28.344 ( -0.246 0.938 1.677) 1.937 28.602 ( 0.339 -1.298 1.137) 1.759 28.602 ( 0.339 1.298 1.137) 1.759 28.636 ( 1.544 -0.622 -0.195) 1.676 28.636 ( 1.544 0.622 -0.195) 1.676 28.727 ( -1.976 -0.993 -1.092) 2.466 28.727 ( -1.976 0.993 -1.092) 2.466 32.372 ( -0.709 -0.892 1.809) 2.138 32.372 ( -0.709 0.892 1.809) 2.138 32.501 ( 0.110 -1.977 -1.235) 2.334 32.501 ( 0.110 1.977 -1.235) 2.334 35.421 ( -0.128 -1.035 0.572) 1.190 35.421 ( -0.128 1.035 0.572) 1.190 35.552 ( 0.632 -0.930 -0.848) 1.408 35.552 ( 0.632 0.930 -0.848) 1.408 88.829 ( -0.765 -1.765 0.752) 2.066 88.829 ( -0.765 1.765 0.752) 2.066 89.003 ( -4.613 -2.935 0.074) 5.467 89.003 ( -4.613 2.935 0.074) 5.467 97.634 ( -0.632 -0.347 -0.224) 0.755 97.634 ( -0.632 0.347 -0.224) 0.755 97.675 ( -1.842 -1.026 -0.049) 2.109 97.675 ( -1.842 1.026 -0.049) 2.109 98.701 ( -0.135 -0.643 0.784) 1.023 98.701 ( -0.135 0.643 0.784) 1.023 99.057 ( 2.522 -2.658 -3.269) 4.910 99.057 ( 2.522 2.658 -3.269) 4.910 99.707 ( 2.572 -1.873 0.549) 3.228 99.707 ( 2.572 1.873 0.549) 3.228 99.889 ( -3.106 -5.352 0.758) 6.234 99.889 ( -3.106 5.352 0.758) 6.234 =================== 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 10.0 299.215 255.892 281.705 0.000 -15.201 0.000 3/32400 20.0 60.235 46.678 53.056 0.000 -4.634 0.000 3/32400 30.0 26.559 19.804 23.513 0.000 -2.312 0.000 3/32400 40.0 15.145 11.082 13.572 0.000 -1.315 0.000 3/32400 50.0 9.894 7.163 8.938 0.000 -0.841 0.000 3/32400 60.0 7.079 5.092 6.427 0.000 -0.591 0.000 3/32400 70.0 5.407 3.873 4.924 0.000 -0.445 0.000 3/32400 80.0 4.333 3.095 3.953 0.000 -0.353 0.000 3/32400 90.0 3.600 2.566 3.288 0.000 -0.291 0.000 3/32400 100.0 3.074 2.189 2.810 0.000 -0.247 0.000 3/32400 110.0 2.681 1.907 2.453 0.000 -0.214 0.000 3/32400 120.0 2.378 1.691 2.176 0.000 -0.189 0.000 3/32400 130.0 2.138 1.519 1.957 0.000 -0.169 0.000 3/32400 140.0 1.943 1.380 1.778 0.000 -0.153 0.000 3/32400 150.0 1.781 1.265 1.631 0.000 -0.140 0.000 3/32400 160.0 1.645 1.168 1.506 0.000 -0.129 0.000 3/32400 170.0 1.529 1.086 1.400 0.000 -0.120 0.000 3/32400 180.0 1.429 1.015 1.308 0.000 -0.112 0.000 3/32400 190.0 1.342 0.953 1.228 0.000 -0.105 0.000 3/32400 200.0 1.265 0.898 1.157 0.000 -0.098 0.000 3/32400 210.0 1.196 0.849 1.095 0.000 -0.093 0.000 3/32400 220.0 1.135 0.806 1.039 0.000 -0.088 0.000 3/32400 230.0 1.080 0.767 0.988 0.000 -0.084 0.000 3/32400 240.0 1.030 0.731 0.942 0.000 -0.080 0.000 3/32400 250.0 0.985 0.699 0.901 0.000 -0.076 0.000 3/32400 260.0 0.944 0.670 0.863 0.000 -0.073 0.000 3/32400 270.0 0.906 0.643 0.828 0.000 -0.070 0.000 3/32400 280.0 0.871 0.618 0.796 0.000 -0.067 0.000 3/32400 290.0 0.839 0.595 0.766 0.000 -0.065 0.000 3/32400 300.0 0.809 0.574 0.739 0.000 -0.062 0.000 3/32400 310.0 0.781 0.554 0.713 0.000 -0.060 0.000 3/32400 320.0 0.755 0.536 0.690 0.000 -0.058 0.000 3/32400 330.0 0.731 0.518 0.667 0.000 -0.056 0.000 3/32400 340.0 0.708 0.502 0.646 0.000 -0.055 0.000 3/32400 350.0 0.686 0.487 0.627 0.000 -0.053 0.000 3/32400 360.0 0.666 0.473 0.609 0.000 -0.051 0.000 3/32400 370.0 0.648 0.460 0.591 0.000 -0.050 0.000 3/32400 380.0 0.630 0.447 0.575 0.000 -0.049 0.000 3/32400 390.0 0.613 0.435 0.559 0.000 -0.047 0.000 3/32400 400.0 0.597 0.424 0.545 0.000 -0.046 0.000 3/32400 410.0 0.582 0.413 0.531 0.000 -0.045 0.000 3/32400 420.0 0.567 0.403 0.518 0.000 -0.044 0.000 3/32400 430.0 0.554 0.393 0.505 0.000 -0.043 0.000 3/32400 440.0 0.541 0.384 0.493 0.000 -0.042 0.000 3/32400 450.0 0.528 0.375 0.482 0.000 -0.041 0.000 3/32400 460.0 0.516 0.366 0.471 0.000 -0.040 0.000 3/32400 470.0 0.505 0.358 0.461 0.000 -0.039 0.000 3/32400 480.0 0.494 0.351 0.451 0.000 -0.038 0.000 3/32400 490.0 0.484 0.343 0.441 0.000 -0.037 0.000 3/32400 500.0 0.474 0.336 0.432 0.000 -0.037 0.000 3/32400 510.0 0.464 0.329 0.423 0.000 -0.036 0.000 3/32400 520.0 0.455 0.323 0.415 0.000 -0.035 0.000 3/32400 530.0 0.446 0.317 0.407 0.000 -0.034 0.000 3/32400 540.0 0.438 0.311 0.399 0.000 -0.034 0.000 3/32400 550.0 0.430 0.305 0.392 0.000 -0.033 0.000 3/32400 560.0 0.422 0.299 0.385 0.000 -0.033 0.000 3/32400 570.0 0.414 0.294 0.378 0.000 -0.032 0.000 3/32400 580.0 0.407 0.289 0.371 0.000 -0.031 0.000 3/32400 590.0 0.400 0.284 0.365 0.000 -0.031 0.000 3/32400 600.0 0.393 0.279 0.358 0.000 -0.030 0.000 3/32400 610.0 0.387 0.274 0.352 0.000 -0.030 0.000 3/32400 620.0 0.380 0.270 0.347 0.000 -0.029 0.000 3/32400 630.0 0.374 0.265 0.341 0.000 -0.029 0.000 3/32400 640.0 0.368 0.261 0.336 0.000 -0.028 0.000 3/32400 650.0 0.362 0.257 0.330 0.000 -0.028 0.000 3/32400 660.0 0.357 0.253 0.325 0.000 -0.028 0.000 3/32400 670.0 0.351 0.249 0.320 0.000 -0.027 0.000 3/32400 680.0 0.346 0.246 0.315 0.000 -0.027 0.000 3/32400 690.0 0.341 0.242 0.311 0.000 -0.026 0.000 3/32400 700.0 0.336 0.239 0.306 0.000 -0.026 0.000 3/32400 710.0 0.331 0.235 0.302 0.000 -0.026 0.000 3/32400 720.0 0.327 0.232 0.298 0.000 -0.025 0.000 3/32400 730.0 0.322 0.229 0.294 0.000 -0.025 0.000 3/32400 740.0 0.318 0.225 0.290 0.000 -0.025 0.000 3/32400 750.0 0.313 0.222 0.286 0.000 -0.024 0.000 3/32400 760.0 0.309 0.219 0.282 0.000 -0.024 0.000 3/32400 770.0 0.305 0.217 0.278 0.000 -0.024 0.000 3/32400 780.0 0.301 0.214 0.274 0.000 -0.023 0.000 3/32400 790.0 0.297 0.211 0.271 0.000 -0.023 0.000 3/32400 800.0 0.294 0.208 0.268 0.000 -0.023 0.000 3/32400 810.0 0.290 0.206 0.264 0.000 -0.022 0.000 3/32400 820.0 0.286 0.203 0.261 0.000 -0.022 0.000 3/32400 830.0 0.283 0.201 0.258 0.000 -0.022 0.000 3/32400 840.0 0.280 0.198 0.255 0.000 -0.022 0.000 3/32400 850.0 0.276 0.196 0.252 0.000 -0.021 0.000 3/32400 860.0 0.273 0.194 0.249 0.000 -0.021 0.000 3/32400 870.0 0.270 0.191 0.246 0.000 -0.021 0.000 3/32400 880.0 0.267 0.189 0.243 0.000 -0.021 0.000 3/32400 890.0 0.264 0.187 0.240 0.000 -0.020 0.000 3/32400 900.0 0.261 0.185 0.238 0.000 -0.020 0.000 3/32400 910.0 0.258 0.183 0.235 0.000 -0.020 0.000 3/32400 920.0 0.255 0.181 0.232 0.000 -0.020 0.000 3/32400 930.0 0.252 0.179 0.230 0.000 -0.019 0.000 3/32400 940.0 0.250 0.177 0.227 0.000 -0.019 0.000 3/32400 950.0 0.247 0.175 0.225 0.000 -0.019 0.000 3/32400 960.0 0.244 0.173 0.223 0.000 -0.019 0.000 3/32400 970.0 0.242 0.172 0.220 0.000 -0.019 0.000 3/32400 980.0 0.239 0.170 0.218 0.000 -0.018 0.000 3/32400 990.0 0.237 0.168 0.216 0.000 -0.018 0.000 3/32400 1000.0 0.235 0.166 0.214 0.000 -0.018 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 20:56:29]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|