# Fileset [LTC-calc.log](https://mdr.nims.go.jp/filesets/ebff77bc-7087-49d6-9fee-0fa988c6cd27/download) ## Creator [Atsushi Togo](https://orcid.org/0000-0001-8393-9766) ## Rights Creative Commons Attribution 4.0 International[Creative Commons BY Attribution 4.0 International](https://creativecommons.org/licenses/by/4.0/) ## Other metadata [First-principles lattice thermal conductivity calculation for Ba2In2S5 / Pbca (61) / materials id 22841](https://mdr.nims.go.jp/datasets/e5c4a407-7928-4c40-83cd-d80a60711005) ## Fulltext ------------------------------------ calculate fc2 ------------------------------------ _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1-------------------------[time 2026-01-08 05:10:04]-------------------------Compiled with OpenMP support (max 128 threads).Running in phonopy.load mode.Python version 3.14.2Spglib version 2.6.1Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz".Unit of length: angstromSettings: Supercell: [2 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: Pbca (61)Number of symmetry operations in supercell: 16------------------------------ primitive cell ------------------------------Lattice vectors: a 11.781687300000000 0.000000000000000 0.000000000000000 b 0.000000000000000 13.070274219999998 0.000000000000000 c 0.000000000000000 0.000000000000000 12.650316950000001Atomic positions (fractional): *1 S 0.76204573404827 0.45717873214708 0.85512474812310 32.065 2 S 0.26204573404827 0.04282126785292 0.14487525187690 32.065 3 S 0.73795426595173 0.54282126785292 0.35512474812310 32.065 4 S 0.23795426595173 0.95717873214708 0.64487525187690 32.065 5 S 0.23795426595173 0.54282126785292 0.14487525187690 32.065 6 S 0.73795426595173 0.95717873214708 0.85512474812310 32.065 7 S 0.26204573404827 0.45717873214708 0.64487525187690 32.065 8 S 0.76204573404827 0.04282126785292 0.35512474812310 32.065 *9 S 0.24224027809173 0.78885431856502 0.98752124440088 32.065 10 S 0.74224027809173 0.71114568143498 0.01247875559912 32.065 11 S 0.25775972190827 0.21114568143498 0.48752124440088 32.065 12 S 0.75775972190827 0.28885431856502 0.51247875559912 32.065 13 S 0.75775972190827 0.21114568143498 0.01247875559912 32.065 14 S 0.25775972190827 0.28885431856502 0.98752124440088 32.065 15 S 0.74224027809173 0.78885431856502 0.51247875559912 32.065 16 S 0.24224027809173 0.71114568143498 0.48752124440088 32.065 *17 S 0.43201700792990 0.57290230245329 0.89214343814871 32.065 *18 S 0.00097712539055 0.27386378893744 0.71824519842848 32.065 19 S 0.93201700792990 0.92709769754671 0.10785656185129 32.065 20 S 0.56798299207010 0.07290230245329 0.60785656185129 32.065 21 S 0.56798299207010 0.42709769754671 0.10785656185129 32.065 22 S 0.06798299207010 0.07290230245329 0.89214343814871 32.065 23 S 0.93201700792990 0.57290230245329 0.60785656185129 32.065 24 S 0.43201700792990 0.92709769754671 0.39214343814871 32.065 *25 S 0.90787655517307 0.02533249688452 0.62347792080389 32.065 26 S 0.40787655517307 0.47466750311548 0.37652207919611 32.065 27 S 0.59212344482693 0.97466750311548 0.12347792080389 32.065 28 S 0.09212344482693 0.52533249688452 0.87652207919611 32.065 29 S 0.09212344482693 0.97466750311548 0.37652207919611 32.065 30 S 0.59212344482693 0.52533249688452 0.62347792080389 32.065 31 S 0.40787655517307 0.02533249688452 0.87652207919611 32.065 32 S 0.90787655517307 0.47466750311548 0.12347792080389 32.065 33 S 0.00097712539055 0.22613621106256 0.21824519842848 32.065 34 S 0.50097712539055 0.27386378893744 0.78175480157152 32.065 35 S 0.49902287460945 0.77386378893744 0.71824519842848 32.065 36 S 0.99902287460945 0.72613621106256 0.28175480157152 32.065 37 S 0.99902287460945 0.77386378893744 0.78175480157152 32.065 38 S 0.49902287460945 0.72613621106256 0.21824519842848 32.065 39 S 0.50097712539055 0.22613621106256 0.28175480157152 32.065 40 S 0.06798299207010 0.42709769754671 0.39214343814871 32.065 *41 In 0.55819055507712 0.44914152142525 0.80321998932025 114.818 42 In 0.05819055507712 0.05085847857475 0.19678001067975 114.818 43 In 0.94180944492288 0.55085847857475 0.30321998932025 114.818 44 In 0.44180944492288 0.94914152142525 0.69678001067975 114.818 45 In 0.44180944492288 0.55085847857475 0.19678001067975 114.818 46 In 0.94180944492288 0.94914152142525 0.80321998932025 114.818 47 In 0.05819055507712 0.44914152142525 0.69678001067975 114.818 48 In 0.55819055507712 0.05085847857475 0.30321998932025 114.818 *49 In 0.77338361508100 0.02737308677672 0.03508366687249 114.818 50 In 0.27338361508100 0.47262691322328 0.96491633312751 114.818 51 In 0.72661638491900 0.97262691322328 0.53508366687249 114.818 52 In 0.22661638491900 0.52737308677672 0.46491633312751 114.818 53 In 0.22661638491900 0.97262691322328 0.96491633312751 114.818 54 In 0.72661638491900 0.52737308677672 0.03508366687249 114.818 55 In 0.27338361508100 0.02737308677672 0.46491633312751 114.818 56 In 0.77338361508100 0.47262691322328 0.53508366687249 114.818 *57 Ba 0.75126126027263 0.69134505551688 0.75467898502767 137.327 58 Ba 0.25126126027263 0.80865494448312 0.24532101497233 137.327 59 Ba 0.74873873972737 0.30865494448312 0.25467898502767 137.327 60 Ba 0.24873873972737 0.19134505551688 0.74532101497233 137.327 61 Ba 0.24873873972737 0.30865494448312 0.24532101497233 137.327 62 Ba 0.74873873972737 0.19134505551688 0.75467898502767 137.327 63 Ba 0.25126126027263 0.69134505551688 0.74532101497233 137.327 64 Ba 0.75126126027263 0.80865494448312 0.25467898502767 137.327 *65 Ba 0.50583609250845 0.80764058381501 0.97166391260729 137.327 66 Ba 0.00583609250845 0.69235941618499 0.02833608739271 137.327 67 Ba 0.99416390749155 0.19235941618499 0.47166391260729 137.327 68 Ba 0.49416390749155 0.30764058381501 0.52833608739271 137.327 69 Ba 0.49416390749155 0.19235941618499 0.02833608739271 137.327 70 Ba 0.99416390749155 0.30764058381501 0.97166391260729 137.327 71 Ba 0.00583609250845 0.80764058381501 0.52833608739271 137.327 72 Ba 0.50583609250845 0.69235941618499 0.47166391260729 137.327-------------------------------- unit cell ---------------------------------Lattice vectors: a 11.781687300000000 0.000000000000000 0.000000000000000 b 0.000000000000000 13.070274219999998 0.000000000000000 c 0.000000000000000 0.000000000000000 12.650316950000001Atomic positions (fractional): *1 S 0.76204573404827 0.45717873214708 0.85512474812310 32.065 > 1 2 S 0.26204573404827 0.04282126785292 0.14487525187690 32.065 > 2 3 S 0.73795426595173 0.54282126785292 0.35512474812310 32.065 > 3 4 S 0.23795426595173 0.95717873214708 0.64487525187690 32.065 > 4 5 S 0.23795426595173 0.54282126785292 0.14487525187690 32.065 > 5 6 S 0.73795426595173 0.95717873214708 0.85512474812310 32.065 > 6 7 S 0.26204573404827 0.45717873214708 0.64487525187690 32.065 > 7 8 S 0.76204573404827 0.04282126785292 0.35512474812310 32.065 > 8 *9 S 0.24224027809173 0.78885431856502 0.98752124440088 32.065 > 9 10 S 0.74224027809173 0.71114568143498 0.01247875559912 32.065 > 10 11 S 0.25775972190827 0.21114568143498 0.48752124440088 32.065 > 11 12 S 0.75775972190827 0.28885431856502 0.51247875559912 32.065 > 12 13 S 0.75775972190827 0.21114568143498 0.01247875559912 32.065 > 13 14 S 0.25775972190827 0.28885431856502 0.98752124440088 32.065 > 14 15 S 0.74224027809173 0.78885431856502 0.51247875559912 32.065 > 15 16 S 0.24224027809173 0.71114568143498 0.48752124440088 32.065 > 16 *17 S 0.43201700792990 0.57290230245329 0.89214343814871 32.065 > 17 *18 S 0.00097712539055 0.27386378893744 0.71824519842848 32.065 > 18 19 S 0.93201700792990 0.92709769754671 0.10785656185129 32.065 > 19 20 S 0.56798299207010 0.07290230245329 0.60785656185129 32.065 > 20 21 S 0.56798299207010 0.42709769754671 0.10785656185129 32.065 > 21 22 S 0.06798299207010 0.07290230245329 0.89214343814871 32.065 > 22 23 S 0.93201700792990 0.57290230245329 0.60785656185129 32.065 > 23 24 S 0.43201700792990 0.92709769754671 0.39214343814871 32.065 > 24 *25 S 0.90787655517307 0.02533249688452 0.62347792080389 32.065 > 25 26 S 0.40787655517307 0.47466750311548 0.37652207919611 32.065 > 26 27 S 0.59212344482693 0.97466750311548 0.12347792080389 32.065 > 27 28 S 0.09212344482693 0.52533249688452 0.87652207919611 32.065 > 28 29 S 0.09212344482693 0.97466750311548 0.37652207919611 32.065 > 29 30 S 0.59212344482693 0.52533249688452 0.62347792080389 32.065 > 30 31 S 0.40787655517307 0.02533249688452 0.87652207919611 32.065 > 31 32 S 0.90787655517307 0.47466750311548 0.12347792080389 32.065 > 32 33 S 0.00097712539055 0.22613621106256 0.21824519842848 32.065 > 33 34 S 0.50097712539055 0.27386378893744 0.78175480157152 32.065 > 34 35 S 0.49902287460945 0.77386378893744 0.71824519842848 32.065 > 35 36 S 0.99902287460945 0.72613621106256 0.28175480157152 32.065 > 36 37 S 0.99902287460945 0.77386378893744 0.78175480157152 32.065 > 37 38 S 0.49902287460945 0.72613621106256 0.21824519842848 32.065 > 38 39 S 0.50097712539055 0.22613621106256 0.28175480157152 32.065 > 39 40 S 0.06798299207010 0.42709769754671 0.39214343814871 32.065 > 40 *41 In 0.55819055507712 0.44914152142525 0.80321998932025 114.818 > 41 42 In 0.05819055507712 0.05085847857475 0.19678001067975 114.818 > 42 43 In 0.94180944492288 0.55085847857475 0.30321998932025 114.818 > 43 44 In 0.44180944492288 0.94914152142525 0.69678001067975 114.818 > 44 45 In 0.44180944492288 0.55085847857475 0.19678001067975 114.818 > 45 46 In 0.94180944492288 0.94914152142525 0.80321998932025 114.818 > 46 47 In 0.05819055507712 0.44914152142525 0.69678001067975 114.818 > 47 48 In 0.55819055507712 0.05085847857475 0.30321998932025 114.818 > 48 *49 In 0.77338361508100 0.02737308677672 0.03508366687249 114.818 > 49 50 In 0.27338361508100 0.47262691322328 0.96491633312751 114.818 > 50 51 In 0.72661638491900 0.97262691322328 0.53508366687249 114.818 > 51 52 In 0.22661638491900 0.52737308677672 0.46491633312751 114.818 > 52 53 In 0.22661638491900 0.97262691322328 0.96491633312751 114.818 > 53 54 In 0.72661638491900 0.52737308677672 0.03508366687249 114.818 > 54 55 In 0.27338361508100 0.02737308677672 0.46491633312751 114.818 > 55 56 In 0.77338361508100 0.47262691322328 0.53508366687249 114.818 > 56 *57 Ba 0.75126126027263 0.69134505551688 0.75467898502767 137.327 > 57 58 Ba 0.25126126027263 0.80865494448312 0.24532101497233 137.327 > 58 59 Ba 0.74873873972737 0.30865494448312 0.25467898502767 137.327 > 59 60 Ba 0.24873873972737 0.19134505551688 0.74532101497233 137.327 > 60 61 Ba 0.24873873972737 0.30865494448312 0.24532101497233 137.327 > 61 62 Ba 0.74873873972737 0.19134505551688 0.75467898502767 137.327 > 62 63 Ba 0.25126126027263 0.69134505551688 0.74532101497233 137.327 > 63 64 Ba 0.75126126027263 0.80865494448312 0.25467898502767 137.327 > 64 *65 Ba 0.50583609250845 0.80764058381501 0.97166391260729 137.327 > 65 66 Ba 0.00583609250845 0.69235941618499 0.02833608739271 137.327 > 66 67 Ba 0.99416390749155 0.19235941618499 0.47166391260729 137.327 > 67 68 Ba 0.49416390749155 0.30764058381501 0.52833608739271 137.327 > 68 69 Ba 0.49416390749155 0.19235941618499 0.02833608739271 137.327 > 69 70 Ba 0.99416390749155 0.30764058381501 0.97166391260729 137.327 > 70 71 Ba 0.00583609250845 0.80764058381501 0.52833608739271 137.327 > 71 72 Ba 0.50583609250845 0.69235941618499 0.47166391260729 137.327 > 72-------------------------------- super cell --------------------------------Lattice vectors: a 23.563374600000000 0.000000000000000 0.000000000000000 b 0.000000000000000 13.070274219999998 0.000000000000000 c 0.000000000000000 0.000000000000000 12.650316950000001Atomic positions (fractional): *1 S 0.38102286702413 0.45717873214708 0.85512474812310 32.065 > 1 2 S 0.88102286702413 0.45717873214708 0.85512474812310 32.065 > 1 3 S 0.13102286702413 0.04282126785292 0.14487525187690 32.065 > 2 4 S 0.63102286702413 0.04282126785292 0.14487525187690 32.065 > 2 5 S 0.36897713297587 0.54282126785292 0.35512474812310 32.065 > 3 6 S 0.86897713297587 0.54282126785292 0.35512474812310 32.065 > 3 7 S 0.11897713297587 0.95717873214708 0.64487525187690 32.065 > 4 8 S 0.61897713297587 0.95717873214708 0.64487525187690 32.065 > 4 9 S 0.11897713297587 0.54282126785292 0.14487525187690 32.065 > 5 10 S 0.61897713297587 0.54282126785292 0.14487525187690 32.065 > 5 11 S 0.36897713297587 0.95717873214708 0.85512474812310 32.065 > 6 12 S 0.86897713297587 0.95717873214708 0.85512474812310 32.065 > 6 13 S 0.13102286702413 0.45717873214708 0.64487525187690 32.065 > 7 14 S 0.63102286702413 0.45717873214708 0.64487525187690 32.065 > 7 15 S 0.38102286702413 0.04282126785292 0.35512474812310 32.065 > 8 16 S 0.88102286702413 0.04282126785292 0.35512474812310 32.065 > 8 *17 S 0.12112013904587 0.78885431856502 0.98752124440088 32.065 > 9 18 S 0.62112013904587 0.78885431856502 0.98752124440088 32.065 > 9 19 S 0.37112013904587 0.71114568143498 0.01247875559912 32.065 > 10 20 S 0.87112013904587 0.71114568143498 0.01247875559912 32.065 > 10 21 S 0.12887986095413 0.21114568143498 0.48752124440088 32.065 > 11 22 S 0.62887986095413 0.21114568143498 0.48752124440088 32.065 > 11 23 S 0.37887986095413 0.28885431856502 0.51247875559912 32.065 > 12 24 S 0.87887986095413 0.28885431856502 0.51247875559912 32.065 > 12 25 S 0.37887986095413 0.21114568143498 0.01247875559912 32.065 > 13 26 S 0.87887986095413 0.21114568143498 0.01247875559912 32.065 > 13 27 S 0.12887986095413 0.28885431856502 0.98752124440088 32.065 > 14 28 S 0.62887986095413 0.28885431856502 0.98752124440088 32.065 > 14 29 S 0.37112013904587 0.78885431856502 0.51247875559912 32.065 > 15 30 S 0.87112013904587 0.78885431856502 0.51247875559912 32.065 > 15 31 S 0.12112013904587 0.71114568143498 0.48752124440088 32.065 > 16 32 S 0.62112013904587 0.71114568143498 0.48752124440088 32.065 > 16 *33 S 0.21600850396495 0.57290230245329 0.89214343814871 32.065 > 17 34 S 0.71600850396495 0.57290230245329 0.89214343814871 32.065 > 17 *35 S 0.00048856269527 0.27386378893744 0.71824519842848 32.065 > 18 36 S 0.50048856269527 0.27386378893744 0.71824519842848 32.065 > 18 37 S 0.46600850396495 0.92709769754671 0.10785656185129 32.065 > 19 38 S 0.96600850396495 0.92709769754671 0.10785656185129 32.065 > 19 39 S 0.28399149603505 0.07290230245329 0.60785656185129 32.065 > 20 40 S 0.78399149603505 0.07290230245329 0.60785656185129 32.065 > 20 41 S 0.28399149603505 0.42709769754671 0.10785656185129 32.065 > 21 42 S 0.78399149603505 0.42709769754671 0.10785656185129 32.065 > 21 43 S 0.03399149603505 0.07290230245329 0.89214343814871 32.065 > 22 44 S 0.53399149603505 0.07290230245329 0.89214343814871 32.065 > 22 45 S 0.46600850396495 0.57290230245329 0.60785656185129 32.065 > 23 46 S 0.96600850396495 0.57290230245329 0.60785656185129 32.065 > 23 47 S 0.21600850396495 0.92709769754671 0.39214343814871 32.065 > 24 48 S 0.71600850396495 0.92709769754671 0.39214343814871 32.065 > 24 *49 S 0.45393827758653 0.02533249688452 0.62347792080389 32.065 > 25 50 S 0.95393827758654 0.02533249688452 0.62347792080389 32.065 > 25 51 S 0.20393827758653 0.47466750311548 0.37652207919611 32.065 > 26 52 S 0.70393827758654 0.47466750311548 0.37652207919611 32.065 > 26 53 S 0.29606172241347 0.97466750311548 0.12347792080389 32.065 > 27 54 S 0.79606172241346 0.97466750311548 0.12347792080389 32.065 > 27 55 S 0.04606172241346 0.52533249688452 0.87652207919611 32.065 > 28 56 S 0.54606172241346 0.52533249688452 0.87652207919611 32.065 > 28 57 S 0.04606172241346 0.97466750311548 0.37652207919611 32.065 > 29 58 S 0.54606172241346 0.97466750311548 0.37652207919611 32.065 > 29 59 S 0.29606172241347 0.52533249688452 0.62347792080389 32.065 > 30 60 S 0.79606172241346 0.52533249688452 0.62347792080389 32.065 > 30 61 S 0.20393827758653 0.02533249688452 0.87652207919611 32.065 > 31 62 S 0.70393827758654 0.02533249688452 0.87652207919611 32.065 > 31 63 S 0.45393827758653 0.47466750311548 0.12347792080389 32.065 > 32 64 S 0.95393827758654 0.47466750311548 0.12347792080389 32.065 > 32 65 S 0.00048856269527 0.22613621106256 0.21824519842848 32.065 > 33 66 S 0.50048856269527 0.22613621106256 0.21824519842848 32.065 > 33 67 S 0.25048856269527 0.27386378893744 0.78175480157152 32.065 > 34 68 S 0.75048856269527 0.27386378893744 0.78175480157152 32.065 > 34 69 S 0.24951143730473 0.77386378893744 0.71824519842848 32.065 > 35 70 S 0.74951143730473 0.77386378893744 0.71824519842848 32.065 > 35 71 S 0.49951143730473 0.72613621106256 0.28175480157152 32.065 > 36 72 S 0.99951143730473 0.72613621106256 0.28175480157152 32.065 > 36 73 S 0.49951143730473 0.77386378893744 0.78175480157152 32.065 > 37 74 S 0.99951143730473 0.77386378893744 0.78175480157152 32.065 > 37 75 S 0.24951143730473 0.72613621106256 0.21824519842848 32.065 > 38 76 S 0.74951143730473 0.72613621106256 0.21824519842848 32.065 > 38 77 S 0.25048856269527 0.22613621106256 0.28175480157152 32.065 > 39 78 S 0.75048856269527 0.22613621106256 0.28175480157152 32.065 > 39 79 S 0.03399149603505 0.42709769754671 0.39214343814871 32.065 > 40 80 S 0.53399149603505 0.42709769754671 0.39214343814871 32.065 > 40 *81 In 0.27909527753856 0.44914152142525 0.80321998932025 114.818 > 41 82 In 0.77909527753856 0.44914152142525 0.80321998932025 114.818 > 41 83 In 0.02909527753856 0.05085847857475 0.19678001067975 114.818 > 42 84 In 0.52909527753856 0.05085847857475 0.19678001067975 114.818 > 42 85 In 0.47090472246144 0.55085847857475 0.30321998932025 114.818 > 43 86 In 0.97090472246144 0.55085847857475 0.30321998932025 114.818 > 43 87 In 0.22090472246144 0.94914152142525 0.69678001067975 114.818 > 44 88 In 0.72090472246144 0.94914152142525 0.69678001067975 114.818 > 44 89 In 0.22090472246144 0.55085847857475 0.19678001067975 114.818 > 45 90 In 0.72090472246144 0.55085847857475 0.19678001067975 114.818 > 45 91 In 0.47090472246144 0.94914152142525 0.80321998932025 114.818 > 46 92 In 0.97090472246144 0.94914152142525 0.80321998932025 114.818 > 46 93 In 0.02909527753856 0.44914152142525 0.69678001067975 114.818 > 47 94 In 0.52909527753856 0.44914152142525 0.69678001067975 114.818 > 47 95 In 0.27909527753856 0.05085847857475 0.30321998932025 114.818 > 48 96 In 0.77909527753856 0.05085847857475 0.30321998932025 114.818 > 48 *97 In 0.38669180754050 0.02737308677672 0.03508366687249 114.818 > 49 98 In 0.88669180754050 0.02737308677672 0.03508366687249 114.818 > 49 99 In 0.13669180754050 0.47262691322328 0.96491633312751 114.818 > 50 100 In 0.63669180754050 0.47262691322328 0.96491633312751 114.818 > 50 101 In 0.36330819245950 0.97262691322328 0.53508366687249 114.818 > 51 102 In 0.86330819245950 0.97262691322328 0.53508366687249 114.818 > 51 103 In 0.11330819245950 0.52737308677672 0.46491633312751 114.818 > 52 104 In 0.61330819245950 0.52737308677672 0.46491633312751 114.818 > 52 105 In 0.11330819245950 0.97262691322328 0.96491633312751 114.818 > 53 106 In 0.61330819245950 0.97262691322328 0.96491633312751 114.818 > 53 107 In 0.36330819245950 0.52737308677672 0.03508366687249 114.818 > 54 108 In 0.86330819245950 0.52737308677672 0.03508366687249 114.818 > 54 109 In 0.13669180754050 0.02737308677672 0.46491633312751 114.818 > 55 110 In 0.63669180754050 0.02737308677672 0.46491633312751 114.818 > 55 111 In 0.38669180754050 0.47262691322328 0.53508366687249 114.818 > 56 112 In 0.88669180754050 0.47262691322328 0.53508366687249 114.818 > 56 *113 Ba 0.37563063013631 0.69134505551688 0.75467898502767 137.327 > 57 114 Ba 0.87563063013631 0.69134505551688 0.75467898502767 137.327 > 57 115 Ba 0.12563063013631 0.80865494448312 0.24532101497233 137.327 > 58 116 Ba 0.62563063013631 0.80865494448312 0.24532101497233 137.327 > 58 117 Ba 0.37436936986369 0.30865494448312 0.25467898502767 137.327 > 59 118 Ba 0.87436936986369 0.30865494448312 0.25467898502767 137.327 > 59 119 Ba 0.12436936986369 0.19134505551688 0.74532101497233 137.327 > 60 120 Ba 0.62436936986369 0.19134505551688 0.74532101497233 137.327 > 60 121 Ba 0.12436936986369 0.30865494448312 0.24532101497233 137.327 > 61 122 Ba 0.62436936986369 0.30865494448312 0.24532101497233 137.327 > 61 123 Ba 0.37436936986369 0.19134505551688 0.75467898502767 137.327 > 62 124 Ba 0.87436936986369 0.19134505551688 0.75467898502767 137.327 > 62 125 Ba 0.12563063013631 0.69134505551688 0.74532101497233 137.327 > 63 126 Ba 0.62563063013631 0.69134505551688 0.74532101497233 137.327 > 63 127 Ba 0.37563063013631 0.80865494448312 0.25467898502767 137.327 > 64 128 Ba 0.87563063013631 0.80865494448312 0.25467898502767 137.327 > 64 *129 Ba 0.25291804625423 0.80764058381501 0.97166391260729 137.327 > 65 130 Ba 0.75291804625423 0.80764058381501 0.97166391260729 137.327 > 65 131 Ba 0.00291804625423 0.69235941618499 0.02833608739271 137.327 > 66 132 Ba 0.50291804625423 0.69235941618499 0.02833608739271 137.327 > 66 133 Ba 0.49708195374577 0.19235941618499 0.47166391260729 137.327 > 67 134 Ba 0.99708195374577 0.19235941618499 0.47166391260729 137.327 > 67 135 Ba 0.24708195374577 0.30764058381501 0.52833608739271 137.327 > 68 136 Ba 0.74708195374577 0.30764058381501 0.52833608739271 137.327 > 68 137 Ba 0.24708195374577 0.19235941618499 0.02833608739271 137.327 > 69 138 Ba 0.74708195374577 0.19235941618499 0.02833608739271 137.327 > 69 139 Ba 0.49708195374577 0.30764058381501 0.97166391260729 137.327 > 70 140 Ba 0.99708195374577 0.30764058381501 0.97166391260729 137.327 > 70 141 Ba 0.00291804625423 0.80764058381501 0.52833608739271 137.327 > 71 142 Ba 0.50291804625423 0.80764058381501 0.52833608739271 137.327 > 71 143 Ba 0.25291804625423 0.69235941618499 0.47166391260729 137.327 > 72 144 Ba 0.75291804625423 0.69235941618499 0.47166391260729 137.327 > 72----------------------------------------------------------------------------NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz".--------------------------- Dielectric constant ---------------------------- 5.8246358 0.0000000 0.0000000 0.0000000 5.8510156 0.0000000 0.0000000 0.0000000 5.7379035-------------------------- Born effective charges -------------------------- 1 S -2.1078993 0.0352511 -0.2790731 0.0229185 -1.9200345 -0.2317430 -0.5390123 -0.2414597 -2.4011630 2 S -2.1078993 -0.0352511 0.2790731 -0.0229185 -1.9200345 -0.2317430 0.5390123 -0.2414597 -2.4011630 3 S -2.1078993 0.0352511 0.2790731 0.0229185 -1.9200345 0.2317430 0.5390123 0.2414597 -2.4011630 4 S -2.1078993 -0.0352511 -0.2790731 -0.0229185 -1.9200345 0.2317430 -0.5390123 0.2414597 -2.4011630 5 S -2.1078993 0.0352511 -0.2790731 0.0229185 -1.9200345 -0.2317430 -0.5390123 -0.2414597 -2.4011630 6 S -2.1078993 -0.0352511 0.2790731 -0.0229185 -1.9200345 -0.2317430 0.5390123 -0.2414597 -2.4011630 7 S -2.1078993 0.0352511 0.2790731 0.0229185 -1.9200345 0.2317430 0.5390123 0.2414597 -2.4011630 8 S -2.1078993 -0.0352511 -0.2790731 -0.0229185 -1.9200345 0.2317430 -0.5390123 0.2414597 -2.4011630 9 S -2.1960722 -0.1177169 0.1976906 -0.0585028 -2.2849284 -0.0480603 0.1169938 -0.1489489 -1.9985395 10 S -2.1960722 0.1177169 -0.1976906 0.0585028 -2.2849284 -0.0480603 -0.1169938 -0.1489489 -1.9985395 11 S -2.1960722 -0.1177169 -0.1976906 -0.0585028 -2.2849284 0.0480603 -0.1169938 0.1489489 -1.9985395 12 S -2.1960722 0.1177169 0.1976906 0.0585028 -2.2849284 0.0480603 0.1169938 0.1489489 -1.9985395 13 S -2.1960722 -0.1177169 0.1976906 -0.0585028 -2.2849284 -0.0480603 0.1169938 -0.1489489 -1.9985395 14 S -2.1960722 0.1177169 -0.1976906 0.0585028 -2.2849284 -0.0480603 -0.1169938 -0.1489489 -1.9985395 15 S -2.1960722 -0.1177169 -0.1976906 -0.0585028 -2.2849284 0.0480603 -0.1169938 0.1489489 -1.9985395 16 S -2.1960722 0.1177169 0.1976906 0.0585028 -2.2849284 0.0480603 0.1169938 0.1489489 -1.9985395 17 S -2.5248507 0.0451465 0.3617051 0.0583319 -2.0276081 -0.1251134 0.3857942 -0.1272551 -1.6852504 18 S -2.1255354 -0.1784213 0.1063041 -0.2209374 -2.1735160 0.0688584 0.2303822 -0.0070581 -2.0703442 19 S -2.5248507 -0.0451465 -0.3617051 -0.0583319 -2.0276081 -0.1251134 -0.3857942 -0.1272551 -1.6852504 20 S -2.5248507 -0.0451465 0.3617051 -0.0583319 -2.0276081 0.1251134 0.3857942 0.1272551 -1.6852504 21 S -2.5248507 0.0451465 0.3617051 0.0583319 -2.0276081 -0.1251134 0.3857942 -0.1272551 -1.6852504 22 S -2.5248507 -0.0451465 -0.3617051 -0.0583319 -2.0276081 -0.1251134 -0.3857942 -0.1272551 -1.6852504 23 S -2.5248507 0.0451465 -0.3617051 0.0583319 -2.0276081 0.1251134 -0.3857942 0.1272551 -1.6852504 24 S -2.5248507 -0.0451465 0.3617051 -0.0583319 -2.0276081 0.1251134 0.3857942 0.1272551 -1.6852504 25 S -2.2014977 0.0520504 -0.3819732 -0.0243833 -2.0187189 0.2097204 -0.3149892 0.2647223 -2.7017608 26 S -2.2014977 -0.0520504 0.3819732 0.0243833 -2.0187189 0.2097204 0.3149892 0.2647223 -2.7017608 27 S -2.2014977 0.0520504 0.3819732 -0.0243833 -2.0187189 -0.2097204 0.3149892 -0.2647223 -2.7017608 28 S -2.2014977 -0.0520504 -0.3819732 0.0243833 -2.0187189 -0.2097204 -0.3149892 -0.2647223 -2.7017608 29 S -2.2014977 0.0520504 -0.3819732 -0.0243833 -2.0187189 0.2097204 -0.3149892 0.2647223 -2.7017608 30 S -2.2014977 -0.0520504 0.3819732 0.0243833 -2.0187189 0.2097204 0.3149892 0.2647223 -2.7017608 31 S -2.2014977 0.0520504 0.3819732 -0.0243833 -2.0187189 -0.2097204 0.3149892 -0.2647223 -2.7017608 32 S -2.2014977 -0.0520504 -0.3819732 0.0243833 -2.0187189 -0.2097204 -0.3149892 -0.2647223 -2.7017608 33 S -2.1255354 0.1784213 0.1063041 0.2209374 -2.1735160 -0.0688584 0.2303822 0.0070581 -2.0703442 34 S -2.1255354 -0.1784213 -0.1063041 -0.2209374 -2.1735160 -0.0688584 -0.2303822 0.0070581 -2.0703442 35 S -2.1255354 0.1784213 -0.1063041 0.2209374 -2.1735160 0.0688584 -0.2303822 -0.0070581 -2.0703442 36 S -2.1255354 -0.1784213 0.1063041 -0.2209374 -2.1735160 0.0688584 0.2303822 -0.0070581 -2.0703442 37 S -2.1255354 0.1784213 0.1063041 0.2209374 -2.1735160 -0.0688584 0.2303822 0.0070581 -2.0703442 38 S -2.1255354 -0.1784213 -0.1063041 -0.2209374 -2.1735160 -0.0688584 -0.2303822 0.0070581 -2.0703442 39 S -2.1255354 0.1784213 -0.1063041 0.2209374 -2.1735160 0.0688584 -0.2303822 -0.0070581 -2.0703442 40 S -2.5248507 0.0451465 -0.3617051 0.0583319 -2.0276081 0.1251134 -0.3857942 0.1272551 -1.6852504 41 In 2.8066336 -0.1212765 -0.4698735 0.1439316 2.5117308 0.0136405 0.3943264 0.0612191 2.8354543 42 In 2.8066336 0.1212765 0.4698735 -0.1439316 2.5117308 0.0136405 -0.3943264 0.0612191 2.8354543 43 In 2.8066336 -0.1212765 0.4698735 0.1439316 2.5117308 -0.0136405 -0.3943264 -0.0612191 2.8354543 44 In 2.8066336 0.1212765 -0.4698735 -0.1439316 2.5117308 -0.0136405 0.3943264 -0.0612191 2.8354543 45 In 2.8066336 -0.1212765 -0.4698735 0.1439316 2.5117308 0.0136405 0.3943264 0.0612191 2.8354543 46 In 2.8066336 0.1212765 0.4698735 -0.1439316 2.5117308 0.0136405 -0.3943264 0.0612191 2.8354543 47 In 2.8066336 -0.1212765 0.4698735 0.1439316 2.5117308 -0.0136405 -0.3943264 -0.0612191 2.8354543 48 In 2.8066336 0.1212765 -0.4698735 -0.1439316 2.5117308 -0.0136405 0.3943264 -0.0612191 2.8354543 49 In 2.7852591 -0.3649330 -0.3195485 -0.0684048 2.5090464 0.0262323 -0.1092653 -0.1693841 2.7080671 50 In 2.7852591 0.3649330 0.3195485 0.0684048 2.5090464 0.0262323 0.1092653 -0.1693841 2.7080671 51 In 2.7852591 -0.3649330 0.3195485 -0.0684048 2.5090464 -0.0262323 0.1092653 0.1693841 2.7080671 52 In 2.7852591 0.3649330 -0.3195485 0.0684048 2.5090464 -0.0262323 -0.1092653 0.1693841 2.7080671 53 In 2.7852591 -0.3649330 -0.3195485 -0.0684048 2.5090464 0.0262323 -0.1092653 -0.1693841 2.7080671 54 In 2.7852591 0.3649330 0.3195485 0.0684048 2.5090464 0.0262323 0.1092653 -0.1693841 2.7080671 55 In 2.7852591 -0.3649330 0.3195485 -0.0684048 2.5090464 -0.0262323 0.1092653 0.1693841 2.7080671 56 In 2.7852591 0.3649330 -0.3195485 0.0684048 2.5090464 -0.0262323 -0.1092653 0.1693841 2.7080671 57 Ba 2.6777465 0.1588165 -0.0047305 -0.0059731 2.7315363 -0.0841459 0.0514852 0.0288035 2.6075466 58 Ba 2.6777465 -0.1588165 0.0047305 0.0059731 2.7315363 -0.0841459 -0.0514852 0.0288035 2.6075466 59 Ba 2.6777465 0.1588165 0.0047305 -0.0059731 2.7315363 0.0841459 -0.0514852 -0.0288035 2.6075466 60 Ba 2.6777465 -0.1588165 -0.0047305 0.0059731 2.7315363 0.0841459 0.0514852 -0.0288035 2.6075466 61 Ba 2.6777465 0.1588165 -0.0047305 -0.0059731 2.7315363 -0.0841459 0.0514852 0.0288035 2.6075466 62 Ba 2.6777465 -0.1588165 0.0047305 0.0059731 2.7315363 -0.0841459 -0.0514852 0.0288035 2.6075466 63 Ba 2.6777465 0.1588165 0.0047305 -0.0059731 2.7315363 0.0841459 -0.0514852 -0.0288035 2.6075466 64 Ba 2.6777465 -0.1588165 -0.0047305 0.0059731 2.7315363 0.0841459 0.0514852 -0.0288035 2.6075466 65 Ba 2.8862160 0.0845467 0.2741894 -0.2298185 2.6724924 -0.0964670 0.4828050 0.0852103 2.7059899 66 Ba 2.8862160 -0.0845467 -0.2741894 0.2298185 2.6724924 -0.0964670 -0.4828050 0.0852103 2.7059899 67 Ba 2.8862160 0.0845467 -0.2741894 -0.2298185 2.6724924 0.0964670 -0.4828050 -0.0852103 2.7059899 68 Ba 2.8862160 -0.0845467 0.2741894 0.2298185 2.6724924 0.0964670 0.4828050 -0.0852103 2.7059899 69 Ba 2.8862160 0.0845467 0.2741894 -0.2298185 2.6724924 -0.0964670 0.4828050 0.0852103 2.7059899 70 Ba 2.8862160 -0.0845467 -0.2741894 0.2298185 2.6724924 -0.0964670 -0.4828050 0.0852103 2.7059899 71 Ba 2.8862160 0.0845467 -0.2741894 -0.2298185 2.6724924 0.0964670 -0.4828050 -0.0852103 2.7059899 72 Ba 2.8862160 -0.0845467 0.2741894 0.2298185 2.6724924 0.0964670 0.4828050 -0.0852103 2.7059899----------------------------------------------------------------------------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: 432/432Permutation basis: 46872/46872Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 5994Number of blocks in projector: 5994Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 6--- Eigsh_solver_block: 1 / 6 ---Block_size: 1296Use submatrix version of eigh solver.(1) Block: 500 / 1296 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found.(1) 482 eigenvectors found.(1) Block: 1000 / 1296 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found.(1) 485 eigenvectors found.(1) Block: 1296 / 1296(1) 280 eigenvectors found.(1) Complementary block size: 49(1) Compute compressed projector.(1) Use standard solver.(1) 31 eigenvectors found.--- Eigsh_solver_block: 2 / 6 ---Block_size: 1296Use submatrix version of eigh solver.(1) Block: 500 / 1296 (2) Block: 250 / 500 (2) 233 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 35 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found.(1) 482 eigenvectors found.(1) Block: 1000 / 1296 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 235 eigenvectors found. (2) Complementary block size: 31 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found.(1) 483 eigenvectors found.(1) Block: 1296 / 1296(1) 278 eigenvectors found.(1) Complementary block size: 53(1) Compute compressed projector.(1) Use standard solver.(1) 35 eigenvectors found.--- Eigsh_solver_block: 3 / 6 ---Block_size: 1296Use submatrix version of eigh solver.(1) Block: 500 / 1296 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found.(1) 482 eigenvectors found.(1) Block: 1000 / 1296 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 240 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 10 eigenvectors found.(1) 484 eigenvectors found.(1) Block: 1296 / 1296(1) 278 eigenvectors found.(1) Complementary block size: 52(1) Compute compressed projector.(1) Use standard solver.(1) 34 eigenvectors found.--- Eigsh_solver_block: 4 / 6 ---Block_size: 702Use submatrix version of eigh solver.(1) Block: 500 / 702 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 242 eigenvectors found. (2) Complementary block size: 17 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found.(1) 491 eigenvectors found.(1) Block: 702 / 702(1) 193 eigenvectors found.(1) Complementary block size: 18(1) Compute compressed projector.(1) Use standard solver.(1) 9 eigenvectors found.--- Eigsh_solver_block: 5 / 6 ---Block_size: 702Use submatrix version of eigh solver.(1) Block: 500 / 702 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 242 eigenvectors found. (2) Complementary block size: 17 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found.(1) 491 eigenvectors found.(1) Block: 702 / 702(1) 193 eigenvectors found.(1) Complementary block size: 18(1) Compute compressed projector.(1) Use standard solver.(1) 9 eigenvectors found.--- Eigsh_solver_block: 6 / 6 ---Block_size: 702Use submatrix version of eigh solver.(1) Block: 500 / 702 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 242 eigenvectors found. (2) Complementary block size: 17 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found.(1) 491 eigenvectors found.(1) Block: 702 / 702(1) 193 eigenvectors found.(1) Complementary block size: 18(1) Compute compressed projector.(1) Use standard solver.(1) 9 eigenvectors found.Tree of FC basis block matrices:- (5994, 5913), data: False|-- (702, 693), data: False |-- (702, 9), data: (702, 18) @ (18, 9) |-- (202, 193), data: True |-- (500, 491), data: False |-- (500, 8), data: (500, 17) @ (17, 8) |-- (250, 242), data: True |-- (250, 241), data: True|-- (702, 693), data: False |-- (702, 9), data: (702, 18) @ (18, 9) |-- (202, 193), data: True |-- (500, 491), data: False |-- (500, 8), data: (500, 17) @ (17, 8) |-- (250, 242), data: True |-- (250, 241), data: True|-- (702, 693), data: False |-- (702, 9), data: (702, 18) @ (18, 9) |-- (202, 193), data: True |-- (500, 491), data: False |-- (500, 8), data: (500, 17) @ (17, 8) |-- (250, 242), data: True |-- (250, 241), data: True|-- (1296, 1278), data: False |-- (1296, 34), data: (1296, 52) @ (52, 34) |-- (296, 278), data: True |-- (500, 484), data: False |-- (500, 10), data: (500, 26) @ (26, 10) |-- (250, 240), data: True |-- (250, 234), data: True |-- (500, 482), data: False |-- (500, 18), data: (500, 36) @ (36, 18) |-- (250, 232), data: True |-- (250, 232), data: True|-- (1296, 1278), data: False |-- (1296, 35), data: (1296, 53) @ (53, 35) |-- (296, 278), data: True |-- (500, 483), data: False |-- (500, 14), data: (500, 31) @ (31, 14) |-- (250, 235), data: True |-- (250, 234), data: True |-- (500, 482), data: False |-- (500, 17), data: (500, 35) @ (35, 17) |-- (250, 232), data: True |-- (250, 233), data: True|-- (1296, 1278), data: False |-- (1296, 31), data: (1296, 49) @ (49, 31) |-- (296, 280), data: True |-- (500, 485), data: False |-- (500, 11), data: (500, 26) @ (26, 11) |-- (250, 236), data: True |-- (250, 238), data: True |-- (500, 482), data: False |-- (500, 18), data: (500, 36) @ (36, 18) |-- (250, 232), data: True |-- (250, 232), data: True-----Solver_atoms: 1 -- 144 / 144Time (Solver_compr_matrix_reshape): 0.004Solver_block: 100 / 1120 - Time: 4.085Solver_block: 200 / 1120 - Time: 3.652Solver_block: 300 / 1120 - Time: 3.869Solver_block: 400 / 1120 - Time: 3.660Solver_block: 500 / 1120 - Time: 3.396Solver_block: 600 / 1120 - Time: 3.820Solver_block: 700 / 1120 - Time: 3.019Solver_block: 800 / 1120 - Time: 2.703Solver_block: 900 / 1120 - Time: 1.943Solver_block: 1000 / 1120 - Time: 1.828Solver_block: 1100 / 1120 - Time: 1.941Solver_block: 1120 / 1120 - Time: 0.607Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 35.637--------------------------------- Symfc end --------------------------------Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 432/432Permutation basis: 46872/46872Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 5994Number of blocks in projector: 5994Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 6--- Eigsh_solver_block: 1 / 6 ---Block_size: 1296Use submatrix version of eigh solver.(1) Block: 500 / 1296 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found.(1) 482 eigenvectors found.(1) Block: 1000 / 1296 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found.(1) 485 eigenvectors found.(1) Block: 1296 / 1296(1) 280 eigenvectors found.(1) Complementary block size: 49(1) Compute compressed projector.(1) Use standard solver.(1) 31 eigenvectors found.--- Eigsh_solver_block: 2 / 6 ---Block_size: 1296Use submatrix version of eigh solver.(1) Block: 500 / 1296 (2) Block: 250 / 500 (2) 233 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 35 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found.(1) 482 eigenvectors found.(1) Block: 1000 / 1296 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 235 eigenvectors found. (2) Complementary block size: 31 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found.(1) 483 eigenvectors found.(1) Block: 1296 / 1296(1) 278 eigenvectors found.(1) Complementary block size: 53(1) Compute compressed projector.(1) Use standard solver.(1) 35 eigenvectors found.--- Eigsh_solver_block: 3 / 6 ---Block_size: 1296Use submatrix version of eigh solver.(1) Block: 500 / 1296 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found.(1) 482 eigenvectors found.(1) Block: 1000 / 1296 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 240 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 10 eigenvectors found.(1) 484 eigenvectors found.(1) Block: 1296 / 1296(1) 278 eigenvectors found.(1) Complementary block size: 52(1) Compute compressed projector.(1) Use standard solver.(1) 34 eigenvectors found.--- Eigsh_solver_block: 4 / 6 ---Block_size: 702Use submatrix version of eigh solver.(1) Block: 500 / 702 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 242 eigenvectors found. (2) Complementary block size: 17 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found.(1) 491 eigenvectors found.(1) Block: 702 / 702(1) 193 eigenvectors found.(1) Complementary block size: 18(1) Compute compressed projector.(1) Use standard solver.(1) 9 eigenvectors found.--- Eigsh_solver_block: 5 / 6 ---Block_size: 702Use submatrix version of eigh solver.(1) Block: 500 / 702 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 242 eigenvectors found. (2) Complementary block size: 17 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found.(1) 491 eigenvectors found.(1) Block: 702 / 702(1) 193 eigenvectors found.(1) Complementary block size: 18(1) Compute compressed projector.(1) Use standard solver.(1) 9 eigenvectors found.--- Eigsh_solver_block: 6 / 6 ---Block_size: 702Use submatrix version of eigh solver.(1) Block: 500 / 702 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 242 eigenvectors found. (2) Complementary block size: 17 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found.(1) 491 eigenvectors found.(1) Block: 702 / 702(1) 193 eigenvectors found.(1) Complementary block size: 18(1) Compute compressed projector.(1) Use standard solver.(1) 9 eigenvectors found.Tree of FC basis block matrices:- (5994, 5913), data: False|-- (702, 693), data: False |-- (702, 9), data: (702, 18) @ (18, 9) |-- (202, 193), data: True |-- (500, 491), data: False |-- (500, 8), data: (500, 17) @ (17, 8) |-- (250, 242), data: True |-- (250, 241), data: True|-- (702, 693), data: False |-- (702, 9), data: (702, 18) @ (18, 9) |-- (202, 193), data: True |-- (500, 491), data: False |-- (500, 8), data: (500, 17) @ (17, 8) |-- (250, 242), data: True |-- (250, 241), data: True|-- (702, 693), data: False |-- (702, 9), data: (702, 18) @ (18, 9) |-- (202, 193), data: True |-- (500, 491), data: False |-- (500, 8), data: (500, 17) @ (17, 8) |-- (250, 242), data: True |-- (250, 241), data: True|-- (1296, 1278), data: False |-- (1296, 34), data: (1296, 52) @ (52, 34) |-- (296, 278), data: True |-- (500, 484), data: False |-- (500, 10), data: (500, 26) @ (26, 10) |-- (250, 240), data: True |-- (250, 234), data: True |-- (500, 482), data: False |-- (500, 18), data: (500, 36) @ (36, 18) |-- (250, 232), data: True |-- (250, 232), data: True|-- (1296, 1278), data: False |-- (1296, 35), data: (1296, 53) @ (53, 35) |-- (296, 278), data: True |-- (500, 483), data: False |-- (500, 14), data: (500, 31) @ (31, 14) |-- (250, 235), data: True |-- (250, 234), data: True |-- (500, 482), data: False |-- (500, 17), data: (500, 35) @ (35, 17) |-- (250, 232), data: True |-- (250, 233), data: True|-- (1296, 1278), data: False |-- (1296, 31), data: (1296, 49) @ (49, 31) |-- (296, 280), data: True |-- (500, 485), data: False |-- (500, 11), data: (500, 26) @ (26, 11) |-- (250, 236), data: True |-- (250, 238), data: True |-- (500, 482), data: False |-- (500, 18), data: (500, 36) @ (36, 18) |-- (250, 232), data: True |-- (250, 232), data: TrueMax drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) 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 05:12:09]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate fc3 ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-08 05:12:10]-------------------------Compiled with OpenMP support (max 128 threads).Running in phono3py.load mode.Python version 3.14.2Spglib version 2.6.1----------------------------- General settings -----------------------------Run mode: force constantsHDF5 data compression filter: gzipCrystal 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: Pbca (61)------------------------------ primitive cell ------------------------------Lattice vectors: a 11.781687300000000 0.000000000000000 0.000000000000000 b 0.000000000000000 13.070274219999998 0.000000000000000 c 0.000000000000000 0.000000000000000 12.650316950000001Atomic positions (fractional): 1 S 0.76204573404827 0.45717873214708 0.85512474812310 32.065 2 S 0.26204573404827 0.04282126785292 0.14487525187690 32.065 3 S 0.73795426595173 0.54282126785292 0.35512474812310 32.065 4 S 0.23795426595173 0.95717873214708 0.64487525187690 32.065 5 S 0.23795426595173 0.54282126785292 0.14487525187690 32.065 6 S 0.73795426595173 0.95717873214708 0.85512474812310 32.065 7 S 0.26204573404827 0.45717873214708 0.64487525187690 32.065 8 S 0.76204573404827 0.04282126785292 0.35512474812310 32.065 9 S 0.24224027809173 0.78885431856502 0.98752124440088 32.065 10 S 0.74224027809173 0.71114568143498 0.01247875559912 32.065 11 S 0.25775972190827 0.21114568143498 0.48752124440088 32.065 12 S 0.75775972190827 0.28885431856502 0.51247875559912 32.065 13 S 0.75775972190827 0.21114568143498 0.01247875559912 32.065 14 S 0.25775972190827 0.28885431856502 0.98752124440088 32.065 15 S 0.74224027809173 0.78885431856502 0.51247875559912 32.065 16 S 0.24224027809173 0.71114568143498 0.48752124440088 32.065 17 S 0.43201700792990 0.57290230245329 0.89214343814871 32.065 18 S 0.00097712539055 0.27386378893744 0.71824519842848 32.065 19 S 0.93201700792990 0.92709769754671 0.10785656185129 32.065 20 S 0.56798299207010 0.07290230245329 0.60785656185129 32.065 21 S 0.56798299207010 0.42709769754671 0.10785656185129 32.065 22 S 0.06798299207010 0.07290230245329 0.89214343814871 32.065 23 S 0.93201700792990 0.57290230245329 0.60785656185129 32.065 24 S 0.43201700792990 0.92709769754671 0.39214343814871 32.065 25 S 0.90787655517307 0.02533249688452 0.62347792080389 32.065 26 S 0.40787655517307 0.47466750311548 0.37652207919611 32.065 27 S 0.59212344482693 0.97466750311548 0.12347792080389 32.065 28 S 0.09212344482693 0.52533249688452 0.87652207919611 32.065 29 S 0.09212344482693 0.97466750311548 0.37652207919611 32.065 30 S 0.59212344482693 0.52533249688452 0.62347792080389 32.065 31 S 0.40787655517307 0.02533249688452 0.87652207919611 32.065 32 S 0.90787655517307 0.47466750311548 0.12347792080389 32.065 33 S 0.00097712539055 0.22613621106256 0.21824519842848 32.065 34 S 0.50097712539055 0.27386378893744 0.78175480157152 32.065 35 S 0.49902287460945 0.77386378893744 0.71824519842848 32.065 36 S 0.99902287460945 0.72613621106256 0.28175480157152 32.065 37 S 0.99902287460945 0.77386378893744 0.78175480157152 32.065 38 S 0.49902287460945 0.72613621106256 0.21824519842848 32.065 39 S 0.50097712539055 0.22613621106256 0.28175480157152 32.065 40 S 0.06798299207010 0.42709769754671 0.39214343814871 32.065 41 In 0.55819055507712 0.44914152142525 0.80321998932025 114.818 42 In 0.05819055507712 0.05085847857475 0.19678001067975 114.818 43 In 0.94180944492288 0.55085847857475 0.30321998932025 114.818 44 In 0.44180944492288 0.94914152142525 0.69678001067975 114.818 45 In 0.44180944492288 0.55085847857475 0.19678001067975 114.818 46 In 0.94180944492288 0.94914152142525 0.80321998932025 114.818 47 In 0.05819055507712 0.44914152142525 0.69678001067975 114.818 48 In 0.55819055507712 0.05085847857475 0.30321998932025 114.818 49 In 0.77338361508100 0.02737308677672 0.03508366687249 114.818 50 In 0.27338361508100 0.47262691322328 0.96491633312751 114.818 51 In 0.72661638491900 0.97262691322328 0.53508366687249 114.818 52 In 0.22661638491900 0.52737308677672 0.46491633312751 114.818 53 In 0.22661638491900 0.97262691322328 0.96491633312751 114.818 54 In 0.72661638491900 0.52737308677672 0.03508366687249 114.818 55 In 0.27338361508100 0.02737308677672 0.46491633312751 114.818 56 In 0.77338361508100 0.47262691322328 0.53508366687249 114.818 57 Ba 0.75126126027263 0.69134505551688 0.75467898502767 137.327 58 Ba 0.25126126027263 0.80865494448312 0.24532101497233 137.327 59 Ba 0.74873873972737 0.30865494448312 0.25467898502767 137.327 60 Ba 0.24873873972737 0.19134505551688 0.74532101497233 137.327 61 Ba 0.24873873972737 0.30865494448312 0.24532101497233 137.327 62 Ba 0.74873873972737 0.19134505551688 0.75467898502767 137.327 63 Ba 0.25126126027263 0.69134505551688 0.74532101497233 137.327 64 Ba 0.75126126027263 0.80865494448312 0.25467898502767 137.327 65 Ba 0.50583609250845 0.80764058381501 0.97166391260729 137.327 66 Ba 0.00583609250845 0.69235941618499 0.02833608739271 137.327 67 Ba 0.99416390749155 0.19235941618499 0.47166391260729 137.327 68 Ba 0.49416390749155 0.30764058381501 0.52833608739271 137.327 69 Ba 0.49416390749155 0.19235941618499 0.02833608739271 137.327 70 Ba 0.99416390749155 0.30764058381501 0.97166391260729 137.327 71 Ba 0.00583609250845 0.80764058381501 0.52833608739271 137.327 72 Ba 0.50583609250845 0.69235941618499 0.47166391260729 137.327-------------------------------- supercell ---------------------------------Lattice vectors: a 23.563374600000000 0.000000000000000 0.000000000000000 b 0.000000000000000 13.070274219999998 0.000000000000000 c 0.000000000000000 0.000000000000000 12.650316950000001Atomic positions (fractional): 1 S 0.38102286702413 0.45717873214708 0.85512474812310 32.065 > 1 2 S 0.88102286702413 0.45717873214708 0.85512474812310 32.065 > 1 3 S 0.13102286702413 0.04282126785292 0.14487525187690 32.065 > 3 4 S 0.63102286702413 0.04282126785292 0.14487525187690 32.065 > 3 5 S 0.36897713297587 0.54282126785292 0.35512474812310 32.065 > 5 6 S 0.86897713297587 0.54282126785292 0.35512474812310 32.065 > 5 7 S 0.11897713297587 0.95717873214708 0.64487525187690 32.065 > 7 8 S 0.61897713297587 0.95717873214708 0.64487525187690 32.065 > 7 9 S 0.11897713297587 0.54282126785292 0.14487525187690 32.065 > 9 10 S 0.61897713297587 0.54282126785292 0.14487525187690 32.065 > 9 11 S 0.36897713297587 0.95717873214708 0.85512474812310 32.065 > 11 12 S 0.86897713297587 0.95717873214708 0.85512474812310 32.065 > 11 13 S 0.13102286702413 0.45717873214708 0.64487525187690 32.065 > 13 14 S 0.63102286702413 0.45717873214708 0.64487525187690 32.065 > 13 15 S 0.38102286702413 0.04282126785292 0.35512474812310 32.065 > 15 16 S 0.88102286702413 0.04282126785292 0.35512474812310 32.065 > 15 17 S 0.12112013904587 0.78885431856502 0.98752124440088 32.065 > 17 18 S 0.62112013904587 0.78885431856502 0.98752124440088 32.065 > 17 19 S 0.37112013904587 0.71114568143498 0.01247875559912 32.065 > 19 20 S 0.87112013904587 0.71114568143498 0.01247875559912 32.065 > 19 21 S 0.12887986095413 0.21114568143498 0.48752124440088 32.065 > 21 22 S 0.62887986095413 0.21114568143498 0.48752124440088 32.065 > 21 23 S 0.37887986095413 0.28885431856502 0.51247875559912 32.065 > 23 24 S 0.87887986095413 0.28885431856502 0.51247875559912 32.065 > 23 25 S 0.37887986095413 0.21114568143498 0.01247875559912 32.065 > 25 26 S 0.87887986095413 0.21114568143498 0.01247875559912 32.065 > 25 27 S 0.12887986095413 0.28885431856502 0.98752124440088 32.065 > 27 28 S 0.62887986095413 0.28885431856502 0.98752124440088 32.065 > 27 29 S 0.37112013904587 0.78885431856502 0.51247875559912 32.065 > 29 30 S 0.87112013904587 0.78885431856502 0.51247875559912 32.065 > 29 31 S 0.12112013904587 0.71114568143498 0.48752124440088 32.065 > 31 32 S 0.62112013904587 0.71114568143498 0.48752124440088 32.065 > 31 33 S 0.21600850396495 0.57290230245329 0.89214343814871 32.065 > 33 34 S 0.71600850396495 0.57290230245329 0.89214343814871 32.065 > 33 35 S 0.00048856269527 0.27386378893744 0.71824519842848 32.065 > 35 36 S 0.50048856269527 0.27386378893744 0.71824519842848 32.065 > 35 37 S 0.46600850396495 0.92709769754671 0.10785656185129 32.065 > 37 38 S 0.96600850396495 0.92709769754671 0.10785656185129 32.065 > 37 39 S 0.28399149603505 0.07290230245329 0.60785656185129 32.065 > 39 40 S 0.78399149603505 0.07290230245329 0.60785656185129 32.065 > 39 41 S 0.28399149603505 0.42709769754671 0.10785656185129 32.065 > 41 42 S 0.78399149603505 0.42709769754671 0.10785656185129 32.065 > 41 43 S 0.03399149603505 0.07290230245329 0.89214343814871 32.065 > 43 44 S 0.53399149603505 0.07290230245329 0.89214343814871 32.065 > 43 45 S 0.46600850396495 0.57290230245329 0.60785656185129 32.065 > 45 46 S 0.96600850396495 0.57290230245329 0.60785656185129 32.065 > 45 47 S 0.21600850396495 0.92709769754671 0.39214343814871 32.065 > 47 48 S 0.71600850396495 0.92709769754671 0.39214343814871 32.065 > 47 49 S 0.45393827758653 0.02533249688452 0.62347792080389 32.065 > 49 50 S 0.95393827758654 0.02533249688452 0.62347792080389 32.065 > 49 51 S 0.20393827758653 0.47466750311548 0.37652207919611 32.065 > 51 52 S 0.70393827758654 0.47466750311548 0.37652207919611 32.065 > 51 53 S 0.29606172241347 0.97466750311548 0.12347792080389 32.065 > 53 54 S 0.79606172241346 0.97466750311548 0.12347792080389 32.065 > 53 55 S 0.04606172241346 0.52533249688452 0.87652207919611 32.065 > 55 56 S 0.54606172241346 0.52533249688452 0.87652207919611 32.065 > 55 57 S 0.04606172241346 0.97466750311548 0.37652207919611 32.065 > 57 58 S 0.54606172241346 0.97466750311548 0.37652207919611 32.065 > 57 59 S 0.29606172241347 0.52533249688452 0.62347792080389 32.065 > 59 60 S 0.79606172241346 0.52533249688452 0.62347792080389 32.065 > 59 61 S 0.20393827758653 0.02533249688452 0.87652207919611 32.065 > 61 62 S 0.70393827758654 0.02533249688452 0.87652207919611 32.065 > 61 63 S 0.45393827758653 0.47466750311548 0.12347792080389 32.065 > 63 64 S 0.95393827758654 0.47466750311548 0.12347792080389 32.065 > 63 65 S 0.00048856269527 0.22613621106256 0.21824519842848 32.065 > 65 66 S 0.50048856269527 0.22613621106256 0.21824519842848 32.065 > 65 67 S 0.25048856269527 0.27386378893744 0.78175480157152 32.065 > 67 68 S 0.75048856269527 0.27386378893744 0.78175480157152 32.065 > 67 69 S 0.24951143730473 0.77386378893744 0.71824519842848 32.065 > 69 70 S 0.74951143730473 0.77386378893744 0.71824519842848 32.065 > 69 71 S 0.49951143730473 0.72613621106256 0.28175480157152 32.065 > 71 72 S 0.99951143730473 0.72613621106256 0.28175480157152 32.065 > 71 73 S 0.49951143730473 0.77386378893744 0.78175480157152 32.065 > 73 74 S 0.99951143730473 0.77386378893744 0.78175480157152 32.065 > 73 75 S 0.24951143730473 0.72613621106256 0.21824519842848 32.065 > 75 76 S 0.74951143730473 0.72613621106256 0.21824519842848 32.065 > 75 77 S 0.25048856269527 0.22613621106256 0.28175480157152 32.065 > 77 78 S 0.75048856269527 0.22613621106256 0.28175480157152 32.065 > 77 79 S 0.03399149603505 0.42709769754671 0.39214343814871 32.065 > 79 80 S 0.53399149603505 0.42709769754671 0.39214343814871 32.065 > 79 81 In 0.27909527753856 0.44914152142525 0.80321998932025 114.818 > 81 82 In 0.77909527753856 0.44914152142525 0.80321998932025 114.818 > 81 83 In 0.02909527753856 0.05085847857475 0.19678001067975 114.818 > 83 84 In 0.52909527753856 0.05085847857475 0.19678001067975 114.818 > 83 85 In 0.47090472246144 0.55085847857475 0.30321998932025 114.818 > 85 86 In 0.97090472246144 0.55085847857475 0.30321998932025 114.818 > 85 87 In 0.22090472246144 0.94914152142525 0.69678001067975 114.818 > 87 88 In 0.72090472246144 0.94914152142525 0.69678001067975 114.818 > 87 89 In 0.22090472246144 0.55085847857475 0.19678001067975 114.818 > 89 90 In 0.72090472246144 0.55085847857475 0.19678001067975 114.818 > 89 91 In 0.47090472246144 0.94914152142525 0.80321998932025 114.818 > 91 92 In 0.97090472246144 0.94914152142525 0.80321998932025 114.818 > 91 93 In 0.02909527753856 0.44914152142525 0.69678001067975 114.818 > 93 94 In 0.52909527753856 0.44914152142525 0.69678001067975 114.818 > 93 95 In 0.27909527753856 0.05085847857475 0.30321998932025 114.818 > 95 96 In 0.77909527753856 0.05085847857475 0.30321998932025 114.818 > 95 97 In 0.38669180754050 0.02737308677672 0.03508366687249 114.818 > 97 98 In 0.88669180754050 0.02737308677672 0.03508366687249 114.818 > 97 99 In 0.13669180754050 0.47262691322328 0.96491633312751 114.818 > 99 100 In 0.63669180754050 0.47262691322328 0.96491633312751 114.818 > 99 101 In 0.36330819245950 0.97262691322328 0.53508366687249 114.818 > 101 102 In 0.86330819245950 0.97262691322328 0.53508366687249 114.818 > 101 103 In 0.11330819245950 0.52737308677672 0.46491633312751 114.818 > 103 104 In 0.61330819245950 0.52737308677672 0.46491633312751 114.818 > 103 105 In 0.11330819245950 0.97262691322328 0.96491633312751 114.818 > 105 106 In 0.61330819245950 0.97262691322328 0.96491633312751 114.818 > 105 107 In 0.36330819245950 0.52737308677672 0.03508366687249 114.818 > 107 108 In 0.86330819245950 0.52737308677672 0.03508366687249 114.818 > 107 109 In 0.13669180754050 0.02737308677672 0.46491633312751 114.818 > 109 110 In 0.63669180754050 0.02737308677672 0.46491633312751 114.818 > 109 111 In 0.38669180754050 0.47262691322328 0.53508366687249 114.818 > 111 112 In 0.88669180754050 0.47262691322328 0.53508366687249 114.818 > 111 113 Ba 0.37563063013631 0.69134505551688 0.75467898502767 137.327 > 113 114 Ba 0.87563063013631 0.69134505551688 0.75467898502767 137.327 > 113 115 Ba 0.12563063013631 0.80865494448312 0.24532101497233 137.327 > 115 116 Ba 0.62563063013631 0.80865494448312 0.24532101497233 137.327 > 115 117 Ba 0.37436936986369 0.30865494448312 0.25467898502767 137.327 > 117 118 Ba 0.87436936986369 0.30865494448312 0.25467898502767 137.327 > 117 119 Ba 0.12436936986369 0.19134505551688 0.74532101497233 137.327 > 119 120 Ba 0.62436936986369 0.19134505551688 0.74532101497233 137.327 > 119 121 Ba 0.12436936986369 0.30865494448312 0.24532101497233 137.327 > 121 122 Ba 0.62436936986369 0.30865494448312 0.24532101497233 137.327 > 121 123 Ba 0.37436936986369 0.19134505551688 0.75467898502767 137.327 > 123 124 Ba 0.87436936986369 0.19134505551688 0.75467898502767 137.327 > 123 125 Ba 0.12563063013631 0.69134505551688 0.74532101497233 137.327 > 125 126 Ba 0.62563063013631 0.69134505551688 0.74532101497233 137.327 > 125 127 Ba 0.37563063013631 0.80865494448312 0.25467898502767 137.327 > 127 128 Ba 0.87563063013631 0.80865494448312 0.25467898502767 137.327 > 127 129 Ba 0.25291804625423 0.80764058381501 0.97166391260729 137.327 > 129 130 Ba 0.75291804625423 0.80764058381501 0.97166391260729 137.327 > 129 131 Ba 0.00291804625423 0.69235941618499 0.02833608739271 137.327 > 131 132 Ba 0.50291804625423 0.69235941618499 0.02833608739271 137.327 > 131 133 Ba 0.49708195374577 0.19235941618499 0.47166391260729 137.327 > 133 134 Ba 0.99708195374577 0.19235941618499 0.47166391260729 137.327 > 133 135 Ba 0.24708195374577 0.30764058381501 0.52833608739271 137.327 > 135 136 Ba 0.74708195374577 0.30764058381501 0.52833608739271 137.327 > 135 137 Ba 0.24708195374577 0.19235941618499 0.02833608739271 137.327 > 137 138 Ba 0.74708195374577 0.19235941618499 0.02833608739271 137.327 > 137 139 Ba 0.49708195374577 0.30764058381501 0.97166391260729 137.327 > 139 140 Ba 0.99708195374577 0.30764058381501 0.97166391260729 137.327 > 139 141 Ba 0.00291804625423 0.80764058381501 0.52833608739271 137.327 > 141 142 Ba 0.50291804625423 0.80764058381501 0.52833608739271 137.327 > 141 143 Ba 0.25291804625423 0.69235941618499 0.47166391260729 137.327 > 143 144 Ba 0.75291804625423 0.69235941618499 0.47166391260729 137.327 > 143----------------------------------------------------------------------------NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz".--------------------------- Dielectric constant ---------------------------- 5.8246358 0.0000000 0.0000000 0.0000000 5.8510156 0.0000000 0.0000000 0.0000000 5.7379035-------------------------- Born effective charges -------------------------- 1 S -2.1078993 0.0352511 -0.2790731 0.0229185 -1.9200345 -0.2317430 -0.5390123 -0.2414597 -2.4011630 2 S -2.1078993 -0.0352511 0.2790731 -0.0229185 -1.9200345 -0.2317430 0.5390123 -0.2414597 -2.4011630 3 S -2.1078993 0.0352511 0.2790731 0.0229185 -1.9200345 0.2317430 0.5390123 0.2414597 -2.4011630 4 S -2.1078993 -0.0352511 -0.2790731 -0.0229185 -1.9200345 0.2317430 -0.5390123 0.2414597 -2.4011630 5 S -2.1078993 0.0352511 -0.2790731 0.0229185 -1.9200345 -0.2317430 -0.5390123 -0.2414597 -2.4011630 6 S -2.1078993 -0.0352511 0.2790731 -0.0229185 -1.9200345 -0.2317430 0.5390123 -0.2414597 -2.4011630 7 S -2.1078993 0.0352511 0.2790731 0.0229185 -1.9200345 0.2317430 0.5390123 0.2414597 -2.4011630 8 S -2.1078993 -0.0352511 -0.2790731 -0.0229185 -1.9200345 0.2317430 -0.5390123 0.2414597 -2.4011630 9 S -2.1960722 -0.1177169 0.1976906 -0.0585028 -2.2849284 -0.0480603 0.1169938 -0.1489489 -1.9985395 10 S -2.1960722 0.1177169 -0.1976906 0.0585028 -2.2849284 -0.0480603 -0.1169938 -0.1489489 -1.9985395 11 S -2.1960722 -0.1177169 -0.1976906 -0.0585028 -2.2849284 0.0480603 -0.1169938 0.1489489 -1.9985395 12 S -2.1960722 0.1177169 0.1976906 0.0585028 -2.2849284 0.0480603 0.1169938 0.1489489 -1.9985395 13 S -2.1960722 -0.1177169 0.1976906 -0.0585028 -2.2849284 -0.0480603 0.1169938 -0.1489489 -1.9985395 14 S -2.1960722 0.1177169 -0.1976906 0.0585028 -2.2849284 -0.0480603 -0.1169938 -0.1489489 -1.9985395 15 S -2.1960722 -0.1177169 -0.1976906 -0.0585028 -2.2849284 0.0480603 -0.1169938 0.1489489 -1.9985395 16 S -2.1960722 0.1177169 0.1976906 0.0585028 -2.2849284 0.0480603 0.1169938 0.1489489 -1.9985395 17 S -2.5248507 0.0451465 0.3617051 0.0583319 -2.0276081 -0.1251134 0.3857942 -0.1272551 -1.6852504 18 S -2.1255354 -0.1784213 0.1063041 -0.2209374 -2.1735160 0.0688584 0.2303822 -0.0070581 -2.0703442 19 S -2.5248507 -0.0451465 -0.3617051 -0.0583319 -2.0276081 -0.1251134 -0.3857942 -0.1272551 -1.6852504 20 S -2.5248507 -0.0451465 0.3617051 -0.0583319 -2.0276081 0.1251134 0.3857942 0.1272551 -1.6852504 21 S -2.5248507 0.0451465 0.3617051 0.0583319 -2.0276081 -0.1251134 0.3857942 -0.1272551 -1.6852504 22 S -2.5248507 -0.0451465 -0.3617051 -0.0583319 -2.0276081 -0.1251134 -0.3857942 -0.1272551 -1.6852504 23 S -2.5248507 0.0451465 -0.3617051 0.0583319 -2.0276081 0.1251134 -0.3857942 0.1272551 -1.6852504 24 S -2.5248507 -0.0451465 0.3617051 -0.0583319 -2.0276081 0.1251134 0.3857942 0.1272551 -1.6852504 25 S -2.2014977 0.0520504 -0.3819732 -0.0243833 -2.0187189 0.2097204 -0.3149892 0.2647223 -2.7017608 26 S -2.2014977 -0.0520504 0.3819732 0.0243833 -2.0187189 0.2097204 0.3149892 0.2647223 -2.7017608 27 S -2.2014977 0.0520504 0.3819732 -0.0243833 -2.0187189 -0.2097204 0.3149892 -0.2647223 -2.7017608 28 S -2.2014977 -0.0520504 -0.3819732 0.0243833 -2.0187189 -0.2097204 -0.3149892 -0.2647223 -2.7017608 29 S -2.2014977 0.0520504 -0.3819732 -0.0243833 -2.0187189 0.2097204 -0.3149892 0.2647223 -2.7017608 30 S -2.2014977 -0.0520504 0.3819732 0.0243833 -2.0187189 0.2097204 0.3149892 0.2647223 -2.7017608 31 S -2.2014977 0.0520504 0.3819732 -0.0243833 -2.0187189 -0.2097204 0.3149892 -0.2647223 -2.7017608 32 S -2.2014977 -0.0520504 -0.3819732 0.0243833 -2.0187189 -0.2097204 -0.3149892 -0.2647223 -2.7017608 33 S -2.1255354 0.1784213 0.1063041 0.2209374 -2.1735160 -0.0688584 0.2303822 0.0070581 -2.0703442 34 S -2.1255354 -0.1784213 -0.1063041 -0.2209374 -2.1735160 -0.0688584 -0.2303822 0.0070581 -2.0703442 35 S -2.1255354 0.1784213 -0.1063041 0.2209374 -2.1735160 0.0688584 -0.2303822 -0.0070581 -2.0703442 36 S -2.1255354 -0.1784213 0.1063041 -0.2209374 -2.1735160 0.0688584 0.2303822 -0.0070581 -2.0703442 37 S -2.1255354 0.1784213 0.1063041 0.2209374 -2.1735160 -0.0688584 0.2303822 0.0070581 -2.0703442 38 S -2.1255354 -0.1784213 -0.1063041 -0.2209374 -2.1735160 -0.0688584 -0.2303822 0.0070581 -2.0703442 39 S -2.1255354 0.1784213 -0.1063041 0.2209374 -2.1735160 0.0688584 -0.2303822 -0.0070581 -2.0703442 40 S -2.5248507 0.0451465 -0.3617051 0.0583319 -2.0276081 0.1251134 -0.3857942 0.1272551 -1.6852504 41 In 2.8066336 -0.1212765 -0.4698735 0.1439316 2.5117308 0.0136405 0.3943264 0.0612191 2.8354543 42 In 2.8066336 0.1212765 0.4698735 -0.1439316 2.5117308 0.0136405 -0.3943264 0.0612191 2.8354543 43 In 2.8066336 -0.1212765 0.4698735 0.1439316 2.5117308 -0.0136405 -0.3943264 -0.0612191 2.8354543 44 In 2.8066336 0.1212765 -0.4698735 -0.1439316 2.5117308 -0.0136405 0.3943264 -0.0612191 2.8354543 45 In 2.8066336 -0.1212765 -0.4698735 0.1439316 2.5117308 0.0136405 0.3943264 0.0612191 2.8354543 46 In 2.8066336 0.1212765 0.4698735 -0.1439316 2.5117308 0.0136405 -0.3943264 0.0612191 2.8354543 47 In 2.8066336 -0.1212765 0.4698735 0.1439316 2.5117308 -0.0136405 -0.3943264 -0.0612191 2.8354543 48 In 2.8066336 0.1212765 -0.4698735 -0.1439316 2.5117308 -0.0136405 0.3943264 -0.0612191 2.8354543 49 In 2.7852591 -0.3649330 -0.3195485 -0.0684048 2.5090464 0.0262323 -0.1092653 -0.1693841 2.7080671 50 In 2.7852591 0.3649330 0.3195485 0.0684048 2.5090464 0.0262323 0.1092653 -0.1693841 2.7080671 51 In 2.7852591 -0.3649330 0.3195485 -0.0684048 2.5090464 -0.0262323 0.1092653 0.1693841 2.7080671 52 In 2.7852591 0.3649330 -0.3195485 0.0684048 2.5090464 -0.0262323 -0.1092653 0.1693841 2.7080671 53 In 2.7852591 -0.3649330 -0.3195485 -0.0684048 2.5090464 0.0262323 -0.1092653 -0.1693841 2.7080671 54 In 2.7852591 0.3649330 0.3195485 0.0684048 2.5090464 0.0262323 0.1092653 -0.1693841 2.7080671 55 In 2.7852591 -0.3649330 0.3195485 -0.0684048 2.5090464 -0.0262323 0.1092653 0.1693841 2.7080671 56 In 2.7852591 0.3649330 -0.3195485 0.0684048 2.5090464 -0.0262323 -0.1092653 0.1693841 2.7080671 57 Ba 2.6777465 0.1588165 -0.0047305 -0.0059731 2.7315363 -0.0841459 0.0514852 0.0288035 2.6075466 58 Ba 2.6777465 -0.1588165 0.0047305 0.0059731 2.7315363 -0.0841459 -0.0514852 0.0288035 2.6075466 59 Ba 2.6777465 0.1588165 0.0047305 -0.0059731 2.7315363 0.0841459 -0.0514852 -0.0288035 2.6075466 60 Ba 2.6777465 -0.1588165 -0.0047305 0.0059731 2.7315363 0.0841459 0.0514852 -0.0288035 2.6075466 61 Ba 2.6777465 0.1588165 -0.0047305 -0.0059731 2.7315363 -0.0841459 0.0514852 0.0288035 2.6075466 62 Ba 2.6777465 -0.1588165 0.0047305 0.0059731 2.7315363 -0.0841459 -0.0514852 0.0288035 2.6075466 63 Ba 2.6777465 0.1588165 0.0047305 -0.0059731 2.7315363 0.0841459 -0.0514852 -0.0288035 2.6075466 64 Ba 2.6777465 -0.1588165 -0.0047305 0.0059731 2.7315363 0.0841459 0.0514852 -0.0288035 2.6075466 65 Ba 2.8862160 0.0845467 0.2741894 -0.2298185 2.6724924 -0.0964670 0.4828050 0.0852103 2.7059899 66 Ba 2.8862160 -0.0845467 -0.2741894 0.2298185 2.6724924 -0.0964670 -0.4828050 0.0852103 2.7059899 67 Ba 2.8862160 0.0845467 -0.2741894 -0.2298185 2.6724924 0.0964670 -0.4828050 -0.0852103 2.7059899 68 Ba 2.8862160 -0.0845467 0.2741894 0.2298185 2.6724924 0.0964670 0.4828050 -0.0852103 2.7059899 69 Ba 2.8862160 0.0845467 0.2741894 -0.2298185 2.6724924 -0.0964670 0.4828050 0.0852103 2.7059899 70 Ba 2.8862160 -0.0845467 -0.2741894 0.2298185 2.6724924 -0.0964670 -0.4828050 0.0852103 2.7059899 71 Ba 2.8862160 0.0845467 -0.2741894 -0.2298185 2.6724924 0.0964670 -0.4828050 -0.0852103 2.7059899 72 Ba 2.8862160 -0.0845467 0.2741894 0.2298185 2.6724924 0.0964670 0.4828050 -0.0852103 2.7059899----------------------------------------------------------------------------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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Computing fc3[ 35, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Computing fc3[ 81, x, x ] using numpy.linalg.pinv.Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Computing fc3[ 97, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Computing fc3[ 113, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Computing fc3[ 129, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Expanding fc3.Symmetrizing fc3 by traditional approach (N=3).Symmetrizing fc2 by traditional approach (N=3).Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy)fc3 was written into "fc3.hdf5".Max drift of fc2: 0.00000000 (yx) 0.00000000 (yx) fc2 was written into "fc2.hdf5".--------------------------- Calculation settings ---------------------------Non-analytical term correction (NAC): TrueNAC unit conversion factor: 14.39965BZ integration: Tetrahedron-methodTemperatures: 0.0 300.0 Cutoff frequency: 0.01Frequency 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 05:13:22]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate LTC ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-08 05:13:23]-------------------------Compiled with OpenMP support (max 128 threads).Running in phono3py.load mode.Python version 3.14.2Spglib version 2.6.1----------------------------- General settings -----------------------------Run mode: conductivity-RTAHDF5 data compression filter: gzipCrystal structure was read from "phono3py.yaml".Supercell (dim): [2 1 1]Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: Pbca (61)------------------------------ primitive cell ------------------------------Lattice vectors: a 11.781687300000000 0.000000000000000 0.000000000000000 b 0.000000000000000 13.070274219999998 0.000000000000000 c 0.000000000000000 0.000000000000000 12.650316950000001Atomic positions (fractional): 1 S 0.76204573404827 0.45717873214708 0.85512474812310 32.065 2 S 0.26204573404827 0.04282126785292 0.14487525187690 32.065 3 S 0.73795426595173 0.54282126785292 0.35512474812310 32.065 4 S 0.23795426595173 0.95717873214708 0.64487525187690 32.065 5 S 0.23795426595173 0.54282126785292 0.14487525187690 32.065 6 S 0.73795426595173 0.95717873214708 0.85512474812310 32.065 7 S 0.26204573404827 0.45717873214708 0.64487525187690 32.065 8 S 0.76204573404827 0.04282126785292 0.35512474812310 32.065 9 S 0.24224027809173 0.78885431856502 0.98752124440088 32.065 10 S 0.74224027809173 0.71114568143498 0.01247875559912 32.065 11 S 0.25775972190827 0.21114568143498 0.48752124440088 32.065 12 S 0.75775972190827 0.28885431856502 0.51247875559912 32.065 13 S 0.75775972190827 0.21114568143498 0.01247875559912 32.065 14 S 0.25775972190827 0.28885431856502 0.98752124440088 32.065 15 S 0.74224027809173 0.78885431856502 0.51247875559912 32.065 16 S 0.24224027809173 0.71114568143498 0.48752124440088 32.065 17 S 0.43201700792990 0.57290230245329 0.89214343814871 32.065 18 S 0.00097712539055 0.27386378893744 0.71824519842848 32.065 19 S 0.93201700792990 0.92709769754671 0.10785656185129 32.065 20 S 0.56798299207010 0.07290230245329 0.60785656185129 32.065 21 S 0.56798299207010 0.42709769754671 0.10785656185129 32.065 22 S 0.06798299207010 0.07290230245329 0.89214343814871 32.065 23 S 0.93201700792990 0.57290230245329 0.60785656185129 32.065 24 S 0.43201700792990 0.92709769754671 0.39214343814871 32.065 25 S 0.90787655517307 0.02533249688452 0.62347792080389 32.065 26 S 0.40787655517307 0.47466750311548 0.37652207919611 32.065 27 S 0.59212344482693 0.97466750311548 0.12347792080389 32.065 28 S 0.09212344482693 0.52533249688452 0.87652207919611 32.065 29 S 0.09212344482693 0.97466750311548 0.37652207919611 32.065 30 S 0.59212344482693 0.52533249688452 0.62347792080389 32.065 31 S 0.40787655517307 0.02533249688452 0.87652207919611 32.065 32 S 0.90787655517307 0.47466750311548 0.12347792080389 32.065 33 S 0.00097712539055 0.22613621106256 0.21824519842848 32.065 34 S 0.50097712539055 0.27386378893744 0.78175480157152 32.065 35 S 0.49902287460945 0.77386378893744 0.71824519842848 32.065 36 S 0.99902287460945 0.72613621106256 0.28175480157152 32.065 37 S 0.99902287460945 0.77386378893744 0.78175480157152 32.065 38 S 0.49902287460945 0.72613621106256 0.21824519842848 32.065 39 S 0.50097712539055 0.22613621106256 0.28175480157152 32.065 40 S 0.06798299207010 0.42709769754671 0.39214343814871 32.065 41 In 0.55819055507712 0.44914152142525 0.80321998932025 114.818 42 In 0.05819055507712 0.05085847857475 0.19678001067975 114.818 43 In 0.94180944492288 0.55085847857475 0.30321998932025 114.818 44 In 0.44180944492288 0.94914152142525 0.69678001067975 114.818 45 In 0.44180944492288 0.55085847857475 0.19678001067975 114.818 46 In 0.94180944492288 0.94914152142525 0.80321998932025 114.818 47 In 0.05819055507712 0.44914152142525 0.69678001067975 114.818 48 In 0.55819055507712 0.05085847857475 0.30321998932025 114.818 49 In 0.77338361508100 0.02737308677672 0.03508366687249 114.818 50 In 0.27338361508100 0.47262691322328 0.96491633312751 114.818 51 In 0.72661638491900 0.97262691322328 0.53508366687249 114.818 52 In 0.22661638491900 0.52737308677672 0.46491633312751 114.818 53 In 0.22661638491900 0.97262691322328 0.96491633312751 114.818 54 In 0.72661638491900 0.52737308677672 0.03508366687249 114.818 55 In 0.27338361508100 0.02737308677672 0.46491633312751 114.818 56 In 0.77338361508100 0.47262691322328 0.53508366687249 114.818 57 Ba 0.75126126027263 0.69134505551688 0.75467898502767 137.327 58 Ba 0.25126126027263 0.80865494448312 0.24532101497233 137.327 59 Ba 0.74873873972737 0.30865494448312 0.25467898502767 137.327 60 Ba 0.24873873972737 0.19134505551688 0.74532101497233 137.327 61 Ba 0.24873873972737 0.30865494448312 0.24532101497233 137.327 62 Ba 0.74873873972737 0.19134505551688 0.75467898502767 137.327 63 Ba 0.25126126027263 0.69134505551688 0.74532101497233 137.327 64 Ba 0.75126126027263 0.80865494448312 0.25467898502767 137.327 65 Ba 0.50583609250845 0.80764058381501 0.97166391260729 137.327 66 Ba 0.00583609250845 0.69235941618499 0.02833608739271 137.327 67 Ba 0.99416390749155 0.19235941618499 0.47166391260729 137.327 68 Ba 0.49416390749155 0.30764058381501 0.52833608739271 137.327 69 Ba 0.49416390749155 0.19235941618499 0.02833608739271 137.327 70 Ba 0.99416390749155 0.30764058381501 0.97166391260729 137.327 71 Ba 0.00583609250845 0.80764058381501 0.52833608739271 137.327 72 Ba 0.50583609250845 0.69235941618499 0.47166391260729 137.327-------------------------------- supercell ---------------------------------Lattice vectors: a 23.563374600000000 0.000000000000000 0.000000000000000 b 0.000000000000000 13.070274219999998 0.000000000000000 c 0.000000000000000 0.000000000000000 12.650316950000001Atomic positions (fractional): 1 S 0.38102286702413 0.45717873214708 0.85512474812310 32.065 > 1 2 S 0.88102286702413 0.45717873214708 0.85512474812310 32.065 > 1 3 S 0.13102286702413 0.04282126785292 0.14487525187690 32.065 > 3 4 S 0.63102286702413 0.04282126785292 0.14487525187690 32.065 > 3 5 S 0.36897713297587 0.54282126785292 0.35512474812310 32.065 > 5 6 S 0.86897713297587 0.54282126785292 0.35512474812310 32.065 > 5 7 S 0.11897713297587 0.95717873214708 0.64487525187690 32.065 > 7 8 S 0.61897713297587 0.95717873214708 0.64487525187690 32.065 > 7 9 S 0.11897713297587 0.54282126785292 0.14487525187690 32.065 > 9 10 S 0.61897713297587 0.54282126785292 0.14487525187690 32.065 > 9 11 S 0.36897713297587 0.95717873214708 0.85512474812310 32.065 > 11 12 S 0.86897713297587 0.95717873214708 0.85512474812310 32.065 > 11 13 S 0.13102286702413 0.45717873214708 0.64487525187690 32.065 > 13 14 S 0.63102286702413 0.45717873214708 0.64487525187690 32.065 > 13 15 S 0.38102286702413 0.04282126785292 0.35512474812310 32.065 > 15 16 S 0.88102286702413 0.04282126785292 0.35512474812310 32.065 > 15 17 S 0.12112013904587 0.78885431856502 0.98752124440088 32.065 > 17 18 S 0.62112013904587 0.78885431856502 0.98752124440088 32.065 > 17 19 S 0.37112013904587 0.71114568143498 0.01247875559912 32.065 > 19 20 S 0.87112013904587 0.71114568143498 0.01247875559912 32.065 > 19 21 S 0.12887986095413 0.21114568143498 0.48752124440088 32.065 > 21 22 S 0.62887986095413 0.21114568143498 0.48752124440088 32.065 > 21 23 S 0.37887986095413 0.28885431856502 0.51247875559912 32.065 > 23 24 S 0.87887986095413 0.28885431856502 0.51247875559912 32.065 > 23 25 S 0.37887986095413 0.21114568143498 0.01247875559912 32.065 > 25 26 S 0.87887986095413 0.21114568143498 0.01247875559912 32.065 > 25 27 S 0.12887986095413 0.28885431856502 0.98752124440088 32.065 > 27 28 S 0.62887986095413 0.28885431856502 0.98752124440088 32.065 > 27 29 S 0.37112013904587 0.78885431856502 0.51247875559912 32.065 > 29 30 S 0.87112013904587 0.78885431856502 0.51247875559912 32.065 > 29 31 S 0.12112013904587 0.71114568143498 0.48752124440088 32.065 > 31 32 S 0.62112013904587 0.71114568143498 0.48752124440088 32.065 > 31 33 S 0.21600850396495 0.57290230245329 0.89214343814871 32.065 > 33 34 S 0.71600850396495 0.57290230245329 0.89214343814871 32.065 > 33 35 S 0.00048856269527 0.27386378893744 0.71824519842848 32.065 > 35 36 S 0.50048856269527 0.27386378893744 0.71824519842848 32.065 > 35 37 S 0.46600850396495 0.92709769754671 0.10785656185129 32.065 > 37 38 S 0.96600850396495 0.92709769754671 0.10785656185129 32.065 > 37 39 S 0.28399149603505 0.07290230245329 0.60785656185129 32.065 > 39 40 S 0.78399149603505 0.07290230245329 0.60785656185129 32.065 > 39 41 S 0.28399149603505 0.42709769754671 0.10785656185129 32.065 > 41 42 S 0.78399149603505 0.42709769754671 0.10785656185129 32.065 > 41 43 S 0.03399149603505 0.07290230245329 0.89214343814871 32.065 > 43 44 S 0.53399149603505 0.07290230245329 0.89214343814871 32.065 > 43 45 S 0.46600850396495 0.57290230245329 0.60785656185129 32.065 > 45 46 S 0.96600850396495 0.57290230245329 0.60785656185129 32.065 > 45 47 S 0.21600850396495 0.92709769754671 0.39214343814871 32.065 > 47 48 S 0.71600850396495 0.92709769754671 0.39214343814871 32.065 > 47 49 S 0.45393827758653 0.02533249688452 0.62347792080389 32.065 > 49 50 S 0.95393827758654 0.02533249688452 0.62347792080389 32.065 > 49 51 S 0.20393827758653 0.47466750311548 0.37652207919611 32.065 > 51 52 S 0.70393827758654 0.47466750311548 0.37652207919611 32.065 > 51 53 S 0.29606172241347 0.97466750311548 0.12347792080389 32.065 > 53 54 S 0.79606172241346 0.97466750311548 0.12347792080389 32.065 > 53 55 S 0.04606172241346 0.52533249688452 0.87652207919611 32.065 > 55 56 S 0.54606172241346 0.52533249688452 0.87652207919611 32.065 > 55 57 S 0.04606172241346 0.97466750311548 0.37652207919611 32.065 > 57 58 S 0.54606172241346 0.97466750311548 0.37652207919611 32.065 > 57 59 S 0.29606172241347 0.52533249688452 0.62347792080389 32.065 > 59 60 S 0.79606172241346 0.52533249688452 0.62347792080389 32.065 > 59 61 S 0.20393827758653 0.02533249688452 0.87652207919611 32.065 > 61 62 S 0.70393827758654 0.02533249688452 0.87652207919611 32.065 > 61 63 S 0.45393827758653 0.47466750311548 0.12347792080389 32.065 > 63 64 S 0.95393827758654 0.47466750311548 0.12347792080389 32.065 > 63 65 S 0.00048856269527 0.22613621106256 0.21824519842848 32.065 > 65 66 S 0.50048856269527 0.22613621106256 0.21824519842848 32.065 > 65 67 S 0.25048856269527 0.27386378893744 0.78175480157152 32.065 > 67 68 S 0.75048856269527 0.27386378893744 0.78175480157152 32.065 > 67 69 S 0.24951143730473 0.77386378893744 0.71824519842848 32.065 > 69 70 S 0.74951143730473 0.77386378893744 0.71824519842848 32.065 > 69 71 S 0.49951143730473 0.72613621106256 0.28175480157152 32.065 > 71 72 S 0.99951143730473 0.72613621106256 0.28175480157152 32.065 > 71 73 S 0.49951143730473 0.77386378893744 0.78175480157152 32.065 > 73 74 S 0.99951143730473 0.77386378893744 0.78175480157152 32.065 > 73 75 S 0.24951143730473 0.72613621106256 0.21824519842848 32.065 > 75 76 S 0.74951143730473 0.72613621106256 0.21824519842848 32.065 > 75 77 S 0.25048856269527 0.22613621106256 0.28175480157152 32.065 > 77 78 S 0.75048856269527 0.22613621106256 0.28175480157152 32.065 > 77 79 S 0.03399149603505 0.42709769754671 0.39214343814871 32.065 > 79 80 S 0.53399149603505 0.42709769754671 0.39214343814871 32.065 > 79 81 In 0.27909527753856 0.44914152142525 0.80321998932025 114.818 > 81 82 In 0.77909527753856 0.44914152142525 0.80321998932025 114.818 > 81 83 In 0.02909527753856 0.05085847857475 0.19678001067975 114.818 > 83 84 In 0.52909527753856 0.05085847857475 0.19678001067975 114.818 > 83 85 In 0.47090472246144 0.55085847857475 0.30321998932025 114.818 > 85 86 In 0.97090472246144 0.55085847857475 0.30321998932025 114.818 > 85 87 In 0.22090472246144 0.94914152142525 0.69678001067975 114.818 > 87 88 In 0.72090472246144 0.94914152142525 0.69678001067975 114.818 > 87 89 In 0.22090472246144 0.55085847857475 0.19678001067975 114.818 > 89 90 In 0.72090472246144 0.55085847857475 0.19678001067975 114.818 > 89 91 In 0.47090472246144 0.94914152142525 0.80321998932025 114.818 > 91 92 In 0.97090472246144 0.94914152142525 0.80321998932025 114.818 > 91 93 In 0.02909527753856 0.44914152142525 0.69678001067975 114.818 > 93 94 In 0.52909527753856 0.44914152142525 0.69678001067975 114.818 > 93 95 In 0.27909527753856 0.05085847857475 0.30321998932025 114.818 > 95 96 In 0.77909527753856 0.05085847857475 0.30321998932025 114.818 > 95 97 In 0.38669180754050 0.02737308677672 0.03508366687249 114.818 > 97 98 In 0.88669180754050 0.02737308677672 0.03508366687249 114.818 > 97 99 In 0.13669180754050 0.47262691322328 0.96491633312751 114.818 > 99 100 In 0.63669180754050 0.47262691322328 0.96491633312751 114.818 > 99 101 In 0.36330819245950 0.97262691322328 0.53508366687249 114.818 > 101 102 In 0.86330819245950 0.97262691322328 0.53508366687249 114.818 > 101 103 In 0.11330819245950 0.52737308677672 0.46491633312751 114.818 > 103 104 In 0.61330819245950 0.52737308677672 0.46491633312751 114.818 > 103 105 In 0.11330819245950 0.97262691322328 0.96491633312751 114.818 > 105 106 In 0.61330819245950 0.97262691322328 0.96491633312751 114.818 > 105 107 In 0.36330819245950 0.52737308677672 0.03508366687249 114.818 > 107 108 In 0.86330819245950 0.52737308677672 0.03508366687249 114.818 > 107 109 In 0.13669180754050 0.02737308677672 0.46491633312751 114.818 > 109 110 In 0.63669180754050 0.02737308677672 0.46491633312751 114.818 > 109 111 In 0.38669180754050 0.47262691322328 0.53508366687249 114.818 > 111 112 In 0.88669180754050 0.47262691322328 0.53508366687249 114.818 > 111 113 Ba 0.37563063013631 0.69134505551688 0.75467898502767 137.327 > 113 114 Ba 0.87563063013631 0.69134505551688 0.75467898502767 137.327 > 113 115 Ba 0.12563063013631 0.80865494448312 0.24532101497233 137.327 > 115 116 Ba 0.62563063013631 0.80865494448312 0.24532101497233 137.327 > 115 117 Ba 0.37436936986369 0.30865494448312 0.25467898502767 137.327 > 117 118 Ba 0.87436936986369 0.30865494448312 0.25467898502767 137.327 > 117 119 Ba 0.12436936986369 0.19134505551688 0.74532101497233 137.327 > 119 120 Ba 0.62436936986369 0.19134505551688 0.74532101497233 137.327 > 119 121 Ba 0.12436936986369 0.30865494448312 0.24532101497233 137.327 > 121 122 Ba 0.62436936986369 0.30865494448312 0.24532101497233 137.327 > 121 123 Ba 0.37436936986369 0.19134505551688 0.75467898502767 137.327 > 123 124 Ba 0.87436936986369 0.19134505551688 0.75467898502767 137.327 > 123 125 Ba 0.12563063013631 0.69134505551688 0.74532101497233 137.327 > 125 126 Ba 0.62563063013631 0.69134505551688 0.74532101497233 137.327 > 125 127 Ba 0.37563063013631 0.80865494448312 0.25467898502767 137.327 > 127 128 Ba 0.87563063013631 0.80865494448312 0.25467898502767 137.327 > 127 129 Ba 0.25291804625423 0.80764058381501 0.97166391260729 137.327 > 129 130 Ba 0.75291804625423 0.80764058381501 0.97166391260729 137.327 > 129 131 Ba 0.00291804625423 0.69235941618499 0.02833608739271 137.327 > 131 132 Ba 0.50291804625423 0.69235941618499 0.02833608739271 137.327 > 131 133 Ba 0.49708195374577 0.19235941618499 0.47166391260729 137.327 > 133 134 Ba 0.99708195374577 0.19235941618499 0.47166391260729 137.327 > 133 135 Ba 0.24708195374577 0.30764058381501 0.52833608739271 137.327 > 135 136 Ba 0.74708195374577 0.30764058381501 0.52833608739271 137.327 > 135 137 Ba 0.24708195374577 0.19235941618499 0.02833608739271 137.327 > 137 138 Ba 0.74708195374577 0.19235941618499 0.02833608739271 137.327 > 137 139 Ba 0.49708195374577 0.30764058381501 0.97166391260729 137.327 > 139 140 Ba 0.99708195374577 0.30764058381501 0.97166391260729 137.327 > 139 141 Ba 0.00291804625423 0.80764058381501 0.52833608739271 137.327 > 141 142 Ba 0.50291804625423 0.80764058381501 0.52833608739271 137.327 > 141 143 Ba 0.25291804625423 0.69235941618499 0.47166391260729 137.327 > 143 144 Ba 0.75291804625423 0.69235941618499 0.47166391260729 137.327 > 143----------------------------------------------------------------------------NAC parameters were read from "phono3py.yaml".--------------------------- Dielectric constant ---------------------------- 5.8246358 0.0000000 0.0000000 0.0000000 5.8510156 0.0000000 0.0000000 0.0000000 5.7379035-------------------------- Born effective charges -------------------------- 1 S -2.1078993 0.0352511 -0.2790731 0.0229185 -1.9200345 -0.2317430 -0.5390123 -0.2414597 -2.4011630 2 S -2.1078993 -0.0352511 0.2790731 -0.0229185 -1.9200345 -0.2317430 0.5390123 -0.2414597 -2.4011630 3 S -2.1078993 0.0352511 0.2790731 0.0229185 -1.9200345 0.2317430 0.5390123 0.2414597 -2.4011630 4 S -2.1078993 -0.0352511 -0.2790731 -0.0229185 -1.9200345 0.2317430 -0.5390123 0.2414597 -2.4011630 5 S -2.1078993 0.0352511 -0.2790731 0.0229185 -1.9200345 -0.2317430 -0.5390123 -0.2414597 -2.4011630 6 S -2.1078993 -0.0352511 0.2790731 -0.0229185 -1.9200345 -0.2317430 0.5390123 -0.2414597 -2.4011630 7 S -2.1078993 0.0352511 0.2790731 0.0229185 -1.9200345 0.2317430 0.5390123 0.2414597 -2.4011630 8 S -2.1078993 -0.0352511 -0.2790731 -0.0229185 -1.9200345 0.2317430 -0.5390123 0.2414597 -2.4011630 9 S -2.1960722 -0.1177169 0.1976906 -0.0585028 -2.2849284 -0.0480603 0.1169938 -0.1489489 -1.9985395 10 S -2.1960722 0.1177169 -0.1976906 0.0585028 -2.2849284 -0.0480603 -0.1169938 -0.1489489 -1.9985395 11 S -2.1960722 -0.1177169 -0.1976906 -0.0585028 -2.2849284 0.0480603 -0.1169938 0.1489489 -1.9985395 12 S -2.1960722 0.1177169 0.1976906 0.0585028 -2.2849284 0.0480603 0.1169938 0.1489489 -1.9985395 13 S -2.1960722 -0.1177169 0.1976906 -0.0585028 -2.2849284 -0.0480603 0.1169938 -0.1489489 -1.9985395 14 S -2.1960722 0.1177169 -0.1976906 0.0585028 -2.2849284 -0.0480603 -0.1169938 -0.1489489 -1.9985395 15 S -2.1960722 -0.1177169 -0.1976906 -0.0585028 -2.2849284 0.0480603 -0.1169938 0.1489489 -1.9985395 16 S -2.1960722 0.1177169 0.1976906 0.0585028 -2.2849284 0.0480603 0.1169938 0.1489489 -1.9985395 17 S -2.5248507 0.0451465 0.3617051 0.0583319 -2.0276081 -0.1251134 0.3857942 -0.1272551 -1.6852504 18 S -2.1255354 -0.1784213 0.1063041 -0.2209374 -2.1735160 0.0688584 0.2303822 -0.0070581 -2.0703442 19 S -2.5248507 -0.0451465 -0.3617051 -0.0583319 -2.0276081 -0.1251134 -0.3857942 -0.1272551 -1.6852504 20 S -2.5248507 -0.0451465 0.3617051 -0.0583319 -2.0276081 0.1251134 0.3857942 0.1272551 -1.6852504 21 S -2.5248507 0.0451465 0.3617051 0.0583319 -2.0276081 -0.1251134 0.3857942 -0.1272551 -1.6852504 22 S -2.5248507 -0.0451465 -0.3617051 -0.0583319 -2.0276081 -0.1251134 -0.3857942 -0.1272551 -1.6852504 23 S -2.5248507 0.0451465 -0.3617051 0.0583319 -2.0276081 0.1251134 -0.3857942 0.1272551 -1.6852504 24 S -2.5248507 -0.0451465 0.3617051 -0.0583319 -2.0276081 0.1251134 0.3857942 0.1272551 -1.6852504 25 S -2.2014977 0.0520504 -0.3819732 -0.0243833 -2.0187189 0.2097204 -0.3149892 0.2647223 -2.7017608 26 S -2.2014977 -0.0520504 0.3819732 0.0243833 -2.0187189 0.2097204 0.3149892 0.2647223 -2.7017608 27 S -2.2014977 0.0520504 0.3819732 -0.0243833 -2.0187189 -0.2097204 0.3149892 -0.2647223 -2.7017608 28 S -2.2014977 -0.0520504 -0.3819732 0.0243833 -2.0187189 -0.2097204 -0.3149892 -0.2647223 -2.7017608 29 S -2.2014977 0.0520504 -0.3819732 -0.0243833 -2.0187189 0.2097204 -0.3149892 0.2647223 -2.7017608 30 S -2.2014977 -0.0520504 0.3819732 0.0243833 -2.0187189 0.2097204 0.3149892 0.2647223 -2.7017608 31 S -2.2014977 0.0520504 0.3819732 -0.0243833 -2.0187189 -0.2097204 0.3149892 -0.2647223 -2.7017608 32 S -2.2014977 -0.0520504 -0.3819732 0.0243833 -2.0187189 -0.2097204 -0.3149892 -0.2647223 -2.7017608 33 S -2.1255354 0.1784213 0.1063041 0.2209374 -2.1735160 -0.0688584 0.2303822 0.0070581 -2.0703442 34 S -2.1255354 -0.1784213 -0.1063041 -0.2209374 -2.1735160 -0.0688584 -0.2303822 0.0070581 -2.0703442 35 S -2.1255354 0.1784213 -0.1063041 0.2209374 -2.1735160 0.0688584 -0.2303822 -0.0070581 -2.0703442 36 S -2.1255354 -0.1784213 0.1063041 -0.2209374 -2.1735160 0.0688584 0.2303822 -0.0070581 -2.0703442 37 S -2.1255354 0.1784213 0.1063041 0.2209374 -2.1735160 -0.0688584 0.2303822 0.0070581 -2.0703442 38 S -2.1255354 -0.1784213 -0.1063041 -0.2209374 -2.1735160 -0.0688584 -0.2303822 0.0070581 -2.0703442 39 S -2.1255354 0.1784213 -0.1063041 0.2209374 -2.1735160 0.0688584 -0.2303822 -0.0070581 -2.0703442 40 S -2.5248507 0.0451465 -0.3617051 0.0583319 -2.0276081 0.1251134 -0.3857942 0.1272551 -1.6852504 41 In 2.8066336 -0.1212765 -0.4698735 0.1439316 2.5117308 0.0136405 0.3943264 0.0612191 2.8354543 42 In 2.8066336 0.1212765 0.4698735 -0.1439316 2.5117308 0.0136405 -0.3943264 0.0612191 2.8354543 43 In 2.8066336 -0.1212765 0.4698735 0.1439316 2.5117308 -0.0136405 -0.3943264 -0.0612191 2.8354543 44 In 2.8066336 0.1212765 -0.4698735 -0.1439316 2.5117308 -0.0136405 0.3943264 -0.0612191 2.8354543 45 In 2.8066336 -0.1212765 -0.4698735 0.1439316 2.5117308 0.0136405 0.3943264 0.0612191 2.8354543 46 In 2.8066336 0.1212765 0.4698735 -0.1439316 2.5117308 0.0136405 -0.3943264 0.0612191 2.8354543 47 In 2.8066336 -0.1212765 0.4698735 0.1439316 2.5117308 -0.0136405 -0.3943264 -0.0612191 2.8354543 48 In 2.8066336 0.1212765 -0.4698735 -0.1439316 2.5117308 -0.0136405 0.3943264 -0.0612191 2.8354543 49 In 2.7852591 -0.3649330 -0.3195485 -0.0684048 2.5090464 0.0262323 -0.1092653 -0.1693841 2.7080671 50 In 2.7852591 0.3649330 0.3195485 0.0684048 2.5090464 0.0262323 0.1092653 -0.1693841 2.7080671 51 In 2.7852591 -0.3649330 0.3195485 -0.0684048 2.5090464 -0.0262323 0.1092653 0.1693841 2.7080671 52 In 2.7852591 0.3649330 -0.3195485 0.0684048 2.5090464 -0.0262323 -0.1092653 0.1693841 2.7080671 53 In 2.7852591 -0.3649330 -0.3195485 -0.0684048 2.5090464 0.0262323 -0.1092653 -0.1693841 2.7080671 54 In 2.7852591 0.3649330 0.3195485 0.0684048 2.5090464 0.0262323 0.1092653 -0.1693841 2.7080671 55 In 2.7852591 -0.3649330 0.3195485 -0.0684048 2.5090464 -0.0262323 0.1092653 0.1693841 2.7080671 56 In 2.7852591 0.3649330 -0.3195485 0.0684048 2.5090464 -0.0262323 -0.1092653 0.1693841 2.7080671 57 Ba 2.6777465 0.1588165 -0.0047305 -0.0059731 2.7315363 -0.0841459 0.0514852 0.0288035 2.6075466 58 Ba 2.6777465 -0.1588165 0.0047305 0.0059731 2.7315363 -0.0841459 -0.0514852 0.0288035 2.6075466 59 Ba 2.6777465 0.1588165 0.0047305 -0.0059731 2.7315363 0.0841459 -0.0514852 -0.0288035 2.6075466 60 Ba 2.6777465 -0.1588165 -0.0047305 0.0059731 2.7315363 0.0841459 0.0514852 -0.0288035 2.6075466 61 Ba 2.6777465 0.1588165 -0.0047305 -0.0059731 2.7315363 -0.0841459 0.0514852 0.0288035 2.6075466 62 Ba 2.6777465 -0.1588165 0.0047305 0.0059731 2.7315363 -0.0841459 -0.0514852 0.0288035 2.6075466 63 Ba 2.6777465 0.1588165 0.0047305 -0.0059731 2.7315363 0.0841459 -0.0514852 -0.0288035 2.6075466 64 Ba 2.6777465 -0.1588165 -0.0047305 0.0059731 2.7315363 0.0841459 0.0514852 -0.0288035 2.6075466 65 Ba 2.8862160 0.0845467 0.2741894 -0.2298185 2.6724924 -0.0964670 0.4828050 0.0852103 2.7059899 66 Ba 2.8862160 -0.0845467 -0.2741894 0.2298185 2.6724924 -0.0964670 -0.4828050 0.0852103 2.7059899 67 Ba 2.8862160 0.0845467 -0.2741894 -0.2298185 2.6724924 0.0964670 -0.4828050 -0.0852103 2.7059899 68 Ba 2.8862160 -0.0845467 0.2741894 0.2298185 2.6724924 0.0964670 0.4828050 -0.0852103 2.7059899 69 Ba 2.8862160 0.0845467 0.2741894 -0.2298185 2.6724924 -0.0964670 0.4828050 0.0852103 2.7059899 70 Ba 2.8862160 -0.0845467 -0.2741894 0.2298185 2.6724924 -0.0964670 -0.4828050 0.0852103 2.7059899 71 Ba 2.8862160 0.0845467 -0.2741894 -0.2298185 2.6724924 0.0964670 -0.4828050 -0.0852103 2.7059899 72 Ba 2.8862160 -0.0845467 0.2741894 0.2298185 2.6724924 0.0964670 0.4828050 -0.0852103 2.7059899----------------------------------------------------------------------------fc3 was read from "fc3.hdf5".fc2 was read from "fc2.hdf5".----------------------------- Force constants ------------------------------Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy)Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- Calculation settings ---------------------------Non-analytical term correction (NAC): TrueNAC unit conversion factor: 14.39965BZ integration: Tetrahedron-methodTemperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0Cutoff frequency: 0.01Frequency conversion factor to THz: 15.63330Length for sampling mesh generation: 50.00Generating grid system ... [ 4 4 4 ]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: 0.33, Number of G-points: 299, Lambda: 0.08Running harmonic phonon calculations...-------------------- Lattice thermal conductivity (RTA) --------------------======================= Grid point 0 (1/27) =======================q-point: ( 0.00 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 27Calculating Gamma of ph-isotope with tetrahedron methodFrequency 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 1.098 ( 0.000 0.000 0.000) 0.000 1.180 ( 0.000 0.000 0.000) 0.000 1.286 ( 0.000 0.000 0.000) 0.000 1.332 ( 0.000 0.000 0.000) 0.000 1.335 ( 0.000 0.000 0.000) 0.000 1.343 ( 0.000 0.000 0.000) 0.000 1.375 ( 0.000 0.000 0.000) 0.000 1.386 ( 0.000 0.000 0.000) 0.000 1.399 ( 0.000 0.000 0.000) 0.000 1.435 ( 0.000 0.000 0.000) 0.000 1.443 ( 0.000 0.000 0.000) 0.000 1.468 ( 0.000 0.000 0.000) 0.000 1.488 ( 0.000 0.000 0.000) 0.000 1.521 ( 0.000 0.000 0.000) 0.000 1.571 ( 0.000 0.000 0.000) 0.000 1.586 ( 0.000 0.000 0.000) 0.000 1.600 ( 0.000 0.000 0.000) 0.000 1.606 ( 0.000 0.000 0.000) 0.000 1.630 ( 0.000 0.000 0.000) 0.000 1.659 ( 0.000 0.000 0.000) 0.000 1.677 ( 0.000 0.000 0.000) 0.000 1.766 ( 0.000 0.000 0.000) 0.000 1.768 ( 0.000 0.000 0.000) 0.000 1.770 ( 0.000 0.000 0.000) 0.000 1.773 ( 0.000 0.000 0.000) 0.000 1.827 ( 0.000 0.000 0.000) 0.000 1.848 ( 0.000 0.000 0.000) 0.000 1.856 ( 0.000 0.000 0.000) 0.000 1.881 ( 0.000 0.000 0.000) 0.000 1.887 ( 0.000 0.000 0.000) 0.000 1.944 ( 0.000 0.000 0.000) 0.000 1.955 ( 0.000 0.000 0.000) 0.000 1.970 ( 0.000 0.000 0.000) 0.000 1.976 ( 0.000 0.000 0.000) 0.000 2.015 ( 0.000 0.000 0.000) 0.000 2.037 ( 0.000 0.000 0.000) 0.000 2.067 ( 0.000 0.000 0.000) 0.000 2.087 ( 0.000 0.000 0.000) 0.000 2.109 ( 0.000 0.000 0.000) 0.000 2.110 ( 0.000 0.000 0.000) 0.000 2.115 ( 0.000 0.000 0.000) 0.000 2.124 ( 0.000 0.000 0.000) 0.000 2.162 ( 0.000 0.000 0.000) 0.000 2.183 ( 0.000 0.000 0.000) 0.000 2.200 ( 0.000 0.000 0.000) 0.000 2.213 ( 0.000 0.000 0.000) 0.000 2.257 ( 0.000 0.000 0.000) 0.000 2.277 ( 0.000 0.000 0.000) 0.000 2.278 ( 0.000 0.000 0.000) 0.000 2.295 ( 0.000 0.000 0.000) 0.000 2.312 ( 0.000 0.000 0.000) 0.000 2.324 ( 0.000 0.000 0.000) 0.000 2.353 ( 0.000 0.000 0.000) 0.000 2.356 ( 0.000 0.000 0.000) 0.000 2.389 ( 0.000 0.000 0.000) 0.000 2.402 ( 0.000 0.000 0.000) 0.000 2.412 ( 0.000 0.000 0.000) 0.000 2.433 ( 0.000 0.000 0.000) 0.000 2.452 ( 0.000 0.000 0.000) 0.000 2.500 ( 0.000 0.000 0.000) 0.000 2.549 ( 0.000 0.000 0.000) 0.000 2.557 ( 0.000 0.000 0.000) 0.000 2.668 ( 0.000 0.000 0.000) 0.000 2.698 ( 0.000 0.000 0.000) 0.000 2.750 ( 0.000 0.000 0.000) 0.000 2.784 ( 0.000 0.000 0.000) 0.000 2.789 ( 0.000 0.000 0.000) 0.000 2.835 ( 0.000 0.000 0.000) 0.000 2.867 ( 0.000 0.000 0.000) 0.000 2.920 ( 0.000 0.000 0.000) 0.000 2.932 ( 0.000 0.000 0.000) 0.000 2.950 ( 0.000 0.000 0.000) 0.000 2.986 ( 0.000 0.000 0.000) 0.000 2.994 ( 0.000 0.000 0.000) 0.000 2.994 ( 0.000 0.000 0.000) 0.000 3.005 ( 0.000 0.000 0.000) 0.000 3.022 ( 0.000 0.000 0.000) 0.000 3.040 ( 0.000 0.000 0.000) 0.000 3.069 ( 0.000 0.000 0.000) 0.000 3.137 ( 0.000 0.000 0.000) 0.000 3.156 ( 0.000 0.000 0.000) 0.000 3.217 ( 0.000 0.000 0.000) 0.000 3.262 ( 0.000 0.000 0.000) 0.000 3.315 ( 0.000 0.000 0.000) 0.000 3.397 ( 0.000 0.000 0.000) 0.000 3.479 ( 0.000 0.000 0.000) 0.000 3.499 ( 0.000 0.000 0.000) 0.000 3.511 ( 0.000 0.000 0.000) 0.000 3.587 ( 0.000 0.000 0.000) 0.000 3.608 ( 0.000 0.000 0.000) 0.000 3.627 ( 0.000 0.000 0.000) 0.000 3.660 ( 0.000 0.000 0.000) 0.000 3.696 ( 0.000 0.000 0.000) 0.000 3.705 ( 0.000 0.000 0.000) 0.000 3.743 ( 0.000 0.000 0.000) 0.000 3.768 ( 0.000 0.000 0.000) 0.000 3.804 ( 0.000 0.000 0.000) 0.000 3.935 ( 0.000 0.000 0.000) 0.000 3.952 ( 0.000 0.000 0.000) 0.000 3.986 ( 0.000 0.000 0.000) 0.000 4.012 ( 0.000 0.000 0.000) 0.000 4.056 ( 0.000 0.000 0.000) 0.000 4.086 ( 0.000 0.000 0.000) 0.000 4.093 ( 0.000 0.000 0.000) 0.000 4.095 ( 0.000 0.000 0.000) 0.000 4.237 ( 0.000 0.000 0.000) 0.000 4.286 ( 0.000 0.000 0.000) 0.000 4.383 ( 0.000 0.000 0.000) 0.000 4.418 ( 0.000 0.000 0.000) 0.000 4.432 ( 0.000 0.000 0.000) 0.000 4.461 ( 0.000 0.000 0.000) 0.000 4.469 ( 0.000 0.000 0.000) 0.000 4.668 ( 0.000 0.000 0.000) 0.000 4.733 ( 0.000 0.000 0.000) 0.000 4.737 ( 0.000 0.000 0.000) 0.000 4.775 ( 0.000 0.000 0.000) 0.000 4.785 ( 0.000 0.000 0.000) 0.000 4.786 ( 0.000 0.000 0.000) 0.000 4.799 ( 0.000 0.000 0.000) 0.000 4.865 ( 0.000 0.000 0.000) 0.000 4.897 ( 0.000 0.000 0.000) 0.000 4.924 ( 0.000 0.000 0.000) 0.000 4.945 ( 0.000 0.000 0.000) 0.000 5.015 ( 0.000 0.000 0.000) 0.000 5.020 ( 0.000 0.000 0.000) 0.000 5.025 ( 0.000 0.000 0.000) 0.000 5.049 ( 0.000 0.000 0.000) 0.000 5.082 ( 0.000 0.000 0.000) 0.000 5.205 ( 0.000 0.000 0.000) 0.000 5.266 ( 0.000 0.000 0.000) 0.000 5.343 ( 0.000 0.000 0.000) 0.000 5.385 ( 0.000 0.000 0.000) 0.000 5.593 ( 0.000 0.000 0.000) 0.000 5.656 ( 0.000 0.000 0.000) 0.000 5.709 ( 0.000 0.000 0.000) 0.000 5.732 ( 0.000 0.000 0.000) 0.000 5.739 ( 0.000 0.000 0.000) 0.000 5.749 ( 0.000 0.000 0.000) 0.000 5.814 ( 0.000 0.000 0.000) 0.000 5.916 ( 0.000 0.000 0.000) 0.000 5.953 ( 0.000 0.000 0.000) 0.000 6.302 ( 0.000 0.000 0.000) 0.000 6.305 ( 0.000 0.000 0.000) 0.000 6.334 ( 0.000 0.000 0.000) 0.000 6.337 ( 0.000 0.000 0.000) 0.000 6.419 ( 0.000 0.000 0.000) 0.000 6.487 ( 0.000 0.000 0.000) 0.000 6.602 ( 0.000 0.000 0.000) 0.000 6.610 ( 0.000 0.000 0.000) 0.000 7.680 ( 0.000 0.000 0.000) 0.000 7.701 ( 0.000 0.000 0.000) 0.000 7.705 ( 0.000 0.000 0.000) 0.000 7.767 ( 0.000 0.000 0.000) 0.000 7.768 ( 0.000 0.000 0.000) 0.000 7.781 ( 0.000 0.000 0.000) 0.000 7.810 ( 0.000 0.000 0.000) 0.000 7.834 ( 0.000 0.000 0.000) 0.000 7.852 ( 0.000 0.000 0.000) 0.000 7.881 ( 0.000 0.000 0.000) 0.000 7.901 ( 0.000 0.000 0.000) 0.000 7.919 ( 0.000 0.000 0.000) 0.000 8.003 ( 0.000 0.000 0.000) 0.000 8.009 ( 0.000 0.000 0.000) 0.000 8.050 ( 0.000 0.000 0.000) 0.000 8.106 ( 0.000 0.000 0.000) 0.000 8.139 ( 0.000 0.000 0.000) 0.000 8.160 ( 0.000 0.000 0.000) 0.000 8.189 ( 0.000 0.000 0.000) 0.000 8.276 ( 0.000 0.000 0.000) 0.000 8.301 ( 0.000 0.000 0.000) 0.000 8.302 ( 0.000 0.000 0.000) 0.000 8.311 ( 0.000 0.000 0.000) 0.000 8.374 ( 0.000 0.000 0.000) 0.000 8.426 ( 0.000 0.000 0.000) 0.000 8.488 ( 0.000 0.000 0.000) 0.000 8.554 ( 0.000 0.000 0.000) 0.000 8.567 ( 0.000 0.000 0.000) 0.000 8.590 ( 0.000 0.000 0.000) 0.000 8.609 ( 0.000 0.000 0.000) 0.000 8.616 ( 0.000 0.000 0.000) 0.000 8.692 ( 0.000 0.000 0.000) 0.000 8.874 ( 0.000 0.000 0.000) 0.000 8.999 ( 0.000 0.000 0.000) 0.000 9.013 ( 0.000 0.000 0.000) 0.000 9.062 ( 0.000 0.000 0.000) 0.000 9.110 ( 0.000 0.000 0.000) 0.000 9.174 ( 0.000 0.000 0.000) 0.000 9.258 ( 0.000 0.000 0.000) 0.000 9.305 ( 0.000 0.000 0.000) 0.000 9.358 ( 0.000 0.000 0.000) 0.000 9.391 ( 0.000 0.000 0.000) 0.000 9.400 ( 0.000 0.000 0.000) 0.000 9.425 ( 0.000 0.000 0.000) 0.000 9.479 ( 0.000 0.000 0.000) 0.000 9.546 ( 0.000 0.000 0.000) 0.000 9.555 ( 0.000 0.000 0.000) 0.000 9.561 ( 0.000 0.000 0.000) 0.000 9.617 ( 0.000 0.000 0.000) 0.000 9.667 ( 0.000 0.000 0.000) 0.000 9.706 ( 0.000 0.000 0.000) 0.000 9.711 ( 0.000 0.000 0.000) 0.000 9.725 ( 0.000 0.000 0.000) 0.000 9.811 ( 0.000 0.000 0.000) 0.000 9.834 ( 0.000 0.000 0.000) 0.000 9.856 ( 0.000 0.000 0.000) 0.000 9.944 ( 0.000 0.000 0.000) 0.000 9.986 ( 0.000 0.000 0.000) 0.000 10.014 ( 0.000 0.000 0.000) 0.000 10.026 ( 0.000 0.000 0.000) 0.000 10.063 ( 0.000 0.000 0.000) 0.000 10.067 ( 0.000 0.000 0.000) 0.000 10.272 ( 0.000 0.000 0.000) 0.000 10.330 ( 0.000 0.000 0.000) 0.000======================= Grid point 1 (2/27) =======================q-point: ( 0.25 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 18Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.405 ( 18.759 0.000 0.000) 18.759 0.460 ( 20.985 0.000 0.000) 20.985 0.688 ( 29.161 0.000 0.000) 29.161 1.134 ( -12.838 0.000 0.000) 12.838 1.142 ( 0.626 0.000 0.000) 0.626 1.273 ( -0.416 0.000 0.000) 0.416 1.296 ( 0.337 0.000 0.000) 0.337 1.299 ( -3.328 0.000 0.000) 3.328 1.333 ( -7.453 0.000 0.000) 7.453 1.335 ( 1.428 0.000 0.000) 1.428 1.373 ( 2.294 0.000 0.000) 2.294 1.410 ( 3.274 0.000 0.000) 3.274 1.427 ( -0.103 0.000 0.000) 0.103 1.439 ( 2.443 0.000 0.000) 2.443 1.443 ( 0.688 0.000 0.000) 0.688 1.498 ( 5.867 0.000 0.000) 5.867 1.528 ( 0.692 0.000 0.000) 0.692 1.570 ( -2.907 0.000 0.000) 2.907 1.637 ( 1.456 0.000 0.000) 1.456 1.652 ( -2.277 0.000 0.000) 2.277 1.669 ( 1.708 0.000 0.000) 1.708 1.672 ( 3.183 0.000 0.000) 3.183 1.692 ( -2.627 0.000 0.000) 2.627 1.700 ( 3.893 0.000 0.000) 3.893 1.721 ( 2.843 0.000 0.000) 2.843 1.793 ( 6.166 0.000 0.000) 6.166 1.804 ( 0.283 0.000 0.000) 0.283 1.828 ( 4.857 0.000 0.000) 4.857 1.834 ( -3.877 0.000 0.000) 3.877 1.837 ( -3.835 0.000 0.000) 3.835 1.848 ( -3.417 0.000 0.000) 3.417 1.887 ( 3.196 0.000 0.000) 3.196 1.898 ( 1.030 0.000 0.000) 1.030 1.915 ( -0.832 0.000 0.000) 0.832 1.920 ( -1.943 0.000 0.000) 1.943 1.931 ( 0.012 0.000 0.000) 0.012 1.974 ( 1.280 0.000 0.000) 1.280 2.021 ( -5.622 0.000 0.000) 5.622 2.022 ( 1.526 0.000 0.000) 1.526 2.065 ( -4.568 0.000 0.000) 4.568 2.091 ( -1.281 0.000 0.000) 1.281 2.110 ( 3.665 0.000 0.000) 3.665 2.120 ( -2.276 0.000 0.000) 2.276 2.126 ( 1.031 0.000 0.000) 1.031 2.147 ( 1.782 0.000 0.000) 1.782 2.148 ( 4.961 0.000 0.000) 4.961 2.181 ( 0.956 0.000 0.000) 0.956 2.191 ( -1.907 0.000 0.000) 1.907 2.204 ( 0.118 0.000 0.000) 0.118 2.251 ( -2.153 0.000 0.000) 2.153 2.260 ( -0.481 0.000 0.000) 0.481 2.281 ( -0.955 0.000 0.000) 0.955 2.285 ( -1.885 0.000 0.000) 1.885 2.287 ( -5.033 0.000 0.000) 5.033 2.328 ( -2.724 0.000 0.000) 2.724 2.355 ( 0.693 0.000 0.000) 0.693 2.362 ( 0.088 0.000 0.000) 0.088 2.391 ( 6.661 0.000 0.000) 6.661 2.421 ( -1.734 0.000 0.000) 1.734 2.438 ( 8.251 0.000 0.000) 8.251 2.463 ( 1.633 0.000 0.000) 1.633 2.484 ( -3.262 0.000 0.000) 3.262 2.504 ( 1.219 0.000 0.000) 1.219 2.556 ( -0.199 0.000 0.000) 0.199 2.626 ( 7.399 0.000 0.000) 7.399 2.677 ( -5.573 0.000 0.000) 5.573 2.717 ( 1.003 0.000 0.000) 1.003 2.760 ( 5.909 0.000 0.000) 5.909 2.784 ( -0.062 0.000 0.000) 0.062 2.802 ( 7.154 0.000 0.000) 7.154 2.830 ( 1.191 0.000 0.000) 1.191 2.837 ( -3.315 0.000 0.000) 3.315 2.924 ( -0.059 0.000 0.000) 0.059 2.928 ( -5.869 0.000 0.000) 5.869 2.962 ( 2.259 0.000 0.000) 2.259 2.969 ( 1.998 0.000 0.000) 1.998 2.988 ( 0.387 0.000 0.000) 0.387 2.994 ( -0.651 0.000 0.000) 0.651 3.014 ( 1.833 0.000 0.000) 1.833 3.059 ( -7.818 0.000 0.000) 7.818 3.069 ( -0.103 0.000 0.000) 0.103 3.074 ( 0.853 0.000 0.000) 0.853 3.086 ( 3.841 0.000 0.000) 3.841 3.184 ( 3.299 0.000 0.000) 3.299 3.218 ( -7.089 0.000 0.000) 7.089 3.219 ( -5.415 0.000 0.000) 5.415 3.249 ( -0.368 0.000 0.000) 0.368 3.389 ( -3.979 0.000 0.000) 3.979 3.446 ( 5.787 0.000 0.000) 5.787 3.457 ( -4.341 0.000 0.000) 4.341 3.515 ( -0.432 0.000 0.000) 0.432 3.522 ( -8.200 0.000 0.000) 8.200 3.604 ( -0.246 0.000 0.000) 0.246 3.673 ( 2.266 0.000 0.000) 2.266 3.676 ( 1.149 0.000 0.000) 1.149 3.688 ( -2.158 0.000 0.000) 2.158 3.694 ( 0.237 0.000 0.000) 0.237 3.746 ( -0.807 0.000 0.000) 0.807 3.749 ( -0.130 0.000 0.000) 0.130 3.838 ( -2.654 0.000 0.000) 2.654 3.931 ( 0.453 0.000 0.000) 0.453 3.960 ( 0.755 0.000 0.000) 0.755 3.978 ( -0.075 0.000 0.000) 0.075 4.001 ( -1.192 0.000 0.000) 1.192 4.019 ( -2.750 0.000 0.000) 2.750 4.042 ( -1.330 0.000 0.000) 1.330 4.101 ( 0.470 0.000 0.000) 0.470 4.123 ( 0.082 0.000 0.000) 0.082 4.262 ( 2.035 0.000 0.000) 2.035 4.312 ( 1.517 0.000 0.000) 1.517 4.377 ( -0.007 0.000 0.000) 0.007 4.422 ( 0.169 0.000 0.000) 0.169 4.430 ( 0.586 0.000 0.000) 0.586 4.456 ( -1.159 0.000 0.000) 1.159 4.462 ( -0.149 0.000 0.000) 0.149 4.612 ( -4.841 0.000 0.000) 4.841 4.699 ( -1.236 0.000 0.000) 1.236 4.730 ( -2.823 0.000 0.000) 2.823 4.750 ( 0.017 0.000 0.000) 0.017 4.787 ( 2.841 0.000 0.000) 2.841 4.840 ( -2.349 0.000 0.000) 2.349 4.851 ( 3.832 0.000 0.000) 3.832 4.859 ( 2.959 0.000 0.000) 2.959 4.917 ( -1.345 0.000 0.000) 1.345 4.936 ( 0.799 0.000 0.000) 0.799 4.976 ( 5.011 0.000 0.000) 5.011 4.991 ( -2.148 0.000 0.000) 2.148 5.036 ( 1.404 0.000 0.000) 1.404 5.037 ( 1.211 0.000 0.000) 1.211 5.048 ( -0.082 0.000 0.000) 0.082 5.100 ( -1.670 0.000 0.000) 1.670 5.182 ( -2.045 0.000 0.000) 2.045 5.216 ( -5.752 0.000 0.000) 5.752 5.222 ( -3.525 0.000 0.000) 3.525 5.348 ( -5.595 0.000 0.000) 5.595 5.499 ( -11.590 0.000 0.000) 11.590 5.680 ( 5.824 0.000 0.000) 5.824 5.765 ( 1.256 0.000 0.000) 1.256 5.780 ( 4.961 0.000 0.000) 4.961 5.835 ( 1.690 0.000 0.000) 1.690 5.838 ( 5.624 0.000 0.000) 5.624 5.922 ( -0.921 0.000 0.000) 0.921 5.941 ( 0.200 0.000 0.000) 0.200 5.964 ( -3.362 0.000 0.000) 3.362 6.352 ( 1.859 0.000 0.000) 1.859 6.370 ( 2.458 0.000 0.000) 2.458 6.416 ( -0.084 0.000 0.000) 0.084 6.440 ( 8.898 0.000 0.000) 8.898 6.460 ( -2.227 0.000 0.000) 2.227 6.616 ( 0.434 0.000 0.000) 0.434 6.630 ( 1.426 0.000 0.000) 1.426 6.699 ( -1.781 0.000 0.000) 1.781 7.679 ( -0.014 0.000 0.000) 0.014 7.697 ( -0.658 0.000 0.000) 0.658 7.708 ( 0.800 0.000 0.000) 0.800 7.759 ( -1.390 0.000 0.000) 1.390 7.817 ( 2.835 0.000 0.000) 2.835 7.828 ( 1.039 0.000 0.000) 1.039 7.843 ( 0.798 0.000 0.000) 0.798 7.851 ( -0.014 0.000 0.000) 0.014 7.886 ( -1.070 0.000 0.000) 1.070 7.895 ( 1.237 0.000 0.000) 1.237 7.914 ( -1.557 0.000 0.000) 1.557 7.925 ( 0.266 0.000 0.000) 0.266 8.042 ( 4.149 0.000 0.000) 4.149 8.067 ( 1.442 0.000 0.000) 1.442 8.117 ( 0.870 0.000 0.000) 0.870 8.139 ( -1.366 0.000 0.000) 1.366 8.145 ( 0.467 0.000 0.000) 0.467 8.213 ( 2.024 0.000 0.000) 2.024 8.238 ( 1.302 0.000 0.000) 1.302 8.268 ( -0.645 0.000 0.000) 0.645 8.282 ( -2.293 0.000 0.000) 2.293 8.297 ( -0.562 0.000 0.000) 0.562 8.354 ( -2.401 0.000 0.000) 2.401 8.355 ( -1.328 0.000 0.000) 1.328 8.483 ( -0.312 0.000 0.000) 0.312 8.491 ( 3.261 0.000 0.000) 3.261 8.530 ( -1.937 0.000 0.000) 1.937 8.581 ( 1.447 0.000 0.000) 1.447 8.603 ( 0.334 0.000 0.000) 0.334 8.626 ( 0.961 0.000 0.000) 0.961 8.672 ( -1.028 0.000 0.000) 1.028 8.756 ( -2.856 0.000 0.000) 2.856 8.907 ( 2.479 0.000 0.000) 2.479 8.961 ( -0.524 0.000 0.000) 0.524 9.056 ( -4.040 0.000 0.000) 4.040 9.130 ( 3.762 0.000 0.000) 3.762 9.144 ( -3.903 0.000 0.000) 3.903 9.250 ( -4.515 0.000 0.000) 4.515 9.250 ( -0.051 0.000 0.000) 0.051 9.297 ( -1.918 0.000 0.000) 1.918 9.338 ( 2.013 0.000 0.000) 2.013 9.417 ( -0.833 0.000 0.000) 0.833 9.435 ( 5.638 0.000 0.000) 5.638 9.493 ( 1.055 0.000 0.000) 1.055 9.510 ( 3.488 0.000 0.000) 3.488 9.537 ( -0.788 0.000 0.000) 0.788 9.557 ( 0.044 0.000 0.000) 0.044 9.634 ( -1.173 0.000 0.000) 1.173 9.646 ( 2.578 0.000 0.000) 2.578 9.683 ( -1.723 0.000 0.000) 1.723 9.688 ( 1.659 0.000 0.000) 1.659 9.698 ( -1.126 0.000 0.000) 1.126 9.800 ( -0.939 0.000 0.000) 0.939 9.824 ( -2.522 0.000 0.000) 2.522 9.836 ( 0.149 0.000 0.000) 0.149 9.862 ( -1.253 0.000 0.000) 1.253 9.952 ( 1.109 0.000 0.000) 1.109 9.990 ( 0.479 0.000 0.000) 0.479 10.014 ( -0.119 0.000 0.000) 0.119 10.015 ( -1.033 0.000 0.000) 1.033 10.104 ( 3.169 0.000 0.000) 3.169 10.119 ( 4.321 0.000 0.000) 4.321 10.280 ( -3.500 0.000 0.000) 3.500 10.300 ( -2.805 0.000 0.000) 2.805======================= Grid point 2 (3/27) =======================q-point: (-0.50 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 18Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.791 ( -17.543 0.000 0.000) 17.543 0.791 ( 17.543 0.000 0.000) 17.543 0.865 ( -15.491 0.000 0.000) 15.491 0.865 ( 15.491 0.000 0.000) 15.491 1.195 ( -7.869 0.000 0.000) 7.869 1.195 ( 7.869 0.000 0.000) 7.869 1.288 ( -0.811 0.000 0.000) 0.811 1.288 ( 0.811 0.000 0.000) 0.811 1.373 ( -1.338 0.000 0.000) 1.338 1.373 ( 1.338 0.000 0.000) 1.338 1.385 ( -9.534 0.000 0.000) 9.534 1.385 ( 9.534 0.000 0.000) 9.534 1.450 ( -1.088 0.000 0.000) 1.088 1.450 ( 1.088 0.000 0.000) 1.088 1.530 ( -0.646 0.000 0.000) 0.646 1.530 ( 0.646 0.000 0.000) 0.646 1.537 ( -3.172 0.000 0.000) 3.172 1.537 ( 3.172 0.000 0.000) 3.172 1.630 ( -1.248 0.000 0.000) 1.248 1.630 ( 1.248 0.000 0.000) 1.248 1.683 ( -0.775 0.000 0.000) 0.775 1.683 ( 0.775 0.000 0.000) 0.775 1.720 ( -3.384 0.000 0.000) 3.384 1.720 ( 3.384 0.000 0.000) 3.384 1.750 ( -3.430 0.000 0.000) 3.430 1.750 ( 3.430 0.000 0.000) 3.430 1.804 ( -2.242 0.000 0.000) 2.242 1.804 ( 2.242 0.000 0.000) 2.242 1.833 ( -6.268 0.000 0.000) 6.268 1.833 ( 6.268 0.000 0.000) 6.268 1.892 ( -0.993 0.000 0.000) 0.993 1.892 ( 0.993 0.000 0.000) 0.993 1.918 ( -0.741 0.000 0.000) 0.741 1.918 ( 0.741 0.000 0.000) 0.741 1.923 ( -0.838 0.000 0.000) 0.838 1.923 ( 0.838 0.000 0.000) 0.838 1.943 ( -4.041 0.000 0.000) 4.041 1.943 ( 4.041 0.000 0.000) 4.041 2.042 ( -0.451 0.000 0.000) 0.451 2.042 ( 0.451 0.000 0.000) 0.451 2.119 ( -4.323 0.000 0.000) 4.323 2.119 ( 4.323 0.000 0.000) 4.323 2.129 ( -4.211 0.000 0.000) 4.211 2.129 ( 4.211 0.000 0.000) 4.211 2.151 ( -1.368 0.000 0.000) 1.368 2.151 ( 1.368 0.000 0.000) 1.368 2.190 ( -3.367 0.000 0.000) 3.367 2.190 ( 3.367 0.000 0.000) 3.367 2.232 ( -2.096 0.000 0.000) 2.096 2.232 ( 2.096 0.000 0.000) 2.096 2.235 ( -2.217 0.000 0.000) 2.217 2.235 ( 2.217 0.000 0.000) 2.217 2.277 ( -2.431 0.000 0.000) 2.431 2.277 ( 2.431 0.000 0.000) 2.431 2.300 ( -6.679 0.000 0.000) 6.679 2.300 ( 6.679 0.000 0.000) 6.679 2.369 ( -0.200 0.000 0.000) 0.200 2.369 ( 0.200 0.000 0.000) 0.200 2.505 ( -0.302 0.000 0.000) 0.302 2.505 ( 0.302 0.000 0.000) 0.302 2.520 ( -3.759 0.000 0.000) 3.759 2.520 ( 3.759 0.000 0.000) 3.759 2.555 ( -3.643 0.000 0.000) 3.643 2.555 ( 3.643 0.000 0.000) 3.643 2.633 ( -9.323 0.000 0.000) 9.323 2.633 ( 9.323 0.000 0.000) 9.323 2.747 ( -6.141 0.000 0.000) 6.141 2.747 ( 6.141 0.000 0.000) 6.141 2.831 ( -3.533 0.000 0.000) 3.533 2.831 ( 3.533 0.000 0.000) 3.533 2.860 ( -0.970 0.000 0.000) 0.970 2.860 ( 0.970 0.000 0.000) 0.970 2.925 ( -1.113 0.000 0.000) 1.113 2.925 ( 1.113 0.000 0.000) 1.113 2.969 ( -3.172 0.000 0.000) 3.172 2.969 ( 3.172 0.000 0.000) 3.172 3.006 ( -1.120 0.000 0.000) 1.120 3.006 ( 1.120 0.000 0.000) 1.120 3.031 ( -3.193 0.000 0.000) 3.193 3.031 ( 3.193 0.000 0.000) 3.193 3.053 ( -6.181 0.000 0.000) 6.181 3.053 ( 6.181 0.000 0.000) 6.181 3.082 ( -1.854 0.000 0.000) 1.854 3.082 ( 1.854 0.000 0.000) 1.854 3.186 ( -5.218 0.000 0.000) 5.218 3.186 ( 5.218 0.000 0.000) 5.218 3.318 ( -9.131 0.000 0.000) 9.131 3.318 ( 9.131 0.000 0.000) 9.131 3.377 ( -2.107 0.000 0.000) 2.107 3.377 ( 2.107 0.000 0.000) 2.107 3.547 ( -2.844 0.000 0.000) 2.844 3.547 ( 2.844 0.000 0.000) 2.844 3.597 ( -6.002 0.000 0.000) 6.002 3.597 ( 6.002 0.000 0.000) 6.002 3.689 ( -0.324 0.000 0.000) 0.324 3.689 ( 0.324 0.000 0.000) 0.324 3.724 ( -1.865 0.000 0.000) 1.865 3.724 ( 1.865 0.000 0.000) 1.865 3.772 ( -2.742 0.000 0.000) 2.742 3.772 ( 2.742 0.000 0.000) 2.742 3.958 ( -1.835 0.000 0.000) 1.835 3.958 ( 1.835 0.000 0.000) 1.835 3.981 ( -1.200 0.000 0.000) 1.200 3.981 ( 1.200 0.000 0.000) 1.200 4.005 ( -1.763 0.000 0.000) 1.763 4.005 ( 1.763 0.000 0.000) 1.763 4.113 ( -0.649 0.000 0.000) 0.649 4.113 ( 0.649 0.000 0.000) 0.649 4.307 ( -1.787 0.000 0.000) 1.787 4.307 ( 1.787 0.000 0.000) 1.787 4.398 ( -1.877 0.000 0.000) 1.877 4.398 ( 1.877 0.000 0.000) 1.877 4.452 ( -0.653 0.000 0.000) 0.653 4.452 ( 0.653 0.000 0.000) 0.653 4.495 ( -5.200 0.000 0.000) 5.200 4.495 ( 5.200 0.000 0.000) 5.200 4.691 ( -0.672 0.000 0.000) 0.672 4.691 ( 0.672 0.000 0.000) 0.672 4.781 ( -2.601 0.000 0.000) 2.601 4.781 ( 2.601 0.000 0.000) 2.601 4.854 ( -3.265 0.000 0.000) 3.265 4.854 ( 3.265 0.000 0.000) 3.265 4.920 ( -2.153 0.000 0.000) 2.153 4.920 ( 2.153 0.000 0.000) 2.153 4.932 ( -3.086 0.000 0.000) 3.086 4.932 ( 3.086 0.000 0.000) 3.086 5.046 ( -0.090 0.000 0.000) 0.090 5.046 ( 0.090 0.000 0.000) 0.090 5.077 ( -0.355 0.000 0.000) 0.355 5.077 ( 0.355 0.000 0.000) 0.355 5.127 ( -2.813 0.000 0.000) 2.813 5.127 ( 2.813 0.000 0.000) 2.813 5.160 ( -0.715 0.000 0.000) 0.715 5.160 ( 0.715 0.000 0.000) 0.715 5.291 ( -4.657 0.000 0.000) 4.657 5.291 ( 4.657 0.000 0.000) 4.657 5.769 ( -1.832 0.000 0.000) 1.832 5.769 ( 1.832 0.000 0.000) 1.832 5.872 ( -3.353 0.000 0.000) 3.353 5.872 ( 3.353 0.000 0.000) 3.353 5.887 ( -3.359 0.000 0.000) 3.359 5.887 ( 3.359 0.000 0.000) 3.359 5.931 ( -2.367 0.000 0.000) 2.367 5.931 ( 2.367 0.000 0.000) 2.367 6.403 ( -2.820 0.000 0.000) 2.820 6.403 ( 2.820 0.000 0.000) 2.820 6.410 ( -0.925 0.000 0.000) 0.925 6.410 ( 0.925 0.000 0.000) 0.925 6.585 ( -4.026 0.000 0.000) 4.026 6.585 ( 4.026 0.000 0.000) 4.026 6.661 ( -1.552 0.000 0.000) 1.552 6.661 ( 1.552 0.000 0.000) 1.552 7.684 ( -0.500 0.000 0.000) 0.500 7.684 ( 0.500 0.000 0.000) 0.500 7.731 ( -1.235 0.000 0.000) 1.235 7.731 ( 1.235 0.000 0.000) 1.235 7.843 ( -0.100 0.000 0.000) 0.100 7.843 ( 0.100 0.000 0.000) 0.100 7.855 ( -0.204 0.000 0.000) 0.204 7.855 ( 0.204 0.000 0.000) 0.204 7.881 ( -1.178 0.000 0.000) 1.178 7.881 ( 1.178 0.000 0.000) 1.178 7.920 ( -0.826 0.000 0.000) 0.826 7.920 ( 0.826 0.000 0.000) 0.826 8.105 ( -1.894 0.000 0.000) 1.894 8.105 ( 1.894 0.000 0.000) 1.894 8.129 ( -0.561 0.000 0.000) 0.561 8.129 ( 0.561 0.000 0.000) 0.561 8.186 ( -5.265 0.000 0.000) 5.265 8.186 ( 5.265 0.000 0.000) 5.265 8.254 ( -0.538 0.000 0.000) 0.538 8.254 ( 0.538 0.000 0.000) 0.538 8.268 ( -2.122 0.000 0.000) 2.122 8.268 ( 2.122 0.000 0.000) 2.122 8.334 ( -0.368 0.000 0.000) 0.368 8.334 ( 0.368 0.000 0.000) 0.368 8.491 ( -1.312 0.000 0.000) 1.312 8.491 ( 1.312 0.000 0.000) 1.312 8.563 ( -3.327 0.000 0.000) 3.327 8.563 ( 3.327 0.000 0.000) 3.327 8.619 ( -1.634 0.000 0.000) 1.634 8.619 ( 1.634 0.000 0.000) 1.634 8.695 ( -2.611 0.000 0.000) 2.611 8.695 ( 2.611 0.000 0.000) 2.611 8.971 ( -3.585 0.000 0.000) 3.585 8.971 ( 3.585 0.000 0.000) 3.585 9.020 ( -5.716 0.000 0.000) 5.716 9.020 ( 5.716 0.000 0.000) 5.716 9.193 ( -2.217 0.000 0.000) 2.217 9.193 ( 2.217 0.000 0.000) 2.217 9.262 ( -1.144 0.000 0.000) 1.144 9.262 ( 1.144 0.000 0.000) 1.144 9.386 ( -2.072 0.000 0.000) 2.072 9.386 ( 2.072 0.000 0.000) 2.072 9.517 ( -1.098 0.000 0.000) 1.098 9.517 ( 1.098 0.000 0.000) 1.098 9.551 ( -0.791 0.000 0.000) 0.791 9.551 ( 0.791 0.000 0.000) 0.791 9.559 ( -5.458 0.000 0.000) 5.458 9.559 ( 5.458 0.000 0.000) 5.458 9.674 ( -0.772 0.000 0.000) 0.772 9.674 ( 0.772 0.000 0.000) 0.772 9.701 ( -1.494 0.000 0.000) 1.494 9.701 ( 1.494 0.000 0.000) 1.494 9.785 ( -0.223 0.000 0.000) 0.223 9.785 ( 0.223 0.000 0.000) 0.223 9.842 ( -0.551 0.000 0.000) 0.551 9.842 ( 0.551 0.000 0.000) 0.551 9.985 ( -1.668 0.000 0.000) 1.668 9.985 ( 1.668 0.000 0.000) 1.668 10.005 ( -0.733 0.000 0.000) 0.733 10.005 ( 0.733 0.000 0.000) 0.733 10.189 ( -4.552 0.000 0.000) 4.552 10.189 ( 4.552 0.000 0.000) 4.552 10.218 ( -4.623 0.000 0.000) 4.623 10.218 ( 4.623 0.000 0.000) 4.623======================= Grid point 5 (4/27) =======================q-point: ( 0.00 0.25 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 18Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.347 ( 0.000 17.881 0.000) 17.881 0.391 ( 0.000 20.025 0.000) 20.025 0.637 ( 0.000 31.712 0.000) 31.712 0.971 ( 0.000 -10.928 0.000) 10.928 1.049 ( 0.000 -12.072 0.000) 12.072 1.276 ( 0.000 -2.861 0.000) 2.861 1.310 ( 0.000 1.699 0.000) 1.699 1.343 ( 0.000 -3.658 0.000) 3.658 1.347 ( 0.000 1.119 0.000) 1.119 1.396 ( 0.000 3.780 0.000) 3.780 1.403 ( 0.000 1.879 0.000) 1.879 1.426 ( 0.000 -0.862 0.000) 0.862 1.447 ( 0.000 0.126 0.000) 0.126 1.455 ( 0.000 -0.860 0.000) 0.860 1.472 ( 0.000 5.550 0.000) 5.550 1.477 ( 0.000 0.959 0.000) 0.959 1.536 ( 0.000 -0.957 0.000) 0.957 1.536 ( 0.000 0.098 0.000) 0.098 1.575 ( 0.000 -2.619 0.000) 2.619 1.587 ( 0.000 -3.983 0.000) 3.983 1.633 ( 0.000 3.192 0.000) 3.192 1.651 ( 0.000 0.885 0.000) 0.885 1.661 ( 0.000 -0.469 0.000) 0.469 1.683 ( 0.000 -8.482 0.000) 8.482 1.702 ( 0.000 -2.741 0.000) 2.741 1.714 ( 0.000 2.521 0.000) 2.521 1.773 ( 0.000 -1.920 0.000) 1.920 1.803 ( 0.000 2.868 0.000) 2.868 1.810 ( 0.000 -0.202 0.000) 0.202 1.818 ( 0.000 0.052 0.000) 0.052 1.893 ( 0.000 1.605 0.000) 1.605 1.898 ( 0.000 -1.821 0.000) 1.821 1.904 ( 0.000 -4.104 0.000) 4.104 1.906 ( 0.000 2.756 0.000) 2.756 1.909 ( 0.000 -8.125 0.000) 8.125 1.951 ( 0.000 -3.546 0.000) 3.546 1.970 ( 0.000 -5.434 0.000) 5.434 1.979 ( 0.000 -1.264 0.000) 1.264 2.015 ( 0.000 -5.040 0.000) 5.040 2.032 ( 0.000 1.180 0.000) 1.180 2.056 ( 0.000 -3.696 0.000) 3.696 2.082 ( 0.000 0.498 0.000) 0.498 2.107 ( 0.000 -0.715 0.000) 0.715 2.110 ( 0.000 0.627 0.000) 0.627 2.116 ( 0.000 -1.067 0.000) 1.067 2.145 ( 0.000 0.328 0.000) 0.328 2.157 ( 0.000 0.187 0.000) 0.187 2.186 ( 0.000 -2.111 0.000) 2.111 2.191 ( 0.000 -0.531 0.000) 0.531 2.192 ( 0.000 -2.343 0.000) 2.343 2.241 ( 0.000 -1.344 0.000) 1.344 2.284 ( 0.000 -1.425 0.000) 1.425 2.295 ( 0.000 0.029 0.000) 0.029 2.322 ( 0.000 0.912 0.000) 0.912 2.354 ( 0.000 -3.761 0.000) 3.761 2.360 ( 0.000 -2.149 0.000) 2.149 2.377 ( 0.000 5.090 0.000) 5.090 2.380 ( 0.000 -0.600 0.000) 0.600 2.395 ( 0.000 1.272 0.000) 1.272 2.414 ( 0.000 3.597 0.000) 3.597 2.498 ( 0.000 3.274 0.000) 3.274 2.512 ( 0.000 4.586 0.000) 4.586 2.589 ( 0.000 1.993 0.000) 1.993 2.597 ( 0.000 3.293 0.000) 3.293 2.602 ( 0.000 3.789 0.000) 3.789 2.620 ( 0.000 -2.592 0.000) 2.592 2.691 ( 0.000 0.712 0.000) 0.712 2.736 ( 0.000 0.985 0.000) 0.985 2.778 ( 0.000 -0.854 0.000) 0.854 2.834 ( 0.000 5.911 0.000) 5.911 2.844 ( 0.000 -1.314 0.000) 1.314 2.854 ( 0.000 -4.590 0.000) 4.590 2.883 ( 0.000 -1.076 0.000) 1.076 2.960 ( 0.000 3.940 0.000) 3.940 2.961 ( 0.000 -3.632 0.000) 3.632 2.971 ( 0.000 -0.877 0.000) 0.877 3.003 ( 0.000 -1.581 0.000) 1.581 3.037 ( 0.000 3.764 0.000) 3.764 3.052 ( 0.000 1.266 0.000) 1.266 3.066 ( 0.000 0.838 0.000) 0.838 3.080 ( 0.000 3.266 0.000) 3.266 3.100 ( 0.000 0.640 0.000) 0.640 3.118 ( 0.000 -0.971 0.000) 0.971 3.141 ( 0.000 0.035 0.000) 0.035 3.272 ( 0.000 -3.281 0.000) 3.281 3.287 ( 0.000 1.668 0.000) 1.668 3.361 ( 0.000 2.015 0.000) 2.015 3.393 ( 0.000 1.456 0.000) 1.456 3.475 ( 0.000 -1.698 0.000) 1.698 3.500 ( 0.000 -1.165 0.000) 1.165 3.537 ( 0.000 4.239 0.000) 4.239 3.612 ( 0.000 1.964 0.000) 1.964 3.631 ( 0.000 0.476 0.000) 0.476 3.633 ( 0.000 -0.924 0.000) 0.924 3.662 ( 0.000 -0.108 0.000) 0.108 3.682 ( 0.000 -1.757 0.000) 1.757 3.701 ( 0.000 0.760 0.000) 0.760 3.756 ( 0.000 -1.122 0.000) 1.122 3.763 ( 0.000 0.813 0.000) 0.813 3.800 ( 0.000 -0.742 0.000) 0.742 3.933 ( 0.000 0.409 0.000) 0.409 3.943 ( 0.000 -0.391 0.000) 0.391 3.990 ( 0.000 -1.957 0.000) 1.957 4.009 ( 0.000 1.793 0.000) 1.793 4.040 ( 0.000 -3.548 0.000) 3.548 4.074 ( 0.000 0.281 0.000) 0.281 4.078 ( 0.000 -1.574 0.000) 1.574 4.087 ( 0.000 0.103 0.000) 0.103 4.279 ( 0.000 3.139 0.000) 3.139 4.316 ( 0.000 2.559 0.000) 2.559 4.371 ( 0.000 -1.258 0.000) 1.258 4.390 ( 0.000 -1.457 0.000) 1.457 4.469 ( 0.000 2.080 0.000) 2.080 4.475 ( 0.000 0.690 0.000) 0.690 4.674 ( 0.000 0.765 0.000) 0.765 4.689 ( 0.000 -2.969 0.000) 2.969 4.699 ( 0.000 -2.567 0.000) 2.567 4.752 ( 0.000 -2.782 0.000) 2.782 4.801 ( 0.000 0.308 0.000) 0.308 4.803 ( 0.000 1.128 0.000) 1.128 4.804 ( 0.000 1.378 0.000) 1.378 4.837 ( 0.000 -1.388 0.000) 1.388 4.883 ( 0.000 1.409 0.000) 1.409 4.915 ( 0.000 1.378 0.000) 1.378 4.939 ( 0.000 -0.386 0.000) 0.386 4.953 ( 0.000 1.887 0.000) 1.887 5.012 ( 0.000 -0.583 0.000) 0.583 5.030 ( 0.000 0.446 0.000) 0.446 5.031 ( 0.000 1.645 0.000) 1.645 5.047 ( 0.000 -0.269 0.000) 0.269 5.062 ( 0.000 -1.837 0.000) 1.837 5.140 ( 0.000 -3.876 0.000) 3.876 5.357 ( 0.000 6.624 0.000) 6.624 5.365 ( 0.000 2.041 0.000) 2.041 5.444 ( 0.000 -1.381 0.000) 1.381 5.607 ( 0.000 1.400 0.000) 1.400 5.611 ( 0.000 -4.655 0.000) 4.655 5.682 ( 0.000 -1.975 0.000) 1.975 5.754 ( 0.000 1.450 0.000) 1.450 5.759 ( 0.000 1.048 0.000) 1.048 5.805 ( 0.000 -0.867 0.000) 0.867 5.813 ( 0.000 -1.381 0.000) 1.381 5.922 ( 0.000 0.584 0.000) 0.584 5.947 ( 0.000 -0.556 0.000) 0.556 6.305 ( 0.000 0.274 0.000) 0.274 6.307 ( 0.000 0.233 0.000) 0.233 6.326 ( 0.000 -0.702 0.000) 0.702 6.328 ( 0.000 -0.749 0.000) 0.749 6.447 ( 0.000 2.656 0.000) 2.656 6.511 ( 0.000 1.869 0.000) 1.869 6.580 ( 0.000 -2.959 0.000) 2.959 6.588 ( 0.000 -1.431 0.000) 1.431 7.684 ( 0.000 0.354 0.000) 0.354 7.698 ( 0.000 -0.250 0.000) 0.250 7.721 ( 0.000 1.467 0.000) 1.467 7.774 ( 0.000 -0.730 0.000) 0.730 7.779 ( 0.000 1.113 0.000) 1.113 7.807 ( 0.000 -0.174 0.000) 0.174 7.824 ( 0.000 -0.864 0.000) 0.864 7.834 ( 0.000 -1.098 0.000) 1.098 7.858 ( 0.000 0.357 0.000) 0.357 7.876 ( 0.000 -0.449 0.000) 0.449 7.908 ( 0.000 0.644 0.000) 0.644 7.921 ( 0.000 0.091 0.000) 0.091 8.012 ( 0.000 0.262 0.000) 0.262 8.025 ( 0.000 -0.375 0.000) 0.375 8.064 ( 0.000 1.378 0.000) 1.378 8.108 ( 0.000 -0.008 0.000) 0.008 8.143 ( 0.000 0.415 0.000) 0.415 8.158 ( 0.000 -0.181 0.000) 0.181 8.194 ( 0.000 0.492 0.000) 0.492 8.247 ( 0.000 -2.395 0.000) 2.395 8.310 ( 0.000 0.807 0.000) 0.807 8.323 ( 0.000 1.180 0.000) 1.180 8.357 ( 0.000 -1.317 0.000) 1.317 8.387 ( 0.000 -1.932 0.000) 1.932 8.451 ( 0.000 1.319 0.000) 1.319 8.520 ( 0.000 2.784 0.000) 2.784 8.523 ( 0.000 -2.397 0.000) 2.397 8.586 ( 0.000 1.546 0.000) 1.546 8.596 ( 0.000 0.406 0.000) 0.406 8.637 ( 0.000 1.422 0.000) 1.422 8.659 ( 0.000 0.190 0.000) 0.190 8.662 ( 0.000 -2.853 0.000) 2.853 8.889 ( 0.000 1.552 0.000) 1.552 8.976 ( 0.000 -2.095 0.000) 2.095 9.033 ( 0.000 1.842 0.000) 1.842 9.115 ( 0.000 0.759 0.000) 0.759 9.119 ( 0.000 -1.952 0.000) 1.952 9.181 ( 0.000 0.723 0.000) 0.723 9.206 ( 0.000 -3.776 0.000) 3.776 9.250 ( 0.000 -3.147 0.000) 3.147 9.406 ( 0.000 2.592 0.000) 2.592 9.437 ( 0.000 2.794 0.000) 2.794 9.450 ( 0.000 4.886 0.000) 4.886 9.492 ( 0.000 1.052 0.000) 1.052 9.530 ( 0.000 -1.284 0.000) 1.284 9.551 ( 0.000 -0.933 0.000) 0.933 9.570 ( 0.000 1.649 0.000) 1.649 9.576 ( 0.000 -1.894 0.000) 1.894 9.655 ( 0.000 -0.203 0.000) 0.203 9.667 ( 0.000 4.412 0.000) 4.412 9.688 ( 0.000 -2.017 0.000) 2.017 9.744 ( 0.000 3.062 0.000) 3.062 9.757 ( 0.000 2.444 0.000) 2.444 9.767 ( 0.000 -4.701 0.000) 4.701 9.807 ( 0.000 -5.040 0.000) 5.040 9.871 ( 0.000 -5.236 0.000) 5.236 9.967 ( 0.000 2.432 0.000) 2.432 10.035 ( 0.000 -1.360 0.000) 1.360 10.036 ( 0.000 3.122 0.000) 3.122 10.058 ( 0.000 2.956 0.000) 2.956 10.090 ( 0.000 0.575 0.000) 0.575 10.212 ( 0.000 -4.602 0.000) 4.602 10.366 ( 0.000 2.248 0.000) 2.248 10.436 ( 0.000 -1.312 0.000) 1.312======================= Grid point 6 (5/27) =======================q-point: ( 0.25 0.25 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 24Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.477 ( 11.838 10.953 0.000) 16.128 0.598 ( 15.491 12.474 0.000) 19.889 0.918 ( 16.588 14.002 0.000) 21.707 1.065 ( 8.534 -5.842 0.000) 10.342 1.085 ( -6.426 -4.725 0.000) 7.976 1.146 ( -1.876 -9.120 0.000) 9.311 1.223 ( -6.032 -7.092 0.000) 9.311 1.260 ( -7.618 0.263 0.000) 7.623 1.330 ( -0.659 2.199 0.000) 2.296 1.368 ( -0.408 -0.073 0.000) 0.414 1.410 ( -0.377 2.962 0.000) 2.985 1.417 ( 2.041 0.360 0.000) 2.072 1.428 ( -0.629 0.053 0.000) 0.631 1.460 ( -0.912 4.400 0.000) 4.493 1.477 ( 2.624 -0.426 0.000) 2.658 1.504 ( -0.188 2.370 0.000) 2.377 1.550 ( 0.112 0.944 0.000) 0.951 1.599 ( 3.067 -0.616 0.000) 3.128 1.619 ( 0.681 -2.925 0.000) 3.003 1.639 ( 3.034 -2.332 0.000) 3.827 1.652 ( 0.779 3.623 0.000) 3.706 1.665 ( 1.030 -2.937 0.000) 3.112 1.711 ( 2.884 0.487 0.000) 2.924 1.718 ( 1.907 -1.520 0.000) 2.439 1.719 ( -3.572 -3.352 0.000) 4.898 1.740 ( 3.257 -4.127 0.000) 5.257 1.740 ( 2.790 0.305 0.000) 2.806 1.809 ( -1.642 -0.776 0.000) 1.816 1.812 ( 4.170 1.765 0.000) 4.528 1.814 ( -0.064 -0.348 0.000) 0.354 1.841 ( -0.090 -1.522 0.000) 1.525 1.886 ( 0.454 1.068 0.000) 1.160 1.889 ( -1.653 -2.966 0.000) 3.395 1.909 ( 1.085 -1.506 0.000) 1.856 1.948 ( -1.823 0.214 0.000) 1.836 1.969 ( 1.787 2.334 0.000) 2.939 1.976 ( -0.611 -1.607 0.000) 1.719 1.995 ( -0.578 -3.229 0.000) 3.281 2.007 ( 0.072 -1.677 0.000) 1.679 2.009 ( -4.554 -2.438 0.000) 5.166 2.075 ( 6.210 -4.662 0.000) 7.765 2.100 ( 0.548 -1.008 0.000) 1.147 2.112 ( -0.452 1.821 0.000) 1.876 2.124 ( 2.418 0.876 0.000) 2.572 2.141 ( 0.907 0.218 0.000) 0.933 2.149 ( 1.941 -1.218 0.000) 2.291 2.182 ( 1.543 0.620 0.000) 1.663 2.193 ( -1.069 -0.110 0.000) 1.074 2.218 ( 4.338 0.372 0.000) 4.354 2.227 ( 0.590 -3.085 0.000) 3.141 2.240 ( -4.018 -1.679 0.000) 4.355 2.251 ( 0.694 -2.617 0.000) 2.708 2.273 ( -2.028 0.615 0.000) 2.119 2.284 ( -1.248 -0.112 0.000) 1.253 2.303 ( 0.332 0.275 0.000) 0.431 2.344 ( -3.114 1.753 0.000) 3.574 2.394 ( -1.580 1.029 0.000) 1.886 2.399 ( -1.363 1.232 0.000) 1.837 2.413 ( 0.243 0.584 0.000) 0.632 2.450 ( 5.364 1.300 0.000) 5.520 2.505 ( 4.296 1.898 0.000) 4.697 2.525 ( -4.521 3.965 0.000) 6.014 2.552 ( 1.930 3.811 0.000) 4.271 2.582 ( -3.982 -5.984 0.000) 7.188 2.610 ( -3.850 3.447 0.000) 5.167 2.680 ( 5.466 1.725 0.000) 5.732 2.699 ( 2.632 -2.107 0.000) 3.371 2.719 ( -0.527 -2.127 0.000) 2.192 2.754 ( 2.045 -0.447 0.000) 2.093 2.833 ( -2.274 -0.233 0.000) 2.286 2.845 ( -0.777 -2.919 0.000) 3.021 2.856 ( 3.961 4.187 0.000) 5.763 2.889 ( 0.393 -0.823 0.000) 0.912 2.924 ( -1.007 -4.075 0.000) 4.198 2.960 ( 2.738 2.794 0.000) 3.912 2.996 ( -1.610 0.905 0.000) 1.847 3.013 ( -0.301 1.269 0.000) 1.304 3.027 ( -4.725 0.734 0.000) 4.782 3.036 ( -0.685 3.320 0.000) 3.390 3.047 ( -0.610 2.709 0.000) 2.777 3.080 ( 1.570 0.783 0.000) 1.754 3.093 ( 3.215 -0.547 0.000) 3.262 3.105 ( 1.133 0.710 0.000) 1.337 3.187 ( 2.386 0.351 0.000) 2.412 3.193 ( -6.367 -1.826 0.000) 6.624 3.248 ( -2.572 -0.528 0.000) 2.626 3.279 ( -7.554 4.524 0.000) 8.805 3.428 ( -3.978 3.418 0.000) 5.245 3.439 ( -6.339 -4.158 0.000) 7.581 3.449 ( 2.127 1.194 0.000) 2.439 3.481 ( -0.004 0.955 0.000) 0.955 3.552 ( -3.099 -0.697 0.000) 3.177 3.610 ( -0.640 0.928 0.000) 1.127 3.669 ( -1.255 -0.176 0.000) 1.268 3.671 ( 0.765 -0.895 0.000) 1.178 3.689 ( 1.562 1.078 0.000) 1.898 3.703 ( 0.810 1.107 0.000) 1.371 3.743 ( -0.370 -0.338 0.000) 0.501 3.771 ( -0.265 1.296 0.000) 1.323 3.822 ( -0.817 -0.971 0.000) 1.269 3.926 ( 0.258 -0.133 0.000) 0.290 3.950 ( 0.394 -0.523 0.000) 0.654 3.987 ( 0.239 -0.795 0.000) 0.830 3.992 ( -2.564 -2.442 0.000) 3.541 3.998 ( -1.010 1.186 0.000) 1.558 4.057 ( -1.353 1.131 0.000) 1.763 4.081 ( 0.203 -1.920 0.000) 1.931 4.102 ( 0.025 -1.515 0.000) 1.515 4.291 ( 1.506 2.707 0.000) 3.098 4.336 ( 1.245 2.137 0.000) 2.473 4.381 ( 0.659 -1.024 0.000) 1.217 4.405 ( 1.587 -1.200 0.000) 1.989 4.449 ( -1.285 1.462 0.000) 1.946 4.470 ( -0.614 0.958 0.000) 1.138 4.558 ( -7.730 6.219 0.000) 9.921 4.614 ( -5.092 0.242 0.000) 5.098 4.678 ( -0.375 -1.502 0.000) 1.548 4.713 ( 1.107 -2.474 0.000) 2.710 4.738 ( -3.445 1.040 0.000) 3.598 4.811 ( -2.516 -2.188 0.000) 3.335 4.820 ( 2.255 1.917 0.000) 2.960 4.852 ( 3.401 -0.005 0.000) 3.401 4.868 ( 3.327 1.326 0.000) 3.581 4.938 ( -0.923 1.247 0.000) 1.552 4.949 ( -0.056 0.798 0.000) 0.800 4.977 ( 4.130 0.523 0.000) 4.163 5.007 ( -2.150 1.361 0.000) 2.544 5.018 ( 1.402 -1.595 0.000) 2.123 5.032 ( 0.089 -0.197 0.000) 0.217 5.049 ( 0.542 0.108 0.000) 0.553 5.070 ( 0.226 -2.506 0.000) 2.516 5.128 ( -1.103 -3.234 0.000) 3.417 5.248 ( -6.693 2.498 0.000) 7.144 5.292 ( -5.218 4.822 0.000) 7.105 5.333 ( -5.984 -1.532 0.000) 6.176 5.467 ( -10.611 -3.158 0.000) 11.071 5.699 ( 6.204 1.949 0.000) 6.503 5.775 ( 1.346 1.027 0.000) 1.693 5.807 ( 4.572 2.557 0.000) 5.238 5.811 ( 5.920 -2.603 0.000) 6.468 5.824 ( 1.629 -1.049 0.000) 1.937 5.931 ( -0.497 0.757 0.000) 0.905 5.937 ( -0.067 -2.817 0.000) 2.818 5.944 ( 0.070 0.180 0.000) 0.193 6.357 ( 2.836 0.631 0.000) 2.906 6.361 ( 2.805 -0.297 0.000) 2.821 6.406 ( 4.969 -1.283 0.000) 5.131 6.456 ( 2.542 2.074 0.000) 3.281 6.483 ( -0.299 0.206 0.000) 0.363 6.523 ( 6.386 -8.898 0.000) 10.952 6.593 ( 0.771 -3.524 0.000) 3.608 6.596 ( 0.039 -2.064 0.000) 2.064 7.685 ( 0.156 0.537 0.000) 0.559 7.705 ( 0.709 -0.326 0.000) 0.781 7.711 ( -0.824 1.220 0.000) 1.472 7.753 ( -1.351 -0.615 0.000) 1.484 7.825 ( 2.636 1.006 0.000) 2.821 7.828 ( 1.240 -0.018 0.000) 1.240 7.837 ( 1.039 -0.491 0.000) 1.149 7.857 ( 0.287 0.552 0.000) 0.622 7.873 ( 0.671 -1.214 0.000) 1.387 7.895 ( -1.041 0.830 0.000) 1.331 7.913 ( 0.545 -0.912 0.000) 1.062 7.923 ( 0.024 -0.296 0.000) 0.297 8.047 ( 4.355 0.580 0.000) 4.393 8.080 ( 1.471 1.262 0.000) 1.938 8.118 ( 0.782 -0.086 0.000) 0.786 8.121 ( 4.209 -3.090 0.000) 5.222 8.146 ( -0.893 0.434 0.000) 0.993 8.171 ( 3.181 -2.237 0.000) 3.889 8.213 ( 1.439 -0.007 0.000) 1.439 8.240 ( -0.927 -1.843 0.000) 2.063 8.300 ( -1.460 1.628 0.000) 2.187 8.303 ( -0.864 1.496 0.000) 1.728 8.351 ( -0.232 -0.510 0.000) 0.560 8.401 ( -1.555 0.074 0.000) 1.557 8.448 ( 2.391 -1.511 0.000) 2.829 8.497 ( -1.594 1.501 0.000) 2.190 8.512 ( -1.242 -1.924 0.000) 2.290 8.581 ( -1.217 -0.806 0.000) 1.460 8.611 ( 0.935 0.874 0.000) 1.280 8.635 ( 0.631 1.266 0.000) 1.415 8.651 ( 0.124 -1.608 0.000) 1.613 8.707 ( 0.783 -2.775 0.000) 2.883 8.891 ( 1.884 0.783 0.000) 2.041 8.968 ( 0.491 -0.947 0.000) 1.067 9.067 ( -3.873 1.255 0.000) 4.071 9.100 ( 4.308 -1.214 0.000) 4.476 9.146 ( -4.428 -0.564 0.000) 4.464 9.167 ( 3.089 -4.136 0.000) 5.162 9.183 ( -0.623 -1.822 0.000) 1.926 9.266 ( -0.857 -4.050 0.000) 4.140 9.351 ( -0.340 4.485 0.000) 4.498 9.442 ( 2.881 0.191 0.000) 2.888 9.462 ( -2.894 2.297 0.000) 3.695 9.529 ( -0.271 -1.096 0.000) 1.129 9.532 ( -0.569 0.510 0.000) 0.764 9.540 ( 1.642 2.121 0.000) 2.683 9.570 ( 0.662 2.319 0.000) 2.412 9.592 ( 1.255 -3.198 0.000) 3.436 9.661 ( -1.302 2.517 0.000) 2.834 9.666 ( -0.442 -0.701 0.000) 0.829 9.689 ( 1.681 -0.689 0.000) 1.816 9.701 ( -0.705 4.161 0.000) 4.220 9.780 ( -0.369 -4.694 0.000) 4.709 9.794 ( 0.768 -0.139 0.000) 0.780 9.800 ( 1.025 -2.747 0.000) 2.932 9.867 ( -0.653 -3.719 0.000) 3.776 9.981 ( 1.296 3.024 0.000) 3.290 10.035 ( 0.160 3.152 0.000) 3.156 10.053 ( -0.554 2.777 0.000) 2.831 10.088 ( 4.450 -1.335 0.000) 4.646 10.119 ( 2.436 -0.460 0.000) 2.479 10.148 ( -5.778 2.685 0.000) 6.371 10.275 ( -6.368 2.273 0.000) 6.762 10.323 ( -4.707 0.909 0.000) 4.794======================= Grid point 7 (6/27) =======================q-point: (-0.50 0.25 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 18Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.771 ( -13.830 1.622 0.000) 13.925 0.771 ( 13.830 1.622 0.000) 13.925 0.949 ( -12.406 6.873 0.000) 14.182 0.949 ( 12.406 6.873 0.000) 14.182 1.132 ( -2.215 -10.194 0.000) 10.432 1.132 ( 2.215 -10.194 0.000) 10.432 1.238 ( -2.134 -5.051 0.000) 5.483 1.238 ( 2.134 -5.051 0.000) 5.483 1.337 ( -3.142 3.509 0.000) 4.710 1.337 ( 3.142 3.509 0.000) 4.710 1.430 ( -0.750 -1.864 0.000) 2.009 1.430 ( 0.750 -1.864 0.000) 2.009 1.453 ( -0.345 1.717 0.000) 1.751 1.453 ( 0.345 1.717 0.000) 1.751 1.507 ( -0.077 1.121 0.000) 1.124 1.507 ( 0.077 1.121 0.000) 1.124 1.560 ( -4.754 1.817 0.000) 5.089 1.560 ( 4.754 1.817 0.000) 5.089 1.645 ( -2.203 -0.347 0.000) 2.230 1.645 ( 2.203 -0.347 0.000) 2.230 1.663 ( -0.383 -1.164 0.000) 1.226 1.663 ( 0.383 -1.164 0.000) 1.226 1.742 ( -1.186 -0.661 0.000) 1.358 1.742 ( 1.186 -0.661 0.000) 1.358 1.754 ( -1.754 -2.571 0.000) 3.113 1.754 ( 1.754 -2.571 0.000) 3.113 1.813 ( -1.360 1.737 0.000) 2.206 1.813 ( 1.360 1.737 0.000) 2.206 1.833 ( -5.217 0.004 0.000) 5.217 1.833 ( 5.217 0.004 0.000) 5.217 1.867 ( -2.552 2.986 0.000) 3.928 1.867 ( 2.552 2.986 0.000) 3.928 1.882 ( -0.300 -0.403 0.000) 0.502 1.882 ( 0.300 -0.403 0.000) 0.502 1.929 ( -2.183 0.608 0.000) 2.267 1.929 ( 2.183 0.608 0.000) 2.267 1.965 ( -0.091 -1.396 0.000) 1.399 1.965 ( 0.091 -1.396 0.000) 1.399 2.001 ( -2.231 -2.355 0.000) 3.244 2.001 ( 2.231 -2.355 0.000) 3.244 2.112 ( -0.837 -1.507 0.000) 1.724 2.112 ( 0.837 -1.507 0.000) 1.724 2.142 ( -1.240 0.728 0.000) 1.437 2.142 ( 1.240 0.728 0.000) 1.437 2.168 ( -1.540 1.715 0.000) 2.305 2.168 ( 1.540 1.715 0.000) 2.305 2.201 ( -3.024 0.379 0.000) 3.048 2.201 ( 3.024 0.379 0.000) 3.048 2.208 ( -0.368 -1.186 0.000) 1.242 2.208 ( 0.368 -1.186 0.000) 1.242 2.245 ( -3.066 -1.551 0.000) 3.436 2.245 ( 3.066 -1.551 0.000) 3.436 2.285 ( -2.385 1.409 0.000) 2.771 2.285 ( 2.385 1.409 0.000) 2.771 2.319 ( -5.708 1.175 0.000) 5.828 2.319 ( 5.708 1.175 0.000) 5.828 2.375 ( -2.356 -0.377 0.000) 2.386 2.375 ( 2.356 -0.377 0.000) 2.386 2.418 ( -6.502 -5.072 0.000) 8.246 2.418 ( 6.502 -5.072 0.000) 8.246 2.516 ( -0.496 1.017 0.000) 1.131 2.516 ( 0.496 1.017 0.000) 1.131 2.575 ( -1.618 2.828 0.000) 3.258 2.575 ( 1.618 2.828 0.000) 3.258 2.673 ( -8.439 -0.183 0.000) 8.441 2.673 ( 8.439 -0.183 0.000) 8.441 2.731 ( -2.854 -2.535 0.000) 3.817 2.731 ( 2.854 -2.535 0.000) 3.817 2.757 ( -0.987 -3.557 0.000) 3.691 2.757 ( 0.987 -3.557 0.000) 3.691 2.885 ( -3.404 -2.167 0.000) 4.036 2.885 ( 3.404 -2.167 0.000) 4.036 2.912 ( -2.116 4.293 0.000) 4.786 2.912 ( 2.116 4.293 0.000) 4.786 3.002 ( -2.218 1.611 0.000) 2.741 3.002 ( 2.218 1.611 0.000) 2.741 3.020 ( -0.745 -0.261 0.000) 0.790 3.020 ( 0.745 -0.261 0.000) 0.790 3.051 ( -0.553 3.184 0.000) 3.231 3.051 ( 0.553 3.184 0.000) 3.231 3.087 ( -4.461 2.580 0.000) 5.153 3.087 ( 4.461 2.580 0.000) 5.153 3.112 ( -1.570 2.689 0.000) 3.114 3.112 ( 1.570 2.689 0.000) 3.114 3.177 ( -4.099 -1.215 0.000) 4.276 3.177 ( 4.099 -1.215 0.000) 4.276 3.269 ( -7.007 -4.649 0.000) 8.410 3.269 ( 7.007 -4.649 0.000) 8.410 3.405 ( -1.278 2.732 0.000) 3.016 3.405 ( 1.278 2.732 0.000) 3.016 3.531 ( -0.287 -2.188 0.000) 2.206 3.531 ( 0.287 -2.188 0.000) 2.206 3.619 ( -2.965 2.408 0.000) 3.819 3.619 ( 2.965 2.408 0.000) 3.819 3.691 ( -1.044 -0.184 0.000) 1.060 3.691 ( 1.044 -0.184 0.000) 1.060 3.739 ( -2.075 1.455 0.000) 2.534 3.739 ( 2.075 1.455 0.000) 2.534 3.771 ( -2.695 -0.131 0.000) 2.699 3.771 ( 2.695 -0.131 0.000) 2.699 3.952 ( -0.956 -0.683 0.000) 1.175 3.952 ( 0.956 -0.683 0.000) 1.175 3.966 ( -0.423 -1.020 0.000) 1.104 3.966 ( 0.423 -1.020 0.000) 1.104 4.019 ( -1.960 1.143 0.000) 2.269 4.019 ( 1.960 1.143 0.000) 2.269 4.090 ( -0.716 -2.022 0.000) 2.145 4.090 ( 0.716 -2.022 0.000) 2.145 4.332 ( -1.675 2.212 0.000) 2.775 4.332 ( 1.675 2.212 0.000) 2.775 4.405 ( -1.677 -0.391 0.000) 1.722 4.405 ( 1.677 -0.391 0.000) 1.722 4.466 ( -2.471 1.821 0.000) 3.070 4.466 ( 2.471 1.821 0.000) 3.070 4.499 ( -4.523 0.278 0.000) 4.531 4.499 ( 4.523 0.278 0.000) 4.531 4.687 ( -1.368 0.009 0.000) 1.368 4.687 ( 1.368 0.009 0.000) 1.368 4.752 ( -2.554 -2.303 0.000) 3.439 4.752 ( 2.554 -2.303 0.000) 3.439 4.884 ( -3.225 2.195 0.000) 3.901 4.884 ( 3.225 2.195 0.000) 3.901 4.921 ( -2.095 0.114 0.000) 2.098 4.921 ( 2.095 0.114 0.000) 2.098 4.948 ( -2.843 1.442 0.000) 3.187 4.948 ( 2.843 1.442 0.000) 3.187 5.021 ( -1.016 -1.975 0.000) 2.221 5.021 ( 1.016 -1.975 0.000) 2.221 5.078 ( -0.140 -0.212 0.000) 0.254 5.078 ( 0.140 -0.212 0.000) 0.254 5.100 ( -1.508 -1.692 0.000) 2.267 5.100 ( 1.508 -1.692 0.000) 2.267 5.192 ( -2.345 2.401 0.000) 3.356 5.192 ( 2.345 2.401 0.000) 3.356 5.276 ( -4.356 -1.480 0.000) 4.600 5.276 ( 4.356 -1.480 0.000) 4.600 5.787 ( -1.331 1.805 0.000) 2.243 5.787 ( 1.331 1.805 0.000) 2.243 5.868 ( -1.774 -1.406 0.000) 2.264 5.868 ( 1.774 -1.406 0.000) 2.264 5.888 ( -2.870 1.126 0.000) 3.083 5.888 ( 2.870 1.126 0.000) 3.083 5.929 ( -1.751 -0.346 0.000) 1.785 5.929 ( 1.751 -0.346 0.000) 1.785 6.408 ( -0.477 1.209 0.000) 1.300 6.408 ( 0.477 1.209 0.000) 1.300 6.437 ( -2.314 1.962 0.000) 3.034 6.437 ( 2.314 1.962 0.000) 3.034 6.561 ( -3.805 -2.262 0.000) 4.427 6.561 ( 3.805 -2.262 0.000) 4.427 6.594 ( -0.990 -5.688 0.000) 5.774 6.594 ( 0.990 -5.688 0.000) 5.774 7.693 ( -0.678 0.891 0.000) 1.120 7.693 ( 0.678 0.891 0.000) 1.120 7.726 ( -1.173 -0.513 0.000) 1.281 7.726 ( 1.173 -0.513 0.000) 1.281 7.846 ( -0.295 0.329 0.000) 0.442 7.846 ( 0.295 0.329 0.000) 0.442 7.859 ( -0.622 0.139 0.000) 0.637 7.859 ( 0.622 0.139 0.000) 0.637 7.876 ( -0.339 0.234 0.000) 0.412 7.876 ( 0.339 0.234 0.000) 0.412 7.918 ( -0.409 -0.455 0.000) 0.612 7.918 ( 0.409 -0.455 0.000) 0.612 8.117 ( -1.646 1.038 0.000) 1.946 8.117 ( 1.646 1.038 0.000) 1.946 8.133 ( -0.018 0.314 0.000) 0.315 8.133 ( 0.018 0.314 0.000) 0.315 8.180 ( -4.739 -0.377 0.000) 4.754 8.180 ( 4.739 -0.377 0.000) 4.754 8.231 ( -0.881 -2.468 0.000) 2.620 8.231 ( 0.881 -2.468 0.000) 2.620 8.282 ( -0.229 2.508 0.000) 2.518 8.282 ( 0.229 2.508 0.000) 2.518 8.361 ( -1.390 1.170 0.000) 1.817 8.361 ( 1.390 1.170 0.000) 1.817 8.483 ( -0.502 -0.763 0.000) 0.914 8.483 ( 0.502 -0.763 0.000) 0.914 8.521 ( -3.478 -3.523 0.000) 4.950 8.521 ( 3.478 -3.523 0.000) 4.950 8.634 ( -0.936 1.257 0.000) 1.567 8.634 ( 0.936 1.257 0.000) 1.567 8.682 ( -2.057 -1.029 0.000) 2.300 8.682 ( 2.057 -1.029 0.000) 2.300 8.972 ( -4.835 0.688 0.000) 4.884 8.972 ( 4.835 0.688 0.000) 4.884 9.029 ( -5.102 -0.005 0.000) 5.102 9.029 ( 5.102 -0.005 0.000) 5.102 9.164 ( -1.628 -1.662 0.000) 2.327 9.164 ( 1.628 -1.662 0.000) 2.327 9.225 ( -2.393 -4.092 0.000) 4.740 9.225 ( 2.393 -4.092 0.000) 4.740 9.396 ( -3.024 2.705 0.000) 4.058 9.396 ( 3.024 2.705 0.000) 4.058 9.502 ( -2.215 -2.479 0.000) 3.324 9.502 ( 2.215 -2.479 0.000) 3.324 9.537 ( -0.619 1.537 0.000) 1.657 9.537 ( 0.619 1.537 0.000) 1.657 9.598 ( -1.302 0.451 0.000) 1.378 9.598 ( 1.302 0.451 0.000) 1.378 9.645 ( -0.849 -0.112 0.000) 0.856 9.645 ( 0.849 -0.112 0.000) 0.856 9.708 ( -0.582 1.534 0.000) 1.641 9.708 ( 0.582 1.534 0.000) 1.641 9.786 ( -1.224 -2.121 0.000) 2.449 9.786 ( 1.224 -2.121 0.000) 2.449 9.838 ( -1.874 -1.770 0.000) 2.578 9.838 ( 1.874 -1.770 0.000) 2.578 10.023 ( -2.504 3.969 0.000) 4.693 10.023 ( 2.504 3.969 0.000) 4.693 10.052 ( -1.936 4.114 0.000) 4.546 10.052 ( 1.936 4.114 0.000) 4.546 10.179 ( -3.627 -1.135 0.000) 3.800 10.179 ( 3.627 -1.135 0.000) 3.800 10.207 ( -5.803 -1.173 0.000) 5.920 10.207 ( 5.803 -1.173 0.000) 5.920======================= Grid point 10 (7/27) =======================q-point: ( 0.00 -0.50 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 18Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.676 ( 0.000 -16.009 0.000) 16.009 0.676 ( 0.000 16.009 0.000) 16.009 0.756 ( 0.000 -17.746 0.000) 17.746 0.756 ( 0.000 17.746 0.000) 17.746 1.220 ( 0.000 -21.295 0.000) 21.295 1.220 ( 0.000 21.295 0.000) 21.295 1.273 ( 0.000 -2.388 0.000) 2.388 1.273 ( 0.000 2.388 0.000) 2.388 1.383 ( 0.000 -4.291 0.000) 4.291 1.383 ( 0.000 4.291 0.000) 4.291 1.431 ( 0.000 -0.088 0.000) 0.088 1.431 ( 0.000 0.088 0.000) 0.088 1.465 ( 0.000 -2.414 0.000) 2.414 1.465 ( 0.000 2.414 0.000) 2.414 1.469 ( 0.000 -0.204 0.000) 0.204 1.469 ( 0.000 0.204 0.000) 0.204 1.482 ( 0.000 -2.549 0.000) 2.549 1.482 ( 0.000 2.549 0.000) 2.549 1.577 ( 0.000 -5.101 0.000) 5.101 1.577 ( 0.000 5.101 0.000) 5.101 1.633 ( 0.000 -1.222 0.000) 1.222 1.633 ( 0.000 1.222 0.000) 1.222 1.642 ( 0.000 -3.911 0.000) 3.911 1.642 ( 0.000 3.911 0.000) 3.911 1.703 ( 0.000 -1.920 0.000) 1.920 1.703 ( 0.000 1.920 0.000) 1.920 1.765 ( 0.000 -5.146 0.000) 5.146 1.765 ( 0.000 5.146 0.000) 5.146 1.818 ( 0.000 -1.120 0.000) 1.120 1.818 ( 0.000 1.120 0.000) 1.120 1.862 ( 0.000 -2.717 0.000) 2.717 1.862 ( 0.000 2.717 0.000) 2.717 1.897 ( 0.000 -5.685 0.000) 5.685 1.897 ( 0.000 5.685 0.000) 5.685 1.900 ( 0.000 -0.670 0.000) 0.670 1.900 ( 0.000 0.670 0.000) 0.670 1.947 ( 0.000 -1.852 0.000) 1.852 1.947 ( 0.000 1.852 0.000) 1.852 1.981 ( 0.000 -3.973 0.000) 3.973 1.981 ( 0.000 3.973 0.000) 3.973 2.069 ( 0.000 -2.245 0.000) 2.245 2.069 ( 0.000 2.245 0.000) 2.245 2.112 ( 0.000 -1.160 0.000) 1.160 2.112 ( 0.000 1.160 0.000) 1.160 2.114 ( 0.000 -1.377 0.000) 1.377 2.114 ( 0.000 1.377 0.000) 1.377 2.177 ( 0.000 -0.825 0.000) 0.825 2.177 ( 0.000 0.825 0.000) 0.825 2.181 ( 0.000 -1.191 0.000) 1.191 2.181 ( 0.000 1.191 0.000) 1.191 2.267 ( 0.000 -3.372 0.000) 3.372 2.267 ( 0.000 3.372 0.000) 3.372 2.281 ( 0.000 -0.974 0.000) 0.974 2.281 ( 0.000 0.974 0.000) 0.974 2.339 ( 0.000 -0.373 0.000) 0.373 2.339 ( 0.000 0.373 0.000) 0.373 2.389 ( 0.000 -1.149 0.000) 1.149 2.389 ( 0.000 1.149 0.000) 1.149 2.481 ( 0.000 -4.324 0.000) 4.324 2.481 ( 0.000 4.324 0.000) 4.324 2.499 ( 0.000 -5.352 0.000) 5.352 2.499 ( 0.000 5.352 0.000) 5.352 2.596 ( 0.000 -2.945 0.000) 2.945 2.596 ( 0.000 2.945 0.000) 2.945 2.660 ( 0.000 -0.318 0.000) 0.318 2.660 ( 0.000 0.318 0.000) 0.318 2.726 ( 0.000 -3.308 0.000) 3.308 2.726 ( 0.000 3.308 0.000) 3.308 2.785 ( 0.000 -2.518 0.000) 2.518 2.785 ( 0.000 2.518 0.000) 2.518 2.878 ( 0.000 -4.257 0.000) 4.257 2.878 ( 0.000 4.257 0.000) 4.257 2.931 ( 0.000 -3.784 0.000) 3.784 2.931 ( 0.000 3.784 0.000) 3.784 2.934 ( 0.000 -6.000 0.000) 6.000 2.934 ( 0.000 6.000 0.000) 6.000 3.013 ( 0.000 -2.319 0.000) 2.319 3.013 ( 0.000 2.319 0.000) 2.319 3.075 ( 0.000 -2.286 0.000) 2.286 3.075 ( 0.000 2.286 0.000) 2.286 3.102 ( 0.000 -1.996 0.000) 1.996 3.102 ( 0.000 1.996 0.000) 1.996 3.149 ( 0.000 -1.138 0.000) 1.138 3.149 ( 0.000 1.138 0.000) 1.138 3.255 ( 0.000 -2.321 0.000) 2.321 3.255 ( 0.000 2.321 0.000) 2.321 3.423 ( 0.000 -3.559 0.000) 3.559 3.423 ( 0.000 3.559 0.000) 3.559 3.458 ( 0.000 -3.380 0.000) 3.380 3.458 ( 0.000 3.380 0.000) 3.380 3.610 ( 0.000 -2.460 0.000) 2.460 3.610 ( 0.000 2.460 0.000) 2.460 3.647 ( 0.000 -1.437 0.000) 1.437 3.647 ( 0.000 1.437 0.000) 1.437 3.647 ( 0.000 -1.405 0.000) 1.405 3.647 ( 0.000 1.405 0.000) 1.405 3.728 ( 0.000 -1.738 0.000) 1.738 3.728 ( 0.000 1.738 0.000) 1.738 3.777 ( 0.000 -1.080 0.000) 1.080 3.777 ( 0.000 1.080 0.000) 1.080 3.952 ( 0.000 -1.526 0.000) 1.526 3.952 ( 0.000 1.526 0.000) 1.526 3.969 ( 0.000 -3.169 0.000) 3.169 3.969 ( 0.000 3.169 0.000) 3.169 4.044 ( 0.000 -1.827 0.000) 1.827 4.044 ( 0.000 1.827 0.000) 1.827 4.085 ( 0.000 -0.423 0.000) 0.423 4.085 ( 0.000 0.423 0.000) 0.423 4.335 ( 0.000 -2.493 0.000) 2.493 4.335 ( 0.000 2.493 0.000) 2.493 4.361 ( 0.000 -1.838 0.000) 1.838 4.361 ( 0.000 1.838 0.000) 1.838 4.489 ( 0.000 -0.240 0.000) 0.240 4.489 ( 0.000 0.240 0.000) 0.240 4.662 ( 0.000 -0.616 0.000) 0.616 4.662 ( 0.000 0.616 0.000) 0.616 4.701 ( 0.000 -2.148 0.000) 2.148 4.701 ( 0.000 2.148 0.000) 2.148 4.813 ( 0.000 -1.019 0.000) 1.019 4.813 ( 0.000 1.019 0.000) 1.019 4.816 ( 0.000 -0.086 0.000) 0.086 4.816 ( 0.000 0.086 0.000) 0.086 4.911 ( 0.000 -1.286 0.000) 1.286 4.911 ( 0.000 1.286 0.000) 1.286 4.957 ( 0.000 -1.439 0.000) 1.439 4.957 ( 0.000 1.439 0.000) 1.439 5.024 ( 0.000 -1.879 0.000) 1.879 5.024 ( 0.000 1.879 0.000) 1.879 5.039 ( 0.000 -0.480 0.000) 0.480 5.039 ( 0.000 0.480 0.000) 0.480 5.075 ( 0.000 -2.909 0.000) 2.909 5.075 ( 0.000 2.909 0.000) 2.909 5.408 ( 0.000 -2.258 0.000) 2.258 5.408 ( 0.000 2.258 0.000) 2.258 5.493 ( 0.000 -7.125 0.000) 7.125 5.493 ( 0.000 7.125 0.000) 7.125 5.642 ( 0.000 -2.066 0.000) 2.066 5.642 ( 0.000 2.066 0.000) 2.066 5.783 ( 0.000 -1.623 0.000) 1.623 5.783 ( 0.000 1.623 0.000) 1.623 5.784 ( 0.000 -1.324 0.000) 1.324 5.784 ( 0.000 1.324 0.000) 1.324 5.935 ( 0.000 -0.692 0.000) 0.692 5.935 ( 0.000 0.692 0.000) 0.692 6.313 ( 0.000 -0.575 0.000) 0.575 6.313 ( 0.000 0.575 0.000) 0.575 6.315 ( 0.000 -0.593 0.000) 0.593 6.315 ( 0.000 0.593 0.000) 0.593 6.511 ( 0.000 -3.829 0.000) 3.829 6.511 ( 0.000 3.829 0.000) 3.829 6.552 ( 0.000 -2.207 0.000) 2.207 6.552 ( 0.000 2.207 0.000) 2.207 7.692 ( 0.000 -0.418 0.000) 0.418 7.692 ( 0.000 0.418 0.000) 0.418 7.752 ( 0.000 -1.550 0.000) 1.550 7.752 ( 0.000 1.550 0.000) 1.550 7.807 ( 0.000 -1.606 0.000) 1.606 7.807 ( 0.000 1.606 0.000) 1.606 7.809 ( 0.000 -0.507 0.000) 0.507 7.809 ( 0.000 0.507 0.000) 0.507 7.866 ( 0.000 -0.517 0.000) 0.517 7.866 ( 0.000 0.517 0.000) 0.517 7.919 ( 0.000 -0.371 0.000) 0.371 7.919 ( 0.000 0.371 0.000) 0.371 8.018 ( 0.000 -0.363 0.000) 0.363 8.018 ( 0.000 0.363 0.000) 0.363 8.095 ( 0.000 -1.456 0.000) 1.456 8.095 ( 0.000 1.456 0.000) 1.456 8.152 ( 0.000 -0.451 0.000) 0.451 8.152 ( 0.000 0.451 0.000) 0.451 8.209 ( 0.000 -1.262 0.000) 1.262 8.209 ( 0.000 1.262 0.000) 1.262 8.331 ( 0.000 -1.305 0.000) 1.305 8.331 ( 0.000 1.305 0.000) 1.305 8.352 ( 0.000 -1.738 0.000) 1.738 8.352 ( 0.000 1.738 0.000) 1.738 8.480 ( 0.000 -1.910 0.000) 1.910 8.480 ( 0.000 1.910 0.000) 1.910 8.581 ( 0.000 -2.959 0.000) 2.959 8.581 ( 0.000 2.959 0.000) 2.959 8.611 ( 0.000 -1.314 0.000) 1.314 8.611 ( 0.000 1.314 0.000) 1.314 8.657 ( 0.000 -0.521 0.000) 0.521 8.657 ( 0.000 0.521 0.000) 0.521 8.929 ( 0.000 -2.483 0.000) 2.483 8.929 ( 0.000 2.483 0.000) 2.483 9.075 ( 0.000 -2.439 0.000) 2.439 9.075 ( 0.000 2.439 0.000) 2.439 9.145 ( 0.000 -2.396 0.000) 2.396 9.145 ( 0.000 2.396 0.000) 2.396 9.203 ( 0.000 -1.735 0.000) 1.735 9.203 ( 0.000 1.735 0.000) 1.735 9.451 ( 0.000 -1.484 0.000) 1.484 9.451 ( 0.000 1.484 0.000) 1.484 9.511 ( 0.000 -0.880 0.000) 0.880 9.511 ( 0.000 0.880 0.000) 0.880 9.546 ( 0.000 -4.281 0.000) 4.281 9.546 ( 0.000 4.281 0.000) 4.281 9.547 ( 0.000 -0.748 0.000) 0.748 9.547 ( 0.000 0.748 0.000) 0.748 9.685 ( 0.000 -3.045 0.000) 3.045 9.685 ( 0.000 3.045 0.000) 3.045 9.707 ( 0.000 -4.742 0.000) 4.742 9.707 ( 0.000 4.742 0.000) 4.742 9.765 ( 0.000 -5.547 0.000) 5.547 9.765 ( 0.000 5.547 0.000) 5.547 9.784 ( 0.000 -0.294 0.000) 0.294 9.784 ( 0.000 0.294 0.000) 0.294 10.008 ( 0.000 -1.680 0.000) 1.680 10.008 ( 0.000 1.680 0.000) 1.680 10.082 ( 0.000 -1.445 0.000) 1.445 10.082 ( 0.000 1.445 0.000) 1.445 10.123 ( 0.000 -4.189 0.000) 4.189 10.123 ( 0.000 4.189 0.000) 4.189 10.405 ( 0.000 -1.856 0.000) 1.856 10.405 ( 0.000 1.856 0.000) 1.856======================= Grid point 12 (8/27) =======================q-point: ( 0.25 -0.50 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 18Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.757 ( 5.808 -15.785 0.000) 16.819 0.757 ( 5.808 15.785 0.000) 16.819 0.869 ( 9.423 -14.552 0.000) 17.337 0.869 ( 9.423 14.552 0.000) 17.337 1.111 ( -10.436 -3.380 0.000) 10.970 1.111 ( -10.436 3.380 0.000) 10.970 1.244 ( -0.832 -6.305 0.000) 6.360 1.244 ( -0.832 6.305 0.000) 6.360 1.390 ( -0.601 -2.304 0.000) 2.381 1.390 ( -0.601 2.304 0.000) 2.381 1.408 ( -2.000 -4.200 0.000) 4.652 1.408 ( -2.000 4.200 0.000) 4.652 1.477 ( 6.980 -6.861 0.000) 9.787 1.477 ( 6.980 6.861 0.000) 9.787 1.528 ( 2.067 -1.674 0.000) 2.660 1.528 ( 2.067 1.674 0.000) 2.660 1.538 ( 0.319 -2.090 0.000) 2.115 1.538 ( 0.319 2.090 0.000) 2.115 1.596 ( -0.020 -2.797 0.000) 2.797 1.596 ( -0.020 2.797 0.000) 2.797 1.609 ( -1.479 -1.399 0.000) 2.036 1.609 ( -1.479 1.399 0.000) 2.036 1.715 ( 4.850 -2.457 0.000) 5.437 1.715 ( 4.850 2.457 0.000) 5.437 1.715 ( 2.507 -1.757 0.000) 3.061 1.715 ( 2.507 1.757 0.000) 3.061 1.765 ( 0.655 -2.085 0.000) 2.186 1.765 ( 0.655 2.085 0.000) 2.186 1.832 ( -1.247 -1.741 0.000) 2.142 1.832 ( -1.247 1.741 0.000) 2.142 1.836 ( 1.648 -3.825 0.000) 4.165 1.836 ( 1.648 3.825 0.000) 4.165 1.895 ( 2.404 -0.407 0.000) 2.438 1.895 ( 2.404 0.407 0.000) 2.438 1.906 ( 1.981 -4.613 0.000) 5.020 1.906 ( 1.981 4.613 0.000) 5.020 1.981 ( -1.239 -2.042 0.000) 2.388 1.981 ( -1.239 2.042 0.000) 2.388 1.992 ( -0.759 -0.651 0.000) 1.000 1.992 ( -0.759 0.651 0.000) 1.000 2.074 ( 0.388 -2.525 0.000) 2.555 2.074 ( 0.388 2.525 0.000) 2.555 2.140 ( 2.709 -0.557 0.000) 2.766 2.140 ( 2.709 0.557 0.000) 2.766 2.142 ( 1.918 -0.543 0.000) 1.993 2.142 ( 1.918 0.543 0.000) 1.993 2.182 ( 0.385 -1.052 0.000) 1.120 2.182 ( 0.385 1.052 0.000) 1.120 2.202 ( 1.431 -1.580 0.000) 2.131 2.202 ( 1.431 1.580 0.000) 2.131 2.245 ( 1.690 -1.652 0.000) 2.363 2.245 ( 1.690 1.652 0.000) 2.363 2.257 ( -2.501 -2.105 0.000) 3.269 2.257 ( -2.501 2.105 0.000) 3.269 2.371 ( -1.531 -3.557 0.000) 3.872 2.371 ( -1.531 3.557 0.000) 3.872 2.382 ( -1.125 -1.867 0.000) 2.180 2.382 ( -1.125 1.867 0.000) 2.180 2.462 ( -4.098 -4.659 0.000) 6.205 2.462 ( -4.098 4.659 0.000) 6.205 2.501 ( 4.666 -2.921 0.000) 5.504 2.501 ( 4.666 2.921 0.000) 5.504 2.618 ( -4.037 -4.655 0.000) 6.162 2.618 ( -4.037 4.655 0.000) 6.162 2.630 ( 1.850 -4.760 0.000) 5.106 2.630 ( 1.850 4.760 0.000) 5.106 2.712 ( -2.229 -4.032 0.000) 4.607 2.712 ( -2.229 4.032 0.000) 4.607 2.754 ( -1.397 -4.497 0.000) 4.709 2.754 ( -1.397 4.497 0.000) 4.709 2.846 ( 2.535 -2.469 0.000) 3.538 2.846 ( 2.535 2.469 0.000) 3.538 2.956 ( -0.037 -4.472 0.000) 4.472 2.956 ( -0.037 4.472 0.000) 4.472 2.963 ( 1.817 -4.515 0.000) 4.867 2.963 ( 1.817 4.515 0.000) 4.867 3.029 ( 1.744 -1.765 0.000) 2.481 3.029 ( 1.744 1.765 0.000) 2.481 3.051 ( -1.699 -1.790 0.000) 2.468 3.051 ( -1.699 1.790 0.000) 2.468 3.092 ( 0.858 -1.225 0.000) 1.496 3.092 ( 0.858 1.225 0.000) 1.496 3.151 ( -0.666 -3.042 0.000) 3.114 3.151 ( -0.666 3.042 0.000) 3.114 3.217 ( -2.722 -2.352 0.000) 3.598 3.217 ( -2.722 2.352 0.000) 3.598 3.362 ( -7.535 -4.080 0.000) 8.568 3.362 ( -7.535 4.080 0.000) 8.568 3.478 ( 0.718 -1.205 0.000) 1.403 3.478 ( 0.718 1.205 0.000) 1.403 3.500 ( -3.890 -3.802 0.000) 5.439 3.500 ( -3.890 3.802 0.000) 5.439 3.641 ( 0.185 -2.012 0.000) 2.021 3.641 ( 0.185 2.012 0.000) 2.021 3.690 ( 0.319 -1.246 0.000) 1.287 3.690 ( 0.319 1.246 0.000) 1.287 3.728 ( 0.482 -1.227 0.000) 1.318 3.728 ( 0.482 1.227 0.000) 1.318 3.798 ( 0.488 -1.649 0.000) 1.720 3.798 ( 0.488 1.649 0.000) 1.720 3.943 ( -1.279 -2.086 0.000) 2.447 3.943 ( -1.279 2.086 0.000) 2.447 3.958 ( 0.258 -1.431 0.000) 1.454 3.958 ( 0.258 1.431 0.000) 1.454 4.037 ( -0.335 -2.387 0.000) 2.410 4.037 ( -0.335 2.387 0.000) 2.410 4.078 ( -0.893 -1.058 0.000) 1.384 4.078 ( -0.893 1.058 0.000) 1.384 4.345 ( 1.043 -2.555 0.000) 2.759 4.345 ( 1.043 2.555 0.000) 2.759 4.377 ( 1.236 -1.866 0.000) 2.238 4.377 ( 1.236 1.866 0.000) 2.238 4.474 ( -0.977 -0.800 0.000) 1.262 4.474 ( -0.977 0.800 0.000) 1.262 4.615 ( -6.482 -0.558 0.000) 6.506 4.615 ( -6.482 0.558 0.000) 6.506 4.673 ( 1.001 -1.284 0.000) 1.628 4.673 ( 1.001 1.284 0.000) 1.628 4.770 ( -3.473 -2.041 0.000) 4.028 4.770 ( -3.473 2.041 0.000) 4.028 4.846 ( 2.773 -0.736 0.000) 2.869 4.846 ( 2.773 0.736 0.000) 2.869 4.915 ( 1.839 -2.807 0.000) 3.356 4.915 ( 1.839 2.807 0.000) 3.356 4.975 ( -0.919 -1.348 0.000) 1.632 4.975 ( -0.919 1.348 0.000) 1.632 5.021 ( 2.830 -2.297 0.000) 3.645 5.021 ( 2.830 2.297 0.000) 3.645 5.026 ( -1.357 -0.596 0.000) 1.482 5.026 ( -1.357 0.596 0.000) 1.482 5.072 ( -0.027 -2.405 0.000) 2.405 5.072 ( -0.027 2.405 0.000) 2.405 5.295 ( -6.690 -2.296 0.000) 7.073 5.295 ( -6.690 2.296 0.000) 7.073 5.387 ( -8.067 -4.902 0.000) 9.440 5.387 ( -8.067 4.902 0.000) 9.440 5.751 ( 6.556 -3.231 0.000) 7.309 5.751 ( 6.556 3.231 0.000) 7.309 5.799 ( 1.521 -1.393 0.000) 2.063 5.799 ( 1.521 1.393 0.000) 2.063 5.870 ( 3.488 -3.702 0.000) 5.087 5.870 ( 3.488 3.702 0.000) 5.087 5.943 ( -0.098 -0.388 0.000) 0.401 5.943 ( -0.098 0.388 0.000) 0.401 6.377 ( 4.808 -1.424 0.000) 5.014 6.377 ( 4.808 1.424 0.000) 5.014 6.382 ( 5.078 -3.119 0.000) 5.959 6.382 ( 5.078 3.119 0.000) 5.959 6.516 ( 0.271 -3.966 0.000) 3.975 6.516 ( 0.271 3.966 0.000) 3.975 6.547 ( -0.756 -2.927 0.000) 3.023 6.547 ( -0.756 2.927 0.000) 3.023 7.696 ( 0.470 -0.576 0.000) 0.744 7.696 ( 0.470 0.576 0.000) 0.744 7.736 ( -1.164 -1.189 0.000) 1.663 7.736 ( -1.164 1.189 0.000) 1.663 7.829 ( 1.362 -0.240 0.000) 1.383 7.829 ( 1.362 0.240 0.000) 1.383 7.849 ( 1.480 -1.136 0.000) 1.866 7.849 ( 1.480 1.136 0.000) 1.866 7.882 ( 1.193 -1.783 0.000) 2.145 7.882 ( 1.193 1.783 0.000) 2.145 7.912 ( -0.573 -0.830 0.000) 1.009 7.912 ( -0.573 0.830 0.000) 1.009 8.068 ( 5.272 -1.822 0.000) 5.578 8.068 ( 5.272 1.822 0.000) 5.578 8.106 ( 1.064 -1.160 0.000) 1.574 8.106 ( 1.064 1.160 0.000) 1.574 8.155 ( 0.045 -0.448 0.000) 0.450 8.155 ( 0.045 0.448 0.000) 0.450 8.216 ( 0.186 -0.550 0.000) 0.581 8.216 ( 0.186 0.550 0.000) 0.581 8.333 ( 0.274 -1.399 0.000) 1.426 8.333 ( 0.274 1.399 0.000) 1.426 8.347 ( -0.336 -3.166 0.000) 3.184 8.347 ( -0.336 3.166 0.000) 3.184 8.473 ( -0.632 -2.043 0.000) 2.139 8.473 ( -0.632 2.043 0.000) 2.139 8.539 ( -3.271 -2.754 0.000) 4.276 8.539 ( -3.271 2.754 0.000) 4.276 8.629 ( 1.372 -0.880 0.000) 1.630 8.629 ( 1.372 0.880 0.000) 1.630 8.667 ( 0.549 -1.820 0.000) 1.901 8.667 ( 0.549 1.820 0.000) 1.901 8.928 ( 1.152 -2.548 0.000) 2.796 8.928 ( 1.152 2.548 0.000) 2.796 9.104 ( -3.580 -2.543 0.000) 4.392 9.104 ( -3.580 2.543 0.000) 4.392 9.113 ( 2.612 -1.998 0.000) 3.289 9.113 ( 2.612 1.998 0.000) 3.289 9.200 ( -0.980 -2.472 0.000) 2.659 9.200 ( -0.980 2.472 0.000) 2.659 9.425 ( -0.276 -2.474 0.000) 2.490 9.425 ( -0.276 2.474 0.000) 2.490 9.498 ( -1.456 -1.584 0.000) 2.151 9.498 ( -1.456 1.584 0.000) 2.151 9.550 ( 0.581 -1.331 0.000) 1.452 9.550 ( 0.581 1.331 0.000) 1.452 9.576 ( 0.866 -1.567 0.000) 1.791 9.576 ( 0.866 1.567 0.000) 1.791 9.686 ( 0.156 -3.889 0.000) 3.892 9.686 ( 0.156 3.889 0.000) 3.892 9.732 ( -1.939 -3.457 0.000) 3.963 9.732 ( -1.939 3.457 0.000) 3.963 9.732 ( 2.295 -3.815 0.000) 4.452 9.732 ( 2.295 3.815 0.000) 4.452 9.797 ( 0.164 -3.046 0.000) 3.051 9.797 ( 0.164 3.046 0.000) 3.051 10.042 ( 2.879 -2.780 0.000) 4.002 10.042 ( 2.879 2.780 0.000) 4.002 10.094 ( 1.410 -2.062 0.000) 2.498 10.094 ( 1.410 2.062 0.000) 2.498 10.114 ( -0.852 -3.432 0.000) 3.536 10.114 ( -0.852 3.432 0.000) 3.536 10.320 ( -6.697 -1.290 0.000) 6.820 10.320 ( -6.697 1.290 0.000) 6.820======================= Grid point 14 (9/27) =======================q-point: (-0.50 -0.50 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 15Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.899 ( -7.825 -10.832 0.000) 13.363 0.899 ( 7.825 -10.832 0.000) 13.363 0.899 ( -7.825 10.832 0.000) 13.363 0.899 ( 7.825 10.832 0.000) 13.363 1.109 ( -10.414 -8.315 0.000) 13.326 1.109 ( 10.414 -8.315 0.000) 13.326 1.109 ( -10.414 8.315 0.000) 13.326 1.109 ( 10.414 8.315 0.000) 13.326 1.384 ( -0.093 -2.314 0.000) 2.316 1.384 ( 0.093 -2.314 0.000) 2.316 1.384 ( -0.093 2.314 0.000) 2.316 1.384 ( 0.093 2.314 0.000) 2.316 1.534 ( -0.084 -5.949 0.000) 5.950 1.534 ( 0.084 -5.949 0.000) 5.950 1.534 ( -0.084 5.949 0.000) 5.950 1.534 ( 0.084 5.949 0.000) 5.950 1.562 ( -1.558 -2.555 0.000) 2.993 1.562 ( 1.558 -2.555 0.000) 2.993 1.562 ( -1.558 2.555 0.000) 2.993 1.562 ( 1.558 2.555 0.000) 2.993 1.699 ( -5.593 -2.216 0.000) 6.016 1.699 ( -5.593 2.216 0.000) 6.016 1.699 ( 5.593 -2.216 0.000) 6.016 1.699 ( 5.593 2.216 0.000) 6.016 1.774 ( -0.904 -3.266 0.000) 3.389 1.774 ( 0.904 -3.266 0.000) 3.389 1.774 ( -0.904 3.266 0.000) 3.389 1.774 ( 0.904 3.266 0.000) 3.389 1.879 ( -2.482 -1.148 0.000) 2.735 1.879 ( -2.482 1.148 0.000) 2.735 1.879 ( 2.482 -1.148 0.000) 2.735 1.879 ( 2.482 1.148 0.000) 2.735 1.919 ( -1.603 -1.970 0.000) 2.540 1.919 ( 1.603 -1.970 0.000) 2.540 1.919 ( -1.603 1.970 0.000) 2.540 1.919 ( 1.603 1.970 0.000) 2.540 1.972 ( -1.271 -2.180 0.000) 2.523 1.972 ( 1.271 -2.180 0.000) 2.523 1.972 ( -1.271 2.180 0.000) 2.523 1.972 ( 1.271 2.180 0.000) 2.523 2.099 ( -4.383 -2.380 0.000) 4.988 2.099 ( 4.383 -2.380 0.000) 4.988 2.099 ( -4.383 2.380 0.000) 4.988 2.099 ( 4.383 2.380 0.000) 4.988 2.182 ( -0.632 -1.172 0.000) 1.331 2.182 ( 0.632 -1.172 0.000) 1.331 2.182 ( -0.632 1.172 0.000) 1.331 2.182 ( 0.632 1.172 0.000) 1.331 2.225 ( -0.175 -0.791 0.000) 0.810 2.225 ( 0.175 -0.791 0.000) 0.810 2.225 ( -0.175 0.791 0.000) 0.810 2.225 ( 0.175 0.791 0.000) 0.810 2.315 ( -4.454 -0.585 0.000) 4.492 2.315 ( -4.454 0.585 0.000) 4.492 2.315 ( 4.454 -0.585 0.000) 4.492 2.315 ( 4.454 0.585 0.000) 4.492 2.373 ( -2.704 -1.269 0.000) 2.987 2.373 ( -2.704 1.269 0.000) 2.987 2.373 ( 2.704 -1.269 0.000) 2.987 2.373 ( 2.704 1.269 0.000) 2.987 2.577 ( -0.605 -4.545 0.000) 4.585 2.577 ( 0.605 -4.545 0.000) 4.585 2.577 ( -0.605 4.545 0.000) 4.585 2.577 ( 0.605 4.545 0.000) 4.585 2.652 ( -2.713 -3.932 0.000) 4.777 2.652 ( 2.713 -3.932 0.000) 4.777 2.652 ( -2.713 3.932 0.000) 4.777 2.652 ( 2.713 3.932 0.000) 4.777 2.809 ( -5.144 -4.977 0.000) 7.157 2.809 ( 5.144 -4.977 0.000) 7.157 2.809 ( -5.144 4.977 0.000) 7.157 2.809 ( 5.144 4.977 0.000) 7.157 2.986 ( -0.292 -2.213 0.000) 2.232 2.986 ( 0.292 -2.213 0.000) 2.232 2.986 ( -0.292 2.213 0.000) 2.232 2.986 ( 0.292 2.213 0.000) 2.232 3.070 ( -1.594 -2.725 0.000) 3.157 3.070 ( 1.594 -2.725 0.000) 3.157 3.070 ( -1.594 2.725 0.000) 3.157 3.070 ( 1.594 2.725 0.000) 3.157 3.133 ( -2.264 -2.600 0.000) 3.447 3.133 ( 2.264 -2.600 0.000) 3.447 3.133 ( -2.264 2.600 0.000) 3.447 3.133 ( 2.264 2.600 0.000) 3.447 3.175 ( -4.472 -4.107 0.000) 6.072 3.175 ( 4.472 -4.107 0.000) 6.072 3.175 ( -4.472 4.107 0.000) 6.072 3.175 ( 4.472 4.107 0.000) 6.072 3.471 ( -0.379 -3.722 0.000) 3.742 3.471 ( 0.379 -3.722 0.000) 3.742 3.471 ( -0.379 3.722 0.000) 3.742 3.471 ( 0.379 3.722 0.000) 3.742 3.669 ( -1.762 -2.187 0.000) 2.808 3.669 ( 1.762 -2.187 0.000) 2.808 3.669 ( -1.762 2.187 0.000) 2.808 3.669 ( 1.762 2.187 0.000) 2.808 3.764 ( -2.673 -0.795 0.000) 2.788 3.764 ( -2.673 0.795 0.000) 2.788 3.764 ( 2.673 -0.795 0.000) 2.788 3.764 ( 2.673 0.795 0.000) 2.788 3.948 ( -1.094 -0.576 0.000) 1.236 3.948 ( 1.094 -0.576 0.000) 1.236 3.948 ( -1.094 0.576 0.000) 1.236 3.948 ( 1.094 0.576 0.000) 1.236 4.049 ( -1.437 -2.011 0.000) 2.471 4.049 ( 1.437 -2.011 0.000) 2.471 4.049 ( -1.437 2.011 0.000) 2.471 4.049 ( 1.437 2.011 0.000) 2.471 4.377 ( -1.550 -2.205 0.000) 2.695 4.377 ( 1.550 -2.205 0.000) 2.695 4.377 ( -1.550 2.205 0.000) 2.695 4.377 ( 1.550 2.205 0.000) 2.695 4.497 ( -3.845 -0.806 0.000) 3.929 4.497 ( -3.845 0.806 0.000) 3.929 4.497 ( 3.845 -0.806 0.000) 3.929 4.497 ( 3.845 0.806 0.000) 3.929 4.707 ( -2.295 -2.060 0.000) 3.085 4.707 ( 2.295 -2.060 0.000) 3.085 4.707 ( -2.295 2.060 0.000) 3.085 4.707 ( 2.295 2.060 0.000) 3.085 4.916 ( -3.008 -0.899 0.000) 3.140 4.916 ( -3.008 0.899 0.000) 3.140 4.916 ( 3.008 -0.899 0.000) 3.140 4.916 ( 3.008 0.899 0.000) 3.140 4.982 ( -2.481 -2.020 0.000) 3.199 4.982 ( 2.481 -2.020 0.000) 3.199 4.982 ( -2.481 2.020 0.000) 3.199 4.982 ( 2.481 2.020 0.000) 3.199 5.077 ( -0.397 -0.530 0.000) 0.662 5.077 ( 0.397 -0.530 0.000) 0.662 5.077 ( -0.397 0.530 0.000) 0.662 5.077 ( 0.397 0.530 0.000) 0.662 5.239 ( -3.536 -2.307 0.000) 4.223 5.239 ( 3.536 -2.307 0.000) 4.223 5.239 ( -3.536 2.307 0.000) 4.223 5.239 ( 3.536 2.307 0.000) 4.223 5.830 ( -0.123 -2.375 0.000) 2.378 5.830 ( 0.123 -2.375 0.000) 2.378 5.830 ( -0.123 2.375 0.000) 2.378 5.830 ( 0.123 2.375 0.000) 2.378 5.914 ( -2.220 -1.232 0.000) 2.539 5.914 ( 2.220 -1.232 0.000) 2.539 5.914 ( -2.220 1.232 0.000) 2.539 5.914 ( 2.220 1.232 0.000) 2.539 6.450 ( -0.306 -2.207 0.000) 2.228 6.450 ( 0.306 -2.207 0.000) 2.228 6.450 ( -0.306 2.207 0.000) 2.228 6.450 ( 0.306 2.207 0.000) 2.228 6.521 ( -0.838 -0.637 0.000) 1.052 6.521 ( 0.838 -0.637 0.000) 1.052 6.521 ( -0.838 0.637 0.000) 1.052 6.521 ( 0.838 0.637 0.000) 1.052 7.712 ( -0.985 -0.919 0.000) 1.347 7.712 ( 0.985 -0.919 0.000) 1.347 7.712 ( -0.985 0.919 0.000) 1.347 7.712 ( 0.985 0.919 0.000) 1.347 7.854 ( -0.713 -0.414 0.000) 0.824 7.854 ( 0.713 -0.414 0.000) 0.824 7.854 ( -0.713 0.414 0.000) 0.824 7.854 ( 0.713 0.414 0.000) 0.824 7.898 ( -0.648 -1.492 0.000) 1.626 7.898 ( 0.648 -1.492 0.000) 1.626 7.898 ( -0.648 1.492 0.000) 1.626 7.898 ( 0.648 1.492 0.000) 1.626 8.133 ( -1.007 -0.473 0.000) 1.113 8.133 ( -1.007 0.473 0.000) 1.113 8.133 ( 1.007 -0.473 0.000) 1.113 8.133 ( 1.007 0.473 0.000) 1.113 8.189 ( -3.247 -1.613 0.000) 3.625 8.189 ( -3.247 1.613 0.000) 3.625 8.189 ( 3.247 -1.613 0.000) 3.625 8.189 ( 3.247 1.613 0.000) 3.625 8.341 ( -0.317 -3.078 0.000) 3.094 8.341 ( 0.317 -3.078 0.000) 3.094 8.341 ( -0.317 3.078 0.000) 3.094 8.341 ( 0.317 3.078 0.000) 3.094 8.476 ( -1.722 -0.669 0.000) 1.847 8.476 ( -1.722 0.669 0.000) 1.847 8.476 ( 1.722 -0.669 0.000) 1.847 8.476 ( 1.722 0.669 0.000) 1.847 8.660 ( -1.210 -1.332 0.000) 1.800 8.660 ( 1.210 -1.332 0.000) 1.800 8.660 ( -1.210 1.332 0.000) 1.800 8.660 ( 1.210 1.332 0.000) 1.800 9.003 ( -5.235 -2.172 0.000) 5.667 9.003 ( -5.235 2.172 0.000) 5.667 9.003 ( 5.235 -2.172 0.000) 5.667 9.003 ( 5.235 2.172 0.000) 5.667 9.164 ( -2.112 -1.774 0.000) 2.758 9.164 ( 2.112 -1.774 0.000) 2.758 9.164 ( -2.112 1.774 0.000) 2.758 9.164 ( 2.112 1.774 0.000) 2.758 9.454 ( -2.311 -2.776 0.000) 3.612 9.454 ( 2.311 -2.776 0.000) 3.612 9.454 ( -2.311 2.776 0.000) 3.612 9.454 ( 2.311 2.776 0.000) 3.612 9.570 ( -0.972 -2.017 0.000) 2.239 9.570 ( 0.972 -2.017 0.000) 2.239 9.570 ( -0.972 2.017 0.000) 2.239 9.570 ( 0.972 2.017 0.000) 2.239 9.698 ( -1.098 -4.196 0.000) 4.337 9.698 ( 1.098 -4.196 0.000) 4.337 9.698 ( -1.098 4.196 0.000) 4.337 9.698 ( 1.098 4.196 0.000) 4.337 9.781 ( -1.725 -3.370 0.000) 3.786 9.781 ( 1.725 -3.370 0.000) 3.786 9.781 ( -1.725 3.370 0.000) 3.786 9.781 ( 1.725 3.370 0.000) 3.786 10.090 ( -1.378 -1.913 0.000) 2.357 10.090 ( 1.378 -1.913 0.000) 2.357 10.090 ( -1.378 1.913 0.000) 2.357 10.090 ( 1.378 1.913 0.000) 2.357 10.174 ( -6.149 -1.716 0.000) 6.383 10.174 ( -6.149 1.716 0.000) 6.383 10.174 ( 6.149 -1.716 0.000) 6.383 10.174 ( 6.149 1.716 0.000) 6.383======================= Grid point 25 (10/27) =======================q-point: ( 0.00 0.00 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 18Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.386 ( 0.000 0.000 19.354) 19.354 0.414 ( 0.000 0.000 20.576) 20.576 0.750 ( 0.000 0.000 35.961) 35.961 1.092 ( 0.000 0.000 -9.616) 9.616 1.123 ( 0.000 0.000 -13.126) 13.126 1.209 ( 0.000 0.000 0.533) 0.533 1.255 ( 0.000 0.000 4.628) 4.628 1.324 ( 0.000 0.000 -0.980) 0.980 1.334 ( 0.000 0.000 -0.226) 0.226 1.347 ( 0.000 0.000 3.780) 3.780 1.401 ( 0.000 0.000 0.763) 0.763 1.409 ( 0.000 0.000 1.496) 1.496 1.436 ( 0.000 0.000 -1.463) 1.463 1.458 ( 0.000 0.000 0.864) 0.864 1.534 ( 0.000 0.000 2.608) 2.608 1.539 ( 0.000 0.000 1.163) 1.163 1.553 ( 0.000 0.000 1.239) 1.239 1.595 ( 0.000 0.000 1.123) 1.123 1.604 ( 0.000 0.000 1.411) 1.411 1.614 ( 0.000 0.000 -4.046) 4.046 1.636 ( 0.000 0.000 0.755) 0.755 1.647 ( 0.000 0.000 1.950) 1.950 1.659 ( 0.000 0.000 -3.881) 3.881 1.680 ( 0.000 0.000 5.931) 5.931 1.696 ( 0.000 0.000 -4.319) 4.319 1.718 ( 0.000 0.000 -3.571) 3.571 1.799 ( 0.000 0.000 2.246) 2.246 1.813 ( 0.000 0.000 4.670) 4.670 1.819 ( 0.000 0.000 -2.424) 2.424 1.844 ( 0.000 0.000 0.724) 0.724 1.884 ( 0.000 0.000 -0.319) 0.319 1.920 ( 0.000 0.000 2.064) 2.064 1.922 ( 0.000 0.000 2.115) 2.115 1.947 ( 0.000 0.000 -0.325) 0.325 1.959 ( 0.000 0.000 -0.041) 0.041 1.964 ( 0.000 0.000 1.960) 1.960 1.985 ( 0.000 0.000 2.051) 2.051 2.013 ( 0.000 0.000 -8.022) 8.022 2.038 ( 0.000 0.000 -1.672) 1.672 2.046 ( 0.000 0.000 4.308) 4.308 2.064 ( 0.000 0.000 -2.032) 2.032 2.081 ( 0.000 0.000 -2.306) 2.306 2.104 ( 0.000 0.000 -12.575) 12.575 2.117 ( 0.000 0.000 0.043) 0.043 2.131 ( 0.000 0.000 0.527) 0.527 2.141 ( 0.000 0.000 0.910) 0.910 2.155 ( 0.000 0.000 -1.696) 1.696 2.180 ( 0.000 0.000 0.541) 0.541 2.182 ( 0.000 0.000 -1.851) 1.851 2.239 ( 0.000 0.000 -1.207) 1.207 2.239 ( 0.000 0.000 2.426) 2.426 2.261 ( 0.000 0.000 -1.684) 1.684 2.291 ( 0.000 0.000 -1.120) 1.120 2.303 ( 0.000 0.000 -1.262) 1.262 2.319 ( 0.000 0.000 -3.233) 3.233 2.337 ( 0.000 0.000 3.047) 3.047 2.367 ( 0.000 0.000 0.611) 0.611 2.371 ( 0.000 0.000 -2.487) 2.487 2.386 ( 0.000 0.000 4.191) 4.191 2.400 ( 0.000 0.000 0.316) 0.316 2.450 ( 0.000 0.000 3.093) 3.093 2.503 ( 0.000 0.000 0.746) 0.746 2.523 ( 0.000 0.000 8.265) 8.265 2.593 ( 0.000 0.000 -6.034) 6.034 2.603 ( 0.000 0.000 2.387) 2.387 2.615 ( 0.000 0.000 -4.897) 4.897 2.625 ( 0.000 0.000 -3.472) 3.472 2.773 ( 0.000 0.000 -2.868) 2.868 2.774 ( 0.000 0.000 0.500) 0.500 2.792 ( 0.000 0.000 3.333) 3.333 2.847 ( 0.000 0.000 1.348) 1.348 2.886 ( 0.000 0.000 0.158) 0.158 2.893 ( 0.000 0.000 -3.363) 3.363 2.918 ( 0.000 0.000 -3.721) 3.721 2.936 ( 0.000 0.000 -0.802) 0.802 2.937 ( 0.000 0.000 0.678) 0.678 2.971 ( 0.000 0.000 1.525) 1.525 2.998 ( 0.000 0.000 1.804) 1.804 2.999 ( 0.000 0.000 -1.002) 1.002 3.014 ( 0.000 0.000 -4.340) 4.340 3.038 ( 0.000 0.000 -0.824) 0.824 3.135 ( 0.000 0.000 -1.088) 1.088 3.193 ( 0.000 0.000 10.211) 10.211 3.211 ( 0.000 0.000 5.316) 5.316 3.262 ( 0.000 0.000 4.044) 4.044 3.316 ( 0.000 0.000 3.852) 3.852 3.358 ( 0.000 0.000 2.540) 2.540 3.420 ( 0.000 0.000 2.438) 2.438 3.439 ( 0.000 0.000 -3.774) 3.774 3.488 ( 0.000 0.000 -2.266) 2.266 3.547 ( 0.000 0.000 3.937) 3.937 3.580 ( 0.000 0.000 -3.975) 3.975 3.583 ( 0.000 0.000 -0.245) 0.245 3.598 ( 0.000 0.000 -0.880) 0.880 3.645 ( 0.000 0.000 -6.370) 6.370 3.651 ( 0.000 0.000 -0.910) 0.910 3.721 ( 0.000 0.000 -1.328) 1.328 3.730 ( 0.000 0.000 2.639) 2.639 3.769 ( 0.000 0.000 -2.341) 2.341 3.806 ( 0.000 0.000 -0.112) 0.112 3.937 ( 0.000 0.000 0.444) 0.444 3.948 ( 0.000 0.000 -0.047) 0.047 3.991 ( 0.000 0.000 -1.930) 1.930 4.017 ( 0.000 0.000 0.675) 0.675 4.057 ( 0.000 0.000 -3.483) 3.483 4.074 ( 0.000 0.000 -1.409) 1.409 4.076 ( 0.000 0.000 1.350) 1.350 4.112 ( 0.000 0.000 0.931) 0.931 4.273 ( 0.000 0.000 3.167) 3.167 4.289 ( 0.000 0.000 0.539) 0.539 4.344 ( 0.000 0.000 -2.200) 2.200 4.371 ( 0.000 0.000 -2.293) 2.293 4.507 ( 0.000 0.000 2.324) 2.324 4.524 ( 0.000 0.000 3.661) 3.661 4.633 ( 0.000 0.000 -4.894) 4.894 4.636 ( 0.000 0.000 -2.461) 2.461 4.741 ( 0.000 0.000 -1.815) 1.815 4.742 ( 0.000 0.000 1.264) 1.264 4.776 ( 0.000 0.000 -0.466) 0.466 4.815 ( 0.000 0.000 -4.580) 4.580 4.838 ( 0.000 0.000 2.852) 2.852 4.852 ( 0.000 0.000 3.393) 3.393 4.889 ( 0.000 0.000 1.138) 1.138 4.906 ( 0.000 0.000 0.101) 0.101 4.954 ( 0.000 0.000 1.181) 1.181 5.007 ( 0.000 0.000 0.831) 0.831 5.013 ( 0.000 0.000 -1.989) 1.989 5.021 ( 0.000 0.000 -0.282) 0.282 5.095 ( 0.000 0.000 7.053) 7.053 5.133 ( 0.000 0.000 3.398) 3.398 5.215 ( 0.000 0.000 1.300) 1.300 5.245 ( 0.000 0.000 -1.992) 1.992 5.321 ( 0.000 0.000 -2.169) 2.169 5.343 ( 0.000 0.000 -4.111) 4.111 5.487 ( 0.000 0.000 2.958) 2.958 5.613 ( 0.000 0.000 1.951) 1.951 5.626 ( 0.000 0.000 -2.822) 2.822 5.699 ( 0.000 0.000 -0.253) 0.253 5.719 ( 0.000 0.000 -2.035) 2.035 5.723 ( 0.000 0.000 -0.849) 0.849 5.786 ( 0.000 0.000 2.927) 2.927 5.897 ( 0.000 0.000 -1.832) 1.832 5.970 ( 0.000 0.000 1.478) 1.478 6.027 ( 0.000 0.000 -0.897) 0.897 6.303 ( 0.000 0.000 0.059) 0.059 6.305 ( 0.000 0.000 -0.026) 0.026 6.334 ( 0.000 0.000 -0.026) 0.026 6.335 ( 0.000 0.000 -0.130) 0.130 6.430 ( 0.000 0.000 0.982) 0.982 6.477 ( 0.000 0.000 -0.935) 0.935 6.603 ( 0.000 0.000 0.041) 0.041 6.608 ( 0.000 0.000 -0.189) 0.189 7.705 ( 0.000 0.000 2.100) 2.100 7.717 ( 0.000 0.000 1.321) 1.321 7.761 ( 0.000 0.000 -0.722) 0.722 7.761 ( 0.000 0.000 -0.555) 0.555 7.828 ( 0.000 0.000 1.548) 1.548 7.834 ( 0.000 0.000 3.926) 3.926 7.842 ( 0.000 0.000 0.723) 0.723 7.871 ( 0.000 0.000 1.559) 1.559 7.882 ( 0.000 0.000 -0.145) 0.145 7.887 ( 0.000 0.000 1.178) 1.178 7.921 ( 0.000 0.000 1.021) 1.021 7.977 ( 0.000 0.000 -2.332) 2.332 7.979 ( 0.000 0.000 -2.378) 2.378 8.052 ( 0.000 0.000 -0.649) 0.649 8.097 ( 0.000 0.000 -0.588) 0.588 8.104 ( 0.000 0.000 -0.308) 0.308 8.158 ( 0.000 0.000 2.183) 2.183 8.198 ( 0.000 0.000 3.609) 3.609 8.233 ( 0.000 0.000 3.248) 3.248 8.276 ( 0.000 0.000 -3.196) 3.196 8.284 ( 0.000 0.000 -0.066) 0.066 8.293 ( 0.000 0.000 -0.664) 0.664 8.348 ( 0.000 0.000 5.184) 5.184 8.436 ( 0.000 0.000 -5.493) 5.493 8.440 ( 0.000 0.000 1.410) 1.410 8.485 ( 0.000 0.000 -7.769) 7.769 8.530 ( 0.000 0.000 -2.594) 2.594 8.573 ( 0.000 0.000 1.906) 1.906 8.606 ( 0.000 0.000 -3.541) 3.541 8.635 ( 0.000 0.000 2.442) 2.442 8.681 ( 0.000 0.000 -1.371) 1.371 8.789 ( 0.000 0.000 -4.702) 4.702 8.944 ( 0.000 0.000 -3.263) 3.263 8.955 ( 0.000 0.000 3.082) 3.082 8.978 ( 0.000 0.000 -1.963) 1.963 9.043 ( 0.000 0.000 -1.672) 1.672 9.173 ( 0.000 0.000 3.844) 3.844 9.194 ( 0.000 0.000 1.697) 1.697 9.251 ( 0.000 0.000 -0.804) 0.804 9.287 ( 0.000 0.000 -1.801) 1.801 9.363 ( 0.000 0.000 0.477) 0.477 9.386 ( 0.000 0.000 -0.846) 0.846 9.421 ( 0.000 0.000 2.220) 2.220 9.446 ( 0.000 0.000 2.321) 2.321 9.472 ( 0.000 0.000 -0.676) 0.676 9.566 ( 0.000 0.000 0.340) 0.340 9.566 ( 0.000 0.000 -1.700) 1.700 9.571 ( 0.000 0.000 0.614) 0.614 9.627 ( 0.000 0.000 1.547) 1.547 9.674 ( 0.000 0.000 0.662) 0.662 9.701 ( 0.000 0.000 -0.442) 0.442 9.704 ( 0.000 0.000 -1.561) 1.561 9.819 ( 0.000 0.000 0.794) 0.794 9.864 ( 0.000 0.000 2.111) 2.111 9.871 ( 0.000 0.000 1.283) 1.283 9.882 ( 0.000 0.000 -2.020) 2.020 9.946 ( 0.000 0.000 0.146) 0.146 9.974 ( 0.000 0.000 -1.107) 1.107 10.020 ( 0.000 0.000 0.428) 0.428 10.027 ( 0.000 0.000 0.055) 0.055 10.065 ( 0.000 0.000 0.156) 0.156 10.069 ( 0.000 0.000 0.080) 0.080 10.272 ( 0.000 0.000 0.203) 0.203 10.315 ( 0.000 0.000 -1.413) 1.413======================= Grid point 26 (11/27) =======================q-point: ( 0.25 0.00 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 24Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.560 ( 13.590 0.000 13.398) 19.084 0.600 ( 14.602 0.000 13.384) 19.808 0.980 ( 14.712 0.000 20.736) 25.425 1.167 ( -4.561 0.000 -5.360) 7.038 1.178 ( 6.763 0.000 -9.381) 11.565 1.214 ( -1.130 0.000 4.243) 4.391 1.216 ( -3.193 0.000 -0.947) 3.330 1.283 ( 0.125 0.000 1.169) 1.175 1.319 ( -6.546 0.000 -0.347) 6.555 1.350 ( 1.214 0.000 0.990) 1.566 1.351 ( 0.933 0.000 0.992) 1.361 1.384 ( 0.404 0.000 3.237) 3.262 1.417 ( 1.637 0.000 0.415) 1.689 1.449 ( 2.379 0.000 -2.668) 3.575 1.492 ( -1.424 0.000 1.384) 1.986 1.500 ( -0.958 0.000 3.425) 3.556 1.561 ( -1.659 0.000 -1.866) 2.497 1.584 ( -2.621 0.000 0.583) 2.685 1.622 ( 1.630 0.000 -4.677) 4.953 1.641 ( 0.846 0.000 3.108) 3.221 1.653 ( 1.281 0.000 -0.215) 1.299 1.662 ( 1.599 0.000 -1.867) 2.457 1.709 ( 1.955 0.000 3.453) 3.969 1.728 ( 1.620 0.000 -1.359) 2.115 1.750 ( -1.510 0.000 -0.311) 1.541 1.760 ( 5.126 0.000 1.201) 5.265 1.797 ( 5.490 0.000 0.888) 5.561 1.811 ( 1.162 0.000 -1.201) 1.672 1.846 ( -2.592 0.000 1.196) 2.855 1.860 ( -3.948 0.000 1.728) 4.310 1.894 ( 2.563 0.000 1.279) 2.864 1.901 ( 0.021 0.000 1.358) 1.359 1.905 ( -2.228 0.000 -0.936) 2.416 1.922 ( 1.393 0.000 -1.946) 2.393 1.951 ( 2.325 0.000 2.928) 3.738 1.971 ( -0.018 0.000 3.307) 3.307 1.984 ( 2.158 0.000 1.976) 2.926 1.992 ( -1.630 0.000 1.182) 2.013 2.050 ( 0.142 0.000 -3.597) 3.599 2.053 ( -2.361 0.000 1.161) 2.631 2.075 ( -0.705 0.000 -2.234) 2.342 2.082 ( -1.070 0.000 0.735) 1.298 2.102 ( 0.370 0.000 -0.473) 0.601 2.125 ( -1.587 0.000 -4.627) 4.891 2.136 ( 2.386 0.000 0.293) 2.404 2.141 ( 1.955 0.000 -4.754) 5.141 2.158 ( 0.970 0.000 -4.081) 4.195 2.176 ( -2.295 0.000 1.310) 2.643 2.207 ( 3.708 0.000 -7.069) 7.982 2.210 ( 1.349 0.000 0.086) 1.352 2.241 ( -0.985 0.000 0.880) 1.321 2.259 ( -3.126 0.000 -2.091) 3.760 2.261 ( -2.501 0.000 1.589) 2.963 2.305 ( -1.832 0.000 2.234) 2.889 2.321 ( 0.640 0.000 1.289) 1.439 2.327 ( 1.135 0.000 -0.672) 1.319 2.357 ( -3.809 0.000 2.234) 4.416 2.388 ( 5.716 0.000 -0.365) 5.727 2.394 ( 0.439 0.000 -1.228) 1.304 2.420 ( 0.233 0.000 -0.752) 0.787 2.477 ( 1.946 0.000 3.664) 4.149 2.495 ( 1.050 0.000 -1.509) 1.838 2.557 ( -3.376 0.000 -3.581) 4.921 2.567 ( -0.348 0.000 6.674) 6.683 2.646 ( 3.434 0.000 -5.402) 6.401 2.648 ( 5.167 0.000 1.907) 5.508 2.701 ( 2.103 0.000 -4.535) 4.999 2.721 ( 2.315 0.000 -1.810) 2.939 2.754 ( -2.086 0.000 0.471) 2.139 2.788 ( -1.381 0.000 2.716) 3.047 2.814 ( 1.189 0.000 -6.383) 6.493 2.844 ( -3.131 0.000 1.210) 3.357 2.910 ( -0.607 0.000 -4.537) 4.578 2.919 ( -0.829 0.000 -0.865) 1.198 2.938 ( 2.754 0.000 -0.686) 2.838 2.952 ( -2.098 0.000 1.950) 2.864 2.975 ( 0.707 0.000 -1.812) 1.945 2.988 ( 2.405 0.000 2.758) 3.660 3.050 ( 2.096 0.000 1.367) 2.502 3.066 ( 1.908 0.000 0.593) 1.998 3.076 ( 4.704 0.000 -1.654) 4.986 3.115 ( -1.746 0.000 -0.048) 1.746 3.130 ( -4.085 0.000 4.712) 6.236 3.204 ( 0.291 0.000 5.669) 5.677 3.256 ( -6.439 0.000 2.293) 6.835 3.260 ( -5.764 0.000 2.396) 6.242 3.304 ( -1.814 0.000 4.958) 5.279 3.371 ( -2.430 0.000 -1.401) 2.805 3.451 ( 3.607 0.000 0.710) 3.676 3.455 ( -5.448 0.000 0.421) 5.464 3.500 ( -5.042 0.000 -2.170) 5.489 3.528 ( -0.015 0.000 1.820) 1.820 3.586 ( -2.251 0.000 -2.920) 3.687 3.625 ( 2.120 0.000 -3.452) 4.051 3.648 ( 1.071 0.000 -2.506) 2.726 3.679 ( 1.301 0.000 -0.938) 1.604 3.716 ( -0.477 0.000 1.333) 1.416 3.736 ( 0.405 0.000 0.010) 0.405 3.748 ( -0.996 0.000 -0.579) 1.152 3.816 ( -0.353 0.000 -1.347) 1.392 3.934 ( 0.124 0.000 0.908) 0.916 3.956 ( 0.717 0.000 -0.172) 0.738 3.984 ( -0.331 0.000 -1.064) 1.114 4.001 ( -1.503 0.000 0.097) 1.506 4.018 ( -2.877 0.000 -0.596) 2.938 4.038 ( -2.472 0.000 1.443) 2.862 4.072 ( 0.697 0.000 -2.804) 2.889 4.116 ( -0.576 0.000 -0.846) 1.023 4.261 ( 0.626 0.000 0.503) 0.803 4.329 ( -0.686 0.000 -2.271) 2.373 4.332 ( 1.228 0.000 0.393) 1.290 4.364 ( -1.549 0.000 -4.055) 4.341 4.481 ( 0.550 0.000 3.733) 3.773 4.555 ( -0.023 0.000 4.178) 4.178 4.565 ( -4.458 0.000 3.483) 5.657 4.618 ( -2.327 0.000 -0.885) 2.489 4.732 ( -2.191 0.000 0.696) 2.299 4.744 ( 1.045 0.000 -0.900) 1.379 4.767 ( -2.077 0.000 0.761) 2.213 4.792 ( -0.942 0.000 3.673) 3.792 4.812 ( 3.180 0.000 -1.999) 3.756 4.859 ( -2.551 0.000 0.768) 2.664 4.895 ( -1.093 0.000 2.419) 2.655 4.927 ( -1.181 0.000 4.843) 4.985 4.951 ( -0.852 0.000 0.450) 0.964 4.970 ( 5.064 0.000 -0.337) 5.075 5.029 ( 0.602 0.000 0.897) 1.080 5.034 ( 1.775 0.000 -0.026) 1.775 5.035 ( 1.200 0.000 0.722) 1.401 5.119 ( -5.610 0.000 6.960) 8.939 5.138 ( -3.035 0.000 2.786) 4.120 5.182 ( -4.448 0.000 -2.877) 5.297 5.200 ( -3.408 0.000 2.688) 4.340 5.215 ( -4.323 0.000 -1.146) 4.472 5.316 ( -5.063 0.000 -3.112) 5.943 5.449 ( -11.741 0.000 -4.777) 12.675 5.693 ( 5.845 0.000 1.294) 5.987 5.766 ( 5.072 0.000 -1.435) 5.271 5.782 ( 1.152 0.000 1.415) 1.824 5.828 ( 4.636 0.000 -0.907) 4.724 5.838 ( 2.654 0.000 0.686) 2.742 5.910 ( 0.693 0.000 -1.472) 1.626 5.946 ( -1.303 0.000 0.736) 1.497 5.967 ( -3.386 0.000 0.109) 3.388 6.354 ( 1.854 0.000 0.156) 1.860 6.365 ( 2.393 0.000 -0.420) 2.429 6.426 ( -0.331 0.000 0.852) 0.914 6.444 ( 9.015 0.000 0.538) 9.031 6.456 ( -1.810 0.000 -0.397) 1.853 6.567 ( 7.386 0.000 -7.391) 10.449 6.614 ( 0.427 0.000 -0.110) 0.441 6.626 ( 1.205 0.000 -0.800) 1.446 7.710 ( 0.538 0.000 2.760) 2.812 7.727 ( 0.936 0.000 1.507) 1.774 7.750 ( -0.983 0.000 2.317) 2.517 7.779 ( -0.548 0.000 0.866) 1.025 7.820 ( 1.423 0.000 0.137) 1.430 7.826 ( -0.476 0.000 -0.442) 0.650 7.847 ( 0.355 0.000 1.474) 1.516 7.866 ( -1.328 0.000 -1.145) 1.753 7.887 ( 1.086 0.000 2.110) 2.373 7.898 ( 0.884 0.000 1.030) 1.358 7.927 ( 0.129 0.000 0.939) 0.948 7.936 ( -1.691 0.000 1.376) 2.180 8.028 ( 4.790 0.000 -1.385) 4.986 8.063 ( 1.687 0.000 -0.548) 1.774 8.124 ( 1.853 0.000 0.719) 1.987 8.144 ( -0.104 0.000 -0.265) 0.285 8.171 ( 0.698 0.000 2.173) 2.282 8.229 ( 2.273 0.000 1.262) 2.600 8.244 ( 1.099 0.000 2.793) 3.002 8.266 ( -2.764 0.000 -0.651) 2.840 8.269 ( -0.841 0.000 -0.198) 0.864 8.294 ( 1.326 0.000 -3.136) 3.405 8.332 ( -1.607 0.000 3.192) 3.574 8.418 ( -1.438 0.000 1.034) 1.771 8.447 ( 1.155 0.000 -3.818) 3.989 8.491 ( -0.361 0.000 -3.028) 3.049 8.539 ( -0.692 0.000 -1.313) 1.484 8.549 ( -0.102 0.000 0.145) 0.178 8.553 ( -4.060 0.000 -1.972) 4.514 8.632 ( -0.075 0.000 -3.478) 3.479 8.633 ( -0.579 0.000 0.722) 0.925 8.717 ( -3.024 0.000 -3.299) 4.476 8.921 ( 1.261 0.000 0.999) 1.608 8.947 ( -0.193 0.000 -1.088) 1.105 9.006 ( -1.388 0.000 -2.581) 2.931 9.081 ( -0.391 0.000 -3.393) 3.416 9.169 ( -0.246 0.000 1.398) 1.420 9.235 ( 2.627 0.000 -2.409) 3.564 9.282 ( -3.551 0.000 2.776) 4.507 9.285 ( 1.111 0.000 1.534) 1.894 9.334 ( 2.060 0.000 -0.448) 2.109 9.420 ( 2.111 0.000 -2.303) 3.124 9.426 ( -1.314 0.000 0.734) 1.505 9.468 ( -0.473 0.000 -2.869) 2.908 9.519 ( 3.880 0.000 0.871) 3.977 9.527 ( 0.556 0.000 0.946) 1.097 9.573 ( 0.094 0.000 1.216) 1.220 9.618 ( 0.077 0.000 -1.289) 1.291 9.631 ( 0.121 0.000 -0.238) 0.267 9.639 ( 1.656 0.000 -0.489) 1.726 9.710 ( 2.195 0.000 2.012) 2.977 9.764 ( 0.237 0.000 1.483) 1.502 9.801 ( -1.556 0.000 0.128) 1.561 9.833 ( -2.161 0.000 -2.039) 2.971 9.841 ( -2.286 0.000 1.276) 2.618 9.853 ( -0.987 0.000 0.989) 1.397 9.956 ( 1.186 0.000 0.399) 1.251 9.985 ( 0.672 0.000 -0.663) 0.944 10.016 ( -0.413 0.000 0.136) 0.435 10.017 ( -0.977 0.000 0.190) 0.995 10.106 ( 3.231 0.000 0.178) 3.236 10.116 ( 4.042 0.000 -0.256) 4.050 10.261 ( -2.107 0.000 -0.743) 2.234 10.286 ( -2.617 0.000 -1.198) 2.878======================= Grid point 27 (12/27) =======================q-point: (-0.50 0.00 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 18Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.878 ( -15.393 0.000 8.079) 17.384 0.878 ( 15.393 0.000 8.079) 17.384 0.930 ( -14.807 0.000 6.428) 16.143 0.930 ( 14.807 0.000 6.428) 16.143 1.228 ( -2.717 0.000 0.050) 2.717 1.228 ( 2.717 0.000 0.050) 2.717 1.267 ( -1.979 0.000 -4.076) 4.531 1.267 ( 1.979 0.000 -4.076) 4.531 1.385 ( -0.898 0.000 1.316) 1.593 1.385 ( 0.898 0.000 1.316) 1.593 1.388 ( -4.435 0.000 -4.675) 6.444 1.388 ( 4.435 0.000 -4.675) 6.444 1.438 ( -3.847 0.000 4.448) 5.881 1.438 ( 3.847 0.000 4.448) 5.881 1.491 ( -1.593 0.000 -2.387) 2.869 1.491 ( 1.593 0.000 -2.387) 2.869 1.539 ( -0.361 0.000 3.456) 3.474 1.539 ( 0.361 0.000 3.456) 3.474 1.657 ( -1.447 0.000 -1.087) 1.810 1.657 ( 1.447 0.000 -1.087) 1.810 1.673 ( -4.196 0.000 1.668) 4.515 1.673 ( 4.196 0.000 1.668) 4.515 1.746 ( -6.188 0.000 1.881) 6.468 1.746 ( 6.188 0.000 1.881) 6.468 1.754 ( -1.788 0.000 1.152) 2.127 1.754 ( 1.788 0.000 1.152) 2.127 1.793 ( -2.456 0.000 -1.626) 2.946 1.793 ( 2.456 0.000 -1.626) 2.946 1.883 ( -2.158 0.000 3.998) 4.543 1.883 ( 2.158 0.000 3.998) 4.543 1.897 ( -4.408 0.000 -0.656) 4.456 1.897 ( 4.408 0.000 -0.656) 4.456 1.928 ( -2.946 0.000 0.231) 2.955 1.928 ( 2.946 0.000 0.231) 2.955 1.985 ( -2.715 0.000 1.839) 3.279 1.985 ( 2.715 0.000 1.839) 3.279 1.991 ( -1.747 0.000 3.066) 3.529 1.991 ( 1.747 0.000 3.066) 3.529 2.003 ( -2.734 0.000 3.496) 4.438 2.003 ( 2.734 0.000 3.496) 4.438 2.063 ( -1.746 0.000 -3.550) 3.956 2.063 ( 1.746 0.000 -3.550) 3.956 2.113 ( -3.513 0.000 -2.231) 4.161 2.113 ( 3.513 0.000 -2.231) 4.161 2.128 ( -2.749 0.000 -0.696) 2.835 2.128 ( 2.749 0.000 -0.696) 2.835 2.181 ( -0.751 0.000 -2.468) 2.580 2.181 ( 0.751 0.000 -2.468) 2.580 2.216 ( -2.031 0.000 -3.270) 3.850 2.216 ( 2.031 0.000 -3.270) 3.850 2.259 ( -0.361 0.000 -0.744) 0.827 2.259 ( 0.361 0.000 -0.744) 0.827 2.261 ( -4.976 0.000 0.438) 4.995 2.261 ( 4.976 0.000 0.438) 4.995 2.323 ( -5.562 0.000 2.969) 6.304 2.323 ( 5.562 0.000 2.969) 6.304 2.342 ( -0.958 0.000 -0.119) 0.965 2.342 ( 0.958 0.000 -0.119) 0.965 2.451 ( -5.286 0.000 -6.095) 8.068 2.451 ( 5.286 0.000 -6.095) 8.068 2.504 ( -1.428 0.000 -0.369) 1.475 2.504 ( 1.428 0.000 -0.369) 1.475 2.571 ( -5.858 0.000 0.376) 5.870 2.571 ( 5.858 0.000 0.376) 5.870 2.671 ( -5.880 0.000 3.068) 6.632 2.671 ( 5.880 0.000 3.068) 6.632 2.758 ( -2.965 0.000 1.036) 3.141 2.758 ( 2.965 0.000 1.036) 3.141 2.769 ( -3.197 0.000 -5.567) 6.420 2.769 ( 3.197 0.000 -5.567) 6.420 2.837 ( -4.974 0.000 0.492) 4.998 2.837 ( 4.974 0.000 0.492) 4.998 2.855 ( -3.258 0.000 -6.932) 7.660 2.855 ( 3.258 0.000 -6.932) 7.660 2.970 ( -3.255 0.000 4.598) 5.633 2.970 ( 3.255 0.000 4.598) 5.633 2.996 ( -1.144 0.000 -3.257) 3.452 2.996 ( 1.144 0.000 -3.257) 3.452 3.091 ( -6.464 0.000 3.308) 7.261 3.091 ( 6.464 0.000 3.308) 7.261 3.101 ( -1.988 0.000 4.376) 4.806 3.101 ( 1.988 0.000 4.376) 4.806 3.135 ( -1.261 0.000 1.866) 2.252 3.135 ( 1.261 0.000 1.866) 2.252 3.216 ( -5.935 0.000 2.525) 6.450 3.216 ( 5.935 0.000 2.525) 6.450 3.271 ( -7.603 0.000 -2.533) 8.014 3.271 ( 7.603 0.000 -2.533) 8.014 3.405 ( -2.860 0.000 1.916) 3.443 3.405 ( 2.860 0.000 1.916) 3.443 3.511 ( -3.003 0.000 -2.859) 4.146 3.511 ( 3.003 0.000 -2.859) 4.146 3.610 ( -4.744 0.000 0.882) 4.825 3.610 ( 4.744 0.000 0.882) 4.825 3.671 ( -1.789 0.000 -1.899) 2.609 3.671 ( 1.789 0.000 -1.899) 2.609 3.727 ( -1.166 0.000 0.648) 1.334 3.727 ( 1.166 0.000 0.648) 1.334 3.773 ( -2.874 0.000 -0.345) 2.895 3.773 ( 2.874 0.000 -0.345) 2.895 3.959 ( -1.890 0.000 0.404) 1.933 3.959 ( 1.890 0.000 0.404) 1.933 3.976 ( -1.170 0.000 -0.520) 1.280 3.976 ( 1.170 0.000 -0.520) 1.280 3.996 ( -1.287 0.000 -0.241) 1.310 3.996 ( 1.287 0.000 -0.241) 1.310 4.093 ( -1.232 0.000 -2.185) 2.509 4.093 ( 1.232 0.000 -2.185) 2.509 4.302 ( -2.856 0.000 -0.677) 2.935 4.302 ( 2.856 0.000 -0.677) 2.935 4.330 ( -0.941 0.000 -3.394) 3.522 4.330 ( 0.941 0.000 -3.394) 3.522 4.521 ( -2.469 0.000 3.849) 4.573 4.521 ( 2.469 0.000 3.849) 4.573 4.555 ( -2.780 0.000 4.380) 5.188 4.555 ( 2.780 0.000 4.380) 5.188 4.721 ( -1.244 0.000 1.479) 1.933 4.721 ( 1.244 0.000 1.479) 1.933 4.792 ( -3.120 0.000 0.546) 3.167 4.792 ( 3.120 0.000 0.546) 3.167 4.831 ( -2.852 0.000 0.580) 2.910 4.831 ( 2.852 0.000 0.580) 2.910 4.896 ( -3.920 0.000 -2.087) 4.441 4.896 ( 3.920 0.000 -2.087) 4.441 4.988 ( -3.755 0.000 3.579) 5.187 4.988 ( 3.755 0.000 3.579) 5.187 5.057 ( -0.685 0.000 1.287) 1.458 5.057 ( 0.685 0.000 1.287) 1.458 5.072 ( -2.558 0.000 -0.607) 2.629 5.072 ( 2.558 0.000 -0.607) 2.629 5.139 ( -2.262 0.000 1.303) 2.610 5.139 ( 2.262 0.000 1.303) 2.610 5.146 ( -0.655 0.000 -1.411) 1.556 5.146 ( 0.655 0.000 -1.411) 1.556 5.254 ( -3.711 0.000 -3.398) 5.032 5.254 ( 3.711 0.000 -3.398) 5.032 5.782 ( -1.901 0.000 1.337) 2.324 5.782 ( 1.901 0.000 1.337) 2.324 5.855 ( -2.661 0.000 -1.556) 3.082 5.855 ( 2.661 0.000 -1.556) 3.082 5.894 ( -3.104 0.000 0.728) 3.188 5.894 ( 3.104 0.000 0.728) 3.188 5.926 ( -1.319 0.000 -0.487) 1.406 5.926 ( 1.319 0.000 -0.487) 1.406 6.405 ( -2.709 0.000 0.112) 2.711 6.405 ( 2.709 0.000 0.112) 2.711 6.410 ( -1.480 0.000 -0.068) 1.481 6.410 ( 1.480 0.000 -0.068) 1.481 6.586 ( -3.761 0.000 0.250) 3.769 6.586 ( 3.761 0.000 0.250) 3.769 6.634 ( -0.846 0.000 -2.109) 2.273 6.634 ( 0.846 0.000 -2.109) 2.273 7.727 ( -0.990 0.000 3.404) 3.545 7.727 ( 0.990 0.000 3.404) 3.545 7.752 ( -1.367 0.000 1.630) 2.127 7.752 ( 1.367 0.000 1.630) 2.127 7.836 ( -1.221 0.000 -1.338) 1.811 7.836 ( 1.221 0.000 -1.338) 1.811 7.847 ( -0.509 0.000 -0.222) 0.555 7.847 ( 0.509 0.000 -0.222) 0.555 7.909 ( -1.067 0.000 2.279) 2.516 7.909 ( 1.067 0.000 2.279) 2.516 7.919 ( -0.853 0.000 0.720) 1.117 7.919 ( 0.853 0.000 0.720) 1.117 8.111 ( -2.414 0.000 0.368) 2.442 8.111 ( 2.414 0.000 0.368) 2.442 8.152 ( -4.005 0.000 -2.203) 4.570 8.152 ( 4.005 0.000 -2.203) 4.570 8.173 ( -2.757 0.000 3.372) 4.356 8.173 ( 2.757 0.000 3.372) 4.356 8.250 ( -0.673 0.000 -0.471) 0.821 8.250 ( 0.673 0.000 -0.471) 0.821 8.287 ( -2.427 0.000 1.637) 2.927 8.287 ( 2.427 0.000 1.637) 2.927 8.360 ( -3.824 0.000 2.434) 4.533 8.360 ( 3.824 0.000 2.434) 4.533 8.486 ( -2.448 0.000 -0.893) 2.606 8.486 ( 2.448 0.000 -0.893) 2.606 8.497 ( -1.502 0.000 -5.968) 6.155 8.497 ( 1.502 0.000 -5.968) 6.155 8.597 ( -2.640 0.000 -1.546) 3.059 8.597 ( 2.640 0.000 -1.546) 3.059 8.660 ( -2.214 0.000 -3.107) 3.816 8.660 ( 2.214 0.000 -3.107) 3.816 8.961 ( -2.283 0.000 -0.302) 2.302 8.961 ( 2.283 0.000 -0.302) 2.302 9.000 ( -4.630 0.000 -1.603) 4.900 9.000 ( 4.630 0.000 -1.603) 4.900 9.213 ( -2.924 0.000 1.901) 3.488 9.213 ( 2.924 0.000 1.901) 3.488 9.279 ( -1.433 0.000 0.769) 1.626 9.279 ( 1.433 0.000 0.769) 1.626 9.386 ( -2.327 0.000 0.035) 2.328 9.386 ( 2.327 0.000 0.035) 2.328 9.443 ( -1.239 0.000 -4.571) 4.736 9.443 ( 1.239 0.000 -4.571) 4.736 9.567 ( -0.920 0.000 1.165) 1.484 9.567 ( 0.920 0.000 1.165) 1.484 9.573 ( -2.353 0.000 0.668) 2.446 9.573 ( 2.353 0.000 0.668) 2.446 9.700 ( -3.212 0.000 0.160) 3.216 9.700 ( 3.212 0.000 0.160) 3.216 9.702 ( -4.169 0.000 1.414) 4.402 9.702 ( 4.169 0.000 1.414) 4.402 9.797 ( -1.629 0.000 1.009) 1.916 9.797 ( 1.629 0.000 1.009) 1.916 9.833 ( -0.923 0.000 -0.791) 1.216 9.833 ( 0.923 0.000 -0.791) 1.216 9.989 ( -1.615 0.000 0.327) 1.648 9.989 ( 1.615 0.000 0.327) 1.648 10.002 ( -0.831 0.000 -0.250) 0.868 10.002 ( 0.831 0.000 -0.250) 0.868 10.189 ( -4.143 0.000 0.038) 4.144 10.189 ( 4.143 0.000 0.038) 4.144 10.210 ( -4.364 0.000 -0.771) 4.432 10.210 ( 4.364 0.000 -0.771) 4.432======================= Grid point 30 (13/27) =======================q-point: ( 0.00 0.25 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 24Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.539 ( 0.000 11.372 15.689) 19.377 0.568 ( 0.000 15.542 12.413) 19.891 0.932 ( 0.000 13.841 21.973) 25.969 1.047 ( 0.000 -5.899 8.139) 10.052 1.153 ( 0.000 1.965 -10.333) 10.518 1.154 ( 0.000 -8.788 8.763) 12.411 1.175 ( 0.000 3.315 -12.138) 12.582 1.311 ( 0.000 -2.578 0.692) 2.669 1.349 ( 0.000 1.010 1.510) 1.816 1.352 ( 0.000 0.470 -2.174) 2.224 1.417 ( 0.000 1.331 0.598) 1.459 1.433 ( 0.000 0.064 -0.548) 0.552 1.439 ( 0.000 -2.451 0.162) 2.457 1.473 ( 0.000 5.169 0.242) 5.174 1.493 ( 0.000 -2.689 3.756) 4.619 1.509 ( 0.000 -2.505 -2.878) 3.815 1.533 ( 0.000 -5.663 -2.640) 6.248 1.546 ( 0.000 -0.610 2.077) 2.165 1.558 ( 0.000 -2.669 -3.298) 4.243 1.581 ( 0.000 -3.993 0.193) 3.998 1.616 ( 0.000 0.633 -2.782) 2.853 1.623 ( 0.000 -2.448 2.028) 3.179 1.661 ( 0.000 0.187 -1.691) 1.701 1.711 ( 0.000 0.974 2.053) 2.272 1.713 ( 0.000 0.253 -0.822) 0.860 1.748 ( 0.000 0.776 -1.549) 1.733 1.780 ( 0.000 -0.531 0.083) 0.538 1.794 ( 0.000 0.012 2.775) 2.775 1.816 ( 0.000 -2.707 4.540) 5.286 1.858 ( 0.000 -0.303 1.937) 1.961 1.860 ( 0.000 0.545 -0.787) 0.957 1.879 ( 0.000 -2.533 -0.675) 2.622 1.910 ( 0.000 -2.674 1.348) 2.994 1.932 ( 0.000 -2.905 1.605) 3.319 1.941 ( 0.000 1.676 0.774) 1.846 1.964 ( 0.000 -3.423 0.467) 3.454 1.986 ( 0.000 -2.134 -1.025) 2.367 2.014 ( 0.000 -4.867 2.858) 5.644 2.024 ( 0.000 0.886 -1.383) 1.642 2.028 ( 0.000 -0.643 2.684) 2.760 2.057 ( 0.000 1.404 -3.294) 3.581 2.075 ( 0.000 2.815 1.917) 3.405 2.092 ( 0.000 -2.572 -0.967) 2.748 2.103 ( 0.000 -1.060 0.650) 1.243 2.133 ( 0.000 -3.536 2.123) 4.124 2.154 ( 0.000 3.840 -9.800) 10.526 2.158 ( 0.000 1.862 0.595) 1.955 2.172 ( 0.000 2.524 -1.792) 3.095 2.196 ( 0.000 -2.828 2.409) 3.715 2.211 ( 0.000 -0.299 -1.706) 1.732 2.229 ( 0.000 0.614 -0.709) 0.938 2.262 ( 0.000 0.226 0.372) 0.435 2.280 ( 0.000 -0.551 -0.865) 1.026 2.310 ( 0.000 -1.346 -1.335) 1.896 2.320 ( 0.000 0.824 -0.611) 1.026 2.327 ( 0.000 -1.677 1.794) 2.456 2.345 ( 0.000 1.439 -0.895) 1.695 2.363 ( 0.000 -1.819 1.481) 2.346 2.408 ( 0.000 2.701 -1.343) 3.017 2.435 ( 0.000 1.646 -4.911) 5.180 2.443 ( 0.000 -3.436 1.234) 3.651 2.457 ( 0.000 1.868 1.932) 2.687 2.550 ( 0.000 -4.463 -3.950) 5.960 2.596 ( 0.000 1.210 1.293) 1.771 2.618 ( 0.000 0.190 -2.708) 2.715 2.623 ( 0.000 0.350 -0.238) 0.423 2.637 ( 0.000 3.270 -7.256) 7.958 2.715 ( 0.000 0.287 -1.772) 1.795 2.768 ( 0.000 -3.403 -0.026) 3.403 2.852 ( 0.000 4.020 1.654) 4.347 2.857 ( 0.000 1.902 1.063) 2.179 2.866 ( 0.000 -3.921 2.301) 4.546 2.898 ( 0.000 1.672 -3.644) 4.010 2.928 ( 0.000 0.009 -2.580) 2.580 2.938 ( 0.000 0.531 2.830) 2.879 2.969 ( 0.000 6.060 -0.126) 6.061 2.986 ( 0.000 0.925 -2.094) 2.289 2.999 ( 0.000 -0.270 -0.249) 0.367 3.041 ( 0.000 2.158 -0.155) 2.163 3.064 ( 0.000 3.824 -2.466) 4.550 3.069 ( 0.000 0.461 -0.560) 0.726 3.125 ( 0.000 -0.154 1.055) 1.067 3.156 ( 0.000 -2.220 5.899) 6.303 3.207 ( 0.000 -2.428 4.959) 5.522 3.314 ( 0.000 -2.045 3.222) 3.816 3.315 ( 0.000 2.821 2.968) 4.094 3.368 ( 0.000 4.008 2.668) 4.815 3.411 ( 0.000 0.301 2.193) 2.214 3.479 ( 0.000 2.169 -2.447) 3.271 3.482 ( 0.000 -0.610 -1.784) 1.885 3.534 ( 0.000 0.040 1.320) 1.321 3.590 ( 0.000 0.791 -2.578) 2.697 3.592 ( 0.000 0.295 -2.230) 2.249 3.610 ( 0.000 1.172 -0.966) 1.519 3.654 ( 0.000 0.169 -1.265) 1.276 3.657 ( 0.000 0.532 -0.881) 1.029 3.723 ( 0.000 -0.668 1.910) 2.024 3.735 ( 0.000 0.802 -2.341) 2.475 3.754 ( 0.000 -0.944 -2.225) 2.417 3.799 ( 0.000 -0.922 -0.548) 1.073 3.943 ( 0.000 -0.073 0.355) 0.362 3.947 ( 0.000 1.278 1.297) 1.821 3.995 ( 0.000 -1.882 0.614) 1.979 4.013 ( 0.000 1.592 -1.928) 2.501 4.053 ( 0.000 -0.483 -2.215) 2.267 4.059 ( 0.000 -0.850 1.181) 1.455 4.071 ( 0.000 -3.533 1.739) 3.938 4.073 ( 0.000 -0.251 -1.627) 1.646 4.279 ( 0.000 0.636 1.098) 1.269 4.302 ( 0.000 0.783 -0.493) 0.926 4.343 ( 0.000 0.286 -1.866) 1.888 4.378 ( 0.000 0.165 -1.928) 1.935 4.529 ( 0.000 1.845 2.284) 2.936 4.531 ( 0.000 0.655 3.720) 3.778 4.606 ( 0.000 -2.052 -2.585) 3.300 4.626 ( 0.000 -1.096 -2.370) 2.611 4.729 ( 0.000 -0.523 1.522) 1.610 4.743 ( 0.000 0.443 -2.221) 2.265 4.784 ( 0.000 0.208 -1.450) 1.465 4.794 ( 0.000 -1.704 -2.903) 3.366 4.856 ( 0.000 0.460 3.696) 3.724 4.860 ( 0.000 1.312 2.411) 2.745 4.903 ( 0.000 1.029 0.267) 1.063 4.913 ( 0.000 0.561 -0.342) 0.657 4.955 ( 0.000 0.282 1.215) 1.247 4.996 ( 0.000 -1.050 0.682) 1.252 5.009 ( 0.000 -0.397 -1.701) 1.747 5.014 ( 0.000 -0.774 -0.246) 0.812 5.102 ( 0.000 0.610 6.611) 6.639 5.123 ( 0.000 -0.866 4.067) 4.158 5.167 ( 0.000 -2.198 2.507) 3.334 5.224 ( 0.000 -8.283 8.471) 11.848 5.331 ( 0.000 5.940 -2.425) 6.416 5.342 ( 0.000 2.101 -2.277) 3.098 5.432 ( 0.000 -2.695 0.374) 2.721 5.580 ( 0.000 -4.664 -2.940) 5.513 5.625 ( 0.000 1.168 1.732) 2.089 5.685 ( 0.000 -1.326 0.472) 1.407 5.728 ( 0.000 0.427 -1.330) 1.397 5.733 ( 0.000 0.611 -2.998) 3.060 5.802 ( 0.000 1.495 2.728) 3.111 5.904 ( 0.000 0.726 -1.723) 1.870 5.916 ( 0.000 -5.670 3.710) 6.776 5.952 ( 0.000 -1.662 0.403) 1.710 6.305 ( 0.000 0.262 0.053) 0.267 6.307 ( 0.000 0.265 -0.002) 0.265 6.326 ( 0.000 -0.695 0.020) 0.695 6.328 ( 0.000 -0.662 -0.044) 0.663 6.456 ( 0.000 2.541 0.918) 2.701 6.501 ( 0.000 2.070 -0.904) 2.259 6.581 ( 0.000 -2.695 0.068) 2.696 6.586 ( 0.000 -1.627 -0.158) 1.635 7.708 ( 0.000 0.308 2.091) 2.114 7.716 ( 0.000 -0.074 1.504) 1.506 7.763 ( 0.000 0.329 0.324) 0.462 7.766 ( 0.000 0.474 -0.774) 0.908 7.822 ( 0.000 -0.400 1.338) 1.397 7.830 ( 0.000 -0.500 2.331) 2.384 7.839 ( 0.000 -0.040 2.502) 2.502 7.871 ( 0.000 -1.189 0.250) 1.215 7.877 ( 0.000 0.433 2.051) 2.096 7.887 ( 0.000 -0.090 1.442) 1.445 7.924 ( 0.000 0.250 1.165) 1.191 7.955 ( 0.000 -1.995 2.449) 3.159 7.986 ( 0.000 0.593 -2.239) 2.316 8.022 ( 0.000 -2.788 1.206) 3.038 8.058 ( 0.000 0.754 -0.991) 1.245 8.102 ( 0.000 -0.676 -0.889) 1.117 8.166 ( 0.000 0.718 2.287) 2.397 8.194 ( 0.000 -0.145 3.813) 3.816 8.229 ( 0.000 -0.319 2.816) 2.834 8.252 ( 0.000 -2.237 0.465) 2.285 8.281 ( 0.000 0.496 -2.703) 2.749 8.298 ( 0.000 -0.124 -2.202) 2.206 8.365 ( 0.000 1.643 4.267) 4.572 8.442 ( 0.000 -0.309 -5.096) 5.106 8.452 ( 0.000 0.882 1.394) 1.649 8.484 ( 0.000 -0.252 -6.032) 6.037 8.513 ( 0.000 -1.171 0.708) 1.368 8.560 ( 0.000 -1.227 0.596) 1.364 8.606 ( 0.000 -2.135 3.911) 4.455 8.607 ( 0.000 -0.127 -3.152) 3.155 8.667 ( 0.000 -0.967 -0.948) 1.354 8.674 ( 0.000 -1.839 1.504) 2.376 8.889 ( 0.000 0.953 0.804) 1.247 8.959 ( 0.000 -0.215 -2.142) 2.153 8.966 ( 0.000 0.404 -2.900) 2.928 9.059 ( 0.000 -2.469 -5.042) 5.614 9.173 ( 0.000 0.178 3.387) 3.392 9.198 ( 0.000 0.397 1.413) 1.468 9.222 ( 0.000 -2.153 0.781) 2.290 9.250 ( 0.000 -2.360 -0.302) 2.379 9.405 ( 0.000 2.508 -0.087) 2.509 9.422 ( 0.000 3.718 -1.623) 4.057 9.443 ( 0.000 1.255 0.410) 1.320 9.475 ( 0.000 1.177 -1.836) 2.181 9.529 ( 0.000 2.438 0.721) 2.542 9.545 ( 0.000 -1.016 0.648) 1.205 9.558 ( 0.000 -0.627 0.357) 0.721 9.601 ( 0.000 1.095 -0.338) 1.146 9.664 ( 0.000 -0.363 0.839) 0.914 9.677 ( 0.000 4.051 1.136) 4.207 9.710 ( 0.000 -2.060 0.064) 2.061 9.729 ( 0.000 1.137 -1.261) 1.698 9.754 ( 0.000 1.098 1.721) 2.041 9.801 ( 0.000 -3.400 1.637) 3.774 9.817 ( 0.000 -5.072 0.667) 5.116 9.843 ( 0.000 -3.900 -2.367) 4.562 9.977 ( 0.000 2.579 0.915) 2.736 10.025 ( 0.000 2.992 -1.037) 3.167 10.042 ( 0.000 -1.166 0.658) 1.339 10.067 ( 0.000 2.128 0.595) 2.210 10.085 ( 0.000 1.651 -0.076) 1.653 10.225 ( 0.000 -3.804 1.372) 4.044 10.244 ( 0.000 9.199 -10.370) 13.862 10.332 ( 0.000 0.768 -3.005) 3.101======================= Grid point 31 (14/27) =======================q-point: ( 0.25 0.25 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 32Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.612 ( 8.694 8.230 11.953) 16.918 0.729 ( 11.823 10.650 11.259) 19.493 1.057 ( 5.479 -1.427 7.821) 9.655 1.133 ( 2.471 -2.631 -1.981) 4.118 1.147 ( -6.473 -2.970 1.912) 7.374 1.198 ( 7.779 4.992 7.252) 11.748 1.206 ( -0.097 -8.575 5.430) 10.151 1.254 ( 3.092 2.168 -7.742) 8.614 1.290 ( -3.123 -2.549 0.859) 4.122 1.305 ( -8.030 1.559 0.877) 8.226 1.348 ( 0.072 2.893 -0.428) 2.926 1.399 ( -1.600 -2.848 -3.062) 4.477 1.412 ( 0.525 1.228 -0.255) 1.359 1.474 ( -1.766 -2.876 -2.446) 4.168 1.502 ( -2.993 -3.007 0.246) 4.250 1.515 ( 1.363 2.180 2.363) 3.492 1.531 ( 2.412 1.018 -1.651) 3.095 1.551 ( 2.436 -3.157 -1.711) 4.340 1.579 ( 2.045 -2.194 -3.828) 4.863 1.638 ( 1.409 1.617 -2.738) 3.478 1.657 ( 0.383 -0.250 -0.936) 1.041 1.683 ( 0.240 1.513 2.136) 2.629 1.699 ( 2.404 -0.310 2.938) 3.808 1.727 ( 3.718 -0.882 -0.822) 3.908 1.741 ( -0.547 -2.775 2.682) 3.898 1.759 ( 3.790 -0.112 0.249) 3.800 1.783 ( 0.155 -1.772 3.197) 3.658 1.805 ( 2.567 0.496 1.011) 2.803 1.816 ( 0.522 0.636 0.061) 0.825 1.854 ( -0.078 -1.502 3.933) 4.211 1.874 ( 0.580 -0.699 0.495) 1.035 1.889 ( 0.334 -1.054 0.144) 1.116 1.895 ( 2.048 -1.255 0.380) 2.432 1.928 ( -0.062 -1.892 1.597) 2.476 1.959 ( -1.049 0.601 -1.313) 1.785 1.968 ( -0.142 0.606 -0.457) 0.772 1.990 ( -1.490 -0.140 2.352) 2.788 1.999 ( 0.307 -2.755 0.784) 2.880 2.016 ( -0.662 0.902 1.394) 1.787 2.045 ( -0.432 0.202 2.290) 2.339 2.068 ( 2.034 1.662 -1.211) 2.892 2.094 ( 1.599 -3.186 1.021) 3.708 2.107 ( 1.540 -0.229 0.344) 1.595 2.125 ( -0.737 -0.950 -3.042) 3.271 2.141 ( 2.537 -3.037 0.092) 3.958 2.159 ( -2.393 1.878 -1.786) 3.527 2.167 ( 0.838 0.611 1.190) 1.578 2.171 ( 1.838 0.340 -4.005) 4.420 2.187 ( -0.316 1.792 -1.703) 2.492 2.216 ( 1.673 0.004 -3.636) 4.002 2.247 ( 0.267 0.173 1.493) 1.527 2.252 ( -0.169 -1.276 0.925) 1.585 2.271 ( -0.447 1.504 0.778) 1.751 2.287 ( -1.212 -0.915 0.573) 1.623 2.311 ( 0.174 0.554 1.846) 1.935 2.343 ( 1.775 -0.228 0.370) 1.828 2.350 ( -0.273 0.830 -2.179) 2.348 2.396 ( -1.947 1.613 -0.256) 2.541 2.402 ( -0.775 -1.403 -1.266) 2.042 2.428 ( 2.521 2.529 -2.276) 4.234 2.464 ( 2.562 -0.380 -0.260) 2.603 2.512 ( 3.387 0.308 -1.815) 3.855 2.558 ( -0.761 -1.621 -1.168) 2.138 2.578 ( -1.847 -0.445 1.244) 2.271 2.625 ( 2.427 -0.359 -1.842) 3.068 2.652 ( -3.565 1.240 0.260) 3.783 2.669 ( 2.272 -0.831 -4.228) 4.871 2.709 ( -0.225 -3.102 -0.200) 3.116 2.739 ( 1.695 0.127 -2.155) 2.744 2.798 ( 1.442 2.631 0.138) 3.003 2.839 ( -2.513 -0.564 -1.121) 2.809 2.852 ( -3.413 0.400 -0.486) 3.470 2.888 ( 0.501 -2.583 -3.336) 4.249 2.906 ( 0.514 0.564 -0.953) 1.220 2.937 ( 0.553 -1.100 -1.323) 1.807 2.975 ( -1.072 1.488 -2.824) 3.367 2.993 ( 0.696 2.438 1.663) 3.032 3.015 ( 0.936 3.054 1.627) 3.584 3.044 ( -1.464 0.190 1.877) 2.388 3.080 ( 1.807 0.716 0.707) 2.068 3.089 ( 0.798 0.372 -0.005) 0.881 3.124 ( 2.659 0.953 1.550) 3.222 3.159 ( -1.569 0.744 0.641) 1.851 3.188 ( -0.227 -2.009 3.057) 3.665 3.243 ( -5.548 -0.293 4.010) 6.851 3.290 ( -5.676 2.163 1.685) 6.304 3.298 ( -4.239 0.001 3.216) 5.321 3.394 ( -4.945 0.223 -2.029) 5.350 3.426 ( -1.980 0.024 0.396) 2.020 3.483 ( 0.206 2.747 2.259) 3.563 3.504 ( 0.172 -0.240 1.163) 1.200 3.553 ( -2.111 1.376 0.490) 2.567 3.595 ( -1.751 1.030 -2.526) 3.241 3.631 ( 1.890 0.307 -3.746) 4.207 3.643 ( -0.432 -0.204 -1.055) 1.159 3.683 ( 1.164 0.099 -0.921) 1.488 3.714 ( -0.025 -0.085 1.087) 1.091 3.740 ( -0.310 -0.468 -0.797) 0.974 3.753 ( 0.606 1.330 -1.359) 1.996 3.808 ( -0.189 -0.908 -1.442) 1.715 3.935 ( -0.297 0.436 1.227) 1.335 3.952 ( 0.440 -0.148 0.453) 0.648 3.987 ( -0.466 -1.106 -0.156) 1.211 3.993 ( -1.731 -0.264 -0.338) 1.783 4.011 ( -2.097 0.147 0.002) 2.102 4.040 ( -1.507 0.358 0.356) 1.590 4.063 ( 0.297 -1.126 -1.661) 2.029 4.090 ( -0.250 -1.953 -0.900) 2.164 4.279 ( 0.628 1.421 -0.457) 1.619 4.310 ( 0.161 -0.328 -1.270) 1.321 4.352 ( -0.020 0.529 -2.499) 2.554 4.372 ( -0.999 0.292 -3.331) 3.489 4.494 ( 0.173 1.180 3.627) 3.818 4.535 ( -1.651 -1.023 4.340) 4.755 4.589 ( -0.974 1.162 1.360) 2.037 4.616 ( -2.033 -0.233 -0.766) 2.185 4.719 ( -0.907 -0.787 1.073) 1.610 4.752 ( -0.726 -1.578 1.330) 2.188 4.768 ( 0.713 1.980 -1.396) 2.525 4.800 ( -0.891 0.629 0.428) 1.172 4.823 ( 0.603 0.867 0.953) 1.423 4.853 ( -3.890 -0.403 4.047) 5.628 4.915 ( 2.581 1.159 2.223) 3.598 4.924 ( -3.153 0.588 2.294) 3.943 4.947 ( -0.264 -0.493 -0.229) 0.604 4.969 ( 2.858 -0.060 -0.664) 2.935 5.010 ( 0.735 -0.815 -0.363) 1.156 5.030 ( 2.065 -0.694 -0.036) 2.179 5.046 ( 0.545 0.622 1.843) 2.020 5.104 ( -4.400 -1.548 4.519) 6.494 5.121 ( -1.074 -0.777 4.651) 4.837 5.150 ( -2.200 -2.240 2.344) 3.918 5.222 ( -6.861 2.810 -2.386) 7.789 5.273 ( -4.998 3.590 -1.565) 6.350 5.304 ( -5.608 -1.172 -2.668) 6.320 5.421 ( -10.591 -2.870 -4.516) 11.866 5.712 ( 6.054 1.895 1.289) 6.474 5.786 ( 4.754 1.512 -1.327) 5.162 5.792 ( 1.593 0.951 0.886) 2.056 5.809 ( 5.249 -1.912 0.019) 5.586 5.841 ( 2.402 0.482 1.162) 2.712 5.914 ( 0.615 0.205 -1.610) 1.736 5.935 ( -1.152 -1.545 0.166) 1.935 5.947 ( -0.774 -1.350 0.012) 1.556 6.357 ( 2.910 0.393 0.027) 2.936 6.361 ( 2.779 0.142 -0.032) 2.783 6.411 ( 5.661 -1.630 0.477) 5.911 6.459 ( 2.465 0.452 -0.247) 2.518 6.465 ( 3.750 -2.080 -1.306) 4.483 6.495 ( 2.336 -0.515 -1.334) 2.739 6.590 ( 0.491 -3.210 -0.219) 3.255 6.593 ( 0.033 -2.198 -0.304) 2.219 7.715 ( 0.641 0.442 2.644) 2.757 7.726 ( 0.932 -0.056 1.830) 2.054 7.758 ( -0.896 0.764 2.590) 2.845 7.779 ( -0.735 -0.075 1.391) 1.575 7.815 ( 0.787 -0.118 -0.406) 0.893 7.828 ( 0.543 -0.106 -0.586) 0.806 7.846 ( 0.294 0.034 0.975) 1.019 7.861 ( -0.696 -0.448 -0.963) 1.270 7.890 ( 0.907 0.344 2.413) 2.601 7.900 ( 0.838 0.200 1.127) 1.418 7.926 ( -0.178 0.020 1.470) 1.481 7.937 ( -0.822 -0.204 1.552) 1.769 8.034 ( 4.893 0.755 -1.206) 5.096 8.069 ( 2.167 0.407 -0.858) 2.366 8.114 ( 2.831 -1.355 0.081) 3.140 8.128 ( 2.122 -1.303 -0.521) 2.544 8.175 ( 0.421 0.247 2.034) 2.092 8.194 ( 0.912 -1.455 3.915) 4.275 8.238 ( 0.172 -0.823 1.001) 1.307 8.257 ( 0.412 -1.391 1.656) 2.202 8.273 ( -0.571 1.027 -1.607) 1.991 8.296 ( 0.087 0.394 -1.664) 1.712 8.350 ( -1.466 1.444 1.942) 2.830 8.437 ( -1.380 1.181 0.267) 1.836 8.448 ( 0.503 -0.666 -2.415) 2.555 8.478 ( -1.437 -0.748 0.576) 1.719 8.505 ( -0.017 -1.547 -4.763) 5.008 8.531 ( -2.192 -1.366 0.203) 2.591 8.582 ( -0.592 1.260 -1.338) 1.931 8.609 ( -0.537 -1.564 -2.684) 3.152 8.633 ( -0.472 0.087 -1.203) 1.295 8.683 ( -1.237 -2.126 -2.223) 3.316 8.906 ( 1.952 0.300 1.523) 2.494 8.958 ( 0.908 0.104 -0.865) 1.258 9.007 ( 1.171 0.108 -2.971) 3.195 9.069 ( -0.487 -1.229 -3.771) 3.996 9.160 ( -0.015 -1.507 1.376) 2.041 9.178 ( -0.582 -0.482 0.443) 0.876 9.211 ( -0.892 -3.257 2.088) 3.970 9.271 ( -0.488 -4.138 -0.174) 4.171 9.366 ( -0.041 4.443 1.657) 4.742 9.446 ( 2.644 1.100 0.252) 2.874 9.458 ( -1.149 2.004 -0.780) 2.438 9.500 ( 0.389 1.514 -2.209) 2.706 9.534 ( -0.976 0.573 -0.105) 1.136 9.539 ( 0.344 -0.735 0.179) 0.831 9.565 ( 1.458 1.355 0.698) 2.109 9.596 ( 0.199 -1.599 -0.355) 1.650 9.654 ( -0.904 1.949 0.249) 2.162 9.673 ( 0.424 1.877 -0.639) 2.028 9.703 ( 0.118 -0.183 2.179) 2.189 9.734 ( -0.587 0.057 1.935) 2.023 9.783 ( 0.929 -2.791 -0.260) 2.953 9.787 ( -0.080 -1.324 -0.302) 1.361 9.817 ( 0.754 -2.315 1.085) 2.666 9.852 ( -0.229 -3.138 -1.041) 3.314 9.986 ( 1.111 2.994 0.584) 3.246 10.024 ( 0.299 3.148 -0.947) 3.301 10.060 ( -0.748 3.181 0.674) 3.336 10.090 ( 3.700 -1.268 0.123) 3.913 10.108 ( 1.068 1.025 -0.876) 1.720 10.136 ( -3.884 4.619 -1.447) 6.206 10.235 ( -2.023 -1.146 -1.621) 2.834 10.292 ( -3.631 -0.171 -2.481) 4.401======================= Grid point 32 (15/27) =======================q-point: (-0.50 0.25 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 24Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.856 ( -12.284 1.196 7.884) 14.645 0.856 ( 12.284 1.196 7.884) 14.645 1.019 ( -11.583 6.745 6.593) 14.938 1.019 ( 11.583 6.745 6.593) 14.938 1.164 ( -1.404 -8.315 2.028) 8.673 1.164 ( 1.404 -8.315 2.028) 8.673 1.252 ( -1.623 -2.325 -2.370) 3.696 1.252 ( 1.623 -2.325 -2.370) 3.696 1.313 ( -3.395 -3.147 -1.293) 4.806 1.313 ( 3.395 -3.147 -1.293) 4.806 1.372 ( -3.679 -1.192 -5.259) 6.528 1.372 ( 3.679 -1.192 -5.259) 6.528 1.432 ( -2.357 1.910 -0.584) 3.089 1.432 ( 2.357 1.910 -0.584) 3.089 1.484 ( -3.187 -1.981 0.674) 3.812 1.484 ( 3.187 -1.981 0.674) 3.812 1.594 ( -0.218 -0.268 -0.927) 0.989 1.594 ( 0.218 -0.268 -0.927) 0.989 1.625 ( -2.507 -0.797 -1.165) 2.877 1.625 ( 2.507 -0.797 -1.165) 2.877 1.674 ( -1.696 1.629 2.671) 3.558 1.674 ( 1.696 1.629 2.671) 3.558 1.736 ( -2.312 -0.146 1.292) 2.652 1.736 ( 2.312 -0.146 1.292) 2.652 1.794 ( -2.340 1.581 0.710) 2.912 1.794 ( 2.340 1.581 0.710) 2.912 1.825 ( -2.360 0.882 0.116) 2.523 1.825 ( 2.360 0.882 0.116) 2.523 1.850 ( -2.728 -1.686 1.772) 3.664 1.850 ( 2.728 -1.686 1.772) 3.664 1.873 ( -2.579 0.143 4.368) 5.074 1.873 ( 2.579 0.143 4.368) 5.074 1.923 ( -1.352 -0.242 0.474) 1.453 1.923 ( 1.352 -0.242 0.474) 1.453 1.951 ( -0.623 -0.727 0.200) 0.978 1.951 ( 0.623 -0.727 0.200) 0.978 1.983 ( -0.252 -0.490 3.165) 3.213 1.983 ( 0.252 -0.490 3.165) 3.213 2.029 ( -3.414 0.706 2.190) 4.117 2.029 ( 3.414 0.706 2.190) 4.117 2.088 ( -0.676 1.688 -1.974) 2.684 2.088 ( 0.676 1.688 -1.974) 2.684 2.122 ( -1.545 -0.312 -2.977) 3.368 2.122 ( 1.545 -0.312 -2.977) 3.368 2.146 ( -1.403 1.815 0.260) 2.308 2.146 ( 1.403 1.815 0.260) 2.308 2.176 ( -1.841 -0.164 -1.979) 2.708 2.176 ( 1.841 -0.164 -1.979) 2.708 2.219 ( -1.809 -2.452 0.370) 3.070 2.219 ( 1.809 -2.452 0.370) 3.070 2.242 ( -1.870 1.040 -0.247) 2.154 2.242 ( 1.870 1.040 -0.247) 2.154 2.280 ( -0.957 1.101 -0.279) 1.485 2.280 ( 0.957 1.101 -0.279) 1.485 2.326 ( -3.290 0.751 1.747) 3.800 2.326 ( 3.290 0.751 1.747) 3.800 2.370 ( -1.514 0.558 0.133) 1.619 2.370 ( 1.514 0.558 0.133) 1.619 2.453 ( -6.390 -0.870 -0.636) 6.480 2.453 ( 6.390 -0.870 -0.636) 6.480 2.493 ( -3.847 -0.556 -2.957) 4.884 2.493 ( 3.847 -0.556 -2.957) 4.884 2.549 ( -0.632 1.570 1.061) 1.998 2.549 ( 0.632 1.570 1.061) 1.998 2.652 ( -4.275 -3.960 -3.270) 6.682 2.652 ( 4.275 -3.960 -3.270) 6.682 2.724 ( -2.786 -1.265 0.484) 3.097 2.724 ( 2.786 -1.265 0.484) 3.097 2.757 ( -1.481 -2.074 -0.378) 2.577 2.757 ( 1.481 -2.074 -0.378) 2.577 2.824 ( -3.610 -0.232 -4.669) 5.906 2.824 ( 3.610 -0.232 -4.669) 5.906 2.909 ( -2.339 2.657 -0.938) 3.662 2.909 ( 2.339 2.657 -0.938) 3.662 2.939 ( -1.176 1.126 -2.181) 2.722 2.939 ( 1.176 1.126 -2.181) 2.722 3.039 ( -3.449 0.859 0.015) 3.554 3.039 ( 3.449 0.859 0.015) 3.554 3.063 ( -4.506 -0.970 2.317) 5.159 3.063 ( 4.506 -0.970 2.317) 5.159 3.141 ( -2.184 1.300 1.544) 2.974 3.141 ( 2.184 1.300 1.544) 2.974 3.146 ( -1.453 2.225 2.334) 3.536 3.146 ( 1.453 2.225 2.334) 3.536 3.207 ( -4.072 -0.960 2.279) 4.764 3.207 ( 4.072 -0.960 2.279) 4.764 3.241 ( -5.819 -2.885 -1.113) 6.590 3.241 ( 5.819 -2.885 -1.113) 6.590 3.438 ( -2.419 2.931 2.745) 4.688 3.438 ( 2.419 2.931 2.745) 4.688 3.526 ( -0.459 0.308 -0.493) 0.741 3.526 ( 0.459 0.308 -0.493) 0.741 3.608 ( -2.915 0.643 -0.736) 3.074 3.608 ( 2.915 0.643 -0.736) 3.074 3.671 ( -1.692 -0.399 -2.257) 2.849 3.671 ( 1.692 -0.399 -2.257) 2.849 3.738 ( -1.650 1.103 0.352) 2.016 3.738 ( 1.650 1.103 0.352) 2.016 3.772 ( -2.629 -0.159 -0.343) 2.656 3.772 ( 2.629 -0.159 -0.343) 2.656 3.951 ( -1.396 -0.487 0.272) 1.503 3.951 ( 1.396 -0.487 0.272) 1.503 3.970 ( -1.060 -0.610 0.090) 1.226 3.970 ( 1.060 -0.610 0.090) 1.226 4.007 ( -1.291 1.079 -0.406) 1.730 4.007 ( 1.291 1.079 -0.406) 1.730 4.074 ( -0.821 -1.737 -1.493) 2.433 4.074 ( 0.821 -1.737 -1.493) 2.433 4.306 ( -1.210 0.862 -1.785) 2.323 4.306 ( 1.210 0.862 -1.785) 2.323 4.341 ( -0.940 0.307 -3.446) 3.585 4.341 ( 0.940 0.307 -3.446) 3.585 4.533 ( -2.299 1.003 3.501) 4.307 4.533 ( 2.299 1.003 3.501) 4.307 4.555 ( -2.280 -0.016 3.962) 4.571 4.555 ( 2.280 -0.016 3.962) 4.571 4.723 ( -1.854 0.524 2.578) 3.218 4.723 ( 1.854 0.524 2.578) 3.218 4.779 ( -2.677 -1.296 2.211) 3.706 4.779 ( 2.677 -1.296 2.211) 3.706 4.850 ( -3.459 1.687 -1.153) 4.017 4.850 ( 3.459 1.687 -1.153) 4.017 4.895 ( -3.771 -0.222 -2.109) 4.327 4.895 ( 3.771 -0.222 -2.109) 4.327 4.992 ( -3.133 0.286 2.314) 3.905 4.992 ( 3.133 0.286 2.314) 3.905 5.032 ( -1.540 -1.652 0.736) 2.376 5.032 ( 1.540 -1.652 0.736) 2.376 5.080 ( -1.942 0.288 0.551) 2.039 5.080 ( 1.942 0.288 0.551) 2.039 5.111 ( -0.757 -1.357 0.836) 1.765 5.111 ( 0.757 -1.357 0.836) 1.765 5.180 ( -2.622 1.973 -0.984) 3.426 5.180 ( 2.622 1.973 -0.984) 3.426 5.244 ( -3.508 -1.083 -2.985) 4.732 5.244 ( 3.508 -1.083 -2.985) 4.732 5.800 ( -1.539 1.748 1.287) 2.661 5.800 ( 1.539 1.748 1.287) 2.661 5.865 ( -1.895 0.338 -0.932) 2.139 5.865 ( 1.895 0.338 -0.932) 2.139 5.886 ( -2.746 -0.332 0.394) 2.794 5.886 ( 2.746 -0.332 0.394) 2.794 5.922 ( -1.218 -0.546 -0.699) 1.507 5.922 ( 1.218 -0.546 -0.699) 1.507 6.412 ( -0.689 1.333 0.442) 1.564 6.412 ( 0.689 1.333 0.442) 1.564 6.433 ( -1.943 1.857 -0.376) 2.714 6.433 ( 1.943 1.857 -0.376) 2.714 6.560 ( -3.635 -2.509 -0.047) 4.417 6.560 ( 3.635 -2.509 -0.047) 4.417 6.580 ( -1.965 -4.676 -1.092) 5.189 6.580 ( 1.965 -4.676 -1.092) 5.189 7.734 ( -1.092 0.630 3.280) 3.514 7.734 ( 1.092 0.630 3.280) 3.514 7.751 ( -1.344 -0.122 2.093) 2.490 7.751 ( 1.344 -0.122 2.093) 2.490 7.835 ( -1.144 0.137 -1.489) 1.883 7.835 ( 1.144 0.137 -1.489) 1.883 7.847 ( -0.588 -0.086 -0.657) 0.886 7.847 ( 0.588 -0.086 -0.657) 0.886 7.908 ( -0.599 0.200 2.427) 2.507 7.908 ( 0.599 0.200 2.427) 2.507 7.924 ( -0.533 0.096 1.074) 1.203 7.924 ( 0.533 0.096 1.074) 1.203 8.118 ( -2.121 0.644 0.026) 2.217 8.118 ( 2.121 0.644 0.026) 2.217 8.146 ( -2.315 -0.656 -1.410) 2.788 8.146 ( 2.315 -0.656 -1.410) 2.788 8.181 ( -3.231 0.934 2.737) 4.336 8.181 ( 3.231 0.934 2.737) 4.336 8.243 ( -1.536 -1.270 0.843) 2.165 8.243 ( 1.536 -1.270 0.843) 2.165 8.287 ( -1.368 1.164 0.658) 1.913 8.287 ( 1.368 1.164 0.658) 1.913 8.370 ( -3.905 -0.168 0.736) 3.978 8.370 ( 3.905 -0.168 0.736) 3.978 8.470 ( -0.734 -1.034 -2.573) 2.868 8.470 ( 0.734 -1.034 -2.573) 2.868 8.491 ( -0.618 -0.851 -1.544) 1.868 8.491 ( 0.618 -0.851 -1.544) 1.868 8.596 ( -1.173 0.381 -2.764) 3.027 8.596 ( 1.173 0.381 -2.764) 3.027 8.645 ( -1.803 -1.355 -3.341) 4.031 8.645 ( 1.803 -1.355 -3.341) 4.031 8.969 ( -3.192 1.073 0.158) 3.371 8.969 ( 3.192 1.073 0.158) 3.371 9.013 ( -3.611 0.555 -1.363) 3.899 9.013 ( 3.611 0.555 -1.363) 3.899 9.176 ( -1.490 -2.341 1.135) 2.998 9.176 ( 1.490 -2.341 1.135) 2.998 9.227 ( -2.713 -4.419 -0.333) 5.196 9.227 ( 2.713 -4.419 -0.333) 5.196 9.408 ( -2.794 3.217 1.265) 4.445 9.408 ( 2.794 3.217 1.265) 4.445 9.487 ( -0.941 1.898 -2.182) 3.041 9.487 ( 0.941 1.898 -2.182) 3.041 9.537 ( -0.741 -1.492 1.235) 2.074 9.537 ( 0.741 -1.492 1.235) 2.074 9.591 ( -0.968 -0.537 -0.759) 1.342 9.591 ( 0.968 -0.537 -0.759) 1.342 9.671 ( -2.115 -0.232 1.735) 2.746 9.671 ( 2.115 -0.232 1.735) 2.746 9.702 ( -2.018 1.259 -0.350) 2.404 9.702 ( 2.018 1.259 -0.350) 2.404 9.801 ( -0.881 -1.594 1.084) 2.120 9.801 ( 0.881 -1.594 1.084) 2.120 9.832 ( -1.091 -1.347 -0.533) 1.813 9.832 ( 1.091 -1.347 -0.533) 1.813 10.027 ( -2.452 3.924 0.315) 4.638 10.027 ( 2.452 3.924 0.315) 4.638 10.045 ( -1.854 4.017 -0.553) 4.459 10.045 ( 1.854 4.017 -0.553) 4.459 10.175 ( -3.234 -1.583 -0.270) 3.611 10.175 ( 3.234 -1.583 -0.270) 3.611 10.194 ( -5.077 -1.556 -1.049) 5.413 10.194 ( 5.077 -1.556 -1.049) 5.413======================= Grid point 35 (16/27) =======================q-point: ( 0.00 -0.50 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 18Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.782 ( 0.000 -11.259 10.230) 15.212 0.782 ( 0.000 11.259 10.230) 15.212 0.896 ( 0.000 -13.929 10.248) 17.293 0.896 ( 0.000 13.929 10.248) 17.293 1.220 ( 0.000 -6.941 -2.517) 7.384 1.220 ( 0.000 6.941 -2.517) 7.384 1.283 ( 0.000 -1.622 -5.288) 5.531 1.283 ( 0.000 1.622 -5.288) 5.531 1.333 ( 0.000 -1.011 -3.305) 3.456 1.333 ( 0.000 1.011 -3.305) 3.456 1.397 ( 0.000 -2.241 2.200) 3.141 1.397 ( 0.000 2.241 2.200) 3.141 1.447 ( 0.000 -0.766 0.240) 0.802 1.447 ( 0.000 0.766 0.240) 0.802 1.491 ( 0.000 -4.604 6.180) 7.706 1.491 ( 0.000 4.604 6.180) 7.706 1.518 ( 0.000 -0.202 0.588) 0.622 1.518 ( 0.000 0.202 0.588) 0.622 1.533 ( 0.000 -0.943 -2.286) 2.473 1.533 ( 0.000 0.943 -2.286) 2.473 1.609 ( 0.000 -2.184 -0.437) 2.228 1.609 ( 0.000 2.184 -0.437) 2.228 1.667 ( 0.000 -1.033 -0.322) 1.082 1.667 ( 0.000 1.033 -0.322) 1.082 1.704 ( 0.000 -0.967 -2.432) 2.617 1.704 ( 0.000 0.967 -2.432) 2.617 1.798 ( 0.000 -2.649 1.645) 3.118 1.798 ( 0.000 2.649 1.645) 3.118 1.818 ( 0.000 -1.806 2.512) 3.094 1.818 ( 0.000 1.806 2.512) 3.094 1.848 ( 0.000 -2.901 1.034) 3.080 1.848 ( 0.000 2.901 1.034) 3.080 1.905 ( 0.000 -1.410 0.720) 1.583 1.905 ( 0.000 1.410 0.720) 1.583 1.937 ( 0.000 -0.975 1.967) 2.195 1.937 ( 0.000 0.975 1.967) 2.195 1.980 ( 0.000 -0.658 1.718) 1.840 1.980 ( 0.000 0.658 1.718) 1.840 2.020 ( 0.000 -2.262 0.573) 2.334 2.020 ( 0.000 2.262 0.573) 2.334 2.062 ( 0.000 -2.524 0.127) 2.527 2.062 ( 0.000 2.524 0.127) 2.527 2.095 ( 0.000 -0.835 -0.761) 1.130 2.095 ( 0.000 0.835 -0.761) 1.130 2.125 ( 0.000 -2.003 2.662) 3.331 2.125 ( 0.000 2.003 2.662) 3.331 2.191 ( 0.000 -1.473 1.380) 2.018 2.191 ( 0.000 1.473 1.380) 2.018 2.219 ( 0.000 -0.389 -0.806) 0.895 2.219 ( 0.000 0.389 -0.806) 0.895 2.259 ( 0.000 -1.984 0.246) 1.999 2.259 ( 0.000 1.984 0.246) 1.999 2.290 ( 0.000 -1.805 0.932) 2.031 2.290 ( 0.000 1.805 0.932) 2.031 2.307 ( 0.000 -1.881 -6.623) 6.885 2.307 ( 0.000 1.881 -6.623) 6.885 2.349 ( 0.000 -3.908 -1.365) 4.139 2.349 ( 0.000 3.908 -1.365) 4.139 2.435 ( 0.000 -3.878 -2.236) 4.477 2.435 ( 0.000 3.878 -2.236) 4.477 2.456 ( 0.000 -2.912 -2.849) 4.074 2.456 ( 0.000 2.912 -2.849) 4.074 2.536 ( 0.000 -5.570 -1.212) 5.701 2.536 ( 0.000 5.570 -1.212) 5.701 2.626 ( 0.000 -0.285 -2.731) 2.745 2.626 ( 0.000 0.285 -2.731) 2.745 2.699 ( 0.000 -2.566 -5.795) 6.338 2.699 ( 0.000 2.566 -5.795) 6.338 2.783 ( 0.000 -3.553 1.484) 3.850 2.783 ( 0.000 3.553 1.484) 3.850 2.903 ( 0.000 -2.669 -1.042) 2.866 2.903 ( 0.000 2.669 -1.042) 2.866 2.924 ( 0.000 -1.881 1.681) 2.523 2.924 ( 0.000 1.881 1.681) 2.523 2.990 ( 0.000 -5.127 1.092) 5.242 2.990 ( 0.000 5.127 1.092) 5.242 2.994 ( 0.000 -0.526 1.524) 1.612 2.994 ( 0.000 0.526 1.524) 1.612 3.058 ( 0.000 -2.477 -0.301) 2.495 3.058 ( 0.000 2.477 -0.301) 2.495 3.121 ( 0.000 -1.935 -0.884) 2.127 3.121 ( 0.000 1.935 -0.884) 2.127 3.146 ( 0.000 -2.525 2.165) 3.326 3.146 ( 0.000 2.525 2.165) 3.326 3.312 ( 0.000 -1.397 4.782) 4.981 3.312 ( 0.000 1.397 4.782) 4.981 3.447 ( 0.000 -2.714 1.391) 3.049 3.447 ( 0.000 2.714 1.391) 3.049 3.457 ( 0.000 -1.493 -0.052) 1.494 3.457 ( 0.000 1.493 -0.052) 1.494 3.580 ( 0.000 -2.196 -2.590) 3.396 3.580 ( 0.000 2.196 -2.590) 3.396 3.609 ( 0.000 -1.056 -1.689) 1.991 3.609 ( 0.000 1.056 -1.689) 1.991 3.663 ( 0.000 -0.375 0.501) 0.626 3.663 ( 0.000 0.375 0.501) 0.626 3.716 ( 0.000 -0.642 -1.096) 1.270 3.716 ( 0.000 0.642 -1.096) 1.270 3.772 ( 0.000 -1.558 -1.283) 2.018 3.772 ( 0.000 1.558 -1.283) 2.018 3.957 ( 0.000 -1.481 0.927) 1.747 3.957 ( 0.000 1.481 0.927) 1.747 3.994 ( 0.000 -3.149 1.639) 3.550 3.994 ( 0.000 3.149 1.639) 3.550 4.042 ( 0.000 -0.573 -0.380) 0.687 4.042 ( 0.000 0.573 -0.380) 0.687 4.062 ( 0.000 -0.778 -1.638) 1.813 4.062 ( 0.000 0.778 -1.638) 1.813 4.297 ( 0.000 -1.024 -0.758) 1.274 4.297 ( 0.000 1.024 -0.758) 1.274 4.365 ( 0.000 -1.402 -2.011) 2.452 4.365 ( 0.000 1.402 -2.011) 2.452 4.546 ( 0.000 -0.608 3.684) 3.734 4.546 ( 0.000 0.608 3.684) 3.734 4.596 ( 0.000 -1.515 -2.052) 2.551 4.596 ( 0.000 1.515 -2.052) 2.551 4.737 ( 0.000 -1.124 0.196) 1.141 4.737 ( 0.000 1.124 0.196) 1.141 4.779 ( 0.000 -0.389 -2.570) 2.599 4.779 ( 0.000 0.389 -2.570) 2.599 4.867 ( 0.000 -0.490 3.414) 3.449 4.867 ( 0.000 0.490 3.414) 3.449 4.916 ( 0.000 -0.302 -0.044) 0.305 4.916 ( 0.000 0.302 -0.044) 0.305 4.971 ( 0.000 -1.336 0.600) 1.464 4.971 ( 0.000 1.336 0.600) 1.464 5.003 ( 0.000 -0.025 -0.732) 0.733 5.003 ( 0.000 0.025 -0.732) 0.733 5.111 ( 0.000 -0.265 6.207) 6.213 5.111 ( 0.000 0.265 6.207) 6.213 5.145 ( 0.000 -0.355 5.560) 5.572 5.145 ( 0.000 0.355 5.560) 5.572 5.385 ( 0.000 -2.440 -1.970) 3.136 5.385 ( 0.000 2.440 -1.970) 3.136 5.461 ( 0.000 -7.058 -3.102) 7.709 5.461 ( 0.000 7.058 -3.102) 7.709 5.654 ( 0.000 -1.753 1.272) 2.166 5.654 ( 0.000 1.753 1.272) 2.166 5.735 ( 0.000 -0.264 -2.296) 2.311 5.735 ( 0.000 0.264 -2.296) 2.311 5.841 ( 0.000 -2.699 2.944) 3.994 5.841 ( 0.000 2.699 2.944) 3.994 5.924 ( 0.000 -1.272 -1.106) 1.686 5.924 ( 0.000 1.272 -1.106) 1.686 6.313 ( 0.000 -0.587 0.049) 0.589 6.313 ( 0.000 0.587 0.049) 0.589 6.315 ( 0.000 -0.577 0.018) 0.578 6.315 ( 0.000 0.577 0.018) 0.578 6.517 ( 0.000 -3.559 0.580) 3.606 6.517 ( 0.000 3.559 0.580) 3.606 6.546 ( 0.000 -2.427 -0.568) 2.492 6.546 ( 0.000 2.427 -0.568) 2.492 7.714 ( 0.000 -0.214 1.887) 1.899 7.714 ( 0.000 0.214 1.887) 1.899 7.771 ( 0.000 -0.193 -0.129) 0.232 7.771 ( 0.000 0.193 -0.129) 0.232 7.820 ( 0.000 -0.280 1.306) 1.335 7.820 ( 0.000 0.280 1.306) 1.335 7.847 ( 0.000 -0.931 2.663) 2.821 7.847 ( 0.000 0.931 2.663) 2.821 7.884 ( 0.000 -0.218 1.965) 1.977 7.884 ( 0.000 0.218 1.965) 1.977 7.931 ( 0.000 -0.597 2.289) 2.366 7.931 ( 0.000 0.597 2.289) 2.366 7.998 ( 0.000 -0.612 -1.751) 1.855 7.998 ( 0.000 0.612 -1.751) 1.855 8.081 ( 0.000 -1.392 -1.474) 2.027 8.081 ( 0.000 1.392 -1.474) 2.027 8.183 ( 0.000 -0.990 2.958) 3.119 8.183 ( 0.000 0.990 2.958) 3.119 8.226 ( 0.000 -0.274 1.762) 1.784 8.226 ( 0.000 0.274 1.762) 1.784 8.291 ( 0.000 -0.492 -2.371) 2.421 8.291 ( 0.000 0.492 -2.371) 2.421 8.406 ( 0.000 -2.494 1.961) 3.173 8.406 ( 0.000 2.494 1.961) 3.173 8.471 ( 0.000 -1.027 -1.784) 2.058 8.471 ( 0.000 1.027 -1.784) 2.058 8.529 ( 0.000 -1.892 -1.705) 2.547 8.529 ( 0.000 1.892 -1.705) 2.547 8.598 ( 0.000 -0.473 -0.854) 0.976 8.598 ( 0.000 0.473 -0.854) 0.976 8.663 ( 0.000 -0.305 -0.333) 0.452 8.663 ( 0.000 0.305 -0.333) 0.452 8.924 ( 0.000 -2.179 -0.357) 2.208 8.924 ( 0.000 2.179 -0.357) 2.208 9.005 ( 0.000 -2.629 -4.842) 5.510 9.005 ( 0.000 2.629 -4.842) 5.510 9.186 ( 0.000 -1.247 2.299) 2.616 9.186 ( 0.000 1.247 2.299) 2.616 9.215 ( 0.000 -1.244 0.803) 1.481 9.215 ( 0.000 1.244 0.803) 1.481 9.448 ( 0.000 -1.261 -0.234) 1.282 9.448 ( 0.000 1.261 -0.234) 1.282 9.477 ( 0.000 -1.250 -1.974) 2.337 9.477 ( 0.000 1.250 -1.974) 2.337 9.539 ( 0.000 -0.365 0.784) 0.865 9.539 ( 0.000 0.365 0.784) 0.865 9.579 ( 0.000 -2.735 0.439) 2.770 9.579 ( 0.000 2.735 0.439) 2.770 9.693 ( 0.000 -2.849 0.673) 2.928 9.693 ( 0.000 2.849 0.673) 2.928 9.717 ( 0.000 -3.963 0.439) 3.987 9.717 ( 0.000 3.963 0.439) 3.987 9.763 ( 0.000 -3.745 0.146) 3.748 9.763 ( 0.000 3.745 0.146) 3.748 9.785 ( 0.000 -0.048 0.074) 0.088 9.785 ( 0.000 0.048 0.074) 0.088 10.017 ( 0.000 -1.595 0.861) 1.813 10.017 ( 0.000 1.595 0.861) 1.813 10.066 ( 0.000 -1.193 -1.243) 1.723 10.066 ( 0.000 1.193 -1.243) 1.723 10.147 ( 0.000 -3.941 2.277) 4.552 10.147 ( 0.000 3.941 2.277) 4.552 10.329 ( 0.000 -1.389 -6.161) 6.315 10.329 ( 0.000 1.389 -6.161) 6.315======================= Grid point 37 (17/27) =======================q-point: ( 0.25 -0.50 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 24Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.839 ( 4.478 -12.824 7.917) 15.722 0.839 ( 4.478 12.824 7.917) 15.722 0.973 ( 6.704 -11.986 8.433) 16.116 0.973 ( 6.704 11.986 8.433) 16.116 1.139 ( -6.629 -1.005 1.377) 6.845 1.139 ( -6.629 1.005 1.377) 6.845 1.280 ( -2.000 -5.252 -4.579) 7.249 1.280 ( -2.000 5.252 -4.579) 7.249 1.316 ( -2.088 -2.549 4.390) 5.489 1.316 ( -2.088 2.549 4.390) 5.489 1.371 ( -1.316 -3.614 -7.790) 8.688 1.371 ( -1.316 3.614 -7.790) 8.688 1.418 ( 0.209 -2.551 -4.445) 5.129 1.418 ( 0.209 2.551 -4.445) 5.129 1.496 ( 1.190 -5.337 0.369) 5.481 1.496 ( 1.190 5.337 0.369) 5.481 1.548 ( 2.189 -0.335 -1.586) 2.723 1.548 ( 2.189 0.335 -1.586) 2.723 1.601 ( 1.601 -4.203 1.326) 4.689 1.601 ( 1.601 4.203 1.326) 4.689 1.655 ( 2.003 -1.791 3.748) 4.612 1.655 ( 2.003 1.791 3.748) 4.612 1.715 ( 3.027 -0.255 1.566) 3.417 1.715 ( 3.027 0.255 1.566) 3.417 1.737 ( 2.898 -2.471 1.593) 4.129 1.737 ( 2.898 2.471 1.593) 4.129 1.801 ( 2.404 -2.326 1.340) 3.603 1.801 ( 2.404 2.326 1.340) 3.603 1.837 ( 1.917 -2.299 -0.181) 2.998 1.837 ( 1.917 2.299 -0.181) 2.998 1.863 ( -0.316 -2.573 3.442) 4.309 1.863 ( -0.316 2.573 3.442) 4.309 1.887 ( 2.466 -0.981 0.114) 2.657 1.887 ( 2.466 0.981 0.114) 2.657 1.932 ( 0.732 -0.851 2.507) 2.747 1.932 ( 0.732 0.851 2.507) 2.747 1.992 ( -1.534 -1.461 1.633) 2.675 1.992 ( -1.534 1.461 1.633) 2.675 2.035 ( -0.897 -3.037 0.850) 3.279 2.035 ( -0.897 3.037 0.850) 3.279 2.080 ( 2.079 -1.722 -2.011) 3.366 2.080 ( 2.079 1.722 -2.011) 3.366 2.101 ( 1.172 -1.256 -1.053) 2.015 2.101 ( 1.172 1.256 -1.053) 2.015 2.140 ( 1.010 -2.615 1.598) 3.226 2.140 ( 1.010 2.615 1.598) 3.226 2.172 ( -0.495 -0.406 -1.129) 1.298 2.172 ( -0.495 0.406 -1.129) 1.298 2.218 ( -0.008 -1.187 2.006) 2.331 2.218 ( -0.008 1.187 2.006) 2.331 2.248 ( -0.202 -2.455 1.278) 2.775 2.248 ( -0.202 2.455 1.278) 2.775 2.305 ( 0.102 -1.497 0.848) 1.723 2.305 ( 0.102 1.497 0.848) 1.723 2.329 ( -0.475 -4.247 -3.851) 5.753 2.329 ( -0.475 4.247 -3.851) 5.753 2.356 ( 1.306 -1.574 -1.745) 2.688 2.356 ( 1.306 1.574 -1.745) 2.688 2.436 ( -0.052 -2.871 -3.022) 4.169 2.436 ( -0.052 2.871 -3.022) 4.169 2.487 ( 3.658 -2.590 -0.990) 4.590 2.487 ( 3.658 2.590 -0.990) 4.590 2.549 ( 1.280 -4.229 -2.310) 4.986 2.549 ( 1.280 4.229 -2.310) 4.986 2.621 ( -0.767 -2.882 -1.998) 3.590 2.621 ( -0.767 2.882 -1.998) 3.590 2.714 ( -0.142 -2.046 -3.073) 3.695 2.714 ( -0.142 2.046 -3.073) 3.695 2.759 ( -6.238 -4.184 2.885) 8.046 2.759 ( -6.238 4.184 2.885) 8.046 2.845 ( 3.329 -2.516 0.340) 4.187 2.845 ( 3.329 2.516 0.340) 4.187 2.888 ( -1.604 -2.278 -3.528) 4.495 2.888 ( -1.604 2.278 -3.528) 4.495 2.968 ( -1.568 -3.136 -1.950) 4.012 2.968 ( -1.568 3.136 -1.950) 4.012 3.034 ( 1.493 -2.915 1.773) 3.724 3.034 ( 1.493 2.915 1.773) 3.724 3.066 ( -0.320 -0.820 0.013) 0.881 3.066 ( -0.320 0.820 0.013) 0.881 3.109 ( 0.241 -2.102 1.453) 2.567 3.109 ( 0.241 2.102 1.453) 2.567 3.165 ( 1.189 -0.941 0.853) 1.740 3.165 ( 1.189 0.941 0.853) 1.740 3.264 ( -4.044 -2.000 3.989) 6.022 3.264 ( -4.044 2.000 3.989) 6.022 3.354 ( -8.312 -2.991 -1.122) 8.905 3.354 ( -8.312 2.991 -1.122) 8.905 3.471 ( 0.866 -2.626 1.172) 3.004 3.471 ( 0.866 2.626 1.172) 3.004 3.543 ( -1.767 -2.476 3.101) 4.344 3.543 ( -1.767 2.476 3.101) 4.344 3.621 ( 0.430 -1.269 -3.390) 3.645 3.621 ( 0.430 1.269 -3.390) 3.645 3.662 ( -0.299 -2.019 -1.035) 2.288 3.662 ( -0.299 2.019 -1.035) 2.288 3.727 ( 1.018 -1.006 -0.481) 1.510 3.727 ( 1.018 1.006 -0.481) 1.510 3.782 ( 0.336 -1.584 -1.664) 2.322 3.782 ( 0.336 1.584 -1.664) 2.322 3.953 ( -0.577 -0.568 0.771) 1.118 3.953 ( -0.577 0.568 0.771) 1.118 3.972 ( -1.098 -0.728 1.029) 1.672 3.972 ( -1.098 0.728 1.029) 1.672 4.032 ( -0.460 -1.468 -0.164) 1.547 4.032 ( -0.460 1.468 -0.164) 1.547 4.059 ( -0.671 -1.307 -1.330) 1.982 4.059 ( -0.671 1.307 -1.330) 1.982 4.303 ( 0.697 -0.853 -1.512) 1.871 4.303 ( 0.697 0.853 -1.512) 1.871 4.364 ( -0.710 -0.846 -3.180) 3.366 4.364 ( -0.710 0.846 -3.180) 3.366 4.516 ( -0.607 -1.004 3.831) 4.007 4.516 ( -0.607 1.004 3.831) 4.007 4.607 ( -0.968 -0.726 -0.062) 1.211 4.607 ( -0.968 0.726 -0.062) 1.211 4.721 ( -0.531 -1.139 1.985) 2.349 4.721 ( -0.531 1.139 1.985) 2.349 4.799 ( 1.622 -0.877 -2.776) 3.333 4.799 ( 1.622 0.877 -2.776) 3.333 4.841 ( -3.298 -0.910 5.295) 6.304 4.841 ( -3.298 0.910 5.295) 6.304 4.930 ( 1.213 -1.117 0.716) 1.798 4.930 ( 1.213 1.117 0.716) 1.798 4.957 ( -1.483 -1.532 -0.509) 2.192 4.957 ( -1.483 1.532 -0.509) 2.192 5.010 ( 2.129 -0.929 -0.496) 2.375 5.010 ( 2.129 0.929 -0.496) 2.375 5.069 ( -1.078 -1.709 3.143) 3.737 5.069 ( -1.078 1.709 3.143) 3.737 5.121 ( -1.631 -0.772 3.911) 4.307 5.121 ( -1.631 0.772 3.911) 4.307 5.271 ( -6.785 -2.179 -2.127) 7.437 5.271 ( -6.785 2.179 -2.127) 7.437 5.350 ( -7.578 -4.184 -3.576) 9.366 5.350 ( -7.578 4.184 -3.576) 9.366 5.759 ( 6.034 -2.819 0.942) 6.726 5.759 ( 6.034 2.819 0.942) 6.726 5.804 ( 3.260 -0.321 -0.131) 3.278 5.804 ( 3.260 0.321 -0.131) 3.278 5.874 ( 1.874 -2.997 0.771) 3.618 5.874 ( 1.874 2.997 0.771) 3.618 5.931 ( -0.115 -0.674 -1.150) 1.338 5.931 ( -0.115 0.674 -1.150) 1.338 6.376 ( 4.921 -1.163 0.013) 5.056 6.376 ( 4.921 1.163 0.013) 5.056 6.383 ( 4.953 -1.798 -0.064) 5.270 6.383 ( 4.953 1.798 -0.064) 5.270 6.519 ( -0.020 -3.730 0.311) 3.743 6.519 ( -0.020 3.730 0.311) 3.743 6.541 ( -0.709 -2.984 -0.536) 3.113 6.541 ( -0.709 2.984 -0.536) 3.113 7.723 ( 0.828 -0.304 2.342) 2.503 7.723 ( 0.828 0.304 2.342) 2.503 7.772 ( -0.931 -0.608 2.435) 2.677 7.772 ( -0.931 0.608 2.435) 2.677 7.820 ( 0.869 -0.523 -0.918) 1.368 7.820 ( 0.869 0.523 -0.918) 1.368 7.851 ( 0.102 -0.490 -0.195) 0.537 7.851 ( 0.102 0.490 -0.195) 0.537 7.899 ( 0.895 -0.437 1.737) 2.002 7.899 ( 0.895 0.437 1.737) 2.002 7.930 ( -0.311 -0.381 2.067) 2.125 7.930 ( -0.311 0.381 2.067) 2.125 8.057 ( 4.867 -1.486 -0.836) 5.157 8.057 ( 4.867 1.486 -0.836) 5.157 8.106 ( 2.338 -0.974 -0.577) 2.598 8.106 ( 2.338 0.974 -0.577) 2.598 8.180 ( -0.088 -0.362 2.727) 2.752 8.180 ( -0.088 0.362 2.727) 2.752 8.236 ( 0.249 -0.653 1.975) 2.095 8.236 ( 0.249 0.653 1.975) 2.095 8.292 ( 0.403 -0.798 -2.395) 2.557 8.292 ( 0.403 0.798 -2.395) 2.557 8.392 ( -1.583 -2.880 2.099) 3.900 8.392 ( -1.583 2.880 2.099) 3.900 8.476 ( -0.171 -1.711 -0.785) 1.890 8.476 ( -0.171 1.711 -0.785) 1.890 8.497 ( -1.992 -1.943 -2.677) 3.861 8.497 ( -1.992 1.943 -2.677) 3.861 8.592 ( 0.035 -0.206 -2.041) 2.052 8.592 ( 0.035 0.206 -2.041) 2.052 8.650 ( -1.152 -1.475 -2.105) 2.817 8.650 ( -1.152 1.475 -2.105) 2.817 8.933 ( 1.765 -2.020 0.731) 2.780 8.933 ( 1.765 2.020 0.731) 2.780 9.032 ( 1.062 -2.185 -4.059) 4.730 9.032 ( 1.062 2.185 -4.059) 4.730 9.161 ( -1.436 -1.647 2.089) 3.023 9.161 ( -1.436 1.647 2.089) 3.023 9.206 ( -1.448 -2.464 0.128) 2.861 9.206 ( -1.448 2.464 0.128) 2.861 9.436 ( 0.524 -2.298 1.196) 2.643 9.436 ( 0.524 2.298 1.196) 2.643 9.494 ( 0.180 -1.529 -0.671) 1.679 9.494 ( 0.180 1.529 -0.671) 1.679 9.546 ( 0.276 -0.696 -0.204) 0.776 9.546 ( 0.276 0.696 -0.204) 0.776 9.565 ( -0.904 -1.342 -0.854) 1.829 9.565 ( -0.904 1.342 -0.854) 1.829 9.698 ( 0.364 -3.391 0.980) 3.549 9.698 ( 0.364 3.391 0.980) 3.549 9.723 ( 0.096 -1.511 -0.184) 1.526 9.723 ( 0.096 1.511 -0.184) 1.526 9.759 ( 0.513 -1.174 1.532) 1.997 9.759 ( 0.513 1.174 1.532) 1.997 9.794 ( 0.288 -2.091 -0.276) 2.129 9.794 ( 0.288 2.091 -0.276) 2.129 10.046 ( 2.514 -2.657 0.439) 3.684 10.046 ( 2.514 2.657 0.439) 3.684 10.081 ( 1.528 -2.004 -1.001) 2.712 10.081 ( 1.528 2.004 -1.001) 2.712 10.132 ( -1.293 -3.196 1.741) 3.862 10.132 ( -1.293 3.196 1.741) 3.862 10.269 ( -4.993 -2.431 -4.351) 7.054 10.269 ( -4.993 2.431 -4.351) 7.054======================= Grid point 39 (18/27) =======================q-point: (-0.50 -0.50 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 18Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.961 ( -6.986 -9.232 5.850) 12.971 0.961 ( 6.917 -9.219 5.850) 12.924 0.961 ( -6.917 9.219 5.850) 12.924 0.961 ( 6.986 9.232 5.850) 12.971 1.172 ( -9.239 -7.219 5.227) 12.837 1.172 ( 9.159 -7.193 5.227) 12.765 1.172 ( -9.159 7.193 5.227) 12.765 1.172 ( 9.239 7.219 5.227) 12.837 1.305 ( -2.765 -3.631 -6.273) 7.758 1.305 ( 2.613 -3.603 -6.273) 7.692 1.305 ( -2.613 3.603 -6.273) 7.692 1.305 ( 2.765 3.631 -6.273) 7.758 1.477 ( -2.133 -2.595 -4.428) 5.558 1.477 ( 1.040 -2.422 -4.428) 5.153 1.477 ( -1.040 2.422 -4.428) 5.153 1.477 ( 2.133 2.595 -4.428) 5.558 1.582 ( -2.024 -1.886 -0.352) 2.789 1.582 ( 1.834 -1.837 -0.352) 2.620 1.582 ( -1.834 1.837 -0.352) 2.620 1.582 ( 2.024 1.886 -0.352) 2.789 1.722 ( -1.325 -2.226 3.185) 4.105 1.722 ( 0.716 -2.155 3.185) 3.911 1.722 ( -0.716 2.155 3.185) 3.911 1.722 ( 1.325 2.226 3.185) 4.105 1.810 ( -2.901 -1.080 1.819) 3.590 1.810 ( -2.884 1.069 1.819) 3.573 1.810 ( 2.884 -1.069 1.819) 3.573 1.810 ( 2.901 1.080 1.819) 3.590 1.866 ( -0.517 -2.235 1.715) 2.865 1.866 ( 0.496 -2.234 1.715) 2.860 1.866 ( -0.496 2.234 1.715) 2.860 1.866 ( 0.517 2.235 1.715) 2.865 1.939 ( -3.151 -0.678 0.045) 3.224 1.939 ( -3.021 0.508 0.045) 3.064 1.939 ( 3.021 -0.508 0.045) 3.064 1.939 ( 3.151 0.678 0.045) 3.224 2.014 ( -2.537 -3.143 1.096) 4.185 2.014 ( 1.601 -2.985 1.096) 3.560 2.014 ( -1.601 2.985 1.096) 3.560 2.014 ( 2.537 3.143 1.096) 4.185 2.115 ( -5.031 -3.906 1.006) 6.448 2.115 ( 4.950 -3.880 1.006) 6.369 2.115 ( -4.950 3.880 1.006) 6.369 2.115 ( 5.031 3.906 1.006) 6.448 2.151 ( -1.215 -1.588 -0.507) 2.062 2.151 ( 0.761 -1.516 -0.507) 1.770 2.151 ( -0.761 1.516 -0.507) 1.770 2.151 ( 1.215 1.588 -0.507) 2.062 2.224 ( -1.041 -2.210 0.643) 2.526 2.224 ( 1.003 -2.205 0.643) 2.507 2.224 ( -1.003 2.205 0.643) 2.507 2.224 ( 1.041 2.210 0.643) 2.526 2.323 ( -2.255 -2.488 -0.462) 3.390 2.323 ( 0.827 -2.257 -0.462) 2.447 2.323 ( -0.827 2.257 -0.462) 2.447 2.323 ( 2.255 2.488 -0.462) 3.390 2.386 ( -3.763 -3.290 1.803) 5.313 2.386 ( 3.716 -3.276 1.803) 5.272 2.386 ( -3.716 3.276 1.803) 5.272 2.386 ( 3.763 3.290 1.803) 5.313 2.562 ( -2.161 -4.673 -4.374) 6.756 2.562 ( 1.090 -4.579 -4.374) 6.425 2.562 ( -1.090 4.579 -4.374) 6.425 2.562 ( 2.161 4.673 -4.374) 6.756 2.624 ( -2.375 -5.680 0.551) 6.182 2.624 ( 2.316 -5.674 0.551) 6.153 2.624 ( -2.316 5.674 0.551) 6.153 2.624 ( 2.375 5.680 0.551) 6.182 2.795 ( -5.453 -2.651 -1.839) 6.336 2.795 ( -1.458 -0.352 -1.839) 2.374 2.795 ( 1.458 0.352 -1.839) 2.374 2.795 ( 5.453 2.651 -1.839) 6.336 2.949 ( -1.406 -1.025 -2.387) 2.954 2.949 ( 0.456 -0.780 -2.387) 2.553 2.949 ( -0.456 0.780 -2.387) 2.553 2.949 ( 1.406 1.025 -2.387) 2.954 3.053 ( -3.776 -1.011 -1.208) 4.091 3.053 ( -3.540 0.769 -1.208) 3.819 3.053 ( 3.540 -0.769 -1.208) 3.819 3.053 ( 3.776 1.011 -1.208) 4.091 3.162 ( -3.676 -1.577 1.811) 4.391 3.162 ( -1.920 -0.174 1.811) 2.645 3.162 ( 1.920 0.174 1.811) 2.645 3.162 ( 3.676 1.577 1.811) 4.391 3.197 ( -2.531 -1.583 1.735) 3.452 3.197 ( 0.926 -1.057 1.735) 2.233 3.197 ( -0.926 1.057 1.735) 2.233 3.197 ( 2.531 1.583 1.735) 3.452 3.496 ( -1.800 -2.788 2.614) 4.224 3.496 ( 1.435 -2.734 2.614) 4.046 3.496 ( -1.435 2.734 2.614) 4.046 3.496 ( 1.800 2.788 2.614) 4.224 3.645 ( -1.286 -2.271 -2.498) 3.613 3.645 ( 1.228 -2.263 -2.498) 3.588 3.645 ( -1.228 2.263 -2.498) 3.588 3.645 ( 1.286 2.271 -2.498) 3.613 3.761 ( -2.013 -1.045 -0.234) 2.280 3.761 ( 0.632 -0.423 -0.234) 0.796 3.761 ( -0.632 0.423 -0.234) 0.796 3.761 ( 2.013 1.045 -0.234) 2.280 3.953 ( -0.862 -0.788 0.346) 1.218 3.953 ( 0.848 -0.784 0.346) 1.206 3.953 ( -0.848 0.784 0.346) 1.206 3.953 ( 0.862 0.788 0.346) 1.218 4.037 ( -0.947 -1.921 -0.645) 2.237 4.037 ( 0.880 -1.913 -0.645) 2.202 4.037 ( -0.880 1.913 -0.645) 2.202 4.037 ( 0.947 1.921 -0.645) 2.237 4.330 ( -1.535 -1.113 -3.022) 3.567 4.330 ( -0.510 -0.846 -3.022) 3.179 4.330 ( 0.510 0.846 -3.022) 3.179 4.330 ( 1.535 1.113 -3.022) 3.567 4.550 ( -3.058 -0.473 3.269) 4.502 4.550 ( -2.916 0.107 3.269) 4.382 4.550 ( 2.916 -0.107 3.269) 4.382 4.550 ( 3.058 0.473 3.269) 4.502 4.747 ( -2.847 -1.771 3.336) 4.730 4.747 ( 2.512 -1.639 3.336) 4.486 4.747 ( -2.512 1.639 3.336) 4.486 4.747 ( 2.847 1.771 3.336) 4.730 4.881 ( -3.749 -1.276 -2.118) 4.491 4.881 ( -3.701 1.240 -2.118) 4.441 4.881 ( 3.701 -1.240 -2.118) 4.441 4.881 ( 3.749 1.276 -2.118) 4.491 5.003 ( -2.775 -1.055 0.824) 3.081 5.003 ( -1.811 0.086 0.824) 1.992 5.003 ( 1.811 -0.086 0.824) 1.992 5.003 ( 2.775 1.055 0.824) 3.081 5.090 ( -1.332 -0.744 1.322) 2.019 5.090 ( -0.720 -0.490 1.322) 1.583 5.090 ( 0.720 0.490 1.322) 1.583 5.090 ( 1.332 0.744 1.322) 2.019 5.216 ( -3.257 -1.715 -2.014) 4.196 5.216 ( -0.021 -0.538 -2.014) 2.085 5.216 ( 0.021 0.538 -2.014) 2.085 5.216 ( 3.257 1.715 -2.014) 4.196 5.840 ( -1.103 -2.140 1.004) 2.608 5.840 ( 0.985 -2.125 1.004) 2.548 5.840 ( -0.985 2.125 1.004) 2.548 5.840 ( 1.103 2.140 1.004) 2.608 5.903 ( -1.940 -1.291 -0.964) 2.522 5.903 ( 0.325 -0.866 -0.964) 1.336 5.903 ( -0.325 0.866 -0.964) 1.336 5.903 ( 1.940 1.291 -0.964) 2.522 6.452 ( -0.161 -1.586 0.131) 1.600 6.452 ( 0.121 -1.585 0.131) 1.595 6.452 ( -0.121 1.585 0.131) 1.595 6.452 ( 0.161 1.586 0.131) 1.600 6.517 ( -0.631 -0.539 -0.344) 0.899 6.517 ( 0.404 -0.482 -0.344) 0.717 6.517 ( -0.404 0.482 -0.344) 0.717 6.517 ( 0.631 0.539 -0.344) 0.899 7.746 ( -1.248 -0.496 2.836) 3.138 7.746 ( -1.133 0.422 2.836) 3.083 7.746 ( 1.133 -0.422 2.836) 3.083 7.746 ( 1.248 0.496 2.836) 3.138 7.842 ( -0.872 -0.418 -1.355) 1.664 7.842 ( -0.259 -0.039 -1.355) 1.380 7.842 ( 0.259 0.039 -1.355) 1.380 7.842 ( 0.872 0.418 -1.355) 1.664 7.918 ( -0.713 -0.577 1.985) 2.187 7.918 ( 0.076 -0.456 1.985) 2.038 7.918 ( -0.076 0.456 1.985) 2.038 7.918 ( 0.713 0.577 1.985) 2.187 8.132 ( -1.624 -0.713 -0.579) 1.866 8.132 ( -1.126 0.407 -0.579) 1.330 8.132 ( 1.126 -0.407 -0.579) 1.330 8.132 ( 1.624 0.713 -0.579) 1.866 8.209 ( -2.621 -1.835 2.181) 3.872 8.209 ( 0.752 -1.338 2.181) 2.667 8.209 ( -0.752 1.338 2.181) 2.667 8.209 ( 2.621 1.835 2.181) 3.872 8.332 ( -3.022 -2.951 -0.907) 4.320 8.332 ( 1.240 -2.610 -0.907) 3.029 8.332 ( -1.240 2.610 -0.907) 3.029 8.332 ( 3.022 2.951 -0.907) 4.320 8.471 ( -0.601 -0.948 -0.385) 1.187 8.471 ( 0.448 -0.927 -0.385) 1.099 8.471 ( -0.448 0.927 -0.385) 1.099 8.471 ( 0.601 0.948 -0.385) 1.187 8.616 ( -1.549 -1.389 -3.718) 4.261 8.616 ( -0.018 -1.153 -3.718) 3.893 8.616 ( 0.018 1.153 -3.718) 3.893 8.616 ( 1.549 1.389 -3.718) 4.261 9.000 ( -3.626 -1.734 -0.060) 4.020 9.000 ( -1.244 0.326 -0.060) 1.287 9.000 ( 1.244 -0.326 -0.060) 1.287 9.000 ( 3.626 1.734 -0.060) 4.020 9.165 ( -1.746 -1.569 -0.049) 2.348 9.165 ( 1.679 -1.551 -0.049) 2.286 9.165 ( -1.679 1.551 -0.049) 2.286 9.165 ( 1.746 1.569 -0.049) 2.348 9.470 ( -1.937 -2.735 1.390) 3.628 9.470 ( 1.622 -2.683 1.390) 3.430 9.470 ( -1.622 2.683 1.390) 3.430 9.470 ( 1.937 2.735 1.390) 3.628 9.552 ( -0.441 -2.399 -1.490) 2.858 9.552 ( 0.430 -2.398 -1.490) 2.856 9.552 ( -0.430 2.398 -1.490) 2.856 9.552 ( 0.441 2.399 -1.490) 2.858 9.710 ( -0.821 -2.610 0.901) 2.881 9.710 ( 0.817 -2.610 0.901) 2.879 9.710 ( -0.817 2.610 0.901) 2.879 9.710 ( 0.821 2.610 0.901) 2.881 9.785 ( -1.147 -2.261 0.350) 2.560 9.785 ( 1.127 -2.259 0.350) 2.549 9.785 ( -1.127 2.259 0.350) 2.549 9.785 ( 1.147 2.261 0.350) 2.560 10.095 ( -1.816 -1.712 0.573) 2.561 10.095 ( 1.787 -1.704 0.573) 2.535 10.095 ( -1.787 1.704 0.573) 2.535 10.095 ( 1.816 1.712 0.573) 2.561 10.154 ( -4.989 -1.663 -1.735) 5.538 10.154 ( -4.971 1.650 -1.735) 5.517 10.154 ( 4.971 -1.650 -1.735) 5.517 10.154 ( 4.989 1.663 -1.735) 5.538======================= Grid point 50 (19/27) =======================q-point: ( 0.00 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 18Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.759 ( 0.000 0.000 -18.147) 18.147 0.759 ( 0.000 0.000 18.147) 18.147 0.802 ( 0.000 0.000 -18.371) 18.371 0.802 ( 0.000 0.000 18.371) 18.371 1.298 ( 0.000 0.000 -3.772) 3.772 1.298 ( 0.000 0.000 3.772) 3.772 1.326 ( 0.000 0.000 -0.958) 0.958 1.326 ( 0.000 0.000 0.958) 0.958 1.403 ( 0.000 0.000 -13.495) 13.495 1.403 ( 0.000 0.000 13.495) 13.495 1.429 ( 0.000 0.000 -0.777) 0.777 1.429 ( 0.000 0.000 0.777) 0.777 1.462 ( 0.000 0.000 -16.084) 16.084 1.462 ( 0.000 0.000 16.084) 16.084 1.463 ( 0.000 0.000 -8.667) 8.667 1.463 ( 0.000 0.000 8.667) 8.667 1.557 ( 0.000 0.000 -1.633) 1.633 1.557 ( 0.000 0.000 1.633) 1.633 1.580 ( 0.000 0.000 -0.878) 0.878 1.580 ( 0.000 0.000 0.878) 0.878 1.601 ( 0.000 0.000 -0.352) 0.352 1.601 ( 0.000 0.000 0.352) 0.352 1.664 ( 0.000 0.000 -1.693) 1.693 1.664 ( 0.000 0.000 1.693) 1.693 1.716 ( 0.000 0.000 -3.867) 3.867 1.716 ( 0.000 0.000 3.867) 3.867 1.792 ( 0.000 0.000 -5.740) 5.740 1.792 ( 0.000 0.000 5.740) 5.740 1.827 ( 0.000 0.000 -0.532) 0.532 1.827 ( 0.000 0.000 0.532) 0.532 1.866 ( 0.000 0.000 -0.307) 0.307 1.866 ( 0.000 0.000 0.307) 0.307 1.936 ( 0.000 0.000 -0.036) 0.036 1.936 ( 0.000 0.000 0.036) 0.036 1.963 ( 0.000 0.000 -1.650) 1.650 1.963 ( 0.000 0.000 1.650) 1.650 2.007 ( 0.000 0.000 -4.533) 4.533 2.007 ( 0.000 0.000 4.533) 4.533 2.035 ( 0.000 0.000 -1.642) 1.642 2.035 ( 0.000 0.000 1.642) 1.642 2.072 ( 0.000 0.000 -1.275) 1.275 2.072 ( 0.000 0.000 1.275) 1.275 2.100 ( 0.000 0.000 -3.978) 3.978 2.100 ( 0.000 0.000 3.978) 3.978 2.139 ( 0.000 0.000 -2.822) 2.822 2.139 ( 0.000 0.000 2.822) 2.822 2.155 ( 0.000 0.000 -0.078) 0.078 2.155 ( 0.000 0.000 0.078) 0.078 2.239 ( 0.000 0.000 -3.548) 3.548 2.239 ( 0.000 0.000 3.548) 3.548 2.241 ( 0.000 0.000 -0.323) 0.323 2.241 ( 0.000 0.000 0.323) 0.323 2.289 ( 0.000 0.000 -1.332) 1.332 2.289 ( 0.000 0.000 1.332) 1.332 2.296 ( 0.000 0.000 -4.013) 4.013 2.296 ( 0.000 0.000 4.013) 4.013 2.368 ( 0.000 0.000 -0.425) 0.425 2.368 ( 0.000 0.000 0.425) 0.425 2.456 ( 0.000 0.000 -5.560) 5.560 2.456 ( 0.000 0.000 5.560) 5.560 2.459 ( 0.000 0.000 -3.931) 3.931 2.459 ( 0.000 0.000 3.931) 3.931 2.537 ( 0.000 0.000 -5.202) 5.202 2.537 ( 0.000 0.000 5.202) 5.202 2.586 ( 0.000 0.000 -1.839) 1.839 2.586 ( 0.000 0.000 1.839) 1.839 2.682 ( 0.000 0.000 -5.690) 5.690 2.682 ( 0.000 0.000 5.690) 5.690 2.844 ( 0.000 0.000 -4.522) 4.522 2.844 ( 0.000 0.000 4.522) 4.522 2.857 ( 0.000 0.000 -2.908) 2.908 2.857 ( 0.000 0.000 2.908) 2.908 2.878 ( 0.000 0.000 -0.049) 0.049 2.878 ( 0.000 0.000 0.049) 0.049 2.912 ( 0.000 0.000 -0.367) 0.367 2.912 ( 0.000 0.000 0.367) 0.367 2.967 ( 0.000 0.000 -1.821) 1.821 2.967 ( 0.000 0.000 1.821) 1.821 3.001 ( 0.000 0.000 -1.340) 1.340 3.001 ( 0.000 0.000 1.340) 1.340 3.082 ( 0.000 0.000 -4.685) 4.685 3.082 ( 0.000 0.000 4.685) 4.685 3.304 ( 0.000 0.000 -2.450) 2.450 3.304 ( 0.000 0.000 2.450) 2.450 3.352 ( 0.000 0.000 -4.648) 4.648 3.352 ( 0.000 0.000 4.648) 4.648 3.404 ( 0.000 0.000 -0.392) 0.392 3.404 ( 0.000 0.000 0.392) 0.392 3.477 ( 0.000 0.000 -7.414) 7.414 3.477 ( 0.000 0.000 7.414) 7.414 3.491 ( 0.000 0.000 -4.531) 4.531 3.491 ( 0.000 0.000 4.531) 4.531 3.584 ( 0.000 0.000 -0.365) 0.365 3.584 ( 0.000 0.000 0.365) 0.365 3.618 ( 0.000 0.000 -2.680) 2.680 3.618 ( 0.000 0.000 2.680) 2.680 3.723 ( 0.000 0.000 -1.714) 1.714 3.723 ( 0.000 0.000 1.714) 1.714 3.782 ( 0.000 0.000 -2.286) 2.286 3.782 ( 0.000 0.000 2.286) 2.286 3.959 ( 0.000 0.000 -1.156) 1.156 3.959 ( 0.000 0.000 1.156) 1.156 3.976 ( 0.000 0.000 -3.686) 3.686 3.976 ( 0.000 0.000 3.686) 3.686 4.042 ( 0.000 0.000 -1.652) 1.652 4.042 ( 0.000 0.000 1.652) 1.652 4.105 ( 0.000 0.000 -1.406) 1.406 4.105 ( 0.000 0.000 1.406) 1.406 4.310 ( 0.000 0.000 -1.403) 1.403 4.310 ( 0.000 0.000 1.403) 1.403 4.334 ( 0.000 0.000 -2.322) 2.322 4.334 ( 0.000 0.000 2.322) 2.322 4.550 ( 0.000 0.000 -2.895) 2.895 4.550 ( 0.000 0.000 2.895) 2.895 4.586 ( 0.000 0.000 -2.637) 2.637 4.586 ( 0.000 0.000 2.637) 2.637 4.743 ( 0.000 0.000 -2.161) 2.161 4.743 ( 0.000 0.000 2.161) 2.161 4.767 ( 0.000 0.000 -0.840) 0.840 4.767 ( 0.000 0.000 0.840) 0.840 4.886 ( 0.000 0.000 -1.451) 1.451 4.886 ( 0.000 0.000 1.451) 1.451 4.895 ( 0.000 0.000 -1.058) 1.058 4.895 ( 0.000 0.000 1.058) 1.058 4.982 ( 0.000 0.000 -1.371) 1.371 4.982 ( 0.000 0.000 1.371) 1.371 5.016 ( 0.000 0.000 -0.248) 0.248 5.016 ( 0.000 0.000 0.248) 0.248 5.196 ( 0.000 0.000 -2.836) 2.836 5.196 ( 0.000 0.000 2.836) 2.836 5.234 ( 0.000 0.000 -6.579) 6.579 5.234 ( 0.000 0.000 6.579) 6.579 5.263 ( 0.000 0.000 -3.254) 3.254 5.263 ( 0.000 0.000 3.254) 3.254 5.557 ( 0.000 0.000 -3.820) 3.820 5.557 ( 0.000 0.000 3.820) 3.820 5.665 ( 0.000 0.000 -3.075) 3.075 5.665 ( 0.000 0.000 3.075) 3.075 5.705 ( 0.000 0.000 -0.782) 0.782 5.705 ( 0.000 0.000 0.782) 0.782 5.847 ( 0.000 0.000 -3.026) 3.026 5.847 ( 0.000 0.000 3.026) 3.026 6.002 ( 0.000 0.000 -1.577) 1.577 6.002 ( 0.000 0.000 1.577) 1.577 6.304 ( 0.000 0.000 -0.048) 0.048 6.304 ( 0.000 0.000 0.048) 0.048 6.334 ( 0.000 0.000 -0.032) 0.032 6.334 ( 0.000 0.000 0.032) 0.032 6.454 ( 0.000 0.000 -1.301) 1.301 6.454 ( 0.000 0.000 1.301) 1.301 6.605 ( 0.000 0.000 -0.160) 0.160 6.605 ( 0.000 0.000 0.160) 0.160 7.742 ( 0.000 0.000 -1.134) 1.134 7.742 ( 0.000 0.000 1.134) 1.134 7.743 ( 0.000 0.000 -1.424) 1.424 7.743 ( 0.000 0.000 1.424) 1.424 7.858 ( 0.000 0.000 -0.670) 0.670 7.858 ( 0.000 0.000 0.670) 0.670 7.860 ( 0.000 0.000 -1.416) 1.416 7.860 ( 0.000 0.000 1.416) 1.416 7.924 ( 0.000 0.000 -2.842) 2.842 7.924 ( 0.000 0.000 2.842) 2.842 7.928 ( 0.000 0.000 -2.580) 2.580 7.928 ( 0.000 0.000 2.580) 2.580 7.999 ( 0.000 0.000 -4.843) 4.843 7.999 ( 0.000 0.000 4.843) 4.843 8.095 ( 0.000 0.000 -0.382) 0.382 8.095 ( 0.000 0.000 0.382) 0.382 8.211 ( 0.000 0.000 -2.887) 2.887 8.211 ( 0.000 0.000 2.887) 2.887 8.279 ( 0.000 0.000 -1.388) 1.388 8.279 ( 0.000 0.000 1.388) 1.388 8.308 ( 0.000 0.000 -5.523) 5.523 8.308 ( 0.000 0.000 5.523) 5.523 8.328 ( 0.000 0.000 -6.979) 6.979 8.328 ( 0.000 0.000 6.979) 6.979 8.479 ( 0.000 0.000 -2.404) 2.404 8.479 ( 0.000 0.000 2.404) 2.404 8.487 ( 0.000 0.000 -7.638) 7.638 8.487 ( 0.000 0.000 7.638) 7.638 8.627 ( 0.000 0.000 -3.352) 3.352 8.627 ( 0.000 0.000 3.352) 3.352 8.701 ( 0.000 0.000 -4.075) 4.075 8.701 ( 0.000 0.000 4.075) 4.075 8.935 ( 0.000 0.000 -1.724) 1.724 8.935 ( 0.000 0.000 1.724) 1.724 9.005 ( 0.000 0.000 -2.144) 2.144 9.005 ( 0.000 0.000 2.144) 2.144 9.228 ( 0.000 0.000 -1.523) 1.523 9.228 ( 0.000 0.000 1.523) 1.523 9.239 ( 0.000 0.000 -2.891) 2.891 9.239 ( 0.000 0.000 2.891) 2.891 9.374 ( 0.000 0.000 -0.536) 0.536 9.374 ( 0.000 0.000 0.536) 0.536 9.453 ( 0.000 0.000 -1.215) 1.215 9.453 ( 0.000 0.000 1.215) 1.215 9.512 ( 0.000 0.000 -3.558) 3.558 9.512 ( 0.000 0.000 3.558) 3.558 9.571 ( 0.000 0.000 -0.220) 0.220 9.571 ( 0.000 0.000 0.220) 0.220 9.669 ( 0.000 0.000 -2.084) 2.084 9.669 ( 0.000 0.000 2.084) 2.084 9.689 ( 0.000 0.000 -0.755) 0.755 9.689 ( 0.000 0.000 0.755) 0.755 9.843 ( 0.000 0.000 -1.640) 1.640 9.843 ( 0.000 0.000 1.640) 1.640 9.889 ( 0.000 0.000 -0.009) 0.009 9.889 ( 0.000 0.000 0.009) 0.009 9.953 ( 0.000 0.000 -0.729) 0.729 9.953 ( 0.000 0.000 0.729) 0.729 10.026 ( 0.000 0.000 -0.192) 0.192 10.026 ( 0.000 0.000 0.192) 0.192 10.068 ( 0.000 0.000 -0.134) 0.134 10.068 ( 0.000 0.000 0.134) 0.134 10.286 ( 0.000 0.000 -1.206) 1.206 10.286 ( 0.000 0.000 1.206) 1.206======================= Grid point 52 (20/27) =======================q-point: ( 0.25 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 18Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.857 ( 8.425 0.000 -13.509) 15.921 0.857 ( 8.425 0.000 13.509) 15.921 0.908 ( 8.433 0.000 -13.420) 15.850 0.908 ( 8.433 0.000 13.420) 15.850 1.249 ( -5.248 0.000 -2.155) 5.673 1.249 ( -5.248 0.000 2.155) 5.673 1.310 ( -5.505 0.000 -0.999) 5.595 1.310 ( -5.505 0.000 0.999) 5.595 1.365 ( -0.131 0.000 -0.588) 0.603 1.365 ( -0.131 0.000 0.588) 0.603 1.419 ( -2.595 0.000 -1.994) 3.273 1.419 ( -2.595 0.000 1.994) 3.273 1.462 ( 0.486 0.000 -3.231) 3.267 1.462 ( 0.486 0.000 3.231) 3.267 1.505 ( 3.198 0.000 -3.570) 4.793 1.505 ( 3.198 0.000 3.570) 4.793 1.530 ( 2.356 0.000 -5.327) 5.825 1.530 ( 2.356 0.000 5.327) 5.825 1.607 ( 1.220 0.000 -2.895) 3.142 1.607 ( 1.220 0.000 2.895) 3.142 1.645 ( 2.447 0.000 -2.729) 3.666 1.645 ( 2.447 0.000 2.729) 3.666 1.741 ( 5.906 0.000 -1.489) 6.091 1.741 ( 5.906 0.000 1.489) 6.091 1.753 ( 2.616 0.000 -4.909) 5.563 1.753 ( 2.616 0.000 4.909) 5.563 1.787 ( -0.859 0.000 -0.617) 1.057 1.787 ( -0.859 0.000 0.617) 1.057 1.855 ( 0.436 0.000 -1.366) 1.434 1.855 ( 0.436 0.000 1.366) 1.434 1.890 ( 2.353 0.000 -1.025) 2.566 1.890 ( 2.353 0.000 1.025) 2.566 1.914 ( 0.695 0.000 -2.982) 3.062 1.914 ( 0.695 0.000 2.982) 3.062 1.979 ( 1.082 0.000 -2.917) 3.111 1.979 ( 1.082 0.000 2.917) 3.111 1.993 ( 0.750 0.000 -0.258) 0.793 1.993 ( 0.750 0.000 0.258) 0.793 2.028 ( -2.123 0.000 -1.172) 2.425 2.028 ( -2.123 0.000 1.172) 2.425 2.052 ( -1.223 0.000 -1.420) 1.874 2.052 ( -1.223 0.000 1.420) 1.874 2.098 ( -0.690 0.000 -1.893) 2.015 2.098 ( -0.690 0.000 1.893) 2.015 2.115 ( 1.625 0.000 -1.795) 2.421 2.115 ( 1.625 0.000 1.795) 2.421 2.150 ( -0.542 0.000 -1.933) 2.008 2.150 ( -0.542 0.000 1.933) 2.008 2.207 ( -3.778 0.000 -2.464) 4.510 2.207 ( -3.778 0.000 2.464) 4.510 2.272 ( -1.614 0.000 -4.793) 5.057 2.272 ( -1.614 0.000 4.793) 5.057 2.312 ( 2.458 0.000 -2.471) 3.485 2.312 ( 2.458 0.000 2.471) 3.485 2.355 ( 3.085 0.000 -1.515) 3.436 2.355 ( 3.085 0.000 1.515) 3.436 2.368 ( -0.835 0.000 -0.723) 1.105 2.368 ( -0.835 0.000 0.723) 1.105 2.400 ( 3.759 0.000 -2.531) 4.532 2.400 ( 3.759 0.000 2.531) 4.532 2.442 ( -6.428 0.000 -6.642) 9.243 2.442 ( -6.428 0.000 6.642) 9.243 2.577 ( 2.283 0.000 -6.459) 6.850 2.577 ( 2.283 0.000 6.459) 6.850 2.631 ( 4.021 0.000 -2.342) 4.654 2.631 ( 4.021 0.000 2.342) 4.654 2.710 ( -3.608 0.000 -4.224) 5.555 2.710 ( -3.608 0.000 4.224) 5.555 2.725 ( 0.952 0.000 -4.562) 4.660 2.725 ( 0.952 0.000 4.562) 4.660 2.844 ( -2.602 0.000 -1.139) 2.840 2.844 ( -2.602 0.000 1.139) 2.840 2.898 ( -0.667 0.000 -3.425) 3.489 2.898 ( -0.667 0.000 3.425) 3.489 2.928 ( 0.765 0.000 -3.259) 3.347 2.928 ( 0.765 0.000 3.259) 3.347 2.987 ( 3.001 0.000 -2.325) 3.796 2.987 ( 3.001 0.000 2.325) 3.796 3.062 ( 4.165 0.000 -2.333) 4.774 3.062 ( 4.165 0.000 2.333) 4.774 3.088 ( 1.623 0.000 -2.208) 2.740 3.088 ( 1.623 0.000 2.208) 2.740 3.233 ( -5.516 0.000 -4.325) 7.010 3.233 ( -5.516 0.000 4.325) 7.010 3.282 ( -5.542 0.000 -0.163) 5.544 3.282 ( -5.542 0.000 0.163) 5.544 3.400 ( -4.597 0.000 -1.826) 4.946 3.400 ( -4.597 0.000 1.826) 4.946 3.461 ( -0.927 0.000 -3.123) 3.258 3.461 ( -0.927 0.000 3.123) 3.258 3.478 ( -0.359 0.000 -1.760) 1.796 3.478 ( -0.359 0.000 1.760) 1.796 3.562 ( 1.004 0.000 -2.102) 2.329 3.562 ( 1.004 0.000 2.102) 2.329 3.649 ( 1.711 0.000 -1.603) 2.345 3.649 ( 1.711 0.000 1.603) 2.345 3.728 ( -0.066 0.000 -0.968) 0.971 3.728 ( -0.066 0.000 0.968) 0.971 3.776 ( -0.468 0.000 -2.557) 2.600 3.776 ( -0.468 0.000 2.557) 2.600 3.960 ( 0.065 0.000 -0.547) 0.551 3.960 ( 0.065 0.000 0.547) 0.551 3.980 ( 0.314 0.000 -2.924) 2.941 3.980 ( 0.314 0.000 2.924) 2.941 4.018 ( -1.591 0.000 -1.746) 2.363 4.018 ( -1.591 0.000 1.746) 2.363 4.082 ( -2.058 0.000 -2.468) 3.213 4.082 ( -2.058 0.000 2.468) 3.213 4.289 ( -0.894 0.000 -2.218) 2.391 4.289 ( -0.894 0.000 2.218) 2.391 4.327 ( -1.156 0.000 -0.352) 1.209 4.327 ( -1.156 0.000 0.352) 1.209 4.556 ( 0.645 0.000 -3.813) 3.867 4.556 ( 0.645 0.000 3.813) 3.867 4.603 ( 0.585 0.000 -0.070) 0.589 4.603 ( 0.585 0.000 0.070) 0.589 4.724 ( -0.310 0.000 -0.076) 0.319 4.724 ( -0.310 0.000 0.076) 0.319 4.782 ( 1.229 0.000 -1.419) 1.877 4.782 ( 1.229 0.000 1.419) 1.877 4.854 ( -2.255 0.000 -1.682) 2.813 4.854 ( -2.255 0.000 1.682) 2.813 4.949 ( 3.567 0.000 -1.641) 3.926 4.949 ( 3.567 0.000 1.641) 3.926 4.956 ( -3.153 0.000 -0.038) 3.153 4.956 ( -3.153 0.000 0.038) 3.153 5.038 ( 2.093 0.000 -0.139) 2.098 5.038 ( 2.093 0.000 0.139) 2.098 5.108 ( -2.816 0.000 -4.549) 5.350 5.108 ( -2.816 0.000 4.549) 5.350 5.181 ( -4.632 0.000 -2.016) 5.051 5.181 ( -4.632 0.000 2.016) 5.051 5.235 ( -3.441 0.000 -4.791) 5.899 5.235 ( -3.441 0.000 4.791) 5.899 5.322 ( -11.672 0.000 -7.729) 13.999 5.322 ( -11.672 0.000 7.729) 13.999 5.728 ( 5.554 0.000 -2.101) 5.939 5.728 ( 5.554 0.000 2.101) 5.939 5.807 ( 2.810 0.000 -1.148) 3.035 5.807 ( 2.810 0.000 1.148) 3.035 5.870 ( 1.905 0.000 -2.243) 2.943 5.870 ( 1.905 0.000 2.243) 2.943 5.962 ( -2.541 0.000 -0.623) 2.616 5.962 ( -2.541 0.000 0.623) 2.616 6.357 ( 2.089 0.000 -0.261) 2.105 6.357 ( 2.089 0.000 0.261) 2.105 6.444 ( -1.050 0.000 -0.796) 1.317 6.444 ( -1.050 0.000 0.796) 1.317 6.471 ( 9.388 0.000 -2.602) 9.742 6.471 ( 9.388 0.000 2.602) 9.742 6.615 ( 0.547 0.000 -0.283) 0.616 6.615 ( 0.547 0.000 0.283) 0.616 7.753 ( 0.922 0.000 -0.686) 1.149 7.753 ( 0.922 0.000 0.686) 1.149 7.766 ( 1.538 0.000 -1.768) 2.343 7.766 ( 1.538 0.000 1.768) 2.343 7.829 ( -1.710 0.000 -0.531) 1.791 7.829 ( -1.710 0.000 0.531) 1.791 7.848 ( -0.925 0.000 -0.490) 1.047 7.848 ( -0.925 0.000 0.490) 1.047 7.931 ( 0.524 0.000 -0.060) 0.527 7.931 ( 0.524 0.000 0.060) 0.527 7.941 ( 0.510 0.000 -0.248) 0.567 7.941 ( 0.510 0.000 0.248) 0.567 8.034 ( 3.207 0.000 -2.507) 4.071 8.034 ( 3.207 0.000 2.507) 4.071 8.130 ( 2.022 0.000 -0.361) 2.054 8.130 ( 2.022 0.000 0.361) 2.054 8.219 ( 0.568 0.000 -2.434) 2.500 8.219 ( 0.568 0.000 2.434) 2.500 8.263 ( -1.460 0.000 -0.075) 1.462 8.263 ( -1.460 0.000 0.075) 1.462 8.313 ( 0.875 0.000 -1.879) 2.072 8.313 ( 0.875 0.000 1.879) 2.072 8.347 ( 1.622 0.000 -3.600) 3.949 8.347 ( 1.622 0.000 3.600) 3.949 8.426 ( -2.276 0.000 -2.372) 3.287 8.426 ( -2.276 0.000 2.372) 3.287 8.525 ( -0.007 0.000 -1.662) 1.662 8.525 ( -0.007 0.000 1.662) 1.662 8.579 ( -2.852 0.000 -1.585) 3.263 8.579 ( -2.852 0.000 1.585) 3.263 8.658 ( -2.868 0.000 -2.061) 3.531 8.658 ( -2.868 0.000 2.061) 3.531 8.930 ( 0.852 0.000 -0.435) 0.956 8.930 ( 0.852 0.000 0.435) 0.956 9.016 ( -0.899 0.000 -2.741) 2.885 9.016 ( -0.899 0.000 2.741) 2.885 9.197 ( 1.286 0.000 -1.534) 2.001 9.197 ( 1.286 0.000 1.534) 2.001 9.317 ( 1.423 0.000 -1.305) 1.931 9.317 ( 1.423 0.000 1.305) 1.931 9.349 ( -0.610 0.000 -3.853) 3.901 9.349 ( -0.610 0.000 3.853) 3.901 9.441 ( -2.112 0.000 -0.745) 2.240 9.441 ( -2.112 0.000 0.745) 2.240 9.535 ( 2.592 0.000 -0.380) 2.619 9.535 ( 2.592 0.000 0.380) 2.619 9.596 ( 1.215 0.000 -1.152) 1.674 9.596 ( 1.215 0.000 1.152) 1.674 9.632 ( 0.191 0.000 -0.237) 0.305 9.632 ( 0.191 0.000 0.237) 0.305 9.756 ( 3.162 0.000 -2.116) 3.805 9.756 ( 3.162 0.000 2.116) 3.805 9.805 ( -3.265 0.000 -0.439) 3.294 9.805 ( -3.265 0.000 0.439) 3.294 9.861 ( -2.022 0.000 -0.461) 2.074 9.861 ( -2.022 0.000 0.461) 2.074 9.968 ( 1.206 0.000 -0.820) 1.458 9.968 ( 1.206 0.000 0.820) 1.458 10.019 ( -0.777 0.000 -0.095) 0.782 10.019 ( -0.777 0.000 0.095) 0.782 10.110 ( 3.502 0.000 -0.238) 3.510 10.110 ( 3.502 0.000 0.238) 3.510 10.263 ( -2.223 0.000 -0.832) 2.373 10.263 ( -2.223 0.000 0.832) 2.373======================= Grid point 54 (21/27) =======================q-point: (-0.50 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 15Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.054 ( -6.043 0.000 -3.987) 7.240 1.054 ( 6.043 0.000 -3.987) 7.240 1.054 ( -6.043 0.000 3.987) 7.240 1.054 ( 6.043 0.000 3.987) 7.240 1.133 ( -6.202 0.000 -2.974) 6.878 1.133 ( 6.202 0.000 -2.974) 6.878 1.133 ( -6.202 0.000 2.974) 6.878 1.133 ( 6.202 0.000 2.974) 6.878 1.389 ( -0.675 0.000 -1.662) 1.794 1.389 ( 0.675 0.000 -1.662) 1.794 1.389 ( -0.675 0.000 1.662) 1.794 1.389 ( 0.675 0.000 1.662) 1.794 1.491 ( -2.558 0.000 -0.895) 2.710 1.491 ( 2.558 0.000 -0.895) 2.710 1.491 ( -2.558 0.000 0.895) 2.710 1.491 ( 2.558 0.000 0.895) 2.710 1.618 ( -3.675 0.000 -4.497) 5.808 1.618 ( 3.675 0.000 -4.497) 5.808 1.618 ( -3.675 0.000 4.497) 5.808 1.618 ( 3.675 0.000 4.497) 5.808 1.695 ( -5.618 0.000 -2.316) 6.076 1.695 ( 5.618 0.000 -2.316) 6.076 1.695 ( -5.618 0.000 2.316) 6.076 1.695 ( 5.618 0.000 2.316) 6.076 1.824 ( -0.656 0.000 -0.050) 0.658 1.824 ( -0.656 0.000 0.050) 0.658 1.824 ( 0.656 0.000 -0.050) 0.658 1.824 ( 0.656 0.000 0.050) 0.658 1.868 ( -2.206 0.000 -1.036) 2.437 1.868 ( 2.206 0.000 -1.036) 2.437 1.868 ( -2.206 0.000 1.036) 2.437 1.868 ( 2.206 0.000 1.036) 2.437 1.982 ( -1.360 0.000 -2.626) 2.957 1.982 ( 1.360 0.000 -2.626) 2.957 1.982 ( -1.360 0.000 2.626) 2.957 1.982 ( 1.360 0.000 2.626) 2.957 2.025 ( -0.994 0.000 -3.477) 3.617 2.025 ( 0.994 0.000 -3.477) 3.617 2.025 ( -0.994 0.000 3.477) 3.617 2.025 ( 0.994 0.000 3.477) 3.617 2.095 ( -2.424 0.000 -0.923) 2.594 2.095 ( 2.424 0.000 -0.923) 2.594 2.095 ( -2.424 0.000 0.923) 2.594 2.095 ( 2.424 0.000 0.923) 2.594 2.126 ( -2.147 0.000 -0.932) 2.340 2.126 ( 2.147 0.000 -0.932) 2.340 2.126 ( -2.147 0.000 0.932) 2.340 2.126 ( 2.147 0.000 0.932) 2.340 2.184 ( -7.791 0.000 -5.001) 9.258 2.184 ( 7.791 0.000 -5.001) 9.258 2.184 ( -7.791 0.000 5.001) 9.258 2.184 ( 7.791 0.000 5.001) 9.258 2.316 ( -2.321 0.000 -4.114) 4.724 2.316 ( 2.321 0.000 -4.114) 4.724 2.316 ( -2.321 0.000 4.114) 4.724 2.316 ( 2.321 0.000 4.114) 4.724 2.380 ( -2.032 0.000 -1.296) 2.411 2.380 ( 2.032 0.000 -1.296) 2.411 2.380 ( -2.032 0.000 1.296) 2.411 2.380 ( 2.032 0.000 1.296) 2.411 2.515 ( -4.851 0.000 -3.243) 5.835 2.515 ( 4.851 0.000 -3.243) 5.835 2.515 ( -4.851 0.000 3.243) 5.835 2.515 ( 4.851 0.000 3.243) 5.835 2.730 ( -1.761 0.000 -0.813) 1.939 2.730 ( 1.761 0.000 -0.813) 1.939 2.730 ( -1.761 0.000 0.813) 1.939 2.730 ( 1.761 0.000 0.813) 1.939 2.755 ( -3.546 0.000 -1.720) 3.941 2.755 ( 3.546 0.000 -1.720) 3.941 2.755 ( -3.546 0.000 1.720) 3.941 2.755 ( 3.546 0.000 1.720) 3.941 2.901 ( -1.583 0.000 -5.359) 5.588 2.901 ( 1.583 0.000 -5.359) 5.588 2.901 ( -1.583 0.000 5.359) 5.588 2.901 ( 1.583 0.000 5.359) 5.588 3.078 ( -4.601 0.000 -5.377) 7.077 3.078 ( 4.601 0.000 -5.377) 7.077 3.078 ( -4.601 0.000 5.377) 7.077 3.078 ( 4.601 0.000 5.377) 7.077 3.145 ( -5.749 0.000 -1.062) 5.846 3.145 ( -5.749 0.000 1.062) 5.846 3.145 ( 5.749 0.000 -1.062) 5.846 3.145 ( 5.749 0.000 1.062) 5.846 3.254 ( -7.834 0.000 -0.735) 7.868 3.254 ( -7.834 0.000 0.735) 7.868 3.254 ( 7.834 0.000 -0.735) 7.868 3.254 ( 7.834 0.000 0.735) 7.868 3.453 ( -0.800 0.000 -2.857) 2.967 3.453 ( 0.800 0.000 -2.857) 2.967 3.453 ( -0.800 0.000 2.857) 2.967 3.453 ( 0.800 0.000 2.857) 2.967 3.632 ( -3.400 0.000 -1.572) 3.746 3.632 ( 3.400 0.000 -1.572) 3.746 3.632 ( -3.400 0.000 1.572) 3.746 3.632 ( 3.400 0.000 1.572) 3.746 3.750 ( -2.033 0.000 -1.558) 2.562 3.750 ( 2.033 0.000 -1.558) 2.562 3.750 ( -2.033 0.000 1.558) 2.562 3.750 ( 2.033 0.000 1.558) 2.562 3.966 ( -0.913 0.000 -0.293) 0.959 3.966 ( -0.913 0.000 0.293) 0.959 3.966 ( 0.913 0.000 -0.293) 0.959 3.966 ( 0.913 0.000 0.293) 0.959 4.030 ( -2.335 0.000 -3.459) 4.174 4.030 ( 2.335 0.000 -3.459) 4.174 4.030 ( -2.335 0.000 3.459) 4.174 4.030 ( 2.335 0.000 3.459) 4.174 4.294 ( -1.353 0.000 -0.315) 1.390 4.294 ( -1.353 0.000 0.315) 1.390 4.294 ( 1.353 0.000 -0.315) 1.390 4.294 ( 1.353 0.000 0.315) 1.390 4.581 ( -1.724 0.000 -1.854) 2.532 4.581 ( 1.724 0.000 -1.854) 2.532 4.581 ( -1.724 0.000 1.854) 2.532 4.581 ( 1.724 0.000 1.854) 2.532 4.765 ( -3.030 0.000 -3.201) 4.407 4.765 ( 3.030 0.000 -3.201) 4.407 4.765 ( -3.030 0.000 3.201) 4.407 4.765 ( 3.030 0.000 3.201) 4.407 4.863 ( -3.760 0.000 -1.289) 3.975 4.863 ( 3.760 0.000 -1.289) 3.975 4.863 ( -3.760 0.000 1.289) 3.975 4.863 ( 3.760 0.000 1.289) 3.975 5.047 ( -5.377 0.000 -2.098) 5.772 5.047 ( 5.377 0.000 -2.098) 5.772 5.047 ( -5.377 0.000 2.098) 5.772 5.047 ( 5.377 0.000 2.098) 5.772 5.102 ( -1.655 0.000 -2.887) 3.327 5.102 ( 1.655 0.000 -2.887) 3.327 5.102 ( -1.655 0.000 2.887) 3.327 5.102 ( 1.655 0.000 2.887) 3.327 5.182 ( -1.488 0.000 -3.158) 3.491 5.182 ( 1.488 0.000 -3.158) 3.491 5.182 ( -1.488 0.000 3.158) 3.491 5.182 ( 1.488 0.000 3.158) 3.491 5.817 ( -2.081 0.000 -2.055) 2.924 5.817 ( 2.081 0.000 -2.055) 2.924 5.817 ( -2.081 0.000 2.055) 2.924 5.817 ( 2.081 0.000 2.055) 2.924 5.912 ( -2.028 0.000 -0.916) 2.226 5.912 ( 2.028 0.000 -0.916) 2.226 5.912 ( -2.028 0.000 0.916) 2.226 5.912 ( 2.028 0.000 0.916) 2.226 6.407 ( -2.280 0.000 -0.151) 2.285 6.407 ( -2.280 0.000 0.151) 2.285 6.407 ( 2.280 0.000 -0.151) 2.285 6.407 ( 2.280 0.000 0.151) 2.285 6.599 ( -2.798 0.000 -1.167) 3.031 6.599 ( 2.798 0.000 -1.167) 3.031 6.599 ( -2.798 0.000 1.167) 3.031 6.599 ( 2.798 0.000 1.167) 3.031 7.773 ( -0.843 0.000 -0.231) 0.874 7.773 ( -0.843 0.000 0.231) 0.874 7.773 ( 0.843 0.000 -0.231) 0.874 7.773 ( 0.843 0.000 0.231) 0.874 7.824 ( -1.133 0.000 -0.991) 1.506 7.824 ( 1.133 0.000 -0.991) 1.506 7.824 ( -1.133 0.000 0.991) 1.506 7.824 ( 1.133 0.000 0.991) 1.506 7.941 ( -0.375 0.000 -0.009) 0.375 7.941 ( -0.375 0.000 0.009) 0.375 7.941 ( 0.375 0.000 -0.009) 0.375 7.941 ( 0.375 0.000 0.009) 0.375 8.116 ( -3.495 0.000 -0.681) 3.560 8.116 ( -3.495 0.000 0.681) 3.560 8.116 ( 3.495 0.000 -0.681) 3.560 8.116 ( 3.495 0.000 0.681) 3.560 8.233 ( -1.115 0.000 -1.602) 1.951 8.233 ( 1.115 0.000 -1.602) 1.951 8.233 ( -1.115 0.000 1.602) 1.951 8.233 ( 1.115 0.000 1.602) 1.951 8.352 ( -1.948 0.000 -5.187) 5.541 8.352 ( 1.948 0.000 -5.187) 5.541 8.352 ( -1.948 0.000 5.187) 5.541 8.352 ( 1.948 0.000 5.187) 5.541 8.440 ( -4.303 0.000 -3.047) 5.272 8.440 ( 4.303 0.000 -3.047) 5.272 8.440 ( -4.303 0.000 3.047) 5.272 8.440 ( 4.303 0.000 3.047) 5.272 8.600 ( -2.524 0.000 -2.161) 3.322 8.600 ( 2.524 0.000 -2.161) 3.322 8.600 ( -2.524 0.000 2.161) 3.322 8.600 ( 2.524 0.000 2.161) 3.322 8.971 ( -2.572 0.000 -1.159) 2.821 8.971 ( 2.572 0.000 -1.159) 2.821 8.971 ( -2.572 0.000 1.159) 2.821 8.971 ( 2.572 0.000 1.159) 2.821 9.260 ( -3.803 0.000 -2.410) 4.503 9.260 ( 3.803 0.000 -2.410) 4.503 9.260 ( -3.803 0.000 2.410) 4.503 9.260 ( 3.803 0.000 2.410) 4.503 9.391 ( -2.347 0.000 -0.761) 2.467 9.391 ( -2.347 0.000 0.761) 2.467 9.391 ( 2.347 0.000 -0.761) 2.467 9.391 ( 2.347 0.000 0.761) 2.467 9.580 ( -1.559 0.000 -0.096) 1.562 9.580 ( -1.559 0.000 0.096) 1.562 9.580 ( 1.559 0.000 -0.096) 1.562 9.580 ( 1.559 0.000 0.096) 1.562 9.709 ( -4.956 0.000 -0.465) 4.977 9.709 ( -4.956 0.000 0.465) 4.977 9.709 ( 4.956 0.000 -0.465) 4.977 9.709 ( 4.956 0.000 0.465) 4.977 9.816 ( -2.245 0.000 -0.877) 2.410 9.816 ( 2.245 0.000 -0.877) 2.410 9.816 ( -2.245 0.000 0.877) 2.410 9.816 ( 2.245 0.000 0.877) 2.410 9.996 ( -1.283 0.000 -0.344) 1.328 9.996 ( -1.283 0.000 0.344) 1.328 9.996 ( 1.283 0.000 -0.344) 1.328 9.996 ( 1.283 0.000 0.344) 1.328 10.195 ( -3.982 0.000 -0.586) 4.025 10.195 ( -3.982 0.000 0.586) 4.025 10.195 ( 3.982 0.000 -0.586) 4.025 10.195 ( 3.982 0.000 0.586) 4.025======================= Grid point 60 (22/27) =======================q-point: ( 0.00 0.25 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 18Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.835 ( 0.000 8.355 -14.085) 16.377 0.835 ( 0.000 8.355 14.085) 16.377 0.872 ( 0.000 6.863 -16.879) 18.221 0.872 ( 0.000 6.863 16.879) 18.221 1.227 ( 0.000 -6.903 -8.971) 11.319 1.227 ( 0.000 -6.903 8.971) 11.319 1.340 ( 0.000 -5.493 -1.608) 5.723 1.340 ( 0.000 -5.493 1.608) 5.723 1.358 ( 0.000 -2.650 -8.336) 8.747 1.358 ( 0.000 -2.650 8.336) 8.747 1.404 ( 0.000 -0.033 -5.747) 5.747 1.404 ( 0.000 -0.033 5.747) 5.747 1.471 ( 0.000 -0.594 -3.398) 3.449 1.471 ( 0.000 -0.594 3.398) 3.449 1.491 ( 0.000 0.144 -8.492) 8.493 1.491 ( 0.000 0.144 8.492) 8.493 1.530 ( 0.000 0.673 -3.091) 3.163 1.530 ( 0.000 0.673 3.091) 3.163 1.552 ( 0.000 1.178 -3.757) 3.937 1.552 ( 0.000 1.178 3.757) 3.937 1.630 ( 0.000 4.941 -7.120) 8.667 1.630 ( 0.000 4.941 7.120) 8.667 1.686 ( 0.000 -2.393 -7.135) 7.526 1.686 ( 0.000 -2.393 7.135) 7.526 1.691 ( 0.000 -4.573 -4.201) 6.210 1.691 ( 0.000 -4.573 4.201) 6.210 1.747 ( 0.000 2.144 -1.624) 2.690 1.747 ( 0.000 2.144 1.624) 2.690 1.859 ( 0.000 -0.237 -2.692) 2.703 1.859 ( 0.000 -0.237 2.692) 2.703 1.880 ( 0.000 2.788 -0.936) 2.941 1.880 ( 0.000 2.788 0.936) 2.941 1.930 ( 0.000 -0.101 -2.756) 2.758 1.930 ( 0.000 -0.101 2.756) 2.758 1.935 ( 0.000 -2.426 -1.316) 2.760 1.935 ( 0.000 -2.426 1.316) 2.760 2.002 ( 0.000 -1.283 -4.768) 4.937 2.002 ( 0.000 -1.283 4.768) 4.937 2.033 ( 0.000 -1.634 -2.558) 3.035 2.033 ( 0.000 -1.634 2.558) 3.035 2.083 ( 0.000 -0.007 -2.573) 2.573 2.083 ( 0.000 -0.007 2.573) 2.573 2.086 ( 0.000 -0.535 -4.002) 4.038 2.086 ( 0.000 -0.535 4.002) 4.038 2.157 ( 0.000 1.058 -1.983) 2.247 2.157 ( 0.000 1.058 1.983) 2.247 2.168 ( 0.000 2.463 -0.867) 2.611 2.168 ( 0.000 2.463 0.867) 2.611 2.212 ( 0.000 -2.156 -1.329) 2.533 2.212 ( 0.000 -2.156 1.329) 2.533 2.232 ( 0.000 -2.100 -5.209) 5.617 2.232 ( 0.000 -2.100 5.209) 5.617 2.288 ( 0.000 -1.130 -2.768) 2.990 2.288 ( 0.000 -1.130 2.768) 2.990 2.296 ( 0.000 1.449 -4.622) 4.844 2.296 ( 0.000 1.449 4.622) 4.844 2.368 ( 0.000 0.372 -1.946) 1.981 2.368 ( 0.000 0.372 1.946) 1.981 2.405 ( 0.000 -4.401 -2.024) 4.844 2.405 ( 0.000 -4.401 2.024) 4.844 2.464 ( 0.000 1.140 -7.283) 7.372 2.464 ( 0.000 1.140 7.283) 7.372 2.541 ( 0.000 1.264 -4.014) 4.208 2.541 ( 0.000 1.264 4.014) 4.208 2.561 ( 0.000 -2.923 -3.398) 4.482 2.561 ( 0.000 -2.923 3.398) 4.482 2.668 ( 0.000 -1.514 -3.202) 3.542 2.668 ( 0.000 -1.514 3.202) 3.542 2.794 ( 0.000 -1.244 -2.910) 3.165 2.794 ( 0.000 -1.244 2.910) 3.165 2.881 ( 0.000 -0.310 -1.920) 1.945 2.881 ( 0.000 -0.310 1.920) 1.945 2.932 ( 0.000 0.755 -3.390) 3.473 2.932 ( 0.000 0.755 3.390) 3.473 2.941 ( 0.000 4.851 -3.223) 5.824 2.941 ( 0.000 4.851 3.223) 5.824 2.974 ( 0.000 3.503 -2.128) 4.099 2.974 ( 0.000 3.503 2.128) 4.099 3.053 ( 0.000 1.883 -0.839) 2.061 3.053 ( 0.000 1.883 0.839) 2.061 3.089 ( 0.000 1.114 -4.029) 4.180 3.089 ( 0.000 1.114 4.029) 4.180 3.247 ( 0.000 -5.085 -2.244) 5.558 3.247 ( 0.000 -5.085 2.244) 5.558 3.392 ( 0.000 -0.143 -2.621) 2.625 3.392 ( 0.000 -0.143 2.621) 2.625 3.398 ( 0.000 3.222 -4.834) 5.809 3.398 ( 0.000 3.222 4.834) 5.809 3.482 ( 0.000 -0.303 -4.472) 4.483 3.482 ( 0.000 -0.303 4.472) 4.483 3.494 ( 0.000 1.317 -5.760) 5.909 3.494 ( 0.000 1.317 5.760) 5.909 3.620 ( 0.000 0.218 -2.824) 2.832 3.620 ( 0.000 0.218 2.824) 2.832 3.626 ( 0.000 2.642 -2.232) 3.459 3.626 ( 0.000 2.642 2.232) 3.459 3.714 ( 0.000 -0.641 -1.045) 1.226 3.714 ( 0.000 -0.641 1.045) 1.226 3.768 ( 0.000 -1.457 -2.328) 2.747 3.768 ( 0.000 -1.457 2.328) 2.747 3.967 ( 0.000 0.879 -2.020) 2.204 3.967 ( 0.000 0.879 2.020) 2.204 3.987 ( 0.000 0.944 -2.529) 2.699 3.987 ( 0.000 0.944 2.529) 2.699 4.034 ( 0.000 -0.581 -1.694) 1.791 4.034 ( 0.000 -0.581 1.694) 1.791 4.084 ( 0.000 -1.999 -0.670) 2.108 4.084 ( 0.000 -1.999 0.670) 2.108 4.311 ( 0.000 0.078 -1.246) 1.248 4.311 ( 0.000 0.078 1.246) 1.248 4.323 ( 0.000 -0.835 -3.148) 3.257 4.323 ( 0.000 -0.835 3.148) 3.257 4.565 ( 0.000 1.289 -2.091) 2.457 4.565 ( 0.000 1.289 2.091) 2.457 4.588 ( 0.000 0.097 -2.021) 2.023 4.588 ( 0.000 0.097 2.021) 2.023 4.739 ( 0.000 -0.246 -1.862) 1.878 4.739 ( 0.000 -0.246 1.862) 1.878 4.757 ( 0.000 -0.889 -1.308) 1.582 4.757 ( 0.000 -0.889 1.308) 1.582 4.898 ( 0.000 0.879 -1.125) 1.427 4.898 ( 0.000 0.879 1.125) 1.427 4.902 ( 0.000 0.568 -0.999) 1.149 4.902 ( 0.000 0.568 0.999) 1.149 4.980 ( 0.000 -0.099 -1.410) 1.413 4.980 ( 0.000 -0.099 1.410) 1.413 5.006 ( 0.000 -1.017 -0.447) 1.110 5.006 ( 0.000 -1.017 0.447) 1.110 5.197 ( 0.000 0.231 -1.659) 1.675 5.197 ( 0.000 0.231 1.659) 1.675 5.224 ( 0.000 -0.891 -5.025) 5.103 5.224 ( 0.000 -0.891 5.025) 5.103 5.296 ( 0.000 3.304 -0.770) 3.392 5.296 ( 0.000 3.304 0.770) 3.392 5.501 ( 0.000 -5.399 -4.777) 7.209 5.501 ( 0.000 -5.399 4.777) 7.209 5.673 ( 0.000 0.774 -2.982) 3.081 5.673 ( 0.000 0.774 2.982) 3.081 5.702 ( 0.000 -0.367 -1.172) 1.228 5.702 ( 0.000 -0.367 1.172) 1.228 5.858 ( 0.000 1.133 -2.792) 3.013 5.858 ( 0.000 1.133 2.792) 3.013 5.953 ( 0.000 -3.786 -0.593) 3.833 5.953 ( 0.000 -3.786 0.593) 3.833 6.306 ( 0.000 0.273 -0.058) 0.279 6.306 ( 0.000 0.273 0.058) 0.279 6.327 ( 0.000 -0.619 -0.042) 0.620 6.327 ( 0.000 -0.619 0.042) 0.620 6.479 ( 0.000 2.317 -1.233) 2.625 6.479 ( 0.000 2.317 1.233) 2.625 6.583 ( 0.000 -2.128 -0.164) 2.134 6.583 ( 0.000 -2.128 0.164) 2.134 7.745 ( 0.000 0.322 -1.320) 1.358 7.745 ( 0.000 0.322 1.320) 1.358 7.748 ( 0.000 0.372 -1.604) 1.646 7.748 ( 0.000 0.372 1.604) 1.646 7.853 ( 0.000 -0.509 -1.517) 1.600 7.853 ( 0.000 -0.509 1.517) 1.600 7.855 ( 0.000 -0.336 -0.924) 0.983 7.855 ( 0.000 -0.336 0.924) 0.983 7.930 ( 0.000 0.492 -2.796) 2.839 7.930 ( 0.000 0.492 2.796) 2.839 7.933 ( 0.000 0.341 -2.755) 2.776 7.933 ( 0.000 0.341 2.755) 2.776 8.004 ( 0.000 0.652 -4.666) 4.712 8.004 ( 0.000 0.652 4.666) 4.712 8.070 ( 0.000 -2.221 -2.253) 3.164 8.070 ( 0.000 -2.221 2.253) 3.164 8.219 ( 0.000 0.831 -2.849) 2.967 8.219 ( 0.000 0.831 2.849) 2.967 8.267 ( 0.000 -1.201 -1.072) 1.610 8.267 ( 0.000 -1.201 1.072) 1.610 8.305 ( 0.000 -0.007 -7.008) 7.008 8.305 ( 0.000 -0.007 7.008) 7.008 8.323 ( 0.000 -0.519 -6.590) 6.611 8.323 ( 0.000 -0.519 6.590) 6.611 8.488 ( 0.000 0.887 -2.060) 2.243 8.488 ( 0.000 0.887 2.060) 2.243 8.501 ( 0.000 1.109 -6.261) 6.358 8.501 ( 0.000 1.109 6.261) 6.358 8.615 ( 0.000 -0.843 -3.347) 3.451 8.615 ( 0.000 -0.843 3.347) 3.451 8.676 ( 0.000 -2.590 -2.021) 3.285 8.676 ( 0.000 -2.590 2.021) 3.285 8.936 ( 0.000 -0.027 -0.718) 0.718 8.936 ( 0.000 -0.027 0.718) 0.718 8.952 ( 0.000 -2.738 -5.132) 5.816 8.952 ( 0.000 -2.738 5.132) 5.816 9.222 ( 0.000 -0.465 -0.746) 0.879 9.222 ( 0.000 -0.465 0.746) 0.879 9.227 ( 0.000 -0.859 -2.034) 2.208 9.227 ( 0.000 -0.859 2.034) 2.208 9.405 ( 0.000 2.797 -0.241) 2.808 9.405 ( 0.000 2.797 0.241) 2.808 9.452 ( 0.000 0.455 -0.633) 0.780 9.452 ( 0.000 0.455 0.633) 0.780 9.555 ( 0.000 -0.806 -0.439) 0.918 9.555 ( 0.000 -0.806 0.439) 0.918 9.571 ( 0.000 2.653 -2.511) 3.653 9.571 ( 0.000 2.653 2.511) 3.653 9.687 ( 0.000 -0.624 -1.474) 1.601 9.687 ( 0.000 -0.624 1.474) 1.601 9.705 ( 0.000 2.660 -1.341) 2.979 9.705 ( 0.000 2.660 1.341) 2.979 9.797 ( 0.000 -1.842 -2.198) 2.868 9.797 ( 0.000 -1.842 2.198) 2.868 9.821 ( 0.000 -4.569 -0.374) 4.584 9.821 ( 0.000 -4.569 0.374) 4.584 10.000 ( 0.000 2.769 -1.366) 3.088 10.000 ( 0.000 2.769 1.366) 3.088 10.058 ( 0.000 -0.636 -0.897) 1.100 10.058 ( 0.000 -0.636 0.897) 1.100 10.119 ( 0.000 6.159 -3.436) 7.053 10.119 ( 0.000 6.159 3.436) 7.053 10.268 ( 0.000 -1.827 -2.967) 3.484 10.268 ( 0.000 -1.827 2.967) 3.484======================= Grid point 62 (23/27) =======================q-point: ( 0.25 0.25 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 24Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.881 ( 5.721 4.229 -14.149) 15.837 0.881 ( 5.721 4.229 14.149) 15.837 0.988 ( 7.952 7.127 -13.768) 17.424 0.988 ( 7.952 7.127 13.768) 17.424 1.196 ( -1.684 -6.121 -3.885) 7.442 1.196 ( -1.684 -6.121 3.885) 7.442 1.296 ( -5.855 -1.705 -2.833) 6.724 1.296 ( -5.855 -1.705 2.833) 6.724 1.334 ( -4.527 -2.455 -1.209) 5.290 1.334 ( -4.527 -2.455 1.209) 5.290 1.380 ( -3.528 -3.690 -5.004) 7.148 1.380 ( -3.528 -3.690 5.004) 7.148 1.428 ( 2.193 -4.418 -0.289) 4.941 1.428 ( 2.193 -4.418 0.289) 4.941 1.509 ( 1.079 -3.169 -2.857) 4.401 1.509 ( 1.079 -3.169 2.857) 4.401 1.519 ( 1.682 2.429 -4.567) 5.440 1.519 ( 1.682 2.429 4.567) 5.440 1.586 ( -0.412 0.251 -4.297) 4.324 1.586 ( -0.412 0.251 4.297) 4.324 1.678 ( 3.290 3.273 -4.260) 6.300 1.678 ( 3.290 3.273 4.260) 6.300 1.739 ( 5.591 1.302 -3.682) 6.819 1.739 ( 5.591 1.302 3.682) 6.819 1.759 ( 3.282 -1.445 -0.956) 3.711 1.759 ( 3.282 -1.445 0.956) 3.711 1.814 ( 3.455 0.297 -1.727) 3.874 1.814 ( 3.455 0.297 1.727) 3.874 1.847 ( 0.439 3.378 -3.447) 4.847 1.847 ( 0.439 3.378 3.447) 4.847 1.888 ( 0.625 -1.541 -1.746) 2.411 1.888 ( 0.625 -1.541 1.746) 2.411 1.917 ( 1.021 0.564 -1.207) 1.679 1.917 ( 1.021 0.564 1.207) 1.679 1.954 ( 0.709 -1.193 -2.007) 2.440 1.954 ( 0.709 -1.193 2.007) 2.440 1.981 ( 0.070 -1.398 -3.189) 3.483 1.981 ( 0.070 -1.398 3.189) 3.483 2.045 ( -0.380 0.171 -2.184) 2.223 2.045 ( -0.380 0.171 2.184) 2.223 2.057 ( -1.456 0.024 -3.119) 3.442 2.057 ( -1.456 0.024 3.119) 3.442 2.107 ( -0.000 1.193 -0.945) 1.522 2.107 ( -0.000 1.193 0.945) 1.522 2.121 ( 0.022 0.538 -0.549) 0.769 2.121 ( 0.022 0.538 0.549) 0.769 2.174 ( -0.079 2.480 -1.947) 3.155 2.174 ( -0.079 2.480 1.947) 3.155 2.222 ( -0.678 0.652 -3.603) 3.724 2.222 ( -0.678 0.652 3.603) 3.724 2.254 ( -0.038 -2.488 -5.071) 5.649 2.254 ( -0.038 -2.488 5.071) 5.649 2.313 ( 1.238 -1.576 -1.495) 2.500 2.313 ( 1.238 -1.576 1.495) 2.500 2.330 ( 1.769 -0.192 -2.188) 2.820 2.330 ( 1.769 -0.192 2.188) 2.820 2.355 ( -0.200 -0.630 -2.145) 2.245 2.355 ( -0.200 -0.630 2.145) 2.245 2.390 ( 3.592 -1.320 -2.184) 4.407 2.390 ( 3.592 -1.320 2.184) 4.407 2.464 ( -2.665 1.421 -4.461) 5.387 2.464 ( -2.665 1.421 4.461) 5.387 2.561 ( 1.841 -0.663 -4.459) 4.870 2.561 ( 1.841 -0.663 4.459) 4.870 2.606 ( 2.906 -1.981 -3.511) 4.969 2.606 ( 2.906 -1.981 3.511) 4.969 2.685 ( 0.574 -2.524 -2.322) 3.478 2.685 ( 0.574 -2.524 2.322) 3.478 2.763 ( -5.230 4.044 -4.886) 8.221 2.763 ( -5.230 4.044 4.886) 8.221 2.826 ( 1.681 -1.559 -1.872) 2.960 2.826 ( 1.681 -1.559 1.872) 2.960 2.885 ( -3.429 0.043 -1.300) 3.667 2.885 ( -3.429 0.043 1.300) 3.667 2.925 ( -0.689 -0.022 -0.571) 0.895 2.925 ( -0.689 -0.022 0.571) 0.895 3.031 ( 3.147 2.293 -1.762) 4.274 3.031 ( 3.147 2.293 1.762) 4.274 3.080 ( -0.094 0.384 -2.279) 2.313 3.080 ( -0.094 0.384 2.279) 2.313 3.103 ( 2.766 1.951 -1.116) 3.564 3.103 ( 2.766 1.951 1.116) 3.564 3.198 ( -3.573 -2.829 -2.456) 5.178 3.198 ( -3.573 -2.829 2.456) 5.178 3.292 ( -6.124 0.976 -0.638) 6.234 3.292 ( -6.124 0.976 0.638) 6.234 3.376 ( -5.487 -2.172 -2.201) 6.298 3.376 ( -5.487 -2.172 2.201) 6.298 3.476 ( 0.721 2.574 -4.980) 5.652 3.476 ( 0.721 2.574 4.980) 5.652 3.529 ( 1.579 2.964 -2.093) 3.957 3.529 ( 1.579 2.964 2.093) 3.957 3.569 ( -1.410 0.707 -1.279) 2.031 3.569 ( -1.410 0.707 1.279) 2.031 3.654 ( 0.154 -0.140 -1.539) 1.553 3.654 ( 0.154 -0.140 1.539) 1.553 3.721 ( 0.790 -0.131 -0.256) 0.841 3.721 ( 0.790 -0.131 0.256) 0.841 3.768 ( 0.020 -0.923 -2.279) 2.459 3.768 ( 0.020 -0.923 2.279) 2.459 3.961 ( -0.490 0.164 -0.949) 1.081 3.961 ( -0.490 0.164 0.949) 1.081 3.985 ( -0.491 0.016 -1.191) 1.288 3.985 ( -0.491 0.016 1.191) 1.288 4.016 ( -0.774 0.313 -1.795) 1.980 4.016 ( -0.774 0.313 1.795) 1.980 4.070 ( -1.361 -1.170 -1.508) 2.344 4.070 ( -1.361 -1.170 1.508) 2.344 4.293 ( -0.779 0.418 -1.799) 2.004 4.293 ( -0.779 0.418 1.799) 2.004 4.319 ( -0.890 -0.715 -1.441) 1.838 4.319 ( -0.890 -0.715 1.441) 1.838 4.567 ( 0.336 0.949 -3.344) 3.493 4.567 ( 0.336 0.949 3.344) 3.493 4.600 ( 0.280 -0.432 -1.501) 1.587 4.600 ( 0.280 -0.432 1.501) 1.587 4.729 ( 0.404 0.644 -1.059) 1.304 4.729 ( 0.404 0.644 1.059) 1.304 4.773 ( 1.444 -0.942 -1.324) 2.174 4.773 ( 1.444 -0.942 1.324) 2.174 4.875 ( -2.070 1.917 -1.374) 3.138 4.875 ( -2.070 1.917 1.374) 3.138 4.940 ( 0.095 -0.807 -0.365) 0.891 4.940 ( 0.095 -0.807 0.365) 0.891 4.966 ( 0.136 0.808 -1.635) 1.829 4.966 ( 0.136 0.808 1.635) 1.829 5.018 ( 1.391 -1.726 -1.141) 2.494 5.018 ( 1.391 -1.726 1.141) 2.494 5.119 ( -3.051 0.995 -4.079) 5.191 5.119 ( -3.051 0.995 4.079) 5.191 5.178 ( -4.842 -0.982 -1.668) 5.214 5.178 ( -4.842 -0.982 1.668) 5.214 5.234 ( -4.012 0.754 -3.155) 5.159 5.234 ( -4.012 0.754 3.155) 5.159 5.306 ( -9.631 -1.562 -5.931) 11.418 5.306 ( -9.631 -1.562 5.931) 11.418 5.747 ( 5.527 1.770 -2.103) 6.173 5.747 ( 5.527 1.770 2.103) 6.173 5.807 ( 3.845 -0.329 -0.406) 3.881 5.807 ( 3.845 -0.329 0.406) 3.881 5.874 ( 1.182 0.680 -2.166) 2.559 5.874 ( 1.182 0.680 2.166) 2.559 5.943 ( -1.355 -1.889 -0.398) 2.359 5.943 ( -1.355 -1.889 0.398) 2.359 6.359 ( 2.855 0.369 -0.142) 2.882 6.359 ( 2.855 0.369 0.142) 2.882 6.427 ( 6.460 -2.641 -1.259) 7.092 6.427 ( 6.460 -2.641 1.259) 7.092 6.475 ( 0.632 1.922 -0.855) 2.197 6.475 ( 0.632 1.922 0.855) 2.197 6.588 ( 0.105 -2.603 -0.075) 2.606 6.588 ( 0.105 -2.603 0.075) 2.606 7.759 ( 1.101 0.576 -1.112) 1.668 7.759 ( 1.101 0.576 1.112) 1.668 7.772 ( 1.635 0.382 -1.626) 2.337 7.772 ( 1.635 0.382 1.626) 2.337 7.826 ( -1.641 -0.130 -0.837) 1.847 7.826 ( -1.641 -0.130 0.837) 1.847 7.843 ( -1.015 -0.515 -1.033) 1.537 7.843 ( -1.015 -0.515 1.033) 1.537 7.936 ( 0.490 0.398 -0.204) 0.663 7.936 ( 0.490 0.398 0.204) 0.663 7.943 ( 0.474 0.114 -0.402) 0.632 7.943 ( 0.474 0.114 0.402) 0.632 8.043 ( 3.357 1.002 -2.310) 4.197 8.043 ( 3.357 1.002 2.310) 4.197 8.111 ( 2.625 -1.836 -0.587) 3.256 8.111 ( 2.625 -1.836 0.587) 3.256 8.222 ( 0.377 0.406 -2.394) 2.457 8.222 ( 0.377 0.406 2.394) 2.457 8.257 ( -0.634 -0.766 -1.120) 1.498 8.257 ( -0.634 -0.766 1.120) 1.498 8.310 ( 0.307 0.157 -4.687) 4.700 8.310 ( 0.307 0.157 4.687) 4.700 8.342 ( 1.269 -0.634 -4.064) 4.305 8.342 ( 1.269 -0.634 4.064) 4.305 8.443 ( -2.087 1.688 -1.759) 3.209 8.443 ( -2.087 1.688 1.759) 3.209 8.524 ( -0.233 -0.886 -2.672) 2.825 8.524 ( -0.233 -0.886 2.672) 2.825 8.568 ( -2.823 -0.104 -1.106) 3.034 8.568 ( -2.823 -0.104 1.106) 3.034 8.637 ( -2.634 -2.050 -1.984) 3.883 8.637 ( -2.634 -2.050 1.984) 3.883 8.938 ( 1.500 0.897 -1.208) 2.124 8.938 ( 1.500 0.897 1.208) 2.124 8.999 ( 1.572 -1.617 -2.371) 3.272 8.999 ( 1.572 -1.617 2.371) 3.272 9.178 ( -0.901 -0.550 -0.424) 1.137 9.178 ( -0.901 -0.550 0.424) 1.137 9.251 ( -0.734 -3.688 -1.697) 4.126 9.251 ( -0.734 -3.688 1.697) 4.126 9.411 ( 0.907 3.673 -2.604) 4.593 9.411 ( 0.907 3.673 2.604) 4.593 9.468 ( 0.146 1.551 -1.135) 1.928 9.468 ( 0.146 1.551 1.135) 1.928 9.539 ( 0.217 -0.519 -0.282) 0.630 9.539 ( 0.217 -0.519 0.282) 0.630 9.582 ( 0.155 -0.436 -0.898) 1.010 9.582 ( 0.155 -0.436 0.898) 1.010 9.663 ( 0.058 2.177 -0.485) 2.231 9.663 ( 0.058 2.177 0.485) 2.231 9.744 ( -0.616 -1.426 -1.584) 2.219 9.744 ( -0.616 -1.426 1.584) 2.219 9.777 ( 1.003 -0.340 -0.549) 1.193 9.777 ( 1.003 -0.340 0.549) 1.193 9.836 ( 0.196 -3.006 -0.780) 3.112 9.836 ( 0.196 -3.006 0.780) 3.112 10.003 ( 0.687 3.076 -1.056) 3.324 10.003 ( 0.687 3.076 1.056) 3.324 10.078 ( -0.683 3.268 -1.144) 3.530 10.078 ( -0.683 3.268 1.144) 3.530 10.108 ( 1.462 0.941 -0.985) 1.999 10.108 ( 1.462 0.941 0.985) 1.999 10.244 ( -2.323 -2.050 -1.976) 3.675 10.244 ( -2.323 -2.050 1.976) 3.675======================= Grid point 64 (24/27) =======================q-point: (-0.50 0.25 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 18Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.045 ( -7.811 0.233 -10.016) 12.704 1.045 ( 7.762 0.233 -10.012) 12.671 1.045 ( -7.762 0.233 10.012) 12.671 1.045 ( 7.811 0.233 10.016) 12.704 1.191 ( -6.671 5.110 -8.336) 11.837 1.191 ( 6.382 5.110 -8.311) 11.658 1.191 ( -6.382 5.110 8.311) 11.658 1.191 ( 6.671 5.110 8.336) 11.837 1.282 ( -2.027 -7.463 -2.782) 8.218 1.282 ( 0.332 -7.463 -2.701) 7.943 1.282 ( -0.332 -7.463 2.701) 7.943 1.282 ( 2.027 -7.463 2.782) 8.218 1.490 ( -1.748 -5.616 -5.586) 8.112 1.490 ( 1.228 -5.616 -5.571) 8.005 1.490 ( -1.228 -5.616 5.571) 8.005 1.490 ( 1.748 -5.616 5.586) 8.112 1.574 ( -1.298 0.720 -4.254) 4.505 1.574 ( 0.956 0.720 -4.244) 4.409 1.574 ( -0.956 0.720 4.244) 4.409 1.574 ( 1.298 0.720 4.254) 4.505 1.745 ( -2.656 2.826 -2.778) 4.770 1.745 ( 1.148 2.826 -2.661) 4.048 1.745 ( -1.148 2.826 2.661) 4.048 1.745 ( 2.656 2.826 2.778) 4.770 1.816 ( -1.167 -0.481 -1.083) 1.664 1.816 ( 0.695 -0.481 -1.037) 1.338 1.816 ( -0.695 -0.481 1.037) 1.338 1.816 ( 1.167 -0.481 1.083) 1.664 1.881 ( -2.370 1.282 -0.396) 2.723 1.881 ( -2.168 1.282 0.235) 2.530 1.881 ( 2.168 1.282 -0.235) 2.530 1.881 ( 2.370 1.282 0.396) 2.723 1.968 ( -1.574 -2.108 -2.089) 3.359 1.968 ( 1.383 -2.108 -2.074) 3.265 1.968 ( -1.383 -2.108 2.074) 3.265 1.968 ( 1.574 -2.108 2.089) 3.359 2.021 ( -1.437 0.375 -3.729) 4.014 2.021 ( 1.321 0.375 -3.724) 3.969 2.021 ( -1.321 0.375 3.724) 3.969 2.021 ( 1.437 0.375 3.729) 4.014 2.070 ( -2.792 -0.619 -2.463) 3.775 2.070 ( 1.525 -0.619 -2.337) 2.858 2.070 ( -1.525 -0.619 2.337) 2.858 2.070 ( 2.792 -0.619 2.463) 3.775 2.168 ( -2.713 3.299 -2.205) 4.806 2.168 ( 2.627 3.299 -2.193) 4.753 2.168 ( -2.627 3.299 2.193) 4.753 2.168 ( 2.713 3.299 2.205) 4.806 2.228 ( -3.563 2.003 -3.513) 5.390 2.228 ( 1.678 2.003 -3.353) 4.251 2.228 ( -1.678 2.003 3.353) 4.251 2.228 ( 3.563 2.003 3.513) 5.390 2.311 ( -2.134 -0.356 -4.599) 5.082 2.311 ( 1.816 -0.356 -4.584) 4.943 2.311 ( -1.816 -0.356 4.584) 4.943 2.311 ( 2.134 -0.356 4.599) 5.082 2.388 ( -2.490 1.066 -2.024) 3.381 2.388 ( 2.469 1.066 -2.021) 3.364 2.388 ( -2.469 1.066 2.021) 3.364 2.388 ( 2.490 1.066 2.024) 3.381 2.516 ( -5.281 -0.616 -3.980) 6.641 2.516 ( 5.274 -0.616 -3.979) 6.635 2.516 ( -5.274 -0.616 3.979) 6.635 2.516 ( 5.281 -0.616 3.980) 6.641 2.664 ( -1.776 -3.320 -5.115) 6.351 2.664 ( 1.053 -3.320 -5.092) 6.169 2.664 ( -1.053 -3.320 5.092) 6.169 2.664 ( 1.776 -3.320 5.115) 6.351 2.775 ( -4.169 -0.363 -1.789) 4.551 2.775 ( 3.592 -0.363 -1.644) 3.967 2.775 ( -3.592 -0.363 1.644) 3.967 2.775 ( 4.169 -0.363 1.789) 4.551 2.905 ( -2.090 1.005 -1.609) 2.823 2.905 ( 0.131 1.005 -1.451) 1.770 2.905 ( -0.131 1.005 1.451) 1.770 2.905 ( 2.090 1.005 1.609) 2.823 3.067 ( -0.771 -1.803 -2.393) 3.094 3.067 ( 0.728 -1.803 -2.391) 3.082 3.067 ( -0.728 -1.803 2.391) 3.082 3.067 ( 0.771 -1.803 2.393) 3.094 3.154 ( -4.555 1.546 -0.969) 4.907 3.154 ( -3.548 1.546 0.177) 3.874 3.154 ( 3.548 1.546 -0.177) 3.874 3.154 ( 4.555 1.546 0.969) 4.907 3.241 ( -5.849 -1.238 -0.557) 6.004 3.241 ( -5.642 -1.238 0.214) 5.780 3.241 ( 5.642 -1.238 -0.214) 5.780 3.241 ( 5.849 -1.238 0.557) 6.004 3.497 ( -1.745 3.750 -2.732) 4.957 3.497 ( 1.597 3.750 -2.722) 4.901 3.497 ( -1.597 3.750 2.722) 4.901 3.497 ( 1.745 3.750 2.732) 4.957 3.618 ( -3.030 -1.402 -2.223) 4.011 3.618 ( 2.956 -1.402 -2.212) 3.949 3.618 ( -2.956 -1.402 2.212) 3.949 3.618 ( 3.030 -1.402 2.223) 4.011 3.754 ( -1.608 0.324 -1.124) 1.989 3.754 ( 1.521 0.324 -1.111) 1.911 3.754 ( -1.521 0.324 1.111) 1.911 3.754 ( 1.608 0.324 1.124) 1.989 3.961 ( -0.905 -0.461 -0.672) 1.218 3.961 ( 0.836 -0.461 -0.662) 1.162 3.961 ( -0.836 -0.461 0.662) 1.162 3.961 ( 0.905 -0.461 0.672) 1.218 4.032 ( -1.676 0.171 -2.477) 2.996 4.032 ( 1.485 0.171 -2.464) 2.882 4.032 ( -1.485 0.171 2.464) 2.882 4.032 ( 1.676 0.171 2.477) 2.996 4.295 ( -0.925 0.024 -0.984) 1.351 4.295 ( 0.907 0.024 -0.982) 1.337 4.295 ( -0.907 0.024 0.982) 1.337 4.295 ( 0.925 0.024 0.984) 1.351 4.584 ( -1.205 0.172 -1.239) 1.737 4.584 ( 1.199 0.172 -1.238) 1.732 4.584 ( -1.199 0.172 1.238) 1.732 4.584 ( 1.205 0.172 1.239) 1.737 4.776 ( -2.875 0.975 -2.622) 4.011 4.776 ( 2.873 0.975 -2.621) 4.009 4.776 ( -2.873 0.975 2.621) 4.009 4.776 ( 2.875 0.975 2.622) 4.011 4.862 ( -3.313 -0.105 -1.404) 3.600 4.862 ( 1.329 -0.105 -0.973) 1.650 4.862 ( -1.329 -0.105 0.973) 1.650 4.862 ( 3.313 -0.105 1.404) 3.600 5.026 ( -2.764 -1.609 -1.379) 3.482 5.026 ( 2.170 -1.609 -1.255) 2.979 5.026 ( -2.170 -1.609 1.255) 2.979 5.026 ( 2.764 -1.609 1.379) 3.482 5.108 ( -0.440 0.405 -1.563) 1.673 5.108 ( 0.409 0.405 -1.562) 1.665 5.108 ( -0.409 0.405 1.562) 1.665 5.108 ( 0.440 0.405 1.563) 1.673 5.184 ( -1.374 0.156 -2.100) 2.515 5.184 ( 1.048 0.156 -2.079) 2.334 5.184 ( -1.048 0.156 2.079) 2.334 5.184 ( 1.374 0.156 2.100) 2.515 5.833 ( -1.822 1.490 -1.879) 3.012 5.833 ( 1.679 1.490 -1.864) 2.918 5.833 ( -1.679 1.490 1.864) 2.918 5.833 ( 1.822 1.490 1.879) 3.012 5.904 ( -1.860 -0.870 -1.083) 2.322 5.904 ( 1.853 -0.870 -1.081) 2.316 5.904 ( -1.853 -0.870 1.081) 2.316 5.904 ( 1.860 -0.870 1.083) 2.322 6.423 ( -2.410 1.609 -0.444) 2.932 6.423 ( -2.038 1.609 -0.114) 2.599 6.423 ( 2.038 1.609 0.114) 2.599 6.423 ( 2.410 1.609 0.444) 2.932 6.563 ( -3.072 -3.278 -0.490) 4.519 6.563 ( -3.072 -3.278 0.490) 4.519 6.563 ( 3.072 -3.278 -0.490) 4.519 6.563 ( 3.072 -3.278 0.490) 4.519 7.782 ( -0.925 0.838 -0.569) 1.372 7.782 ( 0.769 0.838 -0.542) 1.260 7.782 ( -0.769 0.838 0.542) 1.260 7.782 ( 0.925 0.838 0.569) 1.372 7.818 ( -1.142 -0.597 -1.182) 1.749 7.818 ( 1.104 -0.597 -1.178) 1.721 7.818 ( -1.104 -0.597 1.178) 1.721 7.818 ( 1.142 -0.597 1.182) 1.749 7.945 ( -0.178 0.301 -0.236) 0.422 7.945 ( 0.009 0.301 -0.229) 0.379 7.945 ( -0.009 0.301 0.229) 0.379 7.945 ( 0.178 0.301 0.236) 0.422 8.117 ( -2.487 0.106 -0.454) 2.531 8.117 ( -2.362 0.106 0.372) 2.394 8.117 ( 2.362 0.106 -0.372) 2.394 8.117 ( 2.487 0.106 0.454) 2.531 8.238 ( -1.184 0.563 -1.768) 2.201 8.238 ( 1.115 0.563 -1.763) 2.161 8.238 ( -1.115 0.563 1.763) 2.161 8.238 ( 1.184 0.563 1.768) 2.201 8.335 ( -1.952 -1.490 -4.216) 4.880 8.335 ( 1.908 -1.490 -4.214) 4.860 8.335 ( -1.908 -1.490 4.214) 4.860 8.335 ( 1.952 -1.490 4.216) 4.880 8.453 ( -3.170 1.086 -2.236) 4.028 8.453 ( 2.493 1.086 -2.139) 3.460 8.453 ( -2.493 1.086 2.139) 3.460 8.453 ( 3.170 1.086 2.236) 4.028 8.583 ( -2.138 -1.429 -1.901) 3.198 8.583 ( 1.629 -1.429 -1.844) 2.845 8.583 ( -1.629 -1.429 1.844) 2.845 8.583 ( 2.138 -1.429 1.901) 3.198 8.985 ( -2.061 1.202 -1.248) 2.693 8.985 ( 0.568 1.202 -1.059) 1.700 8.985 ( -0.568 1.202 1.059) 1.700 8.985 ( 2.061 1.202 1.248) 2.693 9.205 ( -2.573 -3.718 -1.583) 4.791 9.205 ( 1.393 -3.718 -1.409) 4.213 9.205 ( -1.393 -3.718 1.409) 4.213 9.205 ( 2.573 -3.718 1.583) 4.791 9.442 ( -1.635 3.530 -2.044) 4.395 9.442 ( 1.424 3.530 -2.027) 4.313 9.442 ( -1.424 3.530 2.027) 4.313 9.442 ( 1.635 3.530 2.044) 4.395 9.568 ( -0.782 -1.833 -1.471) 2.477 9.568 ( 0.033 -1.833 -1.447) 2.336 9.568 ( -0.033 -1.833 1.447) 2.336 9.568 ( 0.782 -1.833 1.471) 2.477 9.695 ( -2.546 0.514 -0.609) 2.668 9.695 ( -2.538 0.514 0.605) 2.659 9.695 ( 2.538 0.514 -0.605) 2.659 9.695 ( 2.546 0.514 0.609) 2.668 9.819 ( -1.127 -1.110 -0.619) 1.699 9.819 ( -0.912 -1.110 -0.578) 1.548 9.819 ( 0.912 -1.110 0.578) 1.548 9.819 ( 1.127 -1.110 0.619) 1.699 10.035 ( -2.151 3.890 -0.487) 4.472 10.035 ( -2.127 3.890 0.476) 4.460 10.035 ( 2.127 3.890 -0.476) 4.460 10.035 ( 2.151 3.890 0.487) 4.472 10.176 ( -3.699 -1.960 -0.546) 4.221 10.176 ( -3.688 -1.960 0.538) 4.211 10.176 ( 3.688 -1.960 -0.538) 4.211 10.176 ( 3.699 -1.960 0.546) 4.221======================= Grid point 70 (25/27) =======================q-point: ( 0.00 -0.50 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 15Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.012 ( 0.000 -1.096 -8.278) 8.350 1.012 ( 0.000 1.096 -8.278) 8.350 1.012 ( 0.000 -1.096 8.278) 8.350 1.012 ( 0.000 1.096 8.278) 8.350 1.113 ( 0.000 -5.904 -3.196) 6.713 1.113 ( 0.000 -5.904 3.196) 6.713 1.113 ( 0.000 5.904 -3.196) 6.713 1.113 ( 0.000 5.904 3.196) 6.713 1.397 ( 0.000 -1.402 -4.373) 4.593 1.397 ( 0.000 1.402 -4.373) 4.593 1.397 ( 0.000 -1.402 4.373) 4.593 1.397 ( 0.000 1.402 4.373) 4.593 1.464 ( 0.000 -0.861 -2.365) 2.516 1.464 ( 0.000 0.861 -2.365) 2.516 1.464 ( 0.000 -0.861 2.365) 2.516 1.464 ( 0.000 0.861 2.365) 2.516 1.581 ( 0.000 -1.034 -4.041) 4.171 1.581 ( 0.000 1.034 -4.041) 4.171 1.581 ( 0.000 -1.034 4.041) 4.171 1.581 ( 0.000 1.034 4.041) 4.171 1.619 ( 0.000 -0.039 -0.942) 0.943 1.619 ( 0.000 0.039 -0.942) 0.943 1.619 ( 0.000 -0.039 0.942) 0.943 1.619 ( 0.000 0.039 0.942) 0.943 1.760 ( 0.000 -3.434 -7.887) 8.602 1.760 ( 0.000 3.434 -7.887) 8.602 1.760 ( 0.000 -3.434 7.887) 8.602 1.760 ( 0.000 3.434 7.887) 8.602 1.870 ( 0.000 -2.467 -0.576) 2.534 1.870 ( 0.000 -2.467 0.576) 2.534 1.870 ( 0.000 2.467 -0.576) 2.534 1.870 ( 0.000 2.467 0.576) 2.534 1.925 ( 0.000 -1.211 -2.371) 2.662 1.925 ( 0.000 1.211 -2.371) 2.662 1.925 ( 0.000 -1.211 2.371) 2.662 1.925 ( 0.000 1.211 2.371) 2.662 1.992 ( 0.000 -1.366 -2.041) 2.456 1.992 ( 0.000 1.366 -2.041) 2.456 1.992 ( 0.000 -1.366 2.041) 2.456 1.992 ( 0.000 1.366 2.041) 2.456 2.077 ( 0.000 -0.017 -0.419) 0.419 2.077 ( 0.000 0.017 -0.419) 0.419 2.077 ( 0.000 -0.017 0.419) 0.419 2.077 ( 0.000 0.017 0.419) 0.419 2.161 ( 0.000 -0.610 -2.247) 2.328 2.161 ( 0.000 0.610 -2.247) 2.328 2.161 ( 0.000 -0.610 2.247) 2.328 2.161 ( 0.000 0.610 2.247) 2.328 2.216 ( 0.000 -0.387 -2.896) 2.921 2.216 ( 0.000 0.387 -2.896) 2.921 2.216 ( 0.000 -0.387 2.896) 2.921 2.216 ( 0.000 0.387 2.896) 2.921 2.303 ( 0.000 -3.185 -1.593) 3.561 2.303 ( 0.000 -3.185 1.593) 3.561 2.303 ( 0.000 3.185 -1.593) 3.561 2.303 ( 0.000 3.185 1.593) 3.561 2.356 ( 0.000 -1.250 -4.237) 4.418 2.356 ( 0.000 1.250 -4.237) 4.418 2.356 ( 0.000 -1.250 4.237) 4.418 2.356 ( 0.000 1.250 4.237) 4.418 2.502 ( 0.000 -2.675 -4.135) 4.925 2.502 ( 0.000 2.675 -4.135) 4.925 2.502 ( 0.000 -2.675 4.135) 4.925 2.502 ( 0.000 2.675 4.135) 4.925 2.599 ( 0.000 -4.354 -2.118) 4.842 2.599 ( 0.000 -4.354 2.118) 4.842 2.599 ( 0.000 4.354 -2.118) 4.842 2.599 ( 0.000 4.354 2.118) 4.842 2.832 ( 0.000 -3.412 -3.695) 5.030 2.832 ( 0.000 3.412 -3.695) 5.030 2.832 ( 0.000 -3.412 3.695) 5.030 2.832 ( 0.000 3.412 3.695) 5.030 2.972 ( 0.000 -1.343 -2.443) 2.787 2.972 ( 0.000 1.343 -2.443) 2.787 2.972 ( 0.000 -1.343 2.443) 2.787 2.972 ( 0.000 1.343 2.443) 2.787 3.042 ( 0.000 -2.777 -1.486) 3.150 3.042 ( 0.000 -2.777 1.486) 3.150 3.042 ( 0.000 2.777 -1.486) 3.150 3.042 ( 0.000 2.777 1.486) 3.150 3.147 ( 0.000 -4.794 -2.249) 5.295 3.147 ( 0.000 -4.794 2.249) 5.295 3.147 ( 0.000 4.794 -2.249) 5.295 3.147 ( 0.000 4.794 2.249) 5.295 3.407 ( 0.000 -1.330 -4.409) 4.605 3.407 ( 0.000 1.330 -4.409) 4.605 3.407 ( 0.000 -1.330 4.409) 4.605 3.407 ( 0.000 1.330 4.409) 4.605 3.504 ( 0.000 -0.993 -4.362) 4.473 3.504 ( 0.000 0.993 -4.362) 4.473 3.504 ( 0.000 -0.993 4.362) 4.473 3.504 ( 0.000 0.993 4.362) 4.473 3.632 ( 0.000 -1.183 -2.868) 3.103 3.632 ( 0.000 1.183 -2.868) 3.103 3.632 ( 0.000 -1.183 2.868) 3.103 3.632 ( 0.000 1.183 2.868) 3.103 3.731 ( 0.000 -2.145 -2.261) 3.117 3.731 ( 0.000 2.145 -2.261) 3.117 3.731 ( 0.000 -2.145 2.261) 3.117 3.731 ( 0.000 2.145 2.261) 3.117 3.989 ( 0.000 -1.020 -1.990) 2.236 3.989 ( 0.000 1.020 -1.990) 2.236 3.989 ( 0.000 -1.020 1.990) 2.236 3.989 ( 0.000 1.020 1.990) 2.236 4.043 ( 0.000 -1.812 -0.935) 2.039 4.043 ( 0.000 -1.812 0.935) 2.039 4.043 ( 0.000 1.812 -0.935) 2.039 4.043 ( 0.000 1.812 0.935) 2.039 4.313 ( 0.000 -0.198 -2.270) 2.279 4.313 ( 0.000 0.198 -2.270) 2.279 4.313 ( 0.000 -0.198 2.270) 2.279 4.313 ( 0.000 0.198 2.270) 2.279 4.585 ( 0.000 -0.558 -0.320) 0.644 4.585 ( 0.000 -0.558 0.320) 0.644 4.585 ( 0.000 0.558 -0.320) 0.644 4.585 ( 0.000 0.558 0.320) 0.644 4.741 ( 0.000 -0.554 -0.993) 1.137 4.741 ( 0.000 0.554 -0.993) 1.137 4.741 ( 0.000 -0.554 0.993) 1.137 4.741 ( 0.000 0.554 0.993) 1.137 4.909 ( 0.000 -0.095 -0.930) 0.935 4.909 ( 0.000 0.095 -0.930) 0.935 4.909 ( 0.000 -0.095 0.930) 0.935 4.909 ( 0.000 0.095 0.930) 0.935 4.985 ( 0.000 -0.831 -0.978) 1.284 4.985 ( 0.000 0.831 -0.978) 1.284 4.985 ( 0.000 -0.831 0.978) 1.284 4.985 ( 0.000 0.831 0.978) 1.284 5.207 ( 0.000 -0.787 -1.834) 1.996 5.207 ( 0.000 0.787 -1.834) 1.996 5.207 ( 0.000 -0.787 1.834) 1.996 5.207 ( 0.000 0.787 1.834) 1.996 5.385 ( 0.000 -5.841 -3.365) 6.741 5.385 ( 0.000 -5.841 3.365) 6.741 5.385 ( 0.000 5.841 -3.365) 6.741 5.385 ( 0.000 5.841 3.365) 6.741 5.690 ( 0.000 -0.848 -2.207) 2.364 5.690 ( 0.000 0.848 -2.207) 2.364 5.690 ( 0.000 -0.848 2.207) 2.364 5.690 ( 0.000 0.848 2.207) 2.364 5.892 ( 0.000 -2.440 -2.109) 3.225 5.892 ( 0.000 2.440 -2.109) 3.225 5.892 ( 0.000 -2.440 2.109) 3.225 5.892 ( 0.000 2.440 2.109) 3.225 6.314 ( 0.000 -0.575 -0.069) 0.579 6.314 ( 0.000 -0.575 0.069) 0.579 6.314 ( 0.000 0.575 -0.069) 0.579 6.314 ( 0.000 0.575 0.069) 0.579 6.532 ( 0.000 -2.970 -0.800) 3.075 6.532 ( 0.000 -2.970 0.800) 3.075 6.532 ( 0.000 2.970 -0.800) 3.075 6.532 ( 0.000 2.970 0.800) 3.075 7.751 ( 0.000 -0.130 -1.616) 1.621 7.751 ( 0.000 0.130 -1.616) 1.621 7.751 ( 0.000 -0.130 1.616) 1.621 7.751 ( 0.000 0.130 1.616) 1.621 7.849 ( 0.000 -0.151 -1.331) 1.340 7.849 ( 0.000 0.151 -1.331) 1.340 7.849 ( 0.000 -0.151 1.331) 1.340 7.849 ( 0.000 0.151 1.331) 1.340 7.936 ( 0.000 -0.058 -2.808) 2.809 7.936 ( 0.000 0.058 -2.808) 2.809 7.936 ( 0.000 -0.058 2.808) 2.809 7.936 ( 0.000 0.058 2.808) 2.809 8.028 ( 0.000 -1.874 -3.995) 4.413 8.028 ( 0.000 1.874 -3.995) 4.413 8.028 ( 0.000 -1.874 3.995) 4.413 8.028 ( 0.000 1.874 3.995) 4.413 8.240 ( 0.000 -1.363 -2.343) 2.710 8.240 ( 0.000 1.363 -2.343) 2.710 8.240 ( 0.000 -1.363 2.343) 2.710 8.240 ( 0.000 1.363 2.343) 2.710 8.311 ( 0.000 -0.557 -6.618) 6.642 8.311 ( 0.000 0.557 -6.618) 6.642 8.311 ( 0.000 -0.557 6.618) 6.642 8.311 ( 0.000 0.557 6.618) 6.642 8.507 ( 0.000 -0.719 -2.431) 2.535 8.507 ( 0.000 0.719 -2.431) 2.535 8.507 ( 0.000 -0.719 2.431) 2.535 8.507 ( 0.000 0.719 2.431) 2.535 8.623 ( 0.000 -2.083 -3.244) 3.855 8.623 ( 0.000 2.083 -3.244) 3.855 8.623 ( 0.000 -2.083 3.244) 3.855 8.623 ( 0.000 2.083 3.244) 3.855 8.933 ( 0.000 -0.099 -1.876) 1.879 8.933 ( 0.000 0.099 -1.876) 1.879 8.933 ( 0.000 -0.099 1.876) 1.879 8.933 ( 0.000 0.099 1.876) 1.879 9.217 ( 0.000 -0.087 -0.788) 0.793 9.217 ( 0.000 0.087 -0.788) 0.793 9.217 ( 0.000 -0.087 0.788) 0.793 9.217 ( 0.000 0.087 0.788) 0.793 9.451 ( 0.000 -1.169 -0.722) 1.374 9.451 ( 0.000 -1.169 0.722) 1.374 9.451 ( 0.000 1.169 -0.722) 1.374 9.451 ( 0.000 1.169 0.722) 1.374 9.564 ( 0.000 -1.860 -1.498) 2.388 9.564 ( 0.000 1.860 -1.498) 2.388 9.564 ( 0.000 -1.860 1.498) 2.388 9.564 ( 0.000 1.860 1.498) 2.388 9.709 ( 0.000 -2.784 -0.851) 2.911 9.709 ( 0.000 -2.784 0.851) 2.911 9.709 ( 0.000 2.784 -0.851) 2.911 9.709 ( 0.000 2.784 0.851) 2.911 9.778 ( 0.000 -0.723 -0.860) 1.124 9.778 ( 0.000 0.723 -0.860) 1.124 9.778 ( 0.000 -0.723 0.860) 1.124 9.778 ( 0.000 0.723 0.860) 1.124 10.040 ( 0.000 -1.384 -1.339) 1.926 10.040 ( 0.000 1.384 -1.339) 1.926 10.040 ( 0.000 -1.384 1.339) 1.926 10.040 ( 0.000 1.384 1.339) 1.926 10.215 ( 0.000 -3.800 -4.726) 6.064 10.215 ( 0.000 3.800 -4.726) 6.064 10.215 ( 0.000 -3.800 4.726) 6.064 10.215 ( 0.000 3.800 4.726) 6.064======================= Grid point 74 (26/27) =======================q-point: ( 0.25 -0.50 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 18Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.024 ( 1.837 -9.142 -9.003) 12.961 1.024 ( 1.837 8.878 -8.885) 12.694 1.024 ( 1.837 -8.878 8.885) 12.694 1.024 ( 1.837 9.142 9.003) 12.961 1.169 ( 3.435 -9.661 -8.920) 13.590 1.169 ( 3.435 9.549 -8.866) 13.476 1.169 ( 3.435 -9.549 8.866) 13.476 1.169 ( 3.435 9.661 8.920) 13.590 1.309 ( -4.739 -1.076 -4.651) 6.727 1.309 ( -4.739 0.441 -4.605) 6.623 1.309 ( -4.739 -0.441 4.605) 6.623 1.309 ( -4.739 1.076 4.651) 6.727 1.444 ( -3.015 -1.913 -5.157) 6.272 1.444 ( -3.015 -0.668 -5.016) 5.891 1.444 ( -3.015 0.668 5.016) 5.891 1.444 ( -3.015 1.913 5.157) 6.272 1.572 ( 0.353 -2.184 -4.113) 4.670 1.572 ( 0.353 2.176 -4.111) 4.664 1.572 ( 0.353 -2.176 4.111) 4.664 1.572 ( 0.353 2.185 4.113) 4.670 1.715 ( 5.545 -2.114 -0.808) 5.989 1.715 ( 5.545 -1.739 -0.102) 5.812 1.715 ( 5.545 1.739 0.102) 5.812 1.715 ( 5.545 2.114 0.808) 5.989 1.800 ( 2.065 -2.504 -2.401) 4.038 1.800 ( 2.065 1.336 -1.942) 3.134 1.800 ( 2.065 -1.336 1.942) 3.134 1.800 ( 2.065 2.504 2.401) 4.038 1.876 ( 0.648 -1.677 -1.327) 2.235 1.876 ( 0.648 -0.490 -0.785) 1.130 1.876 ( 0.648 0.490 0.785) 1.130 1.876 ( 0.648 1.677 1.327) 2.235 1.948 ( 1.404 -1.955 -3.114) 3.936 1.948 ( 1.404 0.867 -2.887) 3.325 1.948 ( 1.404 -0.867 2.887) 3.325 1.948 ( 1.404 1.955 3.114) 3.936 1.992 ( 0.577 -3.287 -3.645) 4.942 1.992 ( 0.577 2.213 -3.264) 3.986 1.992 ( 0.577 -2.213 3.264) 3.986 1.992 ( 0.577 3.287 3.645) 4.942 2.086 ( 0.120 -2.694 -1.746) 3.213 2.086 ( 0.120 -0.670 -0.141) 0.695 2.086 ( 0.120 0.670 0.141) 0.695 2.086 ( 0.120 2.694 1.746) 3.213 2.160 ( 1.823 -3.242 -2.032) 4.238 2.160 ( 1.823 -1.327 0.490) 2.308 2.160 ( 1.823 1.327 -0.490) 2.308 2.160 ( 1.823 3.242 2.032) 4.238 2.233 ( -0.038 -1.641 -2.726) 3.182 2.233 ( -0.038 0.785 -2.551) 2.670 2.233 ( -0.038 -0.785 2.551) 2.670 2.233 ( -0.038 1.641 2.726) 3.182 2.305 ( -0.029 -1.324 -1.671) 2.133 2.305 ( -0.029 0.285 -1.432) 1.460 2.305 ( -0.029 -0.285 1.432) 1.460 2.305 ( -0.029 1.324 1.671) 2.133 2.366 ( 2.359 -0.626 -3.099) 3.944 2.366 ( 2.359 0.376 -3.081) 3.898 2.366 ( 2.359 -0.376 3.081) 3.898 2.366 ( 2.359 0.626 3.099) 3.944 2.509 ( -0.050 -3.310 -2.919) 4.414 2.509 ( -0.050 0.424 -1.931) 1.977 2.509 ( -0.050 -0.424 1.931) 1.977 2.509 ( -0.050 3.310 2.919) 4.414 2.628 ( 1.694 -3.253 -4.103) 5.504 2.628 ( 1.694 3.235 -4.097) 5.488 2.628 ( 1.694 -3.235 4.097) 5.488 2.628 ( 1.694 3.253 4.103) 5.504 2.817 ( -2.104 -1.921 -2.870) 4.045 2.817 ( -2.104 1.820 -2.841) 3.976 2.817 ( -2.104 -1.820 2.841) 3.976 2.817 ( -2.104 1.921 2.870) 4.045 2.903 ( -2.701 -3.005 -3.983) 5.673 2.903 ( -2.701 2.281 -3.764) 5.164 2.903 ( -2.701 -2.281 3.764) 5.164 2.903 ( -2.701 3.005 3.983) 5.673 3.064 ( 0.307 -1.800 -0.944) 2.055 3.064 ( 0.307 -1.146 -0.188) 1.201 3.064 ( 0.307 1.146 0.188) 1.201 3.064 ( 0.307 1.800 0.944) 2.055 3.148 ( 0.397 -2.133 -2.211) 3.098 3.148 ( 0.397 -0.056 -1.694) 1.741 3.148 ( 0.397 0.056 1.694) 1.741 3.148 ( 0.397 2.133 2.211) 3.098 3.327 ( -6.059 -2.591 -1.950) 6.872 3.327 ( -6.059 2.157 -1.699) 6.652 3.327 ( -6.059 -2.157 1.699) 6.652 3.327 ( -6.059 2.591 1.950) 6.872 3.530 ( 1.501 -2.083 -4.505) 5.185 3.530 ( 1.501 1.624 -4.420) 4.942 3.530 ( 1.501 -1.624 4.420) 4.942 3.530 ( 1.501 2.083 4.505) 5.185 3.616 ( -1.479 -2.643 -3.418) 4.566 3.616 ( -1.479 -0.300 -2.935) 3.300 3.616 ( -1.479 0.300 2.935) 3.300 3.616 ( -1.479 2.643 3.418) 4.566 3.741 ( 1.026 -1.652 -1.927) 2.738 3.741 ( 1.026 0.996 -1.716) 2.234 3.741 ( 1.026 -0.996 1.716) 2.234 3.741 ( 1.026 1.652 1.927) 2.738 3.971 ( -1.200 -0.846 -0.954) 1.750 3.971 ( -1.200 0.180 -0.778) 1.442 3.971 ( -1.200 -0.180 0.778) 1.442 3.971 ( -1.200 0.846 0.954) 1.750 4.040 ( -0.339 -1.714 -0.775) 1.911 4.040 ( -0.339 -1.291 0.188) 1.348 4.040 ( -0.339 1.291 -0.188) 1.348 4.040 ( -0.339 1.714 0.775) 1.911 4.304 ( -0.661 -0.527 -1.838) 2.023 4.304 ( -0.661 0.266 -1.813) 1.948 4.304 ( -0.661 -0.266 1.813) 1.948 4.304 ( -0.661 0.527 1.838) 2.023 4.586 ( 0.040 -0.944 -2.556) 2.725 4.586 ( 0.040 0.926 -2.553) 2.716 4.586 ( 0.040 -0.926 2.553) 2.716 4.586 ( 0.040 0.944 2.556) 2.725 4.749 ( 1.272 -1.339 -1.644) 2.473 4.749 ( 1.272 1.226 -1.605) 2.387 4.749 ( 1.272 -1.226 1.605) 2.387 4.749 ( 1.272 1.339 1.644) 2.473 4.915 ( -1.145 -1.362 -1.819) 2.545 4.915 ( -1.145 -0.544 -1.617) 2.055 4.915 ( -1.145 0.544 1.617) 2.055 4.915 ( -1.145 1.362 1.819) 2.545 4.986 ( 0.786 -1.138 -2.048) 2.471 4.986 ( 0.786 0.461 -1.927) 2.132 4.986 ( 0.786 -0.461 1.927) 2.132 4.986 ( 0.786 1.138 2.048) 2.471 5.146 ( -4.102 -1.722 -3.159) 5.456 5.146 ( -4.102 1.344 -3.076) 5.301 5.146 ( -4.102 -1.344 3.076) 5.301 5.146 ( -4.102 1.722 3.159) 5.456 5.268 ( -6.282 -2.119 -3.468) 7.482 5.268 ( -6.282 1.655 -3.353) 7.311 5.268 ( -6.282 -1.655 3.353) 7.311 5.268 ( -6.282 2.119 3.468) 7.482 5.785 ( 5.212 -1.876 -1.451) 5.726 5.785 ( 5.212 1.119 -1.048) 5.433 5.785 ( 5.212 -1.119 1.048) 5.433 5.785 ( 5.212 1.876 1.451) 5.726 5.901 ( 0.131 -1.916 -1.603) 2.501 5.901 ( 0.131 -0.126 -0.973) 0.990 5.901 ( 0.131 0.126 0.973) 0.990 5.901 ( 0.131 1.916 1.603) 2.501 6.379 ( 4.941 -1.829 -0.182) 5.272 6.379 ( 4.941 -1.820 0.132) 5.267 6.379 ( 4.941 1.820 -0.132) 5.267 6.379 ( 4.941 1.829 0.182) 5.272 6.528 ( -0.486 -3.265 -0.624) 3.359 6.528 ( -0.486 -3.264 0.623) 3.358 6.528 ( -0.486 3.264 -0.623) 3.358 6.528 ( -0.486 3.265 0.624) 3.359 7.771 ( 1.491 -0.380 -2.124) 2.623 7.771 ( 1.491 0.310 -2.119) 2.610 7.771 ( 1.491 -0.310 2.119) 2.610 7.771 ( 1.491 0.380 2.124) 2.623 7.831 ( -1.333 -0.527 -1.591) 2.141 7.831 ( -1.333 0.367 -1.571) 2.093 7.831 ( -1.333 -0.367 1.571) 2.093 7.831 ( -1.333 0.527 1.591) 2.141 7.943 ( 0.458 -0.074 -1.762) 1.822 7.943 ( 0.458 0.038 -1.761) 1.820 7.943 ( 0.458 -0.038 1.761) 1.820 7.943 ( 0.458 0.074 1.762) 1.822 8.072 ( 3.349 -1.661 -2.344) 4.413 8.072 ( 3.349 0.358 -2.080) 3.959 8.072 ( 3.349 -0.358 2.080) 3.959 8.072 ( 3.349 1.661 2.344) 4.413 8.236 ( 0.057 -1.079 -2.368) 2.603 8.236 ( 0.057 1.079 -2.368) 2.603 8.236 ( 0.057 -1.079 2.368) 2.603 8.236 ( 0.057 1.079 2.368) 2.603 8.324 ( 0.438 -0.901 -6.145) 6.226 8.324 ( 0.438 0.791 -6.139) 6.205 8.324 ( 0.438 -0.791 6.139) 6.205 8.324 ( 0.438 0.901 6.145) 6.226 8.485 ( -1.646 -2.238 -1.420) 3.120 8.485 ( -1.646 -1.203 -0.658) 2.143 8.485 ( -1.646 1.203 0.658) 2.143 8.485 ( -1.646 2.238 1.420) 3.120 8.593 ( -2.087 -2.081 -2.517) 3.876 8.593 ( -2.087 1.029 -2.210) 3.209 8.593 ( -2.087 -1.029 2.210) 3.209 8.593 ( -2.087 2.081 2.517) 3.876 8.964 ( 2.424 -1.507 -2.460) 3.768 8.964 ( 2.424 0.584 -2.279) 3.378 8.964 ( 2.424 -0.584 2.279) 3.378 8.964 ( 2.424 1.507 2.460) 3.768 9.194 ( -1.928 -2.071 -1.221) 3.081 9.194 ( -1.928 -1.554 0.811) 2.606 9.194 ( -1.928 1.554 -0.811) 2.606 9.194 ( -1.928 2.071 1.221) 3.081 9.468 ( 1.401 -1.842 -1.763) 2.909 9.468 ( 1.401 1.787 -1.738) 2.860 9.468 ( 1.401 -1.787 1.738) 2.860 9.468 ( 1.401 1.842 1.763) 2.909 9.550 ( -1.182 -2.082 -0.407) 2.428 9.550 ( -1.182 -1.997 0.108) 2.323 9.550 ( -1.182 1.997 -0.108) 2.323 9.550 ( -1.182 2.082 0.407) 2.428 9.716 ( 0.449 -3.049 -0.581) 3.137 9.716 ( 0.449 -2.979 0.384) 3.037 9.716 ( 0.449 2.979 -0.384) 3.037 9.716 ( 0.449 3.049 0.581) 3.137 9.784 ( 0.413 -1.968 -0.663) 2.117 9.784 ( 0.413 -1.709 -0.130) 1.763 9.784 ( 0.413 1.709 0.130) 1.763 9.784 ( 0.413 1.968 0.663) 2.117 10.060 ( 1.918 -2.558 -0.934) 3.332 10.060 ( 1.918 -2.371 0.681) 3.125 10.060 ( 1.918 2.371 -0.681) 3.125 10.060 ( 1.918 2.558 0.934) 3.332 10.185 ( -2.646 -3.856 -3.482) 5.830 10.185 ( -2.646 0.419 -2.365) 3.573 10.185 ( -2.646 -0.419 2.365) 3.573 10.185 ( -2.646 3.856 3.482) 5.830======================= Grid point 78 (27/27) =======================q-point: (-0.50 -0.50 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.65e-04 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 14Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.075 ( 0.000 -0.000 -0.000) 0.000 1.075 ( -0.000 -0.000 0.000) 0.000 1.075 ( 0.000 0.000 0.000) 0.000 1.075 ( 0.000 -0.000 0.000) 0.000 1.157 ( 0.000 0.000 -0.000) 0.000 1.157 ( 0.000 0.000 -0.000) 0.000 1.157 ( 0.000 0.000 -0.000) 0.000 1.157 ( -0.000 0.000 0.000) 0.000 1.329 ( 0.000 -0.000 -0.000) 0.000 1.329 ( 0.000 -0.000 0.000) 0.000 1.329 ( 0.000 0.000 -0.000) 0.000 1.329 ( 0.000 0.000 0.000) 0.000 1.350 ( -0.000 -0.000 -0.000) 0.000 1.350 ( -0.000 0.000 0.000) 0.000 1.350 ( -0.000 -0.000 0.000) 0.000 1.350 ( -0.000 0.000 0.000) 0.000 1.593 ( 0.000 0.000 0.000) 0.000 1.593 ( 0.000 0.000 0.000) 0.000 1.593 ( 0.000 0.000 0.000) 0.000 1.593 ( 0.000 0.000 0.000) 0.000 1.764 ( 0.000 0.000 0.000) 0.000 1.764 ( 0.000 0.000 0.000) 0.000 1.764 ( 0.000 0.000 0.000) 0.000 1.764 ( 0.000 0.000 0.000) 0.000 1.825 ( 0.000 -0.000 0.000) 0.000 1.825 ( 0.000 0.000 0.000) 0.000 1.825 ( -0.000 -0.000 0.000) 0.000 1.825 ( 0.000 0.000 0.000) 0.000 1.901 ( 0.000 -0.000 0.000) 0.000 1.901 ( 0.000 0.000 0.000) 0.000 1.901 ( 0.000 0.000 0.000) 0.000 1.901 ( 0.000 0.000 0.000) 0.000 1.944 ( 0.000 -0.000 -0.000) 0.000 1.944 ( 0.000 0.000 0.000) 0.000 1.944 ( -0.000 0.000 0.000) 0.000 1.944 ( -0.000 0.000 0.000) 0.000 1.990 ( 0.000 0.000 0.000) 0.000 1.990 ( 0.000 0.000 0.000) 0.000 1.990 ( 0.000 -0.000 0.000) 0.000 1.990 ( 0.000 0.000 0.000) 0.000 2.110 ( 0.000 -0.000 0.000) 0.000 2.110 ( 0.000 0.000 0.000) 0.000 2.110 ( 0.000 0.000 0.000) 0.000 2.110 ( 0.000 0.000 0.000) 0.000 2.191 ( 0.000 -0.000 -0.000) 0.000 2.191 ( 0.000 0.000 -0.000) 0.000 2.191 ( 0.000 0.000 0.000) 0.000 2.191 ( 0.000 0.000 0.000) 0.000 2.240 ( 0.000 0.000 -0.000) 0.000 2.240 ( -0.000 0.000 -0.000) 0.000 2.240 ( 0.000 0.000 0.000) 0.000 2.240 ( 0.000 0.000 0.000) 0.000 2.305 ( 0.000 0.000 -0.000) 0.000 2.305 ( 0.000 0.000 0.000) 0.000 2.305 ( 0.000 0.000 -0.000) 0.000 2.305 ( 0.000 0.000 0.000) 0.000 2.443 ( 0.000 0.000 -0.000) 0.000 2.443 ( 0.000 0.000 -0.000) 0.000 2.443 ( -0.000 -0.000 0.000) 0.000 2.443 ( 0.000 0.000 0.000) 0.000 2.457 ( -0.000 -0.000 -0.000) 0.000 2.457 ( 0.000 -0.000 -0.000) 0.000 2.457 ( 0.000 0.000 0.000) 0.000 2.457 ( 0.000 0.000 0.000) 0.000 2.651 ( 0.000 -0.000 -0.000) 0.000 2.651 ( 0.000 0.000 -0.000) 0.000 2.651 ( 0.000 0.000 0.000) 0.000 2.651 ( 0.000 0.000 0.000) 0.000 2.756 ( -0.000 -0.000 -0.000) 0.000 2.756 ( -0.000 -0.000 0.000) 0.000 2.756 ( -0.000 0.000 0.000) 0.000 2.756 ( 0.000 0.000 0.000) 0.000 2.928 ( 0.000 -0.000 0.000) 0.000 2.928 ( 0.000 0.000 0.000) 0.000 2.928 ( 0.000 0.000 0.000) 0.000 2.928 ( 0.000 0.000 0.000) 0.000 3.036 ( -0.000 0.000 -0.000) 0.000 3.036 ( 0.000 -0.000 0.000) 0.000 3.036 ( 0.000 0.000 0.000) 0.000 3.036 ( 0.000 0.000 0.000) 0.000 3.185 ( 0.000 -0.000 0.000) 0.000 3.185 ( 0.000 -0.000 0.000) 0.000 3.185 ( 0.000 0.000 0.000) 0.000 3.185 ( 0.000 0.000 0.000) 0.000 3.217 ( -0.000 -0.000 0.000) 0.000 3.217 ( -0.000 0.000 0.000) 0.000 3.217 ( -0.000 0.000 0.000) 0.000 3.217 ( 0.000 0.000 0.000) 0.000 3.555 ( 0.000 -0.000 -0.000) 0.000 3.555 ( -0.000 -0.000 0.000) 0.000 3.555 ( 0.000 0.000 0.000) 0.000 3.555 ( 0.000 0.000 0.000) 0.000 3.588 ( -0.000 0.000 -0.000) 0.000 3.588 ( 0.000 0.000 0.000) 0.000 3.588 ( 0.000 0.000 0.000) 0.000 3.588 ( 0.000 0.000 0.000) 0.000 3.758 ( 0.000 0.000 0.000) 0.000 3.758 ( 0.000 0.000 0.000) 0.000 3.758 ( 0.000 0.000 0.000) 0.000 3.758 ( 0.000 0.000 0.000) 0.000 3.955 ( 0.000 0.000 0.000) 0.000 3.955 ( 0.000 0.000 0.000) 0.000 3.955 ( 0.000 0.000 0.000) 0.000 3.955 ( 0.000 0.000 0.000) 0.000 4.035 ( 0.000 -0.000 0.000) 0.000 4.035 ( 0.000 0.000 0.000) 0.000 4.035 ( 0.000 0.000 0.000) 0.000 4.035 ( 0.000 0.000 0.000) 0.000 4.295 ( 0.000 0.000 0.000) 0.000 4.295 ( 0.000 0.000 0.000) 0.000 4.295 ( 0.000 0.000 0.000) 0.000 4.295 ( 0.000 0.000 0.000) 0.000 4.586 ( 0.000 0.000 0.000) 0.000 4.586 ( 0.000 0.000 0.000) 0.000 4.586 ( 0.000 0.000 0.000) 0.000 4.586 ( 0.000 0.000 0.000) 0.000 4.789 ( -0.000 -0.000 -0.000) 0.000 4.789 ( 0.000 0.000 -0.000) 0.000 4.789 ( -0.000 0.000 0.000) 0.000 4.789 ( 0.000 0.000 0.000) 0.000 4.861 ( -0.000 0.000 0.000) 0.000 4.861 ( 0.000 0.000 0.000) 0.000 4.861 ( -0.000 0.000 0.000) 0.000 4.861 ( 0.000 0.000 0.000) 0.000 5.007 ( -0.000 0.000 0.000) 0.000 5.007 ( -0.000 0.000 0.000) 0.000 5.007 ( 0.000 0.000 0.000) 0.000 5.007 ( 0.000 0.000 0.000) 0.000 5.112 ( -0.000 0.000 0.000) 0.000 5.112 ( 0.000 0.000 0.000) 0.000 5.112 ( 0.000 0.000 0.000) 0.000 5.112 ( 0.000 0.000 0.000) 0.000 5.185 ( 0.000 0.000 -0.000) 0.000 5.185 ( 0.000 0.000 0.000) 0.000 5.185 ( 0.000 0.000 0.000) 0.000 5.185 ( -0.000 0.000 0.000) 0.000 5.858 ( 0.000 -0.000 -0.000) 0.000 5.858 ( 0.000 0.000 -0.000) 0.000 5.858 ( 0.000 -0.000 0.000) 0.000 5.858 ( 0.000 0.000 -0.000) 0.000 5.887 ( -0.000 0.000 -0.000) 0.000 5.887 ( 0.000 0.000 0.000) 0.000 5.887 ( 0.000 0.000 0.000) 0.000 5.887 ( 0.000 0.000 0.000) 0.000 6.454 ( -0.000 0.000 0.000) 0.000 6.454 ( 0.000 0.000 0.000) 0.000 6.454 ( 0.000 0.000 0.000) 0.000 6.454 ( 0.000 0.000 0.000) 0.000 6.512 ( -0.000 -0.000 0.000) 0.000 6.512 ( 0.000 0.000 0.000) 0.000 6.512 ( 0.000 0.000 0.000) 0.000 6.512 ( 0.000 -0.000 0.000) 0.000 7.798 ( 0.000 0.000 -0.000) 0.000 7.798 ( 0.000 0.000 0.000) 0.000 7.798 ( 0.000 0.000 0.000) 0.000 7.798 ( 0.000 0.000 0.000) 0.000 7.805 ( 0.000 0.000 -0.000) 0.000 7.805 ( -0.000 0.000 -0.000) 0.000 7.805 ( -0.000 -0.000 0.000) 0.000 7.805 ( -0.000 0.000 0.000) 0.000 7.949 ( 0.000 0.000 -0.000) 0.000 7.949 ( 0.000 0.000 0.000) 0.000 7.949 ( 0.000 0.000 0.000) 0.000 7.949 ( 0.000 0.000 0.000) 0.000 8.118 ( 0.000 0.000 0.000) 0.000 8.118 ( -0.000 0.000 0.000) 0.000 8.118 ( -0.000 0.000 0.000) 0.000 8.118 ( 0.000 0.000 0.000) 0.000 8.248 ( 0.000 0.000 -0.000) 0.000 8.248 ( 0.000 0.000 0.000) 0.000 8.248 ( 0.000 0.000 0.000) 0.000 8.248 ( 0.000 0.000 0.000) 0.000 8.314 ( 0.000 0.000 -0.000) 0.000 8.314 ( 0.000 0.000 0.000) 0.000 8.314 ( 0.000 0.000 0.000) 0.000 8.314 ( 0.000 0.000 0.000) 0.000 8.467 ( 0.000 0.000 -0.000) 0.000 8.467 ( 0.000 0.000 0.000) 0.000 8.467 ( -0.000 0.000 0.000) 0.000 8.467 ( 0.000 0.000 0.000) 0.000 8.565 ( 0.000 -0.000 -0.000) 0.000 8.565 ( 0.000 0.000 0.000) 0.000 8.565 ( 0.000 0.000 0.000) 0.000 8.565 ( 0.000 0.000 0.000) 0.000 9.001 ( 0.000 0.000 0.000) 0.000 9.001 ( 0.000 0.000 0.000) 0.000 9.001 ( 0.000 0.000 0.000) 0.000 9.001 ( 0.000 0.000 0.000) 0.000 9.163 ( -0.000 0.000 -0.000) 0.000 9.163 ( 0.000 0.000 0.000) 0.000 9.163 ( 0.000 0.000 0.000) 0.000 9.163 ( 0.000 0.000 0.000) 0.000 9.492 ( -0.000 -0.000 -0.000) 0.000 9.492 ( 0.000 0.000 -0.000) 0.000 9.492 ( -0.000 0.000 0.000) 0.000 9.492 ( 0.000 0.000 0.000) 0.000 9.529 ( 0.000 -0.000 -0.000) 0.000 9.529 ( 0.000 0.000 0.000) 0.000 9.529 ( 0.000 0.000 0.000) 0.000 9.529 ( 0.000 0.000 0.000) 0.000 9.721 ( 0.000 -0.000 0.000) 0.000 9.721 ( 0.000 -0.000 0.000) 0.000 9.721 ( 0.000 0.000 0.000) 0.000 9.721 ( 0.000 0.000 0.000) 0.000 9.789 ( 0.000 0.000 0.000) 0.000 9.789 ( 0.000 0.000 0.000) 0.000 9.789 ( 0.000 0.000 0.000) 0.000 9.789 ( 0.000 0.000 0.000) 0.000 10.110 ( -0.000 -0.000 -0.000) 0.000 10.110 ( 0.000 0.000 0.000) 0.000 10.110 ( -0.000 0.000 0.000) 0.000 10.110 ( 0.000 -0.000 0.000) 0.000 10.125 ( 0.000 -0.000 -0.000) 0.000 10.125 ( 0.000 0.000 -0.000) 0.000 10.125 ( 0.000 0.000 0.000) 0.000 10.125 ( 0.000 0.000 0.000) 0.000=================== 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 3/13824 10.0 103.899 117.106 139.634 0.000 0.000 0.000 3/13824 20.0 20.867 22.335 28.523 0.000 0.000 0.000 3/13824 30.0 9.400 9.825 12.626 0.000 0.000 0.000 3/13824 40.0 5.716 5.867 7.529 0.000 0.000 0.000 3/13824 50.0 4.027 4.076 5.219 0.000 0.000 0.000 3/13824 60.0 3.092 3.096 3.957 0.000 0.000 0.000 3/13824 70.0 2.508 2.490 3.179 0.000 0.000 0.000 3/13824 80.0 2.112 2.083 2.657 0.000 0.000 0.000 3/13824 90.0 1.826 1.791 2.284 0.000 0.000 0.000 3/13824 100.0 1.611 1.573 2.005 0.000 0.000 0.000 3/13824 110.0 1.443 1.404 1.789 0.000 0.000 0.000 3/13824 120.0 1.308 1.269 1.617 0.000 0.000 0.000 3/13824 130.0 1.197 1.158 1.475 0.000 0.000 0.000 3/13824 140.0 1.104 1.066 1.358 0.000 0.000 0.000 3/13824 150.0 1.025 0.988 1.258 0.000 0.000 0.000 3/13824 160.0 0.956 0.921 1.172 0.000 0.000 0.000 3/13824 170.0 0.897 0.863 1.098 0.000 0.000 0.000 3/13824 180.0 0.845 0.812 1.033 0.000 0.000 0.000 3/13824 190.0 0.799 0.767 0.975 0.000 0.000 0.000 3/13824 200.0 0.757 0.726 0.924 0.000 0.000 0.000 3/13824 210.0 0.720 0.690 0.878 0.000 0.000 0.000 3/13824 220.0 0.686 0.658 0.836 0.000 0.000 0.000 3/13824 230.0 0.656 0.628 0.798 0.000 0.000 0.000 3/13824 240.0 0.628 0.601 0.764 0.000 0.000 0.000 3/13824 250.0 0.602 0.576 0.732 0.000 0.000 0.000 3/13824 260.0 0.579 0.554 0.704 0.000 0.000 0.000 3/13824 270.0 0.557 0.533 0.677 0.000 0.000 0.000 3/13824 280.0 0.537 0.513 0.652 0.000 0.000 0.000 3/13824 290.0 0.518 0.495 0.629 0.000 0.000 0.000 3/13824 300.0 0.501 0.478 0.608 0.000 0.000 0.000 3/13824 310.0 0.484 0.463 0.588 0.000 0.000 0.000 3/13824 320.0 0.469 0.448 0.569 0.000 0.000 0.000 3/13824 330.0 0.455 0.434 0.551 0.000 0.000 0.000 3/13824 340.0 0.441 0.421 0.535 0.000 0.000 0.000 3/13824 350.0 0.429 0.409 0.519 0.000 0.000 0.000 3/13824 360.0 0.417 0.398 0.505 0.000 0.000 0.000 3/13824 370.0 0.405 0.387 0.491 0.000 0.000 0.000 3/13824 380.0 0.395 0.376 0.478 0.000 0.000 0.000 3/13824 390.0 0.384 0.367 0.466 0.000 0.000 0.000 3/13824 400.0 0.375 0.357 0.454 0.000 0.000 0.000 3/13824 410.0 0.366 0.349 0.443 0.000 0.000 0.000 3/13824 420.0 0.357 0.340 0.432 0.000 0.000 0.000 3/13824 430.0 0.349 0.332 0.422 0.000 0.000 0.000 3/13824 440.0 0.341 0.325 0.412 0.000 0.000 0.000 3/13824 450.0 0.333 0.317 0.403 0.000 0.000 0.000 3/13824 460.0 0.326 0.311 0.394 0.000 0.000 0.000 3/13824 470.0 0.319 0.304 0.386 0.000 0.000 0.000 3/13824 480.0 0.312 0.298 0.378 0.000 0.000 0.000 3/13824 490.0 0.306 0.291 0.370 0.000 0.000 0.000 3/13824 500.0 0.300 0.286 0.363 0.000 0.000 0.000 3/13824 510.0 0.294 0.280 0.355 0.000 0.000 0.000 3/13824 520.0 0.288 0.275 0.349 0.000 0.000 0.000 3/13824 530.0 0.283 0.269 0.342 0.000 0.000 0.000 3/13824 540.0 0.277 0.264 0.336 0.000 0.000 0.000 3/13824 550.0 0.272 0.260 0.329 0.000 0.000 0.000 3/13824 560.0 0.268 0.255 0.324 0.000 0.000 0.000 3/13824 570.0 0.263 0.250 0.318 0.000 0.000 0.000 3/13824 580.0 0.258 0.246 0.312 0.000 0.000 0.000 3/13824 590.0 0.254 0.242 0.307 0.000 0.000 0.000 3/13824 600.0 0.250 0.238 0.302 0.000 0.000 0.000 3/13824 610.0 0.246 0.234 0.297 0.000 0.000 0.000 3/13824 620.0 0.242 0.230 0.292 0.000 0.000 0.000 3/13824 630.0 0.238 0.227 0.287 0.000 0.000 0.000 3/13824 640.0 0.234 0.223 0.283 0.000 0.000 0.000 3/13824 650.0 0.231 0.220 0.279 0.000 0.000 0.000 3/13824 660.0 0.227 0.216 0.274 0.000 0.000 0.000 3/13824 670.0 0.224 0.213 0.270 0.000 0.000 0.000 3/13824 680.0 0.220 0.210 0.266 0.000 0.000 0.000 3/13824 690.0 0.217 0.207 0.262 0.000 0.000 0.000 3/13824 700.0 0.214 0.204 0.259 0.000 0.000 0.000 3/13824 710.0 0.211 0.201 0.255 0.000 0.000 0.000 3/13824 720.0 0.208 0.198 0.251 0.000 0.000 0.000 3/13824 730.0 0.205 0.195 0.248 0.000 0.000 0.000 3/13824 740.0 0.203 0.193 0.245 0.000 0.000 0.000 3/13824 750.0 0.200 0.190 0.241 0.000 0.000 0.000 3/13824 760.0 0.197 0.188 0.238 0.000 0.000 0.000 3/13824 770.0 0.195 0.185 0.235 0.000 0.000 0.000 3/13824 780.0 0.192 0.183 0.232 0.000 0.000 0.000 3/13824 790.0 0.190 0.181 0.229 0.000 0.000 0.000 3/13824 800.0 0.187 0.178 0.226 0.000 0.000 0.000 3/13824 810.0 0.185 0.176 0.224 0.000 0.000 0.000 3/13824 820.0 0.183 0.174 0.221 0.000 0.000 0.000 3/13824 830.0 0.181 0.172 0.218 0.000 0.000 0.000 3/13824 840.0 0.178 0.170 0.216 0.000 0.000 0.000 3/13824 850.0 0.176 0.168 0.213 0.000 0.000 0.000 3/13824 860.0 0.174 0.166 0.211 0.000 0.000 0.000 3/13824 870.0 0.172 0.164 0.208 0.000 0.000 0.000 3/13824 880.0 0.170 0.162 0.206 0.000 0.000 0.000 3/13824 890.0 0.168 0.160 0.203 0.000 0.000 0.000 3/13824 900.0 0.167 0.159 0.201 0.000 0.000 0.000 3/13824 910.0 0.165 0.157 0.199 0.000 0.000 0.000 3/13824 920.0 0.163 0.155 0.197 0.000 0.000 0.000 3/13824 930.0 0.161 0.153 0.195 0.000 0.000 0.000 3/13824 940.0 0.159 0.152 0.193 0.000 0.000 0.000 3/13824 950.0 0.158 0.150 0.191 0.000 0.000 0.000 3/13824 960.0 0.156 0.149 0.189 0.000 0.000 0.000 3/13824 970.0 0.155 0.147 0.187 0.000 0.000 0.000 3/13824 980.0 0.153 0.146 0.185 0.000 0.000 0.000 3/13824 990.0 0.151 0.144 0.183 0.000 0.000 0.000 3/13824 1000.0 0.150 0.143 0.181 0.000 0.000 0.000 3/13824Thermal conductivity related properties were written into "kappa-m444.hdf5".Summary of calculation was written in "phono3py.yaml".-------------------------[time 2026-01-08 05:25:27]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|