----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 18:50:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 8 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.986709870098661 0.000000000000000 0.000000000000000 b 0.000000000000000 6.103057059999999 0.000000000000000 c -1.733362542579822 0.000000000000000 12.977164938893040 Atomic positions (fractional): *1 Li 0.76253655900648 0.88183043851640 0.40705634330659 6.941 *2 Li 0.98814479067925 0.38083812075718 0.74764880503183 6.941 3 Li 0.98814479067925 0.11916187924282 0.24764880503183 6.941 *4 Li 0.25112934593058 0.87312899948923 0.10130550144381 6.941 5 Li 0.74887065406942 0.12687100051077 0.89869449855619 6.941 6 Li 0.01185520932075 0.88083812075718 0.75235119496817 6.941 7 Li 0.01185520932075 0.61916187924282 0.25235119496817 6.941 8 Li 0.25112934593058 0.62687100051077 0.60130550144381 6.941 9 Li 0.23746344099352 0.11816956148360 0.59294365669341 6.941 10 Li 0.74887065406942 0.37312899948923 0.39869449855619 6.941 11 Li 0.76253655900648 0.61816956148360 0.90705634330659 6.941 12 Li 0.23746344099352 0.38183043851640 0.09294365669341 6.941 *13 Be 0.77097575082285 0.59201894261260 0.58777864581734 9.012 *14 Be 0.22499815840453 0.83379738617840 0.40864954313965 9.012 15 Be 0.77500184159547 0.16620261382160 0.59135045686035 9.012 16 Be 0.22902424917715 0.09201894261260 0.91222135418266 9.012 17 Be 0.22499815840453 0.66620261382160 0.90864954313965 9.012 18 Be 0.22902424917715 0.40798105738740 0.41222135418266 9.012 19 Be 0.77500184159547 0.33379738617840 0.09135045686035 9.012 *20 Be 0.43347075544439 0.38188692923482 0.81392548676523 9.012 21 Be 0.43347075544439 0.11811307076518 0.31392548676523 9.012 22 Be 0.77097575082285 0.90798105738740 0.08777864581734 9.012 23 Be 0.56652924455561 0.61811307076518 0.18607451323477 9.012 24 Be 0.56652924455561 0.88188692923482 0.68607451323477 9.012 *25 H 0.70954313569865 0.88203854860068 0.78253057903243 1.008 *26 H 0.69956617980207 0.12038714004395 0.11755228076418 1.008 *27 H 0.57257547258125 0.69419101475133 0.61821622900227 1.008 *28 H 0.97327385495719 0.64310003348791 0.65342344308420 1.008 *29 H 0.32888163752991 0.61913901782591 0.19449922871470 1.008 *30 H 0.97428900143199 0.37956873641579 0.15986424566285 1.008 31 H 0.02672614504281 0.35689996651209 0.34657655691580 1.008 *32 H 0.19315238021548 0.63258499008594 0.01143412301453 1.008 33 H 0.67111836247009 0.38086098217409 0.80550077128530 1.008 34 H 0.02571099856801 0.62043126358421 0.84013575433715 1.008 *35 H 0.77836721298131 0.62249331228722 0.48129886627939 1.008 36 H 0.42742452741875 0.30580898524867 0.38178377099773 1.008 37 H 0.22163278701869 0.12249331228722 0.01870113372061 1.008 38 H 0.42742452741875 0.19419101475133 0.88178377099773 1.008 39 H 0.69956617980207 0.37961285995604 0.61755228076418 1.008 *40 H 0.57082201858803 0.43595495721390 0.11523810759786 1.008 41 H 0.29045686430135 0.38203854860068 0.71746942096757 1.008 42 H 0.42917798141197 0.56404504278610 0.88476189240214 1.008 43 H 0.97327385495719 0.85689996651209 0.15342344308420 1.008 44 H 0.80684761978452 0.13258499008594 0.48856587698547 1.008 45 H 0.30043382019793 0.62038714004396 0.38244771923582 1.008 46 H 0.77836721298131 0.87750668771278 0.98129886627939 1.008 47 H 0.32888163752991 0.88086098217409 0.69449922871470 1.008 48 H 0.29045686430135 0.11796145139932 0.21746942096757 1.008 49 H 0.57082201858803 0.06404504278610 0.61523810759786 1.008 50 H 0.02571099856801 0.87956873641579 0.34013575433715 1.008 51 H 0.67111836247009 0.11913901782591 0.30550077128530 1.008 52 H 0.19315238021548 0.86741500991406 0.51143412301453 1.008 53 H 0.02672614504281 0.14310003348791 0.84657655691580 1.008 54 H 0.70954313569865 0.61796145139932 0.28253057903243 1.008 55 H 0.57257547258125 0.80580898524867 0.11821622900227 1.008 56 H 0.30043382019793 0.87961285995604 0.88244771923582 1.008 57 H 0.80684761978452 0.36741500991406 0.98856587698547 1.008 58 H 0.42917798141197 0.93595495721390 0.38476189240214 1.008 59 H 0.22163278701869 0.37750668771278 0.51870113372061 1.008 60 H 0.97428900143199 0.12043126358421 0.65986424566285 1.008 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.986709870098661 0.000000000000000 0.000000000000000 b 0.000000000000000 6.103057059999999 0.000000000000000 c -1.733362542579822 0.000000000000000 12.977164938893040 Atomic positions (fractional): *1 Li 0.76253655900648 0.88183043851640 0.40705634330659 6.941 > 1 *2 Li 0.98814479067925 0.38083812075718 0.74764880503183 6.941 > 2 3 Li 0.98814479067925 0.11916187924282 0.24764880503183 6.941 > 3 *4 Li 0.25112934593058 0.87312899948923 0.10130550144381 6.941 > 4 5 Li 0.74887065406942 0.12687100051077 0.89869449855619 6.941 > 5 6 Li 0.01185520932075 0.88083812075718 0.75235119496817 6.941 > 6 7 Li 0.01185520932075 0.61916187924282 0.25235119496817 6.941 > 7 8 Li 0.25112934593058 0.62687100051077 0.60130550144381 6.941 > 8 9 Li 0.23746344099352 0.11816956148360 0.59294365669341 6.941 > 9 10 Li 0.74887065406942 0.37312899948923 0.39869449855619 6.941 > 10 11 Li 0.76253655900648 0.61816956148360 0.90705634330659 6.941 > 11 12 Li 0.23746344099352 0.38183043851640 0.09294365669341 6.941 > 12 *13 Be 0.77097575082285 0.59201894261260 0.58777864581734 9.012 > 13 *14 Be 0.22499815840453 0.83379738617840 0.40864954313965 9.012 > 14 15 Be 0.77500184159547 0.16620261382160 0.59135045686035 9.012 > 15 16 Be 0.22902424917715 0.09201894261260 0.91222135418266 9.012 > 16 17 Be 0.22499815840453 0.66620261382160 0.90864954313965 9.012 > 17 18 Be 0.22902424917715 0.40798105738740 0.41222135418266 9.012 > 18 19 Be 0.77500184159547 0.33379738617840 0.09135045686035 9.012 > 19 *20 Be 0.43347075544439 0.38188692923482 0.81392548676523 9.012 > 20 21 Be 0.43347075544439 0.11811307076518 0.31392548676523 9.012 > 21 22 Be 0.77097575082285 0.90798105738740 0.08777864581734 9.012 > 22 23 Be 0.56652924455561 0.61811307076518 0.18607451323477 9.012 > 23 24 Be 0.56652924455561 0.88188692923482 0.68607451323477 9.012 > 24 *25 H 0.70954313569865 0.88203854860068 0.78253057903243 1.008 > 25 *26 H 0.69956617980207 0.12038714004395 0.11755228076418 1.008 > 26 *27 H 0.57257547258125 0.69419101475133 0.61821622900227 1.008 > 27 *28 H 0.97327385495719 0.64310003348791 0.65342344308420 1.008 > 28 *29 H 0.32888163752991 0.61913901782591 0.19449922871470 1.008 > 29 *30 H 0.97428900143199 0.37956873641579 0.15986424566285 1.008 > 30 31 H 0.02672614504281 0.35689996651209 0.34657655691580 1.008 > 31 *32 H 0.19315238021548 0.63258499008594 0.01143412301453 1.008 > 32 33 H 0.67111836247009 0.38086098217409 0.80550077128530 1.008 > 33 34 H 0.02571099856801 0.62043126358421 0.84013575433715 1.008 > 34 *35 H 0.77836721298131 0.62249331228722 0.48129886627939 1.008 > 35 36 H 0.42742452741875 0.30580898524867 0.38178377099773 1.008 > 36 37 H 0.22163278701869 0.12249331228722 0.01870113372061 1.008 > 37 38 H 0.42742452741875 0.19419101475133 0.88178377099773 1.008 > 38 39 H 0.69956617980207 0.37961285995604 0.61755228076418 1.008 > 39 *40 H 0.57082201858803 0.43595495721390 0.11523810759786 1.008 > 40 41 H 0.29045686430135 0.38203854860068 0.71746942096757 1.008 > 41 42 H 0.42917798141197 0.56404504278610 0.88476189240214 1.008 > 42 43 H 0.97327385495719 0.85689996651209 0.15342344308420 1.008 > 43 44 H 0.80684761978452 0.13258499008594 0.48856587698547 1.008 > 44 45 H 0.30043382019793 0.62038714004396 0.38244771923582 1.008 > 45 46 H 0.77836721298131 0.87750668771278 0.98129886627939 1.008 > 46 47 H 0.32888163752991 0.88086098217409 0.69449922871470 1.008 > 47 48 H 0.29045686430135 0.11796145139932 0.21746942096757 1.008 > 48 49 H 0.57082201858803 0.06404504278610 0.61523810759786 1.008 > 49 50 H 0.02571099856801 0.87956873641579 0.34013575433715 1.008 > 50 51 H 0.67111836247009 0.11913901782591 0.30550077128530 1.008 > 51 52 H 0.19315238021548 0.86741500991406 0.51143412301453 1.008 > 52 53 H 0.02672614504281 0.14310003348791 0.84657655691580 1.008 > 53 54 H 0.70954313569865 0.61796145139932 0.28253057903243 1.008 > 54 55 H 0.57257547258125 0.80580898524867 0.11821622900227 1.008 > 55 56 H 0.30043382019793 0.87961285995604 0.88244771923582 1.008 > 56 57 H 0.80684761978452 0.36741500991406 0.98856587698547 1.008 > 57 58 H 0.42917798141197 0.93595495721390 0.38476189240214 1.008 > 58 59 H 0.22163278701869 0.37750668771278 0.51870113372061 1.008 > 59 60 H 0.97428900143199 0.12043126358421 0.65986424566285 1.008 > 60 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.973419740197322 0.000000000000000 0.000000000000000 b 0.000000000000000 6.103057059999999 0.000000000000000 c -1.733362542579822 0.000000000000000 12.977164938893040 Atomic positions (fractional): *1 Li 0.38126827950324 0.88183043851640 0.40705634330659 6.941 > 1 2 Li 0.88126827950324 0.88183043851640 0.40705634330659 6.941 > 1 *3 Li 0.49407239533962 0.38083812075718 0.74764880503183 6.941 > 2 4 Li 0.99407239533962 0.38083812075718 0.74764880503183 6.941 > 2 5 Li 0.49407239533962 0.11916187924282 0.24764880503183 6.941 > 3 6 Li 0.99407239533962 0.11916187924282 0.24764880503183 6.941 > 3 *7 Li 0.12556467296529 0.87312899948923 0.10130550144381 6.941 > 4 8 Li 0.62556467296529 0.87312899948923 0.10130550144381 6.941 > 4 9 Li 0.37443532703471 0.12687100051077 0.89869449855619 6.941 > 5 10 Li 0.87443532703471 0.12687100051077 0.89869449855619 6.941 > 5 11 Li 0.00592760466037 0.88083812075718 0.75235119496817 6.941 > 6 12 Li 0.50592760466038 0.88083812075718 0.75235119496817 6.941 > 6 13 Li 0.00592760466037 0.61916187924282 0.25235119496817 6.941 > 7 14 Li 0.50592760466038 0.61916187924282 0.25235119496817 6.941 > 7 15 Li 0.12556467296529 0.62687100051077 0.60130550144381 6.941 > 8 16 Li 0.62556467296529 0.62687100051077 0.60130550144381 6.941 > 8 17 Li 0.11873172049676 0.11816956148360 0.59294365669341 6.941 > 9 18 Li 0.61873172049676 0.11816956148360 0.59294365669341 6.941 > 9 19 Li 0.37443532703471 0.37312899948923 0.39869449855619 6.941 > 10 20 Li 0.87443532703471 0.37312899948923 0.39869449855619 6.941 > 10 21 Li 0.38126827950324 0.61816956148360 0.90705634330659 6.941 > 11 22 Li 0.88126827950324 0.61816956148360 0.90705634330659 6.941 > 11 23 Li 0.11873172049676 0.38183043851640 0.09294365669341 6.941 > 12 24 Li 0.61873172049676 0.38183043851640 0.09294365669341 6.941 > 12 *25 Be 0.38548787541142 0.59201894261260 0.58777864581734 9.012 > 13 26 Be 0.88548787541142 0.59201894261260 0.58777864581734 9.012 > 13 *27 Be 0.11249907920226 0.83379738617840 0.40864954313965 9.012 > 14 28 Be 0.61249907920226 0.83379738617840 0.40864954313965 9.012 > 14 29 Be 0.38750092079774 0.16620261382160 0.59135045686035 9.012 > 15 30 Be 0.88750092079774 0.16620261382160 0.59135045686035 9.012 > 15 31 Be 0.11451212458858 0.09201894261260 0.91222135418266 9.012 > 16 32 Be 0.61451212458858 0.09201894261260 0.91222135418266 9.012 > 16 33 Be 0.11249907920226 0.66620261382160 0.90864954313965 9.012 > 17 34 Be 0.61249907920226 0.66620261382160 0.90864954313965 9.012 > 17 35 Be 0.11451212458858 0.40798105738740 0.41222135418266 9.012 > 18 36 Be 0.61451212458858 0.40798105738740 0.41222135418266 9.012 > 18 37 Be 0.38750092079774 0.33379738617840 0.09135045686035 9.012 > 19 38 Be 0.88750092079774 0.33379738617840 0.09135045686035 9.012 > 19 *39 Be 0.21673537772219 0.38188692923482 0.81392548676523 9.012 > 20 40 Be 0.71673537772219 0.38188692923482 0.81392548676523 9.012 > 20 41 Be 0.21673537772219 0.11811307076518 0.31392548676523 9.012 > 21 42 Be 0.71673537772219 0.11811307076518 0.31392548676523 9.012 > 21 43 Be 0.38548787541142 0.90798105738740 0.08777864581734 9.012 > 22 44 Be 0.88548787541142 0.90798105738740 0.08777864581734 9.012 > 22 45 Be 0.28326462227781 0.61811307076518 0.18607451323477 9.012 > 23 46 Be 0.78326462227781 0.61811307076518 0.18607451323477 9.012 > 23 47 Be 0.28326462227781 0.88188692923482 0.68607451323477 9.012 > 24 48 Be 0.78326462227781 0.88188692923482 0.68607451323477 9.012 > 24 *49 H 0.35477156784933 0.88203854860068 0.78253057903243 1.008 > 25 50 H 0.85477156784933 0.88203854860068 0.78253057903243 1.008 > 25 *51 H 0.34978308990104 0.12038714004395 0.11755228076418 1.008 > 26 52 H 0.84978308990104 0.12038714004395 0.11755228076418 1.008 > 26 *53 H 0.28628773629063 0.69419101475133 0.61821622900227 1.008 > 27 54 H 0.78628773629063 0.69419101475133 0.61821622900227 1.008 > 27 *55 H 0.48663692747860 0.64310003348791 0.65342344308420 1.008 > 28 56 H 0.98663692747860 0.64310003348791 0.65342344308420 1.008 > 28 *57 H 0.16444081876496 0.61913901782591 0.19449922871470 1.008 > 29 58 H 0.66444081876496 0.61913901782591 0.19449922871470 1.008 > 29 *59 H 0.48714450071599 0.37956873641579 0.15986424566285 1.008 > 30 60 H 0.98714450071599 0.37956873641579 0.15986424566285 1.008 > 30 61 H 0.01336307252140 0.35689996651209 0.34657655691580 1.008 > 31 62 H 0.51336307252140 0.35689996651209 0.34657655691580 1.008 > 31 *63 H 0.09657619010774 0.63258499008594 0.01143412301453 1.008 > 32 64 H 0.59657619010774 0.63258499008594 0.01143412301453 1.008 > 32 65 H 0.33555918123504 0.38086098217409 0.80550077128530 1.008 > 33 66 H 0.83555918123504 0.38086098217409 0.80550077128530 1.008 > 33 67 H 0.01285549928401 0.62043126358421 0.84013575433715 1.008 > 34 68 H 0.51285549928401 0.62043126358421 0.84013575433715 1.008 > 34 *69 H 0.38918360649066 0.62249331228722 0.48129886627939 1.008 > 35 70 H 0.88918360649066 0.62249331228722 0.48129886627939 1.008 > 35 71 H 0.21371226370937 0.30580898524867 0.38178377099773 1.008 > 36 72 H 0.71371226370937 0.30580898524867 0.38178377099773 1.008 > 36 73 H 0.11081639350934 0.12249331228722 0.01870113372061 1.008 > 37 74 H 0.61081639350934 0.12249331228722 0.01870113372061 1.008 > 37 75 H 0.21371226370937 0.19419101475133 0.88178377099773 1.008 > 38 76 H 0.71371226370937 0.19419101475133 0.88178377099773 1.008 > 38 77 H 0.34978308990104 0.37961285995604 0.61755228076418 1.008 > 39 78 H 0.84978308990104 0.37961285995604 0.61755228076418 1.008 > 39 *79 H 0.28541100929401 0.43595495721390 0.11523810759786 1.008 > 40 80 H 0.78541100929401 0.43595495721390 0.11523810759786 1.008 > 40 81 H 0.14522843215067 0.38203854860068 0.71746942096757 1.008 > 41 82 H 0.64522843215067 0.38203854860068 0.71746942096757 1.008 > 41 83 H 0.21458899070599 0.56404504278610 0.88476189240214 1.008 > 42 84 H 0.71458899070599 0.56404504278610 0.88476189240214 1.008 > 42 85 H 0.48663692747860 0.85689996651209 0.15342344308420 1.008 > 43 86 H 0.98663692747860 0.85689996651209 0.15342344308420 1.008 > 43 87 H 0.40342380989226 0.13258499008594 0.48856587698547 1.008 > 44 88 H 0.90342380989226 0.13258499008594 0.48856587698547 1.008 > 44 89 H 0.15021691009896 0.62038714004396 0.38244771923582 1.008 > 45 90 H 0.65021691009896 0.62038714004396 0.38244771923582 1.008 > 45 91 H 0.38918360649066 0.87750668771278 0.98129886627939 1.008 > 46 92 H 0.88918360649066 0.87750668771278 0.98129886627939 1.008 > 46 93 H 0.16444081876496 0.88086098217409 0.69449922871470 1.008 > 47 94 H 0.66444081876496 0.88086098217409 0.69449922871470 1.008 > 47 95 H 0.14522843215067 0.11796145139932 0.21746942096757 1.008 > 48 96 H 0.64522843215067 0.11796145139932 0.21746942096757 1.008 > 48 97 H 0.28541100929401 0.06404504278610 0.61523810759786 1.008 > 49 98 H 0.78541100929401 0.06404504278610 0.61523810759786 1.008 > 49 99 H 0.01285549928401 0.87956873641579 0.34013575433715 1.008 > 50 100 H 0.51285549928401 0.87956873641579 0.34013575433715 1.008 > 50 101 H 0.33555918123504 0.11913901782591 0.30550077128530 1.008 > 51 102 H 0.83555918123504 0.11913901782591 0.30550077128530 1.008 > 51 103 H 0.09657619010774 0.86741500991406 0.51143412301453 1.008 > 52 104 H 0.59657619010774 0.86741500991406 0.51143412301453 1.008 > 52 105 H 0.01336307252140 0.14310003348791 0.84657655691580 1.008 > 53 106 H 0.51336307252140 0.14310003348791 0.84657655691580 1.008 > 53 107 H 0.35477156784933 0.61796145139932 0.28253057903243 1.008 > 54 108 H 0.85477156784933 0.61796145139932 0.28253057903243 1.008 > 54 109 H 0.28628773629063 0.80580898524867 0.11821622900227 1.008 > 55 110 H 0.78628773629063 0.80580898524867 0.11821622900227 1.008 > 55 111 H 0.15021691009896 0.87961285995604 0.88244771923582 1.008 > 56 112 H 0.65021691009896 0.87961285995604 0.88244771923582 1.008 > 56 113 H 0.40342380989226 0.36741500991406 0.98856587698547 1.008 > 57 114 H 0.90342380989226 0.36741500991406 0.98856587698547 1.008 > 57 115 H 0.21458899070599 0.93595495721390 0.38476189240214 1.008 > 58 116 H 0.71458899070599 0.93595495721390 0.38476189240214 1.008 > 58 117 H 0.11081639350934 0.37750668771278 0.51870113372061 1.008 > 59 118 H 0.61081639350934 0.37750668771278 0.51870113372061 1.008 > 59 119 H 0.48714450071599 0.12043126358421 0.65986424566285 1.008 > 60 120 H 0.98714450071599 0.12043126358421 0.65986424566285 1.008 > 60 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.5685107 0.0000000 -0.0232341 0.0000000 3.6018905 0.0000000 -0.0232336 0.0000000 3.4522445 -------------------------- Born effective charges -------------------------- 1 Li 1.1151176 -0.1132604 0.0318522 -0.0485730 1.0513573 0.0167325 0.0499470 0.0689981 1.0212570 2 Li 1.0615004 0.0134741 0.0755710 0.0068105 1.0274395 -0.0139783 0.0177397 -0.0075849 1.0092875 3 Li 1.0615004 -0.0134741 0.0755710 -0.0068105 1.0274395 0.0139783 0.0177397 0.0075849 1.0092875 4 Li 1.0515769 -0.1070635 0.0209301 -0.0421916 0.9834133 0.0345320 0.0380852 0.0831920 1.0362471 5 Li 1.0515769 -0.1070635 0.0209301 -0.0421916 0.9834133 0.0345320 0.0380852 0.0831920 1.0362471 6 Li 1.0615004 -0.0134741 0.0755710 -0.0068105 1.0274395 0.0139783 0.0177397 0.0075849 1.0092875 7 Li 1.0615004 0.0134741 0.0755710 0.0068105 1.0274395 -0.0139783 0.0177397 -0.0075849 1.0092875 8 Li 1.0515769 0.1070635 0.0209301 0.0421916 0.9834133 -0.0345320 0.0380852 -0.0831920 1.0362471 9 Li 1.1151176 -0.1132604 0.0318522 -0.0485730 1.0513573 0.0167325 0.0499470 0.0689981 1.0212570 10 Li 1.0515769 0.1070635 0.0209301 0.0421916 0.9834133 -0.0345320 0.0380852 -0.0831920 1.0362471 11 Li 1.1151176 0.1132604 0.0318522 0.0485730 1.0513573 -0.0167325 0.0499470 -0.0689981 1.0212570 12 Li 1.1151176 0.1132604 0.0318522 0.0485730 1.0513573 -0.0167325 0.0499470 -0.0689981 1.0212570 13 Be 0.7704047 -0.0903209 -0.0367040 -0.0457644 0.9725440 -0.0418367 -0.0965489 0.0449778 0.8471668 14 Be 0.7483766 0.1007027 0.0011275 0.0396726 0.9600275 0.0449599 -0.0942697 -0.0619873 0.7502892 15 Be 0.7483766 0.1007027 0.0011275 0.0396726 0.9600275 0.0449599 -0.0942697 -0.0619873 0.7502892 16 Be 0.7704047 0.0903209 -0.0367040 0.0457644 0.9725440 0.0418367 -0.0965489 -0.0449778 0.8471668 17 Be 0.7483766 -0.1007027 0.0011275 -0.0396726 0.9600275 -0.0449599 -0.0942697 0.0619873 0.7502892 18 Be 0.7704047 -0.0903209 -0.0367040 -0.0457644 0.9725440 -0.0418367 -0.0965489 0.0449778 0.8471668 19 Be 0.7483766 -0.1007027 0.0011275 -0.0396726 0.9600275 -0.0449599 -0.0942697 0.0619873 0.7502892 20 Be 0.8001426 0.0036832 -0.0346631 -0.0157796 0.9947921 -0.0114221 0.1658715 -0.0293654 0.9327541 21 Be 0.8001426 -0.0036832 -0.0346631 0.0157796 0.9947921 0.0114221 0.1658715 0.0293654 0.9327541 22 Be 0.7704047 0.0903209 -0.0367040 0.0457644 0.9725440 0.0418367 -0.0965489 -0.0449778 0.8471668 23 Be 0.8001426 0.0036832 -0.0346631 -0.0157796 0.9947921 -0.0114221 0.1658715 -0.0293654 0.9327541 24 Be 0.8001426 -0.0036832 -0.0346631 0.0157796 0.9947921 0.0114221 0.1658715 0.0293654 0.9327541 25 H -0.6265762 0.0036317 -0.1001231 -0.0026059 -0.5761163 -0.0137870 -0.1423593 -0.0088088 -0.8321347 26 H -0.2721900 -0.0005876 -0.0144492 -0.0054574 -1.0120070 -0.0072030 -0.0211563 -0.0166490 -0.3832051 27 H -0.5999314 0.1572754 0.1094084 0.2014340 -0.6637716 -0.2612947 0.0883566 -0.2062246 -0.4756672 28 H -0.7436424 -0.0425256 -0.1402417 -0.0229730 -0.6046863 -0.0648671 -0.1012208 -0.0397221 -0.6271289 29 H -1.0218076 -0.0006245 0.0702140 0.0046879 -0.6318118 0.0063040 0.0148854 0.0070044 -0.5437856 30 H -0.7208378 -0.0460256 -0.1526316 -0.0203137 -0.6085353 -0.0686194 -0.0908966 -0.0390939 -0.6219912 31 H -0.7436424 -0.0425256 -0.1402417 -0.0229730 -0.6046863 -0.0648671 -0.1012208 -0.0397221 -0.6271289 32 H -0.4804900 -0.0020643 0.0371493 0.0111723 -0.6258850 0.0381662 0.0437304 0.0284898 -0.7883992 33 H -1.0218076 -0.0006245 0.0702140 0.0046879 -0.6318118 0.0063040 0.0148854 0.0070044 -0.5437856 34 H -0.7208378 -0.0460256 -0.1526316 -0.0203137 -0.6085353 -0.0686194 -0.0908966 -0.0390939 -0.6219912 35 H -0.5024318 0.0023899 0.0540225 0.0140945 -0.6276279 0.0387687 0.0602090 0.0299088 -0.8744756 36 H -0.5999314 0.1572754 0.1094084 0.2014340 -0.6637716 -0.2612947 0.0883566 -0.2062246 -0.4756672 37 H -0.5024318 -0.0023899 0.0540225 -0.0140945 -0.6276279 -0.0387687 0.0602090 -0.0299088 -0.8744756 38 H -0.5999314 -0.1572754 0.1094084 -0.2014340 -0.6637716 0.2612947 0.0883566 0.2062246 -0.4756672 39 H -0.2721900 0.0005876 -0.0144492 0.0054574 -1.0120070 0.0072030 -0.0211563 0.0166490 -0.3832051 40 H -0.5792115 0.1559860 0.0785377 0.2014594 -0.6391325 -0.2468501 0.0676270 -0.1891504 -0.4502143 41 H -0.6265762 -0.0036317 -0.1001231 0.0026059 -0.5761163 0.0137870 -0.1423593 0.0088088 -0.8321347 42 H -0.5792115 0.1559860 0.0785377 0.2014594 -0.6391325 -0.2468501 0.0676270 -0.1891504 -0.4502143 43 H -0.7436424 0.0425256 -0.1402417 0.0229730 -0.6046863 0.0648671 -0.1012208 0.0397221 -0.6271289 44 H -0.4804900 0.0020643 0.0371493 -0.0111723 -0.6258850 -0.0381662 0.0437304 -0.0284898 -0.7883992 45 H -0.2721900 0.0005876 -0.0144492 0.0054574 -1.0120070 0.0072030 -0.0211563 0.0166490 -0.3832051 46 H -0.5024318 -0.0023899 0.0540225 -0.0140945 -0.6276279 -0.0387687 0.0602090 -0.0299088 -0.8744756 47 H -1.0218076 0.0006245 0.0702140 -0.0046879 -0.6318118 -0.0063040 0.0148854 -0.0070044 -0.5437856 48 H -0.6265762 0.0036317 -0.1001231 -0.0026059 -0.5761163 -0.0137870 -0.1423593 -0.0088088 -0.8321347 49 H -0.5792115 -0.1559860 0.0785377 -0.2014594 -0.6391325 0.2468501 0.0676270 0.1891504 -0.4502143 50 H -0.7208378 0.0460256 -0.1526316 0.0203137 -0.6085353 0.0686194 -0.0908966 0.0390939 -0.6219912 51 H -1.0218076 0.0006245 0.0702140 -0.0046879 -0.6318118 -0.0063040 0.0148854 -0.0070044 -0.5437856 52 H -0.4804900 0.0020643 0.0371493 -0.0111723 -0.6258850 -0.0381662 0.0437304 -0.0284898 -0.7883992 53 H -0.7436424 0.0425256 -0.1402417 0.0229730 -0.6046863 0.0648671 -0.1012208 0.0397221 -0.6271289 54 H -0.6265762 -0.0036317 -0.1001231 0.0026059 -0.5761163 0.0137870 -0.1423593 0.0088088 -0.8321347 55 H -0.5999314 -0.1572754 0.1094084 -0.2014340 -0.6637716 0.2612947 0.0883566 0.2062246 -0.4756672 56 H -0.2721900 -0.0005876 -0.0144492 -0.0054574 -1.0120070 -0.0072030 -0.0211563 -0.0166490 -0.3832051 57 H -0.4804900 -0.0020643 0.0371493 0.0111723 -0.6258850 0.0381662 0.0437304 0.0284898 -0.7883992 58 H -0.5792115 -0.1559860 0.0785377 -0.2014594 -0.6391325 0.2468501 0.0676270 0.1891504 -0.4502143 59 H -0.5024318 0.0023899 0.0540225 0.0140945 -0.6276279 0.0387687 0.0602090 0.0299088 -0.8744756 60 H -0.7208378 0.0460256 -0.1526316 0.0203137 -0.6085353 0.0686194 -0.0908966 0.0390939 -0.6219912 ---------------------------------------------------------------------------- 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: 360/360 Permutation basis: 32580/32580 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 8280 Number of blocks in projector: 8280 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 1800 Use submatrix version of eigh solver. (1) Block: 500 / 1800 (2) Block: 250 / 500 (2) 221 eigenvectors found. (2) Block: 500 / 500 (2) 223 eigenvectors found. (2) Complementary block size: 56 (2) Compute compressed projector. (2) Use standard solver. (2) 27 eigenvectors found. (1) 471 eigenvectors found. (1) Block: 1000 / 1800 (2) Block: 250 / 500 (2) 225 eigenvectors found. (2) Block: 500 / 500 (2) 227 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 23 eigenvectors found. (1) 475 eigenvectors found. (1) Block: 1500 / 1800 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 1800 / 1800 (1) 287 eigenvectors found. (1) Complementary block size: 86 (1) Compute compressed projector. (1) Use standard solver. (1) 57 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1800 Use submatrix version of eigh solver. (1) Block: 500 / 1800 (2) Block: 250 / 500 (2) 220 eigenvectors found. (2) Block: 500 / 500 (2) 224 eigenvectors found. (2) Complementary block size: 56 (2) Compute compressed projector. (2) Use standard solver. (2) 26 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1000 / 1800 (2) Block: 250 / 500 (2) 229 eigenvectors found. (2) Block: 500 / 500 (2) 222 eigenvectors found. (2) Complementary block size: 49 (2) Compute compressed projector. (2) Use standard solver. (2) 19 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1500 / 1800 (2) Block: 250 / 500 (2) 226 eigenvectors found. (2) Block: 500 / 500 (2) 223 eigenvectors found. (2) Complementary block size: 51 (2) Compute compressed projector. (2) Use standard solver. (2) 21 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1800 / 1800 (1) 277 eigenvectors found. (1) Complementary block size: 113 (1) Compute compressed projector. (1) Use standard solver. (1) 83 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1800 Use submatrix version of eigh solver. (1) Block: 500 / 1800 (2) Block: 250 / 500 (2) 220 eigenvectors found. (2) Block: 500 / 500 (2) 224 eigenvectors found. (2) Complementary block size: 56 (2) Compute compressed projector. (2) Use standard solver. (2) 26 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1000 / 1800 (2) Block: 250 / 500 (2) 229 eigenvectors found. (2) Block: 500 / 500 (2) 222 eigenvectors found. (2) Complementary block size: 49 (2) Compute compressed projector. (2) Use standard solver. (2) 19 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1500 / 1800 (2) Block: 250 / 500 (2) 226 eigenvectors found. (2) Block: 500 / 500 (2) 223 eigenvectors found. (2) Complementary block size: 51 (2) Compute compressed projector. (2) Use standard solver. (2) 21 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1800 / 1800 (1) 277 eigenvectors found. (1) Complementary block size: 113 (1) Compute compressed projector. (1) Use standard solver. (1) 83 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 960 Use submatrix version of eigh solver. (1) Block: 500 / 960 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 960 / 960 (1) 445 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 960 Use submatrix version of eigh solver. (1) Block: 500 / 960 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 960 / 960 (1) 445 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 960 Use submatrix version of eigh solver. (1) Block: 500 / 960 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 960 / 960 (1) 445 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. Tree of FC basis block matrices: - (8280, 8146), data: False |-- (960, 945), data: False |-- (960, 15), data: (960, 30) @ (30, 15) |-- (460, 445), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (960, 945), data: False |-- (960, 15), data: (960, 30) @ (30, 15) |-- (460, 445), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (960, 945), data: False |-- (960, 15), data: (960, 30) @ (30, 15) |-- (460, 445), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (1800, 1770), data: False |-- (1800, 83), data: (1800, 113) @ (113, 83) |-- (300, 277), data: True |-- (500, 470), data: False |-- (500, 21), data: (500, 51) @ (51, 21) |-- (250, 223), data: True |-- (250, 226), data: True |-- (500, 470), data: False |-- (500, 19), data: (500, 49) @ (49, 19) |-- (250, 222), data: True |-- (250, 229), data: True |-- (500, 470), data: False |-- (500, 26), data: (500, 56) @ (56, 26) |-- (250, 224), data: True |-- (250, 220), data: True |-- (1800, 1770), data: False |-- (1800, 83), data: (1800, 113) @ (113, 83) |-- (300, 277), data: True |-- (500, 470), data: False |-- (500, 21), data: (500, 51) @ (51, 21) |-- (250, 223), data: True |-- (250, 226), data: True |-- (500, 470), data: False |-- (500, 19), data: (500, 49) @ (49, 19) |-- (250, 222), data: True |-- (250, 229), data: True |-- (500, 470), data: False |-- (500, 26), data: (500, 56) @ (56, 26) |-- (250, 224), data: True |-- (250, 220), data: True |-- (1800, 1771), data: False |-- (1800, 57), data: (1800, 86) @ (86, 57) |-- (300, 287), data: True |-- (500, 481), data: False |-- (500, 17), data: (500, 36) @ (36, 17) |-- (250, 233), data: True |-- (250, 231), data: True |-- (500, 475), data: False |-- (500, 23), data: (500, 48) @ (48, 23) |-- (250, 227), data: True |-- (250, 225), data: True |-- (500, 471), data: False |-- (500, 27), data: (500, 56) @ (56, 27) |-- (250, 223), data: True |-- (250, 221), data: True ----- Solver_atoms: 1 -- 120 / 120 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 1840 - Time: 2.380 Solver_block: 200 / 1840 - Time: 2.059 Solver_block: 300 / 1840 - Time: 2.063 Solver_block: 400 / 1840 - Time: 2.060 Solver_block: 500 / 1840 - Time: 2.064 Solver_block: 600 / 1840 - Time: 2.059 Solver_block: 700 / 1840 - Time: 2.062 Solver_block: 800 / 1840 - Time: 2.059 Solver_block: 900 / 1840 - Time: 2.060 Solver_block: 1000 / 1840 - Time: 2.056 Solver_block: 1100 / 1840 - Time: 2.063 Solver_block: 1200 / 1840 - Time: 2.064 Solver_block: 1300 / 1840 - Time: 2.061 Solver_block: 1400 / 1840 - Time: 2.065 Solver_block: 1500 / 1840 - Time: 2.061 Solver_block: 1600 / 1840 - Time: 2.053 Solver_block: 1700 / 1840 - Time: 2.044 Solver_block: 1800 / 1840 - Time: 2.054 Solver_block: 1840 / 1840 - Time: 1.026 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 39.434 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) Permutation basis: 360/360 Permutation basis: 32580/32580 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 8280 Number of blocks in projector: 8280 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 1800 Use submatrix version of eigh solver. (1) Block: 500 / 1800 (2) Block: 250 / 500 (2) 221 eigenvectors found. (2) Block: 500 / 500 (2) 223 eigenvectors found. (2) Complementary block size: 56 (2) Compute compressed projector. (2) Use standard solver. (2) 27 eigenvectors found. (1) 471 eigenvectors found. (1) Block: 1000 / 1800 (2) Block: 250 / 500 (2) 225 eigenvectors found. (2) Block: 500 / 500 (2) 227 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 23 eigenvectors found. (1) 475 eigenvectors found. (1) Block: 1500 / 1800 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 1800 / 1800 (1) 287 eigenvectors found. (1) Complementary block size: 86 (1) Compute compressed projector. (1) Use standard solver. (1) 57 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1800 Use submatrix version of eigh solver. (1) Block: 500 / 1800 (2) Block: 250 / 500 (2) 220 eigenvectors found. (2) Block: 500 / 500 (2) 224 eigenvectors found. (2) Complementary block size: 56 (2) Compute compressed projector. (2) Use standard solver. (2) 26 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1000 / 1800 (2) Block: 250 / 500 (2) 229 eigenvectors found. (2) Block: 500 / 500 (2) 222 eigenvectors found. (2) Complementary block size: 49 (2) Compute compressed projector. (2) Use standard solver. (2) 19 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1500 / 1800 (2) Block: 250 / 500 (2) 226 eigenvectors found. (2) Block: 500 / 500 (2) 223 eigenvectors found. (2) Complementary block size: 51 (2) Compute compressed projector. (2) Use standard solver. (2) 21 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1800 / 1800 (1) 277 eigenvectors found. (1) Complementary block size: 113 (1) Compute compressed projector. (1) Use standard solver. (1) 83 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1800 Use submatrix version of eigh solver. (1) Block: 500 / 1800 (2) Block: 250 / 500 (2) 220 eigenvectors found. (2) Block: 500 / 500 (2) 224 eigenvectors found. (2) Complementary block size: 56 (2) Compute compressed projector. (2) Use standard solver. (2) 26 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1000 / 1800 (2) Block: 250 / 500 (2) 229 eigenvectors found. (2) Block: 500 / 500 (2) 222 eigenvectors found. (2) Complementary block size: 49 (2) Compute compressed projector. (2) Use standard solver. (2) 19 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1500 / 1800 (2) Block: 250 / 500 (2) 226 eigenvectors found. (2) Block: 500 / 500 (2) 223 eigenvectors found. (2) Complementary block size: 51 (2) Compute compressed projector. (2) Use standard solver. (2) 21 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1800 / 1800 (1) 277 eigenvectors found. (1) Complementary block size: 113 (1) Compute compressed projector. (1) Use standard solver. (1) 83 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 960 Use submatrix version of eigh solver. (1) Block: 500 / 960 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 960 / 960 (1) 445 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 960 Use submatrix version of eigh solver. (1) Block: 500 / 960 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 960 / 960 (1) 445 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 960 Use submatrix version of eigh solver. (1) Block: 500 / 960 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 960 / 960 (1) 445 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. Tree of FC basis block matrices: - (8280, 8146), data: False |-- (960, 945), data: False |-- (960, 15), data: (960, 30) @ (30, 15) |-- (460, 445), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (960, 945), data: False |-- (960, 15), data: (960, 30) @ (30, 15) |-- (460, 445), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (960, 945), data: False |-- (960, 15), data: (960, 30) @ (30, 15) |-- (460, 445), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (1800, 1770), data: False |-- (1800, 83), data: (1800, 113) @ (113, 83) |-- (300, 277), data: True |-- (500, 470), data: False |-- (500, 21), data: (500, 51) @ (51, 21) |-- (250, 223), data: True |-- (250, 226), data: True |-- (500, 470), data: False |-- (500, 19), data: (500, 49) @ (49, 19) |-- (250, 222), data: True |-- (250, 229), data: True |-- (500, 470), data: False |-- (500, 26), data: (500, 56) @ (56, 26) |-- (250, 224), data: True |-- (250, 220), data: True |-- (1800, 1770), data: False |-- (1800, 83), data: (1800, 113) @ (113, 83) |-- (300, 277), data: True |-- (500, 470), data: False |-- (500, 21), data: (500, 51) @ (51, 21) |-- (250, 223), data: True |-- (250, 226), data: True |-- (500, 470), data: False |-- (500, 19), data: (500, 49) @ (49, 19) |-- (250, 222), data: True |-- (250, 229), data: True |-- (500, 470), data: False |-- (500, 26), data: (500, 56) @ (56, 26) |-- (250, 224), data: True |-- (250, 220), data: True |-- (1800, 1771), data: False |-- (1800, 57), data: (1800, 86) @ (86, 57) |-- (300, 287), data: True |-- (500, 481), data: False |-- (500, 17), data: (500, 36) @ (36, 17) |-- (250, 233), data: True |-- (250, 231), data: True |-- (500, 475), data: False |-- (500, 23), data: (500, 48) @ (48, 23) |-- (250, 227), data: True |-- (250, 225), data: True |-- (500, 471), data: False |-- (500, 27), data: (500, 56) @ (56, 27) |-- (250, 223), data: True |-- (250, 221), data: True Max drift after symmetrization by symfc projector: -0.00000000 (zz) -0.00000000 (zz) 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 18:52:24]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 18:52:25]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.986709870098661 0.000000000000000 0.000000000000000 b 0.000000000000000 6.103057059999999 0.000000000000000 c -1.733362542579822 0.000000000000000 12.977164938893040 Atomic positions (fractional): 1 Li 0.76253655900648 0.88183043851640 0.40705634330659 6.941 2 Li 0.98814479067925 0.38083812075718 0.74764880503183 6.941 3 Li 0.98814479067925 0.11916187924282 0.24764880503183 6.941 4 Li 0.25112934593058 0.87312899948923 0.10130550144381 6.941 5 Li 0.74887065406942 0.12687100051077 0.89869449855619 6.941 6 Li 0.01185520932075 0.88083812075718 0.75235119496817 6.941 7 Li 0.01185520932075 0.61916187924282 0.25235119496817 6.941 8 Li 0.25112934593058 0.62687100051077 0.60130550144381 6.941 9 Li 0.23746344099352 0.11816956148360 0.59294365669341 6.941 10 Li 0.74887065406942 0.37312899948923 0.39869449855619 6.941 11 Li 0.76253655900648 0.61816956148360 0.90705634330659 6.941 12 Li 0.23746344099352 0.38183043851640 0.09294365669341 6.941 13 Be 0.77097575082285 0.59201894261260 0.58777864581734 9.012 14 Be 0.22499815840453 0.83379738617840 0.40864954313965 9.012 15 Be 0.77500184159547 0.16620261382160 0.59135045686035 9.012 16 Be 0.22902424917715 0.09201894261260 0.91222135418266 9.012 17 Be 0.22499815840453 0.66620261382160 0.90864954313965 9.012 18 Be 0.22902424917715 0.40798105738740 0.41222135418266 9.012 19 Be 0.77500184159547 0.33379738617840 0.09135045686035 9.012 20 Be 0.43347075544439 0.38188692923482 0.81392548676523 9.012 21 Be 0.43347075544439 0.11811307076518 0.31392548676523 9.012 22 Be 0.77097575082285 0.90798105738740 0.08777864581734 9.012 23 Be 0.56652924455561 0.61811307076518 0.18607451323477 9.012 24 Be 0.56652924455561 0.88188692923482 0.68607451323477 9.012 25 H 0.70954313569865 0.88203854860068 0.78253057903243 1.008 26 H 0.69956617980207 0.12038714004395 0.11755228076418 1.008 27 H 0.57257547258125 0.69419101475133 0.61821622900227 1.008 28 H 0.97327385495719 0.64310003348791 0.65342344308420 1.008 29 H 0.32888163752991 0.61913901782591 0.19449922871470 1.008 30 H 0.97428900143199 0.37956873641579 0.15986424566285 1.008 31 H 0.02672614504281 0.35689996651209 0.34657655691580 1.008 32 H 0.19315238021548 0.63258499008594 0.01143412301453 1.008 33 H 0.67111836247009 0.38086098217409 0.80550077128530 1.008 34 H 0.02571099856801 0.62043126358421 0.84013575433715 1.008 35 H 0.77836721298131 0.62249331228722 0.48129886627939 1.008 36 H 0.42742452741875 0.30580898524867 0.38178377099773 1.008 37 H 0.22163278701869 0.12249331228722 0.01870113372061 1.008 38 H 0.42742452741875 0.19419101475133 0.88178377099773 1.008 39 H 0.69956617980207 0.37961285995604 0.61755228076418 1.008 40 H 0.57082201858803 0.43595495721390 0.11523810759786 1.008 41 H 0.29045686430135 0.38203854860068 0.71746942096757 1.008 42 H 0.42917798141197 0.56404504278610 0.88476189240214 1.008 43 H 0.97327385495719 0.85689996651209 0.15342344308420 1.008 44 H 0.80684761978452 0.13258499008594 0.48856587698547 1.008 45 H 0.30043382019793 0.62038714004396 0.38244771923582 1.008 46 H 0.77836721298131 0.87750668771278 0.98129886627939 1.008 47 H 0.32888163752991 0.88086098217409 0.69449922871470 1.008 48 H 0.29045686430135 0.11796145139932 0.21746942096757 1.008 49 H 0.57082201858803 0.06404504278610 0.61523810759786 1.008 50 H 0.02571099856801 0.87956873641579 0.34013575433715 1.008 51 H 0.67111836247009 0.11913901782591 0.30550077128530 1.008 52 H 0.19315238021548 0.86741500991406 0.51143412301453 1.008 53 H 0.02672614504281 0.14310003348791 0.84657655691580 1.008 54 H 0.70954313569865 0.61796145139932 0.28253057903243 1.008 55 H 0.57257547258125 0.80580898524867 0.11821622900227 1.008 56 H 0.30043382019793 0.87961285995604 0.88244771923582 1.008 57 H 0.80684761978452 0.36741500991406 0.98856587698547 1.008 58 H 0.42917798141197 0.93595495721390 0.38476189240214 1.008 59 H 0.22163278701869 0.37750668771278 0.51870113372061 1.008 60 H 0.97428900143199 0.12043126358421 0.65986424566285 1.008 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.973419740197322 0.000000000000000 0.000000000000000 b 0.000000000000000 6.103057059999999 0.000000000000000 c -1.733362542579822 0.000000000000000 12.977164938893040 Atomic positions (fractional): 1 Li 0.38126827950324 0.88183043851640 0.40705634330659 6.941 > 1 2 Li 0.88126827950324 0.88183043851640 0.40705634330659 6.941 > 1 3 Li 0.49407239533962 0.38083812075718 0.74764880503183 6.941 > 3 4 Li 0.99407239533962 0.38083812075718 0.74764880503183 6.941 > 3 5 Li 0.49407239533962 0.11916187924282 0.24764880503183 6.941 > 5 6 Li 0.99407239533962 0.11916187924282 0.24764880503183 6.941 > 5 7 Li 0.12556467296529 0.87312899948923 0.10130550144381 6.941 > 7 8 Li 0.62556467296529 0.87312899948923 0.10130550144381 6.941 > 7 9 Li 0.37443532703471 0.12687100051077 0.89869449855619 6.941 > 9 10 Li 0.87443532703471 0.12687100051077 0.89869449855619 6.941 > 9 11 Li 0.00592760466037 0.88083812075718 0.75235119496817 6.941 > 11 12 Li 0.50592760466038 0.88083812075718 0.75235119496817 6.941 > 11 13 Li 0.00592760466037 0.61916187924282 0.25235119496817 6.941 > 13 14 Li 0.50592760466038 0.61916187924282 0.25235119496817 6.941 > 13 15 Li 0.12556467296529 0.62687100051077 0.60130550144381 6.941 > 15 16 Li 0.62556467296529 0.62687100051077 0.60130550144381 6.941 > 15 17 Li 0.11873172049676 0.11816956148360 0.59294365669341 6.941 > 17 18 Li 0.61873172049676 0.11816956148360 0.59294365669341 6.941 > 17 19 Li 0.37443532703471 0.37312899948923 0.39869449855619 6.941 > 19 20 Li 0.87443532703471 0.37312899948923 0.39869449855619 6.941 > 19 21 Li 0.38126827950324 0.61816956148360 0.90705634330659 6.941 > 21 22 Li 0.88126827950324 0.61816956148360 0.90705634330659 6.941 > 21 23 Li 0.11873172049676 0.38183043851640 0.09294365669341 6.941 > 23 24 Li 0.61873172049676 0.38183043851640 0.09294365669341 6.941 > 23 25 Be 0.38548787541142 0.59201894261260 0.58777864581734 9.012 > 25 26 Be 0.88548787541142 0.59201894261260 0.58777864581734 9.012 > 25 27 Be 0.11249907920226 0.83379738617840 0.40864954313965 9.012 > 27 28 Be 0.61249907920226 0.83379738617840 0.40864954313965 9.012 > 27 29 Be 0.38750092079774 0.16620261382160 0.59135045686035 9.012 > 29 30 Be 0.88750092079774 0.16620261382160 0.59135045686035 9.012 > 29 31 Be 0.11451212458858 0.09201894261260 0.91222135418266 9.012 > 31 32 Be 0.61451212458858 0.09201894261260 0.91222135418266 9.012 > 31 33 Be 0.11249907920226 0.66620261382160 0.90864954313965 9.012 > 33 34 Be 0.61249907920226 0.66620261382160 0.90864954313965 9.012 > 33 35 Be 0.11451212458858 0.40798105738740 0.41222135418266 9.012 > 35 36 Be 0.61451212458858 0.40798105738740 0.41222135418266 9.012 > 35 37 Be 0.38750092079774 0.33379738617840 0.09135045686035 9.012 > 37 38 Be 0.88750092079774 0.33379738617840 0.09135045686035 9.012 > 37 39 Be 0.21673537772219 0.38188692923482 0.81392548676523 9.012 > 39 40 Be 0.71673537772219 0.38188692923482 0.81392548676523 9.012 > 39 41 Be 0.21673537772219 0.11811307076518 0.31392548676523 9.012 > 41 42 Be 0.71673537772219 0.11811307076518 0.31392548676523 9.012 > 41 43 Be 0.38548787541142 0.90798105738740 0.08777864581734 9.012 > 43 44 Be 0.88548787541142 0.90798105738740 0.08777864581734 9.012 > 43 45 Be 0.28326462227781 0.61811307076518 0.18607451323477 9.012 > 45 46 Be 0.78326462227781 0.61811307076518 0.18607451323477 9.012 > 45 47 Be 0.28326462227781 0.88188692923482 0.68607451323477 9.012 > 47 48 Be 0.78326462227781 0.88188692923482 0.68607451323477 9.012 > 47 49 H 0.35477156784933 0.88203854860068 0.78253057903243 1.008 > 49 50 H 0.85477156784933 0.88203854860068 0.78253057903243 1.008 > 49 51 H 0.34978308990104 0.12038714004395 0.11755228076418 1.008 > 51 52 H 0.84978308990104 0.12038714004395 0.11755228076418 1.008 > 51 53 H 0.28628773629063 0.69419101475133 0.61821622900227 1.008 > 53 54 H 0.78628773629063 0.69419101475133 0.61821622900227 1.008 > 53 55 H 0.48663692747860 0.64310003348791 0.65342344308420 1.008 > 55 56 H 0.98663692747860 0.64310003348791 0.65342344308420 1.008 > 55 57 H 0.16444081876496 0.61913901782591 0.19449922871470 1.008 > 57 58 H 0.66444081876496 0.61913901782591 0.19449922871470 1.008 > 57 59 H 0.48714450071599 0.37956873641579 0.15986424566285 1.008 > 59 60 H 0.98714450071599 0.37956873641579 0.15986424566285 1.008 > 59 61 H 0.01336307252140 0.35689996651209 0.34657655691580 1.008 > 61 62 H 0.51336307252140 0.35689996651209 0.34657655691580 1.008 > 61 63 H 0.09657619010774 0.63258499008594 0.01143412301453 1.008 > 63 64 H 0.59657619010774 0.63258499008594 0.01143412301453 1.008 > 63 65 H 0.33555918123504 0.38086098217409 0.80550077128530 1.008 > 65 66 H 0.83555918123504 0.38086098217409 0.80550077128530 1.008 > 65 67 H 0.01285549928401 0.62043126358421 0.84013575433715 1.008 > 67 68 H 0.51285549928401 0.62043126358421 0.84013575433715 1.008 > 67 69 H 0.38918360649066 0.62249331228722 0.48129886627939 1.008 > 69 70 H 0.88918360649066 0.62249331228722 0.48129886627939 1.008 > 69 71 H 0.21371226370937 0.30580898524867 0.38178377099773 1.008 > 71 72 H 0.71371226370937 0.30580898524867 0.38178377099773 1.008 > 71 73 H 0.11081639350934 0.12249331228722 0.01870113372061 1.008 > 73 74 H 0.61081639350934 0.12249331228722 0.01870113372061 1.008 > 73 75 H 0.21371226370937 0.19419101475133 0.88178377099773 1.008 > 75 76 H 0.71371226370937 0.19419101475133 0.88178377099773 1.008 > 75 77 H 0.34978308990104 0.37961285995604 0.61755228076418 1.008 > 77 78 H 0.84978308990104 0.37961285995604 0.61755228076418 1.008 > 77 79 H 0.28541100929401 0.43595495721390 0.11523810759786 1.008 > 79 80 H 0.78541100929401 0.43595495721390 0.11523810759786 1.008 > 79 81 H 0.14522843215067 0.38203854860068 0.71746942096757 1.008 > 81 82 H 0.64522843215067 0.38203854860068 0.71746942096757 1.008 > 81 83 H 0.21458899070599 0.56404504278610 0.88476189240214 1.008 > 83 84 H 0.71458899070599 0.56404504278610 0.88476189240214 1.008 > 83 85 H 0.48663692747860 0.85689996651209 0.15342344308420 1.008 > 85 86 H 0.98663692747860 0.85689996651209 0.15342344308420 1.008 > 85 87 H 0.40342380989226 0.13258499008594 0.48856587698547 1.008 > 87 88 H 0.90342380989226 0.13258499008594 0.48856587698547 1.008 > 87 89 H 0.15021691009896 0.62038714004396 0.38244771923582 1.008 > 89 90 H 0.65021691009896 0.62038714004396 0.38244771923582 1.008 > 89 91 H 0.38918360649066 0.87750668771278 0.98129886627939 1.008 > 91 92 H 0.88918360649066 0.87750668771278 0.98129886627939 1.008 > 91 93 H 0.16444081876496 0.88086098217409 0.69449922871470 1.008 > 93 94 H 0.66444081876496 0.88086098217409 0.69449922871470 1.008 > 93 95 H 0.14522843215067 0.11796145139932 0.21746942096757 1.008 > 95 96 H 0.64522843215067 0.11796145139932 0.21746942096757 1.008 > 95 97 H 0.28541100929401 0.06404504278610 0.61523810759786 1.008 > 97 98 H 0.78541100929401 0.06404504278610 0.61523810759786 1.008 > 97 99 H 0.01285549928401 0.87956873641579 0.34013575433715 1.008 > 99 100 H 0.51285549928401 0.87956873641579 0.34013575433715 1.008 > 99 101 H 0.33555918123504 0.11913901782591 0.30550077128530 1.008 > 101 102 H 0.83555918123504 0.11913901782591 0.30550077128530 1.008 > 101 103 H 0.09657619010774 0.86741500991406 0.51143412301453 1.008 > 103 104 H 0.59657619010774 0.86741500991406 0.51143412301453 1.008 > 103 105 H 0.01336307252140 0.14310003348791 0.84657655691580 1.008 > 105 106 H 0.51336307252140 0.14310003348791 0.84657655691580 1.008 > 105 107 H 0.35477156784933 0.61796145139932 0.28253057903243 1.008 > 107 108 H 0.85477156784933 0.61796145139932 0.28253057903243 1.008 > 107 109 H 0.28628773629063 0.80580898524867 0.11821622900227 1.008 > 109 110 H 0.78628773629063 0.80580898524867 0.11821622900227 1.008 > 109 111 H 0.15021691009896 0.87961285995604 0.88244771923582 1.008 > 111 112 H 0.65021691009896 0.87961285995604 0.88244771923582 1.008 > 111 113 H 0.40342380989226 0.36741500991406 0.98856587698547 1.008 > 113 114 H 0.90342380989226 0.36741500991406 0.98856587698547 1.008 > 113 115 H 0.21458899070599 0.93595495721390 0.38476189240214 1.008 > 115 116 H 0.71458899070599 0.93595495721390 0.38476189240214 1.008 > 115 117 H 0.11081639350934 0.37750668771278 0.51870113372061 1.008 > 117 118 H 0.61081639350934 0.37750668771278 0.51870113372061 1.008 > 117 119 H 0.48714450071599 0.12043126358421 0.65986424566285 1.008 > 119 120 H 0.98714450071599 0.12043126358421 0.65986424566285 1.008 > 119 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.5685107 0.0000000 -0.0232341 0.0000000 3.6018905 0.0000000 -0.0232336 0.0000000 3.4522445 -------------------------- Born effective charges -------------------------- 1 Li 1.1151176 -0.1132604 0.0318522 -0.0485730 1.0513573 0.0167325 0.0499470 0.0689981 1.0212570 2 Li 1.0615004 0.0134741 0.0755710 0.0068105 1.0274395 -0.0139783 0.0177397 -0.0075849 1.0092875 3 Li 1.0615004 -0.0134741 0.0755710 -0.0068105 1.0274395 0.0139783 0.0177397 0.0075849 1.0092875 4 Li 1.0515769 -0.1070635 0.0209301 -0.0421916 0.9834133 0.0345320 0.0380852 0.0831920 1.0362471 5 Li 1.0515769 -0.1070635 0.0209301 -0.0421916 0.9834133 0.0345320 0.0380852 0.0831920 1.0362471 6 Li 1.0615004 -0.0134741 0.0755710 -0.0068105 1.0274395 0.0139783 0.0177397 0.0075849 1.0092875 7 Li 1.0615004 0.0134741 0.0755710 0.0068105 1.0274395 -0.0139783 0.0177397 -0.0075849 1.0092875 8 Li 1.0515769 0.1070635 0.0209301 0.0421916 0.9834133 -0.0345320 0.0380852 -0.0831920 1.0362471 9 Li 1.1151176 -0.1132604 0.0318522 -0.0485730 1.0513573 0.0167325 0.0499470 0.0689981 1.0212570 10 Li 1.0515769 0.1070635 0.0209301 0.0421916 0.9834133 -0.0345320 0.0380852 -0.0831920 1.0362471 11 Li 1.1151176 0.1132604 0.0318522 0.0485730 1.0513573 -0.0167325 0.0499470 -0.0689981 1.0212570 12 Li 1.1151176 0.1132604 0.0318522 0.0485730 1.0513573 -0.0167325 0.0499470 -0.0689981 1.0212570 13 Be 0.7704047 -0.0903209 -0.0367040 -0.0457644 0.9725440 -0.0418367 -0.0965489 0.0449778 0.8471668 14 Be 0.7483766 0.1007027 0.0011275 0.0396726 0.9600275 0.0449599 -0.0942697 -0.0619873 0.7502892 15 Be 0.7483766 0.1007027 0.0011275 0.0396726 0.9600275 0.0449599 -0.0942697 -0.0619873 0.7502892 16 Be 0.7704047 0.0903209 -0.0367040 0.0457644 0.9725440 0.0418367 -0.0965489 -0.0449778 0.8471668 17 Be 0.7483766 -0.1007027 0.0011275 -0.0396726 0.9600275 -0.0449599 -0.0942697 0.0619873 0.7502892 18 Be 0.7704047 -0.0903209 -0.0367040 -0.0457644 0.9725440 -0.0418367 -0.0965489 0.0449778 0.8471668 19 Be 0.7483766 -0.1007027 0.0011275 -0.0396726 0.9600275 -0.0449599 -0.0942697 0.0619873 0.7502892 20 Be 0.8001426 0.0036832 -0.0346631 -0.0157796 0.9947921 -0.0114221 0.1658715 -0.0293654 0.9327541 21 Be 0.8001426 -0.0036832 -0.0346631 0.0157796 0.9947921 0.0114221 0.1658715 0.0293654 0.9327541 22 Be 0.7704047 0.0903209 -0.0367040 0.0457644 0.9725440 0.0418367 -0.0965489 -0.0449778 0.8471668 23 Be 0.8001426 0.0036832 -0.0346631 -0.0157796 0.9947921 -0.0114221 0.1658715 -0.0293654 0.9327541 24 Be 0.8001426 -0.0036832 -0.0346631 0.0157796 0.9947921 0.0114221 0.1658715 0.0293654 0.9327541 25 H -0.6265762 0.0036317 -0.1001231 -0.0026059 -0.5761163 -0.0137870 -0.1423593 -0.0088088 -0.8321347 26 H -0.2721900 -0.0005876 -0.0144492 -0.0054574 -1.0120070 -0.0072030 -0.0211563 -0.0166490 -0.3832051 27 H -0.5999314 0.1572754 0.1094084 0.2014340 -0.6637716 -0.2612947 0.0883566 -0.2062246 -0.4756672 28 H -0.7436424 -0.0425256 -0.1402417 -0.0229730 -0.6046863 -0.0648671 -0.1012208 -0.0397221 -0.6271289 29 H -1.0218076 -0.0006245 0.0702140 0.0046879 -0.6318118 0.0063040 0.0148854 0.0070044 -0.5437856 30 H -0.7208378 -0.0460256 -0.1526316 -0.0203137 -0.6085353 -0.0686194 -0.0908966 -0.0390939 -0.6219912 31 H -0.7436424 -0.0425256 -0.1402417 -0.0229730 -0.6046863 -0.0648671 -0.1012208 -0.0397221 -0.6271289 32 H -0.4804900 -0.0020643 0.0371493 0.0111723 -0.6258850 0.0381662 0.0437304 0.0284898 -0.7883992 33 H -1.0218076 -0.0006245 0.0702140 0.0046879 -0.6318118 0.0063040 0.0148854 0.0070044 -0.5437856 34 H -0.7208378 -0.0460256 -0.1526316 -0.0203137 -0.6085353 -0.0686194 -0.0908966 -0.0390939 -0.6219912 35 H -0.5024318 0.0023899 0.0540225 0.0140945 -0.6276279 0.0387687 0.0602090 0.0299088 -0.8744756 36 H -0.5999314 0.1572754 0.1094084 0.2014340 -0.6637716 -0.2612947 0.0883566 -0.2062246 -0.4756672 37 H -0.5024318 -0.0023899 0.0540225 -0.0140945 -0.6276279 -0.0387687 0.0602090 -0.0299088 -0.8744756 38 H -0.5999314 -0.1572754 0.1094084 -0.2014340 -0.6637716 0.2612947 0.0883566 0.2062246 -0.4756672 39 H -0.2721900 0.0005876 -0.0144492 0.0054574 -1.0120070 0.0072030 -0.0211563 0.0166490 -0.3832051 40 H -0.5792115 0.1559860 0.0785377 0.2014594 -0.6391325 -0.2468501 0.0676270 -0.1891504 -0.4502143 41 H -0.6265762 -0.0036317 -0.1001231 0.0026059 -0.5761163 0.0137870 -0.1423593 0.0088088 -0.8321347 42 H -0.5792115 0.1559860 0.0785377 0.2014594 -0.6391325 -0.2468501 0.0676270 -0.1891504 -0.4502143 43 H -0.7436424 0.0425256 -0.1402417 0.0229730 -0.6046863 0.0648671 -0.1012208 0.0397221 -0.6271289 44 H -0.4804900 0.0020643 0.0371493 -0.0111723 -0.6258850 -0.0381662 0.0437304 -0.0284898 -0.7883992 45 H -0.2721900 0.0005876 -0.0144492 0.0054574 -1.0120070 0.0072030 -0.0211563 0.0166490 -0.3832051 46 H -0.5024318 -0.0023899 0.0540225 -0.0140945 -0.6276279 -0.0387687 0.0602090 -0.0299088 -0.8744756 47 H -1.0218076 0.0006245 0.0702140 -0.0046879 -0.6318118 -0.0063040 0.0148854 -0.0070044 -0.5437856 48 H -0.6265762 0.0036317 -0.1001231 -0.0026059 -0.5761163 -0.0137870 -0.1423593 -0.0088088 -0.8321347 49 H -0.5792115 -0.1559860 0.0785377 -0.2014594 -0.6391325 0.2468501 0.0676270 0.1891504 -0.4502143 50 H -0.7208378 0.0460256 -0.1526316 0.0203137 -0.6085353 0.0686194 -0.0908966 0.0390939 -0.6219912 51 H -1.0218076 0.0006245 0.0702140 -0.0046879 -0.6318118 -0.0063040 0.0148854 -0.0070044 -0.5437856 52 H -0.4804900 0.0020643 0.0371493 -0.0111723 -0.6258850 -0.0381662 0.0437304 -0.0284898 -0.7883992 53 H -0.7436424 0.0425256 -0.1402417 0.0229730 -0.6046863 0.0648671 -0.1012208 0.0397221 -0.6271289 54 H -0.6265762 -0.0036317 -0.1001231 0.0026059 -0.5761163 0.0137870 -0.1423593 0.0088088 -0.8321347 55 H -0.5999314 -0.1572754 0.1094084 -0.2014340 -0.6637716 0.2612947 0.0883566 0.2062246 -0.4756672 56 H -0.2721900 -0.0005876 -0.0144492 -0.0054574 -1.0120070 -0.0072030 -0.0211563 -0.0166490 -0.3832051 57 H -0.4804900 -0.0020643 0.0371493 0.0111723 -0.6258850 0.0381662 0.0437304 0.0284898 -0.7883992 58 H -0.5792115 -0.1559860 0.0785377 -0.2014594 -0.6391325 0.2468501 0.0676270 0.1891504 -0.4502143 59 H -0.5024318 0.0023899 0.0540225 0.0140945 -0.6276279 0.0387687 0.0602090 0.0299088 -0.8744756 60 H -0.7208378 0.0460256 -0.1526316 0.0203137 -0.6085353 0.0686194 -0.0908966 0.0390939 -0.6219912 ---------------------------------------------------------------------------- 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] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 3, 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] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 7, 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] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 27, 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] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 39, 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] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] 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] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 51, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 53, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 55, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 57, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 59, 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] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 63, 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] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 69, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Computing fc3[ 79, 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] [-0.0013 0.0000 0.0099] [ 0.0013 0.0000 -0.0099] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000000 (zzz) 0.00000000 (zzz) 0.00000000 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (xz) 0.00000000 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 18:53:42]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 18:53:43]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.986709870098661 0.000000000000000 0.000000000000000 b 0.000000000000000 6.103057059999999 0.000000000000000 c -1.733362542579822 0.000000000000000 12.977164938893040 Atomic positions (fractional): 1 Li 0.76253655900648 0.88183043851640 0.40705634330659 6.941 2 Li 0.98814479067925 0.38083812075718 0.74764880503183 6.941 3 Li 0.98814479067925 0.11916187924282 0.24764880503183 6.941 4 Li 0.25112934593058 0.87312899948923 0.10130550144381 6.941 5 Li 0.74887065406942 0.12687100051077 0.89869449855619 6.941 6 Li 0.01185520932075 0.88083812075718 0.75235119496817 6.941 7 Li 0.01185520932075 0.61916187924282 0.25235119496817 6.941 8 Li 0.25112934593058 0.62687100051077 0.60130550144381 6.941 9 Li 0.23746344099352 0.11816956148360 0.59294365669341 6.941 10 Li 0.74887065406942 0.37312899948923 0.39869449855619 6.941 11 Li 0.76253655900648 0.61816956148360 0.90705634330659 6.941 12 Li 0.23746344099352 0.38183043851640 0.09294365669341 6.941 13 Be 0.77097575082285 0.59201894261260 0.58777864581734 9.012 14 Be 0.22499815840453 0.83379738617840 0.40864954313965 9.012 15 Be 0.77500184159547 0.16620261382160 0.59135045686035 9.012 16 Be 0.22902424917715 0.09201894261260 0.91222135418266 9.012 17 Be 0.22499815840453 0.66620261382160 0.90864954313965 9.012 18 Be 0.22902424917715 0.40798105738740 0.41222135418266 9.012 19 Be 0.77500184159547 0.33379738617840 0.09135045686035 9.012 20 Be 0.43347075544439 0.38188692923482 0.81392548676523 9.012 21 Be 0.43347075544439 0.11811307076518 0.31392548676523 9.012 22 Be 0.77097575082285 0.90798105738740 0.08777864581734 9.012 23 Be 0.56652924455561 0.61811307076518 0.18607451323477 9.012 24 Be 0.56652924455561 0.88188692923482 0.68607451323477 9.012 25 H 0.70954313569865 0.88203854860068 0.78253057903243 1.008 26 H 0.69956617980207 0.12038714004395 0.11755228076418 1.008 27 H 0.57257547258125 0.69419101475133 0.61821622900227 1.008 28 H 0.97327385495719 0.64310003348791 0.65342344308420 1.008 29 H 0.32888163752991 0.61913901782591 0.19449922871470 1.008 30 H 0.97428900143199 0.37956873641579 0.15986424566285 1.008 31 H 0.02672614504281 0.35689996651209 0.34657655691580 1.008 32 H 0.19315238021548 0.63258499008594 0.01143412301453 1.008 33 H 0.67111836247009 0.38086098217409 0.80550077128530 1.008 34 H 0.02571099856801 0.62043126358421 0.84013575433715 1.008 35 H 0.77836721298131 0.62249331228722 0.48129886627939 1.008 36 H 0.42742452741875 0.30580898524867 0.38178377099773 1.008 37 H 0.22163278701869 0.12249331228722 0.01870113372061 1.008 38 H 0.42742452741875 0.19419101475133 0.88178377099773 1.008 39 H 0.69956617980207 0.37961285995604 0.61755228076418 1.008 40 H 0.57082201858803 0.43595495721390 0.11523810759786 1.008 41 H 0.29045686430135 0.38203854860068 0.71746942096757 1.008 42 H 0.42917798141197 0.56404504278610 0.88476189240214 1.008 43 H 0.97327385495719 0.85689996651209 0.15342344308420 1.008 44 H 0.80684761978452 0.13258499008594 0.48856587698547 1.008 45 H 0.30043382019793 0.62038714004396 0.38244771923582 1.008 46 H 0.77836721298131 0.87750668771278 0.98129886627939 1.008 47 H 0.32888163752991 0.88086098217409 0.69449922871470 1.008 48 H 0.29045686430135 0.11796145139932 0.21746942096757 1.008 49 H 0.57082201858803 0.06404504278610 0.61523810759786 1.008 50 H 0.02571099856801 0.87956873641579 0.34013575433715 1.008 51 H 0.67111836247009 0.11913901782591 0.30550077128530 1.008 52 H 0.19315238021548 0.86741500991406 0.51143412301453 1.008 53 H 0.02672614504281 0.14310003348791 0.84657655691580 1.008 54 H 0.70954313569865 0.61796145139932 0.28253057903243 1.008 55 H 0.57257547258125 0.80580898524867 0.11821622900227 1.008 56 H 0.30043382019793 0.87961285995604 0.88244771923582 1.008 57 H 0.80684761978452 0.36741500991406 0.98856587698547 1.008 58 H 0.42917798141197 0.93595495721390 0.38476189240214 1.008 59 H 0.22163278701869 0.37750668771278 0.51870113372061 1.008 60 H 0.97428900143199 0.12043126358421 0.65986424566285 1.008 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.973419740197322 0.000000000000000 0.000000000000000 b 0.000000000000000 6.103057059999999 0.000000000000000 c -1.733362542579822 0.000000000000000 12.977164938893040 Atomic positions (fractional): 1 Li 0.38126827950324 0.88183043851640 0.40705634330659 6.941 > 1 2 Li 0.88126827950324 0.88183043851640 0.40705634330659 6.941 > 1 3 Li 0.49407239533962 0.38083812075718 0.74764880503183 6.941 > 3 4 Li 0.99407239533962 0.38083812075718 0.74764880503183 6.941 > 3 5 Li 0.49407239533962 0.11916187924282 0.24764880503183 6.941 > 5 6 Li 0.99407239533962 0.11916187924282 0.24764880503183 6.941 > 5 7 Li 0.12556467296529 0.87312899948923 0.10130550144381 6.941 > 7 8 Li 0.62556467296529 0.87312899948923 0.10130550144381 6.941 > 7 9 Li 0.37443532703471 0.12687100051077 0.89869449855619 6.941 > 9 10 Li 0.87443532703471 0.12687100051077 0.89869449855619 6.941 > 9 11 Li 0.00592760466037 0.88083812075718 0.75235119496817 6.941 > 11 12 Li 0.50592760466038 0.88083812075718 0.75235119496817 6.941 > 11 13 Li 0.00592760466037 0.61916187924282 0.25235119496817 6.941 > 13 14 Li 0.50592760466038 0.61916187924282 0.25235119496817 6.941 > 13 15 Li 0.12556467296529 0.62687100051077 0.60130550144381 6.941 > 15 16 Li 0.62556467296529 0.62687100051077 0.60130550144381 6.941 > 15 17 Li 0.11873172049676 0.11816956148360 0.59294365669341 6.941 > 17 18 Li 0.61873172049676 0.11816956148360 0.59294365669341 6.941 > 17 19 Li 0.37443532703471 0.37312899948923 0.39869449855619 6.941 > 19 20 Li 0.87443532703471 0.37312899948923 0.39869449855619 6.941 > 19 21 Li 0.38126827950324 0.61816956148360 0.90705634330659 6.941 > 21 22 Li 0.88126827950324 0.61816956148360 0.90705634330659 6.941 > 21 23 Li 0.11873172049676 0.38183043851640 0.09294365669341 6.941 > 23 24 Li 0.61873172049676 0.38183043851640 0.09294365669341 6.941 > 23 25 Be 0.38548787541142 0.59201894261260 0.58777864581734 9.012 > 25 26 Be 0.88548787541142 0.59201894261260 0.58777864581734 9.012 > 25 27 Be 0.11249907920226 0.83379738617840 0.40864954313965 9.012 > 27 28 Be 0.61249907920226 0.83379738617840 0.40864954313965 9.012 > 27 29 Be 0.38750092079774 0.16620261382160 0.59135045686035 9.012 > 29 30 Be 0.88750092079774 0.16620261382160 0.59135045686035 9.012 > 29 31 Be 0.11451212458858 0.09201894261260 0.91222135418266 9.012 > 31 32 Be 0.61451212458858 0.09201894261260 0.91222135418266 9.012 > 31 33 Be 0.11249907920226 0.66620261382160 0.90864954313965 9.012 > 33 34 Be 0.61249907920226 0.66620261382160 0.90864954313965 9.012 > 33 35 Be 0.11451212458858 0.40798105738740 0.41222135418266 9.012 > 35 36 Be 0.61451212458858 0.40798105738740 0.41222135418266 9.012 > 35 37 Be 0.38750092079774 0.33379738617840 0.09135045686035 9.012 > 37 38 Be 0.88750092079774 0.33379738617840 0.09135045686035 9.012 > 37 39 Be 0.21673537772219 0.38188692923482 0.81392548676523 9.012 > 39 40 Be 0.71673537772219 0.38188692923482 0.81392548676523 9.012 > 39 41 Be 0.21673537772219 0.11811307076518 0.31392548676523 9.012 > 41 42 Be 0.71673537772219 0.11811307076518 0.31392548676523 9.012 > 41 43 Be 0.38548787541142 0.90798105738740 0.08777864581734 9.012 > 43 44 Be 0.88548787541142 0.90798105738740 0.08777864581734 9.012 > 43 45 Be 0.28326462227781 0.61811307076518 0.18607451323477 9.012 > 45 46 Be 0.78326462227781 0.61811307076518 0.18607451323477 9.012 > 45 47 Be 0.28326462227781 0.88188692923482 0.68607451323477 9.012 > 47 48 Be 0.78326462227781 0.88188692923482 0.68607451323477 9.012 > 47 49 H 0.35477156784933 0.88203854860068 0.78253057903243 1.008 > 49 50 H 0.85477156784933 0.88203854860068 0.78253057903243 1.008 > 49 51 H 0.34978308990104 0.12038714004395 0.11755228076418 1.008 > 51 52 H 0.84978308990104 0.12038714004395 0.11755228076418 1.008 > 51 53 H 0.28628773629063 0.69419101475133 0.61821622900227 1.008 > 53 54 H 0.78628773629063 0.69419101475133 0.61821622900227 1.008 > 53 55 H 0.48663692747860 0.64310003348791 0.65342344308420 1.008 > 55 56 H 0.98663692747860 0.64310003348791 0.65342344308420 1.008 > 55 57 H 0.16444081876496 0.61913901782591 0.19449922871470 1.008 > 57 58 H 0.66444081876496 0.61913901782591 0.19449922871470 1.008 > 57 59 H 0.48714450071599 0.37956873641579 0.15986424566285 1.008 > 59 60 H 0.98714450071599 0.37956873641579 0.15986424566285 1.008 > 59 61 H 0.01336307252140 0.35689996651209 0.34657655691580 1.008 > 61 62 H 0.51336307252140 0.35689996651209 0.34657655691580 1.008 > 61 63 H 0.09657619010774 0.63258499008594 0.01143412301453 1.008 > 63 64 H 0.59657619010774 0.63258499008594 0.01143412301453 1.008 > 63 65 H 0.33555918123504 0.38086098217409 0.80550077128530 1.008 > 65 66 H 0.83555918123504 0.38086098217409 0.80550077128530 1.008 > 65 67 H 0.01285549928401 0.62043126358421 0.84013575433715 1.008 > 67 68 H 0.51285549928401 0.62043126358421 0.84013575433715 1.008 > 67 69 H 0.38918360649066 0.62249331228722 0.48129886627939 1.008 > 69 70 H 0.88918360649066 0.62249331228722 0.48129886627939 1.008 > 69 71 H 0.21371226370937 0.30580898524867 0.38178377099773 1.008 > 71 72 H 0.71371226370937 0.30580898524867 0.38178377099773 1.008 > 71 73 H 0.11081639350934 0.12249331228722 0.01870113372061 1.008 > 73 74 H 0.61081639350934 0.12249331228722 0.01870113372061 1.008 > 73 75 H 0.21371226370937 0.19419101475133 0.88178377099773 1.008 > 75 76 H 0.71371226370937 0.19419101475133 0.88178377099773 1.008 > 75 77 H 0.34978308990104 0.37961285995604 0.61755228076418 1.008 > 77 78 H 0.84978308990104 0.37961285995604 0.61755228076418 1.008 > 77 79 H 0.28541100929401 0.43595495721390 0.11523810759786 1.008 > 79 80 H 0.78541100929401 0.43595495721390 0.11523810759786 1.008 > 79 81 H 0.14522843215067 0.38203854860068 0.71746942096757 1.008 > 81 82 H 0.64522843215067 0.38203854860068 0.71746942096757 1.008 > 81 83 H 0.21458899070599 0.56404504278610 0.88476189240214 1.008 > 83 84 H 0.71458899070599 0.56404504278610 0.88476189240214 1.008 > 83 85 H 0.48663692747860 0.85689996651209 0.15342344308420 1.008 > 85 86 H 0.98663692747860 0.85689996651209 0.15342344308420 1.008 > 85 87 H 0.40342380989226 0.13258499008594 0.48856587698547 1.008 > 87 88 H 0.90342380989226 0.13258499008594 0.48856587698547 1.008 > 87 89 H 0.15021691009896 0.62038714004396 0.38244771923582 1.008 > 89 90 H 0.65021691009896 0.62038714004396 0.38244771923582 1.008 > 89 91 H 0.38918360649066 0.87750668771278 0.98129886627939 1.008 > 91 92 H 0.88918360649066 0.87750668771278 0.98129886627939 1.008 > 91 93 H 0.16444081876496 0.88086098217409 0.69449922871470 1.008 > 93 94 H 0.66444081876496 0.88086098217409 0.69449922871470 1.008 > 93 95 H 0.14522843215067 0.11796145139932 0.21746942096757 1.008 > 95 96 H 0.64522843215067 0.11796145139932 0.21746942096757 1.008 > 95 97 H 0.28541100929401 0.06404504278610 0.61523810759786 1.008 > 97 98 H 0.78541100929401 0.06404504278610 0.61523810759786 1.008 > 97 99 H 0.01285549928401 0.87956873641579 0.34013575433715 1.008 > 99 100 H 0.51285549928401 0.87956873641579 0.34013575433715 1.008 > 99 101 H 0.33555918123504 0.11913901782591 0.30550077128530 1.008 > 101 102 H 0.83555918123504 0.11913901782591 0.30550077128530 1.008 > 101 103 H 0.09657619010774 0.86741500991406 0.51143412301453 1.008 > 103 104 H 0.59657619010774 0.86741500991406 0.51143412301453 1.008 > 103 105 H 0.01336307252140 0.14310003348791 0.84657655691580 1.008 > 105 106 H 0.51336307252140 0.14310003348791 0.84657655691580 1.008 > 105 107 H 0.35477156784933 0.61796145139932 0.28253057903243 1.008 > 107 108 H 0.85477156784933 0.61796145139932 0.28253057903243 1.008 > 107 109 H 0.28628773629063 0.80580898524867 0.11821622900227 1.008 > 109 110 H 0.78628773629063 0.80580898524867 0.11821622900227 1.008 > 109 111 H 0.15021691009896 0.87961285995604 0.88244771923582 1.008 > 111 112 H 0.65021691009896 0.87961285995604 0.88244771923582 1.008 > 111 113 H 0.40342380989226 0.36741500991406 0.98856587698547 1.008 > 113 114 H 0.90342380989226 0.36741500991406 0.98856587698547 1.008 > 113 115 H 0.21458899070599 0.93595495721390 0.38476189240214 1.008 > 115 116 H 0.71458899070599 0.93595495721390 0.38476189240214 1.008 > 115 117 H 0.11081639350934 0.37750668771278 0.51870113372061 1.008 > 117 118 H 0.61081639350934 0.37750668771278 0.51870113372061 1.008 > 117 119 H 0.48714450071599 0.12043126358421 0.65986424566285 1.008 > 119 120 H 0.98714450071599 0.12043126358421 0.65986424566285 1.008 > 119 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.5685107 0.0000000 -0.0232341 0.0000000 3.6018905 0.0000000 -0.0232336 0.0000000 3.4522445 -------------------------- Born effective charges -------------------------- 1 Li 1.1151176 -0.1132604 0.0318522 -0.0485730 1.0513573 0.0167325 0.0499470 0.0689981 1.0212570 2 Li 1.0615004 0.0134741 0.0755710 0.0068105 1.0274395 -0.0139783 0.0177397 -0.0075849 1.0092875 3 Li 1.0615004 -0.0134741 0.0755710 -0.0068105 1.0274395 0.0139783 0.0177397 0.0075849 1.0092875 4 Li 1.0515769 -0.1070635 0.0209301 -0.0421916 0.9834133 0.0345320 0.0380852 0.0831920 1.0362471 5 Li 1.0515769 -0.1070635 0.0209301 -0.0421916 0.9834133 0.0345320 0.0380852 0.0831920 1.0362471 6 Li 1.0615004 -0.0134741 0.0755710 -0.0068105 1.0274395 0.0139783 0.0177397 0.0075849 1.0092875 7 Li 1.0615004 0.0134741 0.0755710 0.0068105 1.0274395 -0.0139783 0.0177397 -0.0075849 1.0092875 8 Li 1.0515769 0.1070635 0.0209301 0.0421916 0.9834133 -0.0345320 0.0380852 -0.0831920 1.0362471 9 Li 1.1151176 -0.1132604 0.0318522 -0.0485730 1.0513573 0.0167325 0.0499470 0.0689981 1.0212570 10 Li 1.0515769 0.1070635 0.0209301 0.0421916 0.9834133 -0.0345320 0.0380852 -0.0831920 1.0362471 11 Li 1.1151176 0.1132604 0.0318522 0.0485730 1.0513573 -0.0167325 0.0499470 -0.0689981 1.0212570 12 Li 1.1151176 0.1132604 0.0318522 0.0485730 1.0513573 -0.0167325 0.0499470 -0.0689981 1.0212570 13 Be 0.7704047 -0.0903209 -0.0367040 -0.0457644 0.9725440 -0.0418367 -0.0965489 0.0449778 0.8471668 14 Be 0.7483766 0.1007027 0.0011275 0.0396726 0.9600275 0.0449599 -0.0942697 -0.0619873 0.7502892 15 Be 0.7483766 0.1007027 0.0011275 0.0396726 0.9600275 0.0449599 -0.0942697 -0.0619873 0.7502892 16 Be 0.7704047 0.0903209 -0.0367040 0.0457644 0.9725440 0.0418367 -0.0965489 -0.0449778 0.8471668 17 Be 0.7483766 -0.1007027 0.0011275 -0.0396726 0.9600275 -0.0449599 -0.0942697 0.0619873 0.7502892 18 Be 0.7704047 -0.0903209 -0.0367040 -0.0457644 0.9725440 -0.0418367 -0.0965489 0.0449778 0.8471668 19 Be 0.7483766 -0.1007027 0.0011275 -0.0396726 0.9600275 -0.0449599 -0.0942697 0.0619873 0.7502892 20 Be 0.8001426 0.0036832 -0.0346631 -0.0157796 0.9947921 -0.0114221 0.1658715 -0.0293654 0.9327541 21 Be 0.8001426 -0.0036832 -0.0346631 0.0157796 0.9947921 0.0114221 0.1658715 0.0293654 0.9327541 22 Be 0.7704047 0.0903209 -0.0367040 0.0457644 0.9725440 0.0418367 -0.0965489 -0.0449778 0.8471668 23 Be 0.8001426 0.0036832 -0.0346631 -0.0157796 0.9947921 -0.0114221 0.1658715 -0.0293654 0.9327541 24 Be 0.8001426 -0.0036832 -0.0346631 0.0157796 0.9947921 0.0114221 0.1658715 0.0293654 0.9327541 25 H -0.6265762 0.0036317 -0.1001231 -0.0026059 -0.5761163 -0.0137870 -0.1423593 -0.0088088 -0.8321347 26 H -0.2721900 -0.0005876 -0.0144492 -0.0054574 -1.0120070 -0.0072030 -0.0211563 -0.0166490 -0.3832051 27 H -0.5999314 0.1572754 0.1094084 0.2014340 -0.6637716 -0.2612947 0.0883566 -0.2062246 -0.4756672 28 H -0.7436424 -0.0425256 -0.1402417 -0.0229730 -0.6046863 -0.0648671 -0.1012208 -0.0397221 -0.6271289 29 H -1.0218076 -0.0006245 0.0702140 0.0046879 -0.6318118 0.0063040 0.0148854 0.0070044 -0.5437856 30 H -0.7208378 -0.0460256 -0.1526316 -0.0203137 -0.6085353 -0.0686194 -0.0908966 -0.0390939 -0.6219912 31 H -0.7436424 -0.0425256 -0.1402417 -0.0229730 -0.6046863 -0.0648671 -0.1012208 -0.0397221 -0.6271289 32 H -0.4804900 -0.0020643 0.0371493 0.0111723 -0.6258850 0.0381662 0.0437304 0.0284898 -0.7883992 33 H -1.0218076 -0.0006245 0.0702140 0.0046879 -0.6318118 0.0063040 0.0148854 0.0070044 -0.5437856 34 H -0.7208378 -0.0460256 -0.1526316 -0.0203137 -0.6085353 -0.0686194 -0.0908966 -0.0390939 -0.6219912 35 H -0.5024318 0.0023899 0.0540225 0.0140945 -0.6276279 0.0387687 0.0602090 0.0299088 -0.8744756 36 H -0.5999314 0.1572754 0.1094084 0.2014340 -0.6637716 -0.2612947 0.0883566 -0.2062246 -0.4756672 37 H -0.5024318 -0.0023899 0.0540225 -0.0140945 -0.6276279 -0.0387687 0.0602090 -0.0299088 -0.8744756 38 H -0.5999314 -0.1572754 0.1094084 -0.2014340 -0.6637716 0.2612947 0.0883566 0.2062246 -0.4756672 39 H -0.2721900 0.0005876 -0.0144492 0.0054574 -1.0120070 0.0072030 -0.0211563 0.0166490 -0.3832051 40 H -0.5792115 0.1559860 0.0785377 0.2014594 -0.6391325 -0.2468501 0.0676270 -0.1891504 -0.4502143 41 H -0.6265762 -0.0036317 -0.1001231 0.0026059 -0.5761163 0.0137870 -0.1423593 0.0088088 -0.8321347 42 H -0.5792115 0.1559860 0.0785377 0.2014594 -0.6391325 -0.2468501 0.0676270 -0.1891504 -0.4502143 43 H -0.7436424 0.0425256 -0.1402417 0.0229730 -0.6046863 0.0648671 -0.1012208 0.0397221 -0.6271289 44 H -0.4804900 0.0020643 0.0371493 -0.0111723 -0.6258850 -0.0381662 0.0437304 -0.0284898 -0.7883992 45 H -0.2721900 0.0005876 -0.0144492 0.0054574 -1.0120070 0.0072030 -0.0211563 0.0166490 -0.3832051 46 H -0.5024318 -0.0023899 0.0540225 -0.0140945 -0.6276279 -0.0387687 0.0602090 -0.0299088 -0.8744756 47 H -1.0218076 0.0006245 0.0702140 -0.0046879 -0.6318118 -0.0063040 0.0148854 -0.0070044 -0.5437856 48 H -0.6265762 0.0036317 -0.1001231 -0.0026059 -0.5761163 -0.0137870 -0.1423593 -0.0088088 -0.8321347 49 H -0.5792115 -0.1559860 0.0785377 -0.2014594 -0.6391325 0.2468501 0.0676270 0.1891504 -0.4502143 50 H -0.7208378 0.0460256 -0.1526316 0.0203137 -0.6085353 0.0686194 -0.0908966 0.0390939 -0.6219912 51 H -1.0218076 0.0006245 0.0702140 -0.0046879 -0.6318118 -0.0063040 0.0148854 -0.0070044 -0.5437856 52 H -0.4804900 0.0020643 0.0371493 -0.0111723 -0.6258850 -0.0381662 0.0437304 -0.0284898 -0.7883992 53 H -0.7436424 0.0425256 -0.1402417 0.0229730 -0.6046863 0.0648671 -0.1012208 0.0397221 -0.6271289 54 H -0.6265762 -0.0036317 -0.1001231 0.0026059 -0.5761163 0.0137870 -0.1423593 0.0088088 -0.8321347 55 H -0.5999314 -0.1572754 0.1094084 -0.2014340 -0.6637716 0.2612947 0.0883566 0.2062246 -0.4756672 56 H -0.2721900 -0.0005876 -0.0144492 -0.0054574 -1.0120070 -0.0072030 -0.0211563 -0.0166490 -0.3832051 57 H -0.4804900 -0.0020643 0.0371493 0.0111723 -0.6258850 0.0381662 0.0437304 0.0284898 -0.7883992 58 H -0.5792115 -0.1559860 0.0785377 -0.2014594 -0.6391325 0.2468501 0.0676270 0.1891504 -0.4502143 59 H -0.5024318 0.0023899 0.0540225 0.0140945 -0.6276279 0.0387687 0.0602090 0.0299088 -0.8744756 60 H -0.7208378 0.0460256 -0.1526316 0.0203137 -0.6085353 0.0686194 -0.0908966 0.0390939 -0.6219912 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000000 (zzz) 0.00000000 (zzz) 0.00000000 (zzz) Max drift of fc2: -0.00000000 (zz) -0.00000000 (zz) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 8 8 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: 0.53, Number of G-points: 299, Lambda: 0.10 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/90) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.793 ( 0.000 0.000 0.000) 0.000 2.827 ( 0.000 0.000 0.000) 0.000 3.104 ( 0.000 0.000 0.000) 0.000 3.750 ( 0.000 0.000 0.000) 0.000 3.775 ( 0.000 0.000 0.000) 0.000 3.779 ( 0.000 0.000 0.000) 0.000 3.894 ( 0.000 0.000 0.000) 0.000 4.066 ( 0.000 0.000 0.000) 0.000 4.241 ( 0.000 0.000 0.000) 0.000 4.919 ( 0.000 0.000 0.000) 0.000 5.008 ( 0.000 0.000 0.000) 0.000 5.458 ( 0.000 0.000 0.000) 0.000 5.600 ( 0.000 0.000 0.000) 0.000 5.622 ( 0.000 0.000 0.000) 0.000 5.720 ( 0.000 0.000 0.000) 0.000 5.754 ( 0.000 0.000 0.000) 0.000 6.243 ( 0.000 0.000 0.000) 0.000 6.497 ( 0.000 0.000 0.000) 0.000 6.619 ( 0.000 0.000 0.000) 0.000 6.768 ( 0.000 0.000 0.000) 0.000 6.907 ( 0.000 0.000 0.000) 0.000 6.911 ( 0.000 0.000 0.000) 0.000 7.142 ( 0.000 0.000 0.000) 0.000 7.273 ( 0.000 0.000 0.000) 0.000 7.332 ( 0.000 0.000 0.000) 0.000 7.410 ( 0.000 0.000 0.000) 0.000 7.418 ( 0.000 0.000 0.000) 0.000 7.697 ( 0.000 0.000 0.000) 0.000 7.758 ( 0.000 0.000 0.000) 0.000 7.892 ( 0.000 0.000 0.000) 0.000 7.944 ( 0.000 0.000 0.000) 0.000 8.002 ( 0.000 0.000 0.000) 0.000 8.108 ( 0.000 0.000 0.000) 0.000 8.162 ( 0.000 0.000 0.000) 0.000 8.260 ( 0.000 0.000 0.000) 0.000 8.575 ( 0.000 0.000 0.000) 0.000 8.585 ( 0.000 0.000 0.000) 0.000 8.975 ( 0.000 0.000 0.000) 0.000 9.025 ( 0.000 0.000 0.000) 0.000 9.114 ( 0.000 0.000 0.000) 0.000 9.447 ( 0.000 0.000 0.000) 0.000 9.500 ( 0.000 0.000 0.000) 0.000 9.636 ( 0.000 0.000 0.000) 0.000 9.769 ( 0.000 0.000 0.000) 0.000 9.812 ( 0.000 0.000 0.000) 0.000 9.848 ( 0.000 0.000 0.000) 0.000 10.338 ( 0.000 0.000 0.000) 0.000 10.402 ( 0.000 0.000 0.000) 0.000 10.608 ( 0.000 0.000 0.000) 0.000 10.635 ( 0.000 0.000 0.000) 0.000 10.829 ( 0.000 0.000 0.000) 0.000 10.956 ( 0.000 0.000 0.000) 0.000 11.025 ( 0.000 0.000 0.000) 0.000 11.072 ( 0.000 0.000 0.000) 0.000 11.081 ( 0.000 0.000 0.000) 0.000 11.434 ( 0.000 0.000 0.000) 0.000 11.672 ( 0.000 0.000 0.000) 0.000 11.746 ( 0.000 0.000 0.000) 0.000 11.781 ( 0.000 0.000 0.000) 0.000 12.046 ( 0.000 0.000 0.000) 0.000 12.119 ( 0.000 0.000 0.000) 0.000 12.166 ( 0.000 0.000 0.000) 0.000 12.364 ( 0.000 0.000 0.000) 0.000 12.440 ( 0.000 0.000 0.000) 0.000 12.696 ( 0.000 0.000 0.000) 0.000 12.745 ( 0.000 0.000 0.000) 0.000 12.859 ( 0.000 0.000 0.000) 0.000 12.980 ( 0.000 0.000 0.000) 0.000 13.137 ( 0.000 0.000 0.000) 0.000 13.672 ( 0.000 0.000 0.000) 0.000 13.750 ( 0.000 0.000 0.000) 0.000 13.805 ( 0.000 0.000 0.000) 0.000 13.813 ( 0.000 0.000 0.000) 0.000 13.936 ( 0.000 0.000 0.000) 0.000 14.131 ( 0.000 0.000 0.000) 0.000 14.182 ( 0.000 0.000 0.000) 0.000 14.204 ( 0.000 0.000 0.000) 0.000 16.459 ( 0.000 0.000 0.000) 0.000 16.660 ( 0.000 0.000 0.000) 0.000 17.089 ( 0.000 0.000 0.000) 0.000 17.415 ( 0.000 0.000 0.000) 0.000 18.012 ( 0.000 0.000 0.000) 0.000 18.170 ( 0.000 0.000 0.000) 0.000 18.233 ( 0.000 0.000 0.000) 0.000 18.390 ( 0.000 0.000 0.000) 0.000 20.232 ( 0.000 0.000 0.000) 0.000 20.338 ( 0.000 0.000 0.000) 0.000 20.385 ( 0.000 0.000 0.000) 0.000 20.734 ( 0.000 0.000 0.000) 0.000 21.002 ( 0.000 0.000 0.000) 0.000 21.175 ( 0.000 0.000 0.000) 0.000 21.194 ( 0.000 0.000 0.000) 0.000 21.336 ( 0.000 0.000 0.000) 0.000 22.472 ( 0.000 0.000 0.000) 0.000 22.622 ( 0.000 0.000 0.000) 0.000 22.720 ( 0.000 0.000 0.000) 0.000 22.827 ( 0.000 0.000 0.000) 0.000 22.869 ( 0.000 0.000 0.000) 0.000 22.870 ( 0.000 0.000 0.000) 0.000 24.067 ( 0.000 0.000 0.000) 0.000 24.131 ( 0.000 0.000 0.000) 0.000 24.441 ( 0.000 0.000 0.000) 0.000 24.717 ( 0.000 0.000 0.000) 0.000 25.330 ( 0.000 0.000 0.000) 0.000 25.452 ( 0.000 0.000 0.000) 0.000 26.817 ( 0.000 0.000 0.000) 0.000 26.829 ( 0.000 0.000 0.000) 0.000 26.935 ( 0.000 0.000 0.000) 0.000 27.201 ( 0.000 0.000 0.000) 0.000 27.305 ( 0.000 0.000 0.000) 0.000 27.409 ( 0.000 0.000 0.000) 0.000 27.651 ( 0.000 0.000 0.000) 0.000 27.813 ( 0.000 0.000 0.000) 0.000 27.873 ( 0.000 0.000 0.000) 0.000 27.875 ( 0.000 0.000 0.000) 0.000 28.072 ( 0.000 0.000 0.000) 0.000 28.122 ( 0.000 0.000 0.000) 0.000 28.403 ( 0.000 0.000 0.000) 0.000 28.417 ( 0.000 0.000 0.000) 0.000 28.581 ( 0.000 0.000 0.000) 0.000 28.710 ( 0.000 0.000 0.000) 0.000 28.918 ( 0.000 0.000 0.000) 0.000 28.996 ( 0.000 0.000 0.000) 0.000 29.270 ( 0.000 0.000 0.000) 0.000 29.362 ( 0.000 0.000 0.000) 0.000 30.620 ( 0.000 0.000 0.000) 0.000 30.638 ( 0.000 0.000 0.000) 0.000 30.657 ( 0.000 0.000 0.000) 0.000 30.664 ( 0.000 0.000 0.000) 0.000 33.845 ( 0.000 0.000 0.000) 0.000 33.968 ( 0.000 0.000 0.000) 0.000 34.002 ( 0.000 0.000 0.000) 0.000 34.010 ( 0.000 0.000 0.000) 0.000 37.213 ( 0.000 0.000 0.000) 0.000 37.239 ( 0.000 0.000 0.000) 0.000 37.246 ( 0.000 0.000 0.000) 0.000 37.286 ( 0.000 0.000 0.000) 0.000 37.529 ( 0.000 0.000 0.000) 0.000 37.536 ( 0.000 0.000 0.000) 0.000 37.630 ( 0.000 0.000 0.000) 0.000 37.721 ( 0.000 0.000 0.000) 0.000 48.780 ( 0.000 0.000 0.000) 0.000 48.828 ( 0.000 0.000 0.000) 0.000 48.905 ( 0.000 0.000 0.000) 0.000 48.910 ( 0.000 0.000 0.000) 0.000 50.523 ( 0.000 0.000 0.000) 0.000 50.553 ( 0.000 0.000 0.000) 0.000 50.642 ( 0.000 0.000 0.000) 0.000 51.458 ( 0.000 0.000 0.000) 0.000 51.718 ( 0.000 0.000 0.000) 0.000 51.723 ( 0.000 0.000 0.000) 0.000 52.272 ( 0.000 0.000 0.000) 0.000 52.283 ( 0.000 0.000 0.000) 0.000 52.609 ( 0.000 0.000 0.000) 0.000 52.817 ( 0.000 0.000 0.000) 0.000 53.096 ( 0.000 0.000 0.000) 0.000 53.253 ( 0.000 0.000 0.000) 0.000 53.790 ( 0.000 0.000 0.000) 0.000 53.825 ( 0.000 0.000 0.000) 0.000 54.168 ( 0.000 0.000 0.000) 0.000 54.368 ( 0.000 0.000 0.000) 0.000 55.693 ( 0.000 0.000 0.000) 0.000 55.771 ( 0.000 0.000 0.000) 0.000 56.030 ( 0.000 0.000 0.000) 0.000 56.879 ( 0.000 0.000 0.000) 0.000 57.378 ( 0.000 0.000 0.000) 0.000 57.379 ( 0.000 0.000 0.000) 0.000 57.388 ( 0.000 0.000 0.000) 0.000 57.389 ( 0.000 0.000 0.000) 0.000 58.109 ( 0.000 0.000 0.000) 0.000 58.355 ( 0.000 0.000 0.000) 0.000 58.389 ( 0.000 0.000 0.000) 0.000 58.663 ( 0.000 0.000 0.000) 0.000 60.910 ( 0.000 0.000 0.000) 0.000 60.917 ( 0.000 0.000 0.000) 0.000 60.950 ( 0.000 0.000 0.000) 0.000 60.950 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/90) ======================= q-point: ( 0.12 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.945 ( 43.803 0.000 16.964) 46.973 1.141 ( 52.601 0.000 -3.234) 52.700 1.645 ( 73.848 0.000 14.196) 75.201 2.847 ( 1.317 0.000 17.604) 17.653 3.051 ( 23.820 0.000 -10.194) 25.909 3.228 ( -3.594 0.000 1.309) 3.825 3.378 ( -1.159 0.000 -12.048) 12.104 3.666 ( -5.048 0.000 -5.935) 7.791 3.964 ( 8.008 0.000 6.474) 10.297 4.264 ( 15.048 0.000 8.576) 17.320 4.335 ( 10.281 0.000 8.158) 13.124 4.371 ( 25.876 0.000 -7.474) 26.934 4.987 ( 6.039 0.000 -0.077) 6.040 5.131 ( 11.068 0.000 -9.618) 14.663 5.264 ( -17.000 0.000 -1.467) 17.063 5.568 ( 7.585 0.000 -5.387) 9.303 5.619 ( 0.405 0.000 -19.964) 19.968 5.757 ( 8.967 0.000 9.525) 13.082 6.149 ( 15.923 0.000 10.630) 19.145 6.188 ( -3.699 0.000 4.397) 5.745 6.436 ( -4.082 0.000 -0.752) 4.151 6.751 ( -0.825 0.000 -10.011) 10.045 6.787 ( 9.964 0.000 -4.289) 10.848 6.872 ( -3.488 0.000 -3.242) 4.762 7.143 ( 0.907 0.000 -4.323) 4.417 7.208 ( -0.570 0.000 -23.355) 23.362 7.246 ( 0.325 0.000 -3.837) 3.851 7.342 ( -2.357 0.000 1.309) 2.696 7.346 ( -5.522 0.000 0.140) 5.524 7.402 ( -1.427 0.000 7.329) 7.467 7.710 ( -4.152 0.000 15.970) 16.501 7.732 ( -0.451 0.000 -8.220) 8.233 7.852 ( -2.377 0.000 7.946) 8.294 7.961 ( 1.635 0.000 -8.551) 8.705 8.018 ( 0.761 0.000 -0.653) 1.003 8.112 ( -3.941 0.000 -0.519) 3.975 8.187 ( 5.479 0.000 -0.804) 5.538 8.522 ( 0.527 0.000 -9.602) 9.616 8.530 ( -3.316 0.000 -0.690) 3.387 8.805 ( 2.136 0.000 18.778) 18.900 8.974 ( -2.910 0.000 5.257) 6.009 9.147 ( 3.321 0.000 2.683) 4.270 9.215 ( 2.869 0.000 6.661) 7.252 9.445 ( -0.195 0.000 1.084) 1.101 9.521 ( 1.671 0.000 3.196) 3.607 9.648 ( -0.148 0.000 -2.634) 2.638 9.713 ( -8.803 0.000 5.425) 10.341 9.869 ( 0.214 0.000 7.794) 7.797 9.905 ( 13.742 0.000 -8.255) 16.031 10.285 ( -2.264 0.000 -5.459) 5.910 10.486 ( -2.928 0.000 -4.527) 5.391 10.588 ( -1.856 0.000 1.115) 2.165 10.607 ( 4.404 0.000 -4.011) 5.957 10.716 ( -6.487 0.000 -13.540) 15.014 10.976 ( 0.455 0.000 -1.342) 1.417 10.981 ( -1.862 0.000 6.698) 6.952 11.156 ( 5.259 0.000 14.602) 15.520 11.176 ( 3.910 0.000 10.003) 10.740 11.355 ( -5.847 0.000 -1.145) 5.958 11.422 ( -12.752 0.000 -2.035) 12.913 11.734 ( -5.355 0.000 -3.659) 6.486 11.844 ( 0.390 0.000 -5.107) 5.121 12.037 ( -3.523 0.000 -5.539) 6.564 12.112 ( 5.595 0.000 1.616) 5.824 12.319 ( -4.101 0.000 -6.262) 7.485 12.377 ( 6.937 0.000 4.980) 8.539 12.653 ( -3.795 0.000 -3.296) 5.027 12.707 ( -3.813 0.000 1.834) 4.231 12.861 ( 0.238 0.000 3.248) 3.257 13.002 ( 2.885 0.000 -0.290) 2.899 13.123 ( -0.562 0.000 -2.608) 2.668 13.132 ( -3.039 0.000 -0.548) 3.088 13.671 ( -5.835 0.000 -3.109) 6.612 13.786 ( -1.270 0.000 -4.524) 4.699 13.795 ( -1.383 0.000 1.367) 1.944 13.963 ( 1.858 0.000 4.962) 5.299 14.060 ( -10.481 0.000 24.922) 27.036 14.194 ( 4.099 0.000 0.118) 4.101 14.206 ( -0.098 0.000 -6.736) 6.737 14.426 ( -4.825 0.000 31.539) 31.906 16.618 ( -3.870 0.000 4.330) 5.808 16.783 ( -0.908 0.000 -1.653) 1.886 17.185 ( 8.642 0.000 -3.750) 9.421 17.477 ( 4.668 0.000 3.649) 5.925 18.006 ( -0.488 0.000 0.862) 0.990 18.125 ( -3.390 0.000 -2.918) 4.473 18.238 ( -0.090 0.000 2.226) 2.228 18.376 ( -2.842 0.000 2.173) 3.578 20.252 ( -2.708 0.000 7.507) 7.980 20.299 ( -3.357 0.000 0.282) 3.369 20.368 ( -0.745 0.000 2.717) 2.817 20.716 ( -1.084 0.000 -2.441) 2.671 21.024 ( 0.547 0.000 1.016) 1.154 21.188 ( -0.946 0.000 2.419) 2.597 21.284 ( 9.608 0.000 -1.192) 9.682 21.406 ( 7.141 0.000 0.331) 7.149 22.552 ( -4.295 0.000 -3.653) 5.638 22.679 ( -2.973 0.000 18.613) 18.849 22.716 ( -0.244 0.000 -0.758) 0.796 22.853 ( 1.192 0.000 -0.690) 1.377 22.887 ( 1.579 0.000 0.096) 1.582 22.896 ( 2.439 0.000 0.184) 2.446 24.049 ( -1.640 0.000 -1.349) 2.123 24.085 ( -4.917 0.000 2.309) 5.433 24.438 ( 0.277 0.000 -3.544) 3.555 24.643 ( -7.501 0.000 3.725) 8.375 25.263 ( -5.472 0.000 -2.976) 6.229 25.358 ( -9.444 0.000 0.909) 9.488 26.858 ( 2.735 0.000 -0.394) 2.763 26.957 ( 2.010 0.000 -0.055) 2.011 27.089 ( 1.278 0.000 -11.155) 11.228 27.270 ( -3.190 0.000 2.228) 3.891 27.409 ( -0.479 0.000 -0.347) 0.592 27.656 ( 1.078 0.000 -15.548) 15.585 27.702 ( 2.034 0.000 -22.426) 22.518 27.788 ( -4.424 0.000 2.554) 5.109 27.862 ( -1.905 0.000 1.906) 2.694 27.895 ( 4.374 0.000 -31.687) 31.987 27.978 ( -4.831 0.000 7.065) 8.559 28.163 ( 1.368 0.000 -1.709) 2.189 28.352 ( -6.572 0.000 3.559) 7.474 28.498 ( 0.635 0.000 2.536) 2.614 28.645 ( 5.142 0.000 -0.716) 5.192 28.658 ( 4.648 0.000 -0.744) 4.707 29.166 ( 3.155 0.000 -14.254) 14.599 29.198 ( 14.859 0.000 4.105) 15.415 29.308 ( 3.297 0.000 -0.546) 3.342 29.377 ( 1.645 0.000 0.687) 1.783 30.631 ( 0.899 0.000 0.287) 0.944 30.658 ( -0.005 0.000 0.364) 0.364 30.665 ( 0.204 0.000 0.296) 0.360 30.717 ( 0.868 0.000 -5.216) 5.288 33.853 ( 0.850 0.000 -2.627) 2.761 33.938 ( -3.149 0.000 0.361) 3.169 33.966 ( -0.367 0.000 0.886) 0.959 34.057 ( 1.419 0.000 1.077) 1.782 37.222 ( 0.861 0.000 -0.251) 0.896 37.236 ( -0.012 0.000 0.052) 0.054 37.296 ( 0.911 0.000 -0.747) 1.178 37.344 ( 0.219 0.000 0.514) 0.559 37.519 ( -0.809 0.000 -1.184) 1.434 37.634 ( 0.514 0.000 -0.784) 0.937 37.762 ( 3.265 0.000 -1.502) 3.593 37.879 ( -1.647 0.000 14.405) 14.499 48.896 ( 10.797 0.000 -2.248) 11.028 48.958 ( 5.088 0.000 -0.738) 5.141 48.989 ( 6.817 0.000 2.024) 7.111 49.895 ( 4.320 0.000 -38.340) 38.583 50.539 ( 1.801 0.000 -2.091) 2.760 50.632 ( -1.031 0.000 0.609) 1.197 51.315 ( -15.065 0.000 65.860) 67.561 51.355 ( -8.123 0.000 -4.625) 9.348 51.723 ( 0.502 0.000 0.128) 0.518 51.728 ( 0.418 0.000 0.226) 0.475 52.282 ( 0.002 0.000 -0.097) 0.098 52.289 ( 0.237 0.000 -0.495) 0.549 52.752 ( -4.111 0.000 -6.188) 7.430 53.161 ( 4.620 0.000 0.572) 4.655 53.173 ( -7.569 0.000 57.948) 58.440 53.293 ( 2.920 0.000 4.718) 5.548 53.795 ( 0.605 0.000 -0.319) 0.684 53.844 ( 1.670 0.000 0.190) 1.680 54.176 ( -0.069 0.000 -8.866) 8.867 54.368 ( 0.005 0.000 -0.394) 0.394 55.700 ( 0.661 0.000 -0.211) 0.694 55.784 ( 1.209 0.000 0.135) 1.216 56.025 ( -0.689 0.000 -12.559) 12.578 56.793 ( -7.822 0.000 -1.243) 7.920 57.378 ( -0.008 0.000 -0.035) 0.036 57.380 ( 0.106 0.000 0.059) 0.122 57.391 ( 0.266 0.000 0.033) 0.268 57.392 ( 0.186 0.000 -0.071) 0.200 58.267 ( -7.204 0.000 0.953) 7.267 58.365 ( 0.518 0.000 2.774) 2.822 58.493 ( 4.637 0.000 -36.492) 36.785 58.772 ( 5.406 0.000 5.765) 7.903 60.911 ( 0.102 0.000 -0.011) 0.102 60.918 ( 0.083 0.000 0.031) 0.088 60.948 ( -0.124 0.000 -0.098) 0.158 60.950 ( -0.029 0.000 0.091) 0.095 ======================= Grid point 2 (3/90) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.913 ( 43.219 0.000 15.548) 45.930 2.113 ( 39.886 0.000 -6.050) 40.342 2.640 ( 2.240 0.000 4.170) 4.734 2.939 ( -5.965 0.000 18.041) 19.002 3.407 ( 0.519 0.000 -17.485) 17.492 3.425 ( 56.063 0.000 12.329) 57.402 3.703 ( 18.877 0.000 -6.679) 20.024 3.734 ( 26.948 0.000 -15.935) 31.307 4.086 ( 3.079 0.000 17.070) 17.345 4.513 ( 5.400 0.000 3.159) 6.256 4.719 ( 17.879 0.000 13.828) 22.603 4.837 ( 19.009 0.000 -5.991) 19.930 5.015 ( -3.837 0.000 5.649) 6.829 5.165 ( 8.125 0.000 -1.793) 8.321 5.266 ( 0.288 0.000 -10.919) 10.923 5.722 ( 17.382 0.000 -15.259) 23.130 5.749 ( 9.049 0.000 -1.664) 9.200 5.869 ( 2.938 0.000 2.778) 4.043 6.283 ( 6.205 0.000 -9.693) 11.509 6.360 ( 1.683 0.000 -10.884) 11.013 6.387 ( 5.527 0.000 11.037) 12.344 6.620 ( -9.415 0.000 -14.532) 17.316 6.795 ( -0.460 0.000 4.040) 4.066 6.942 ( -0.248 0.000 -4.245) 4.252 7.101 ( -1.273 0.000 0.112) 1.278 7.121 ( -3.085 0.000 0.178) 3.090 7.246 ( -4.550 0.000 5.606) 7.220 7.285 ( 1.111 0.000 -4.074) 4.223 7.316 ( 4.877 0.000 -10.277) 11.375 7.350 ( -5.585 0.000 9.940) 11.402 7.687 ( -2.618 0.000 -6.268) 6.793 7.773 ( 4.118 0.000 22.490) 22.864 7.845 ( 1.245 0.000 -4.668) 4.831 7.920 ( -3.311 0.000 -11.940) 12.391 8.035 ( -2.438 0.000 -4.787) 5.372 8.057 ( 2.920 0.000 4.577) 5.429 8.312 ( 6.529 0.000 14.439) 15.847 8.463 ( -2.374 0.000 0.743) 2.488 8.626 ( 10.579 0.000 -12.300) 16.223 8.904 ( 3.047 0.000 8.741) 9.257 8.951 ( -0.655 0.000 5.866) 5.902 9.232 ( 4.564 0.000 -4.546) 6.441 9.236 ( -1.730 0.000 4.059) 4.412 9.433 ( -4.354 0.000 6.262) 7.627 9.522 ( -5.260 0.000 6.485) 8.350 9.587 ( -5.353 0.000 -1.864) 5.668 9.615 ( 3.968 0.000 3.519) 5.303 9.879 ( -1.206 0.000 10.375) 10.445 10.146 ( -10.216 0.000 -1.967) 10.403 10.186 ( 12.668 0.000 -9.268) 15.697 10.386 ( -0.256 0.000 -5.132) 5.139 10.509 ( -5.690 0.000 -5.640) 8.012 10.599 ( 0.342 0.000 -5.115) 5.127 10.765 ( 8.521 0.000 -4.797) 9.778 10.947 ( -4.127 0.000 0.824) 4.208 10.992 ( 0.331 0.000 7.710) 7.717 11.145 ( -7.312 0.000 0.092) 7.313 11.154 ( -7.544 0.000 -1.413) 7.676 11.310 ( -0.715 0.000 7.185) 7.220 11.379 ( 6.429 0.000 10.501) 12.312 11.581 ( -4.858 0.000 -4.962) 6.944 11.780 ( -4.355 0.000 -9.452) 10.407 11.960 ( -3.180 0.000 -3.177) 4.495 12.092 ( -10.313 0.000 -9.331) 13.908 12.230 ( 0.014 0.000 1.751) 1.751 12.514 ( 1.598 0.000 5.314) 5.550 12.527 ( -6.349 0.000 -5.159) 8.180 12.618 ( -2.043 0.000 0.121) 2.047 12.917 ( 3.936 0.000 7.116) 8.132 12.936 ( -7.038 0.000 -1.937) 7.300 13.123 ( 1.504 0.000 -2.324) 2.768 13.171 ( 4.856 0.000 -0.914) 4.942 13.520 ( -7.182 0.000 -4.329) 8.386 13.736 ( -5.919 0.000 7.288) 9.388 13.778 ( 1.986 0.000 -2.886) 3.503 13.908 ( -7.780 0.000 12.236) 14.500 14.018 ( 1.651 0.000 5.615) 5.853 14.160 ( -1.809 0.000 -6.107) 6.370 14.246 ( 0.624 0.000 -2.147) 2.236 14.419 ( -0.878 0.000 6.053) 6.116 16.547 ( -3.657 0.000 4.044) 5.452 16.767 ( 0.202 0.000 -2.839) 2.846 17.379 ( 9.864 0.000 -3.387) 10.429 17.584 ( 3.618 0.000 3.685) 5.164 18.011 ( 0.988 0.000 1.739) 2.000 18.029 ( -4.693 0.000 -3.080) 5.613 18.241 ( -0.054 0.000 1.832) 1.833 18.305 ( -4.169 0.000 0.590) 4.210 20.195 ( -3.257 0.000 0.870) 3.371 20.223 ( -3.512 0.000 0.325) 3.527 20.405 ( 3.253 0.000 4.718) 5.731 20.692 ( -0.040 0.000 -3.803) 3.803 20.991 ( -4.114 0.000 1.430) 4.355 21.145 ( -3.851 0.000 1.836) 4.266 21.538 ( 13.894 0.000 -0.428) 13.901 21.627 ( 12.801 0.000 0.063) 12.801 22.471 ( -2.089 0.000 -3.481) 4.060 22.670 ( -1.333 0.000 7.851) 7.963 22.710 ( 0.086 0.000 -1.348) 1.351 22.863 ( 0.019 0.000 -0.897) 0.898 22.937 ( 3.377 0.000 0.034) 3.377 22.957 ( 3.617 0.000 -0.056) 3.617 23.936 ( -9.864 0.000 1.878) 10.041 23.979 ( -5.298 0.000 -2.202) 5.737 24.439 ( 1.013 0.000 -4.873) 4.978 24.446 ( -11.430 0.000 5.356) 12.622 25.113 ( -13.388 0.000 3.172) 13.759 25.123 ( -6.107 0.000 -3.797) 7.191 26.931 ( 4.065 0.000 -0.253) 4.073 27.004 ( 1.886 0.000 -0.692) 2.009 27.099 ( 2.346 0.000 -4.741) 5.290 27.205 ( -3.213 0.000 2.500) 4.071 27.369 ( -3.458 0.000 1.280) 3.687 27.586 ( -7.232 0.000 0.233) 7.235 27.605 ( -1.926 0.000 -12.451) 12.599 27.804 ( 3.299 0.000 -2.639) 4.224 27.823 ( -1.609 0.000 1.239) 2.031 27.895 ( 1.723 0.000 -12.917) 13.032 27.925 ( -2.896 0.000 5.501) 6.217 28.171 ( 0.086 0.000 4.764) 4.765 28.285 ( 0.389 0.000 -3.162) 3.186 28.526 ( 1.202 0.000 2.893) 3.133 28.751 ( 4.645 0.000 -1.313) 4.827 28.804 ( 7.262 0.000 1.634) 7.443 29.207 ( 3.287 0.000 -5.996) 6.838 29.375 ( 2.221 0.000 1.729) 2.814 29.388 ( 4.036 0.000 0.107) 4.037 29.489 ( 6.697 0.000 3.656) 7.630 30.643 ( 0.073 0.000 0.025) 0.077 30.658 ( -0.083 0.000 0.225) 0.240 30.686 ( 1.582 0.000 1.052) 1.900 30.723 ( 0.674 0.000 -2.401) 2.494 33.867 ( 1.035 0.000 -1.995) 2.248 33.883 ( -2.195 0.000 0.669) 2.295 33.958 ( -0.607 0.000 1.459) 1.580 34.071 ( -0.211 0.000 0.610) 0.645 37.244 ( 1.219 0.000 -0.347) 1.267 37.250 ( 1.365 0.000 0.295) 1.397 37.315 ( 1.026 0.000 -0.663) 1.222 37.351 ( 0.348 0.000 0.098) 0.361 37.511 ( 0.279 0.000 -1.090) 1.125 37.645 ( 0.728 0.000 -1.152) 1.362 37.821 ( 2.533 0.000 -2.031) 3.247 37.887 ( -0.443 0.000 6.498) 6.513 49.100 ( 8.195 0.000 -0.969) 8.252 49.148 ( 10.868 0.000 -2.914) 11.252 49.201 ( 13.355 0.000 4.711) 14.162 49.874 ( 0.868 0.000 -15.455) 15.480 50.583 ( 3.053 0.000 -3.562) 4.692 50.602 ( -1.972 0.000 0.375) 2.007 51.141 ( -13.358 0.000 26.212) 29.420 51.155 ( -8.287 0.000 -5.926) 10.188 51.738 ( 0.756 0.000 0.204) 0.783 51.740 ( 0.576 0.000 0.189) 0.606 52.285 ( 0.229 0.000 -0.097) 0.249 52.294 ( 0.340 0.000 -0.390) 0.517 52.642 ( -4.317 0.000 -7.240) 8.430 53.178 ( -2.830 0.000 22.962) 23.135 53.248 ( 3.261 0.000 -0.224) 3.268 53.384 ( 3.807 0.000 6.242) 7.311 53.816 ( 1.547 0.000 0.099) 1.550 53.887 ( 2.167 0.000 0.077) 2.168 54.136 ( -1.799 0.000 -5.854) 6.124 54.366 ( -0.081 0.000 -0.379) 0.388 55.720 ( 1.342 0.000 -0.204) 1.357 55.822 ( 2.349 0.000 0.147) 2.353 55.960 ( -2.959 0.000 -5.489) 6.236 56.575 ( -11.735 0.000 -0.412) 11.742 57.379 ( 0.072 0.000 -0.036) 0.080 57.384 ( 0.162 0.000 0.070) 0.177 57.396 ( 0.244 0.000 -0.046) 0.249 57.398 ( 0.306 0.000 0.027) 0.308 58.169 ( -2.502 0.000 1.583) 2.961 58.389 ( 0.721 0.000 4.816) 4.869 58.486 ( 1.821 0.000 -17.234) 17.330 58.853 ( 0.859 0.000 5.214) 5.284 60.914 ( 0.154 0.000 -0.020) 0.156 60.921 ( 0.144 0.000 0.067) 0.159 60.944 ( -0.200 0.000 -0.166) 0.260 60.950 ( -0.046 0.000 0.126) 0.135 ======================= Grid point 3 (4/90) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.394 ( -6.970 0.000 10.633) 12.714 2.707 ( 18.105 0.000 -6.050) 19.089 2.827 ( 19.908 0.000 -4.812) 20.481 3.079 ( 20.701 0.000 15.970) 26.145 3.268 ( -5.001 0.000 -9.994) 11.175 4.032 ( 6.259 0.000 4.283) 7.584 4.084 ( 17.281 0.000 -9.822) 19.877 4.172 ( 2.783 0.000 -2.467) 3.719 4.538 ( 3.047 0.000 5.247) 6.068 4.588 ( 10.884 0.000 15.519) 18.955 4.993 ( 2.910 0.000 6.724) 7.326 5.069 ( 22.959 0.000 -3.771) 23.266 5.232 ( 6.337 0.000 -6.521) 9.093 5.260 ( 21.882 0.000 18.731) 28.804 5.355 ( 11.699 0.000 -1.896) 11.852 5.893 ( 3.974 0.000 5.036) 6.415 6.025 ( -3.370 0.000 -16.594) 16.933 6.040 ( 10.616 0.000 -6.911) 12.667 6.265 ( -1.590 0.000 -8.514) 8.661 6.311 ( 6.868 0.000 -11.316) 13.237 6.357 ( 0.083 0.000 -12.409) 12.409 6.619 ( 4.086 0.000 2.004) 4.551 6.792 ( -7.743 0.000 2.025) 8.003 6.885 ( 4.400 0.000 3.375) 5.545 7.029 ( -1.803 0.000 7.130) 7.354 7.145 ( -5.034 0.000 -1.160) 5.166 7.147 ( -6.280 0.000 2.108) 6.625 7.270 ( -1.401 0.000 6.626) 6.772 7.311 ( 2.693 0.000 -4.295) 5.069 7.381 ( 1.743 0.000 -4.713) 5.024 7.610 ( -1.671 0.000 -3.108) 3.528 7.741 ( -10.550 0.000 -7.129) 12.733 7.811 ( -0.648 0.000 0.848) 1.067 7.882 ( -1.791 0.000 -4.902) 5.219 7.966 ( -2.579 0.000 -8.647) 9.023 8.204 ( 8.029 0.000 10.562) 13.267 8.465 ( 1.897 0.000 2.656) 3.264 8.597 ( 13.676 0.000 23.884) 27.522 8.811 ( 9.175 0.000 -11.076) 14.383 8.964 ( 1.109 0.000 2.180) 2.445 8.979 ( 2.036 0.000 1.638) 2.613 9.170 ( -5.412 0.000 3.736) 6.577 9.205 ( -8.348 0.000 2.932) 8.849 9.370 ( 2.512 0.000 3.355) 4.191 9.449 ( -6.191 0.000 1.886) 6.472 9.528 ( 1.935 0.000 -0.059) 1.936 9.741 ( 5.839 0.000 3.560) 6.839 9.912 ( 2.418 0.000 9.600) 9.900 9.961 ( -5.998 0.000 -0.211) 6.002 10.236 ( -5.075 0.000 -13.240) 14.179 10.439 ( 5.966 0.000 -1.235) 6.093 10.488 ( 5.427 0.000 -3.125) 6.262 10.665 ( 6.739 0.000 -3.705) 7.691 10.816 ( -7.395 0.000 6.092) 9.581 10.840 ( -5.151 0.000 -1.174) 5.283 10.988 ( 0.459 0.000 0.660) 0.804 11.040 ( -4.717 0.000 -2.880) 5.527 11.060 ( 0.288 0.000 2.745) 2.760 11.205 ( -6.796 0.000 -4.445) 8.121 11.456 ( -6.031 0.000 -3.420) 6.933 11.587 ( 4.351 0.000 -1.793) 4.706 11.610 ( -3.080 0.000 -6.166) 6.892 11.862 ( -7.481 0.000 -0.790) 7.522 11.875 ( -5.489 0.000 3.157) 6.332 12.229 ( -1.596 0.000 5.434) 5.664 12.412 ( -2.100 0.000 -6.158) 6.506 12.420 ( -5.973 0.000 2.710) 6.559 12.680 ( 2.079 0.000 -0.609) 2.166 12.809 ( -2.185 0.000 -1.865) 2.872 13.035 ( 4.481 0.000 7.496) 8.733 13.164 ( 2.718 0.000 -2.414) 3.635 13.230 ( 0.285 0.000 -1.988) 2.008 13.361 ( -6.641 0.000 -3.937) 7.721 13.615 ( -6.110 0.000 9.858) 11.598 13.826 ( -2.378 0.000 1.395) 2.757 13.858 ( 5.857 0.000 -1.029) 5.947 14.052 ( -0.391 0.000 6.200) 6.212 14.117 ( -0.893 0.000 -3.315) 3.433 14.206 ( -3.024 0.000 -4.797) 5.671 14.421 ( 0.088 0.000 0.945) 0.949 16.495 ( -2.050 0.000 2.198) 3.006 16.773 ( 0.778 0.000 -1.860) 2.017 17.545 ( 6.167 0.000 -1.495) 6.345 17.632 ( 0.481 0.000 1.838) 1.900 17.929 ( -3.760 0.000 -2.184) 4.348 18.061 ( 3.002 0.000 1.997) 3.605 18.216 ( -4.129 0.000 -0.305) 4.140 18.248 ( 0.368 0.000 0.892) 0.965 20.140 ( -1.860 0.000 0.042) 1.861 20.165 ( -1.994 0.000 0.199) 2.004 20.524 ( 6.795 0.000 3.455) 7.623 20.700 ( 1.694 0.000 -3.371) 3.773 20.869 ( -7.448 0.000 0.465) 7.462 21.051 ( -4.867 0.000 1.385) 5.061 21.809 ( 10.673 0.000 -0.031) 10.673 21.880 ( 9.922 0.000 -0.177) 9.924 22.445 ( 0.022 0.000 -1.806) 1.806 22.668 ( -0.440 0.000 3.762) 3.788 22.715 ( 0.685 0.000 -1.286) 1.457 22.854 ( -0.515 0.000 -0.511) 0.725 23.039 ( 6.508 0.000 0.187) 6.510 23.060 ( 6.351 0.000 -0.202) 6.354 23.694 ( -12.848 0.000 0.490) 12.858 23.787 ( -12.094 0.000 -0.989) 12.134 24.267 ( -5.697 0.000 3.050) 6.463 24.454 ( 1.599 0.000 -4.054) 4.358 24.868 ( -9.811 0.000 3.545) 10.432 25.011 ( -3.530 0.000 -2.286) 4.206 27.017 ( 4.027 0.000 0.147) 4.029 27.019 ( 0.163 0.000 -1.176) 1.187 27.154 ( -2.293 0.000 1.054) 2.523 27.165 ( 4.134 0.000 -1.679) 4.462 27.290 ( -3.764 0.000 1.445) 4.032 27.447 ( -6.147 0.000 4.706) 7.742 27.536 ( -1.538 0.000 -9.513) 9.637 27.801 ( -0.641 0.000 -1.056) 1.235 27.857 ( 2.038 0.000 -0.962) 2.253 27.892 ( -1.407 0.000 4.419) 4.638 27.894 ( 0.581 0.000 -5.588) 5.618 28.206 ( 1.543 0.000 3.165) 3.521 28.301 ( 1.253 0.000 -2.499) 2.796 28.557 ( 0.927 0.000 2.090) 2.287 28.820 ( 2.306 0.000 -0.998) 2.513 28.938 ( 4.722 0.000 1.801) 5.054 29.258 ( 2.367 0.000 -2.621) 3.532 29.410 ( 1.119 0.000 0.958) 1.474 29.461 ( 2.629 0.000 0.390) 2.657 29.575 ( 1.251 0.000 1.571) 2.008 30.643 ( -0.038 0.000 -0.066) 0.077 30.656 ( -0.056 0.000 0.031) 0.064 30.720 ( 1.162 0.000 0.903) 1.472 30.730 ( 0.394 0.000 -1.035) 1.107 33.851 ( -1.046 0.000 0.448) 1.138 33.882 ( 0.834 0.000 -1.473) 1.693 33.950 ( -0.561 0.000 1.326) 1.440 34.062 ( -0.493 0.000 0.068) 0.497 37.266 ( 0.880 0.000 -0.238) 0.911 37.284 ( 1.354 0.000 0.536) 1.456 37.332 ( 0.674 0.000 -0.379) 0.773 37.358 ( 0.209 0.000 -0.019) 0.210 37.520 ( 0.644 0.000 -0.495) 0.812 37.656 ( 0.513 0.000 -0.840) 0.985 37.853 ( 1.087 0.000 -1.415) 1.785 37.895 ( -0.066 0.000 2.936) 2.937 49.266 ( 6.996 0.000 -0.556) 7.018 49.324 ( 6.421 0.000 -0.710) 6.460 49.480 ( 10.226 0.000 3.354) 10.762 49.849 ( -0.251 0.000 -6.511) 6.515 50.560 ( -1.704 0.000 -0.383) 1.747 50.648 ( 4.456 0.000 -4.836) 6.576 50.930 ( -11.442 0.000 13.024) 17.336 51.010 ( -4.143 0.000 -3.462) 5.399 51.751 ( 0.403 0.000 0.092) 0.413 51.753 ( 0.589 0.000 0.182) 0.616 52.290 ( 0.215 0.000 -0.042) 0.219 52.299 ( 0.250 0.000 -0.207) 0.324 52.545 ( -2.995 0.000 -4.972) 5.805 53.182 ( -1.055 0.000 9.120) 9.181 53.295 ( 1.398 0.000 -0.279) 1.426 53.467 ( 2.398 0.000 4.127) 4.773 53.863 ( 2.619 0.000 1.579) 3.058 53.925 ( 1.327 0.000 -0.077) 1.329 54.071 ( -2.814 0.000 -4.775) 5.542 54.363 ( -0.085 0.000 -0.124) 0.150 55.756 ( 2.085 0.000 0.197) 2.095 55.880 ( -3.372 0.000 -2.710) 4.326 55.880 ( 2.984 0.000 -0.014) 2.984 56.345 ( -9.271 0.000 0.409) 9.280 57.380 ( 0.072 0.000 -0.021) 0.075 57.387 ( 0.122 0.000 0.042) 0.129 57.401 ( 0.164 0.000 -0.020) 0.166 57.403 ( 0.198 0.000 0.013) 0.198 58.154 ( 0.176 0.000 0.782) 0.801 58.418 ( 0.535 0.000 5.655) 5.680 58.473 ( 0.669 0.000 -10.175) 10.197 58.855 ( -1.131 0.000 2.679) 2.908 60.917 ( 0.118 0.000 -0.018) 0.120 60.924 ( 0.153 0.000 0.089) 0.177 60.940 ( -0.190 0.000 -0.160) 0.248 60.949 ( -0.039 0.000 0.092) 0.100 ======================= Grid point 4 (5/90) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 50 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.314 ( 0.000 0.000 -0.000) 0.000 2.874 ( 0.000 0.000 -0.000) 0.000 2.946 ( 0.000 0.000 -0.000) 0.000 3.200 ( 0.000 0.000 0.000) 0.000 3.576 ( 0.000 0.000 -0.000) 0.000 4.057 ( 0.000 0.000 0.000) 0.000 4.177 ( 0.000 0.000 -0.000) 0.000 4.248 ( 0.000 0.000 -0.000) 0.000 4.371 ( 0.000 0.000 -0.000) 0.000 4.660 ( 0.000 0.000 0.000) 0.000 5.035 ( 0.000 0.000 0.000) 0.000 5.296 ( 0.000 0.000 -0.000) 0.000 5.523 ( 0.000 0.000 0.000) 0.000 5.579 ( 0.000 0.000 -0.000) 0.000 5.660 ( -0.000 0.000 -0.000) 0.000 5.824 ( 0.000 0.000 -0.000) 0.000 5.986 ( 0.000 0.000 0.000) 0.000 6.028 ( 0.000 0.000 0.000) 0.000 6.108 ( 0.000 0.000 -0.000) 0.000 6.402 ( 0.000 0.000 -0.000) 0.000 6.621 ( 0.000 0.000 0.000) 0.000 6.703 ( -0.000 0.000 0.000) 0.000 6.710 ( 0.000 0.000 -0.000) 0.000 6.864 ( -0.000 0.000 -0.000) 0.000 6.879 ( 0.000 0.000 0.000) 0.000 7.052 ( 0.000 0.000 0.000) 0.000 7.064 ( 0.000 0.000 0.000) 0.000 7.331 ( -0.000 0.000 -0.000) 0.000 7.359 ( 0.000 0.000 0.000) 0.000 7.361 ( 0.000 0.000 -0.000) 0.000 7.565 ( 0.000 0.000 -0.000) 0.000 7.629 ( 0.000 0.000 0.000) 0.000 7.791 ( 0.000 0.000 0.000) 0.000 7.835 ( 0.000 0.000 -0.000) 0.000 7.909 ( 0.000 0.000 -0.000) 0.000 8.316 ( 0.000 0.000 0.000) 0.000 8.502 ( 0.000 0.000 0.000) 0.000 8.788 ( 0.000 0.000 0.000) 0.000 8.941 ( 0.000 0.000 0.000) 0.000 8.975 ( 0.000 0.000 0.000) 0.000 9.040 ( -0.000 0.000 0.000) 0.000 9.064 ( 0.000 0.000 -0.000) 0.000 9.104 ( 0.000 0.000 -0.000) 0.000 9.381 ( 0.000 0.000 -0.000) 0.000 9.416 ( 0.000 0.000 0.000) 0.000 9.552 ( 0.000 0.000 -0.000) 0.000 9.841 ( 0.000 0.000 0.000) 0.000 9.879 ( -0.000 0.000 -0.000) 0.000 10.027 ( -0.000 0.000 -0.000) 0.000 10.073 ( 0.000 0.000 0.000) 0.000 10.573 ( 0.000 0.000 -0.000) 0.000 10.595 ( 0.000 0.000 0.000) 0.000 10.660 ( 0.000 0.000 -0.000) 0.000 10.726 ( -0.000 0.000 0.000) 0.000 10.819 ( 0.000 0.000 -0.000) 0.000 10.884 ( 0.000 0.000 0.000) 0.000 11.023 ( 0.000 0.000 0.000) 0.000 11.058 ( 0.000 0.000 0.000) 0.000 11.126 ( 0.000 0.000 -0.000) 0.000 11.313 ( 0.000 0.000 0.000) 0.000 11.618 ( 0.000 0.000 0.000) 0.000 11.681 ( 0.000 0.000 0.000) 0.000 11.766 ( 0.000 0.000 0.000) 0.000 11.782 ( 0.000 0.000 -0.000) 0.000 12.210 ( 0.000 0.000 0.000) 0.000 12.362 ( 0.000 0.000 0.000) 0.000 12.393 ( 0.000 0.000 0.000) 0.000 12.667 ( 0.000 0.000 0.000) 0.000 12.824 ( 0.000 0.000 0.000) 0.000 13.104 ( 0.000 0.000 -0.000) 0.000 13.209 ( 0.000 0.000 0.000) 0.000 13.214 ( 0.000 0.000 0.000) 0.000 13.250 ( -0.000 0.000 0.000) 0.000 13.569 ( 0.000 0.000 0.000) 0.000 13.804 ( 0.000 0.000 -0.000) 0.000 13.966 ( 0.000 0.000 -0.000) 0.000 14.026 ( -0.000 0.000 0.000) 0.000 14.103 ( 0.000 0.000 0.000) 0.000 14.151 ( 0.000 0.000 0.000) 0.000 14.424 ( 0.000 0.000 0.000) 0.000 16.477 ( 0.000 0.000 -0.000) 0.000 16.780 ( 0.000 0.000 0.000) 0.000 17.611 ( 0.000 0.000 0.000) 0.000 17.636 ( 0.000 0.000 -0.000) 0.000 17.881 ( 0.000 0.000 -0.000) 0.000 18.132 ( 0.000 0.000 0.000) 0.000 18.137 ( -0.000 0.000 -0.000) 0.000 18.255 ( 0.000 0.000 0.000) 0.000 20.121 ( 0.000 0.000 -0.000) 0.000 20.144 ( 0.000 0.000 0.000) 0.000 20.680 ( 0.000 0.000 0.000) 0.000 20.711 ( -0.000 0.000 -0.000) 0.000 20.721 ( 0.000 0.000 -0.000) 0.000 20.992 ( 0.000 0.000 0.000) 0.000 21.929 ( 0.000 0.000 -0.000) 0.000 21.990 ( 0.000 0.000 -0.000) 0.000 22.447 ( 0.000 0.000 -0.000) 0.000 22.669 ( 0.000 0.000 -0.000) 0.000 22.723 ( 0.000 0.000 0.000) 0.000 22.847 ( 0.000 0.000 0.000) 0.000 23.154 ( 0.000 0.000 -0.000) 0.000 23.165 ( 0.000 0.000 0.000) 0.000 23.506 ( 0.000 0.000 -0.000) 0.000 23.603 ( 0.000 0.000 0.000) 0.000 24.217 ( 0.000 0.000 0.000) 0.000 24.470 ( 0.000 0.000 -0.000) 0.000 24.763 ( 0.000 0.000 -0.000) 0.000 24.970 ( 0.000 0.000 -0.000) 0.000 27.017 ( 0.000 0.000 -0.000) 0.000 27.084 ( 0.000 0.000 -0.000) 0.000 27.111 ( -0.000 0.000 -0.000) 0.000 27.220 ( 0.000 0.000 0.000) 0.000 27.249 ( 0.000 0.000 0.000) 0.000 27.379 ( 0.000 0.000 -0.000) 0.000 27.503 ( 0.000 0.000 0.000) 0.000 27.792 ( 0.000 0.000 -0.000) 0.000 27.881 ( -0.000 0.000 -0.000) 0.000 27.885 ( 0.000 0.000 -0.000) 0.000 27.888 ( 0.000 0.000 0.000) 0.000 28.230 ( 0.000 0.000 -0.000) 0.000 28.312 ( 0.000 0.000 0.000) 0.000 28.570 ( 0.000 0.000 -0.000) 0.000 28.843 ( 0.000 0.000 0.000) 0.000 28.993 ( 0.000 0.000 -0.000) 0.000 29.280 ( 0.000 0.000 0.000) 0.000 29.424 ( 0.000 0.000 -0.000) 0.000 29.491 ( 0.000 0.000 -0.000) 0.000 29.583 ( 0.000 0.000 -0.000) 0.000 30.642 ( 0.000 0.000 0.000) 0.000 30.656 ( 0.000 0.000 -0.000) 0.000 30.732 ( 0.000 0.000 0.000) 0.000 30.734 ( 0.000 0.000 0.000) 0.000 33.841 ( 0.000 0.000 0.000) 0.000 33.889 ( 0.000 0.000 -0.000) 0.000 33.945 ( 0.000 0.000 0.000) 0.000 34.056 ( 0.000 0.000 -0.000) 0.000 37.276 ( 0.000 0.000 -0.000) 0.000 37.300 ( 0.000 0.000 -0.000) 0.000 37.339 ( 0.000 0.000 0.000) 0.000 37.360 ( 0.000 0.000 0.000) 0.000 37.527 ( 0.000 0.000 -0.000) 0.000 37.660 ( 0.000 0.000 0.000) 0.000 37.862 ( 0.000 0.000 0.000) 0.000 37.899 ( 0.000 0.000 0.000) 0.000 49.347 ( 0.000 0.000 0.000) 0.000 49.394 ( 0.000 0.000 -0.000) 0.000 49.597 ( 0.000 0.000 0.000) 0.000 49.835 ( 0.000 0.000 -0.000) 0.000 50.540 ( 0.000 0.000 0.000) 0.000 50.740 ( 0.000 0.000 0.000) 0.000 50.771 ( 0.000 0.000 0.000) 0.000 50.962 ( 0.000 0.000 0.000) 0.000 51.756 ( 0.000 0.000 -0.000) 0.000 51.760 ( 0.000 0.000 0.000) 0.000 52.292 ( 0.000 0.000 0.000) 0.000 52.302 ( 0.000 0.000 0.000) 0.000 52.504 ( 0.000 0.000 0.000) 0.000 53.184 ( 0.000 0.000 0.000) 0.000 53.309 ( 0.000 0.000 0.000) 0.000 53.498 ( 0.000 0.000 0.000) 0.000 53.908 ( 0.000 0.000 -0.000) 0.000 53.939 ( 0.000 0.000 0.000) 0.000 54.020 ( 0.000 0.000 -0.000) 0.000 54.362 ( 0.000 0.000 -0.000) 0.000 55.808 ( -0.000 0.000 -0.000) 0.000 55.809 ( 0.000 0.000 0.000) 0.000 55.922 ( 0.000 0.000 0.000) 0.000 56.237 ( 0.000 0.000 -0.000) 0.000 57.381 ( 0.000 0.000 0.000) 0.000 57.388 ( 0.000 0.000 -0.000) 0.000 57.403 ( 0.000 0.000 0.000) 0.000 57.405 ( 0.000 0.000 -0.000) 0.000 58.160 ( 0.000 0.000 -0.000) 0.000 58.435 ( 0.000 0.000 0.000) 0.000 58.463 ( 0.000 0.000 -0.000) 0.000 58.843 ( 0.000 0.000 0.000) 0.000 60.918 ( 0.000 0.000 -0.000) 0.000 60.927 ( 0.000 0.000 0.000) 0.000 60.937 ( 0.000 0.000 0.000) 0.000 60.949 ( 0.000 0.000 -0.000) 0.000 ======================= Grid point 9 (6/90) ======================= q-point: ( 0.00 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.856 ( 0.000 42.012 0.000) 42.012 1.093 ( 0.000 53.192 0.000) 53.192 1.535 ( 0.000 68.302 0.000) 68.302 2.738 ( 0.000 -0.446 0.000) 0.446 3.025 ( 0.000 17.205 0.000) 17.205 3.367 ( 0.000 17.345 0.000) 17.345 3.810 ( 0.000 6.294 0.000) 6.294 3.893 ( 0.000 23.545 0.000) 23.545 4.128 ( 0.000 7.419 0.000) 7.419 4.215 ( 0.000 20.755 0.000) 20.755 4.350 ( 0.000 7.189 0.000) 7.189 4.386 ( 0.000 27.099 0.000) 27.099 4.909 ( 0.000 -0.366 0.000) 0.366 5.171 ( 0.000 13.372 0.000) 13.372 5.423 ( 0.000 -8.864 0.000) 8.864 5.456 ( 0.000 2.186 0.000) 2.186 5.656 ( 0.000 5.657 0.000) 5.657 5.799 ( 0.000 6.011 0.000) 6.011 5.963 ( 0.000 6.760 0.000) 6.760 6.206 ( 0.000 -3.854 0.000) 3.854 6.457 ( 0.000 -1.141 0.000) 1.141 6.513 ( 0.000 -5.327 0.000) 5.327 6.748 ( 0.000 -13.152 0.000) 13.152 6.882 ( 0.000 4.877 0.000) 4.877 6.954 ( 0.000 5.519 0.000) 5.519 6.961 ( 0.000 -10.180 0.000) 10.180 7.147 ( 0.000 -12.518 0.000) 12.518 7.305 ( 0.000 1.425 0.000) 1.425 7.401 ( 0.000 -5.127 0.000) 5.127 7.546 ( 0.000 -8.816 0.000) 8.816 7.637 ( 0.000 13.622 0.000) 13.622 7.795 ( 0.000 -6.330 0.000) 6.330 7.833 ( 0.000 -2.138 0.000) 2.138 7.945 ( 0.000 5.664 0.000) 5.664 8.110 ( 0.000 1.263 0.000) 1.263 8.155 ( 0.000 9.620 0.000) 9.620 8.201 ( 0.000 -0.163 0.000) 0.163 8.370 ( 0.000 10.814 0.000) 10.814 8.455 ( 0.000 -12.814 0.000) 12.814 8.611 ( 0.000 -2.155 0.000) 2.155 8.918 ( 0.000 -6.535 0.000) 6.535 9.006 ( 0.000 -0.512 0.000) 0.512 9.212 ( 0.000 2.911 0.000) 2.911 9.259 ( 0.000 -11.006 0.000) 11.006 9.481 ( 0.000 -5.175 0.000) 5.175 9.602 ( 0.000 -12.780 0.000) 12.780 9.913 ( 0.000 5.934 0.000) 5.934 10.028 ( 0.000 10.873 0.000) 10.873 10.054 ( 0.000 9.111 0.000) 9.111 10.164 ( 0.000 -21.313 0.000) 21.313 10.371 ( 0.000 -11.892 0.000) 11.892 10.503 ( 0.000 8.757 0.000) 8.757 10.563 ( 0.000 -6.713 0.000) 6.713 10.825 ( 0.000 -6.451 0.000) 6.451 11.029 ( 0.000 5.219 0.000) 5.219 11.102 ( 0.000 4.490 0.000) 4.490 11.135 ( 0.000 6.291 0.000) 6.291 11.166 ( 0.000 6.295 0.000) 6.295 11.470 ( 0.000 4.014 0.000) 4.014 11.651 ( 0.000 -9.763 0.000) 9.763 11.712 ( 0.000 1.760 0.000) 1.760 11.805 ( 0.000 2.984 0.000) 2.984 11.971 ( 0.000 -4.433 0.000) 4.433 12.154 ( 0.000 -1.029 0.000) 1.029 12.197 ( 0.000 6.213 0.000) 6.213 12.275 ( 0.000 -7.003 0.000) 7.003 12.416 ( 0.000 -4.025 0.000) 4.025 12.715 ( 0.000 0.508 0.000) 0.508 12.742 ( 0.000 0.056 0.000) 0.056 12.873 ( 0.000 -0.264 0.000) 0.264 12.896 ( 0.000 -7.479 0.000) 7.479 13.052 ( 0.000 -4.684 0.000) 4.684 13.607 ( 0.000 -9.031 0.000) 9.031 13.696 ( 0.000 -0.299 0.000) 0.299 13.822 ( 0.000 1.829 0.000) 1.829 13.855 ( 0.000 -7.112 0.000) 7.112 13.926 ( 0.000 6.895 0.000) 6.895 14.042 ( 0.000 -6.854 0.000) 6.854 14.220 ( 0.000 0.306 0.000) 0.306 14.238 ( 0.000 3.261 0.000) 3.261 16.391 ( 0.000 -6.062 0.000) 6.062 16.549 ( 0.000 -9.949 0.000) 9.949 16.964 ( 0.000 -11.442 0.000) 11.442 17.146 ( 0.000 -21.352 0.000) 21.352 18.039 ( 0.000 5.886 0.000) 5.886 18.181 ( 0.000 -0.260 0.000) 0.260 18.445 ( 0.000 17.864 0.000) 17.864 18.592 ( 0.000 13.835 0.000) 13.835 20.224 ( 0.000 -0.653 0.000) 0.653 20.378 ( 0.000 3.960 0.000) 3.960 20.425 ( 0.000 3.654 0.000) 3.654 20.533 ( 0.000 -12.441 0.000) 12.441 21.020 ( 0.000 -1.447 0.000) 1.447 21.152 ( 0.000 -4.027 0.000) 4.027 21.370 ( 0.000 0.277 0.000) 0.277 21.511 ( 0.000 -5.372 0.000) 5.372 22.471 ( 0.000 -0.103 0.000) 0.103 22.579 ( 0.000 -3.006 0.000) 3.006 22.714 ( 0.000 -0.634 0.000) 0.634 22.807 ( 0.000 -1.816 0.000) 1.816 23.200 ( 0.000 27.864 0.000) 27.864 24.122 ( 0.000 5.257 0.000) 5.257 24.205 ( 0.000 6.858 0.000) 6.858 24.416 ( 0.000 4.884 0.000) 4.884 24.489 ( 0.000 5.235 0.000) 5.235 24.769 ( 0.000 2.877 0.000) 2.877 25.305 ( 0.000 -2.458 0.000) 2.458 25.440 ( 0.000 -1.231 0.000) 1.231 26.813 ( 0.000 -0.469 0.000) 0.469 26.822 ( 0.000 -1.076 0.000) 1.076 26.929 ( 0.000 -0.552 0.000) 0.552 27.164 ( 0.000 -3.489 0.000) 3.489 27.277 ( 0.000 -2.605 0.000) 2.605 27.542 ( 0.000 -7.906 0.000) 7.906 27.587 ( 0.000 -14.388 0.000) 14.388 27.742 ( 0.000 -8.170 0.000) 8.170 27.891 ( 0.000 4.267 0.000) 4.267 28.082 ( 0.000 6.727 0.000) 6.727 28.113 ( 0.000 -1.083 0.000) 1.083 28.439 ( 0.000 1.901 0.000) 1.901 28.573 ( 0.000 7.195 0.000) 7.195 28.591 ( 0.000 1.099 0.000) 1.099 28.670 ( 0.000 -0.070 0.000) 0.070 28.753 ( 0.000 5.495 0.000) 5.495 29.000 ( 0.000 0.573 0.000) 0.573 29.264 ( 0.000 -0.693 0.000) 0.693 29.410 ( 0.000 4.663 0.000) 4.663 29.892 ( 0.000 -2.828 0.000) 2.828 30.575 ( 0.000 -2.003 0.000) 2.003 30.674 ( 0.000 1.598 0.000) 1.598 30.777 ( 0.000 7.132 0.000) 7.132 31.347 ( 0.000 -0.420 0.000) 0.420 33.853 ( 0.000 0.768 0.000) 0.768 33.967 ( 0.000 -0.155 0.000) 0.155 33.997 ( 0.000 -0.421 0.000) 0.421 34.010 ( 0.000 -1.202 0.000) 1.202 37.221 ( 0.000 0.418 0.000) 0.418 37.227 ( 0.000 -1.654 0.000) 1.654 37.246 ( 0.000 -3.154 0.000) 3.154 37.371 ( 0.000 -2.678 0.000) 2.678 37.573 ( 0.000 3.627 0.000) 3.627 37.630 ( 0.000 0.356 0.000) 0.356 37.734 ( 0.000 1.192 0.000) 1.192 37.763 ( 0.000 1.314 0.000) 1.314 48.778 ( 0.000 -0.148 0.000) 0.148 48.828 ( 0.000 0.041 0.000) 0.041 48.892 ( 0.000 -1.103 0.000) 1.103 48.905 ( 0.000 -0.537 0.000) 0.537 50.518 ( 0.000 -0.405 0.000) 0.405 50.544 ( 0.000 -0.865 0.000) 0.865 50.632 ( 0.000 -0.851 0.000) 0.851 51.384 ( 0.000 -6.903 0.000) 6.903 51.766 ( 0.000 4.032 0.000) 4.032 51.886 ( 0.000 3.051 0.000) 3.051 52.295 ( 0.000 2.532 0.000) 2.532 52.330 ( 0.000 4.104 0.000) 4.104 52.582 ( 0.000 -2.543 0.000) 2.543 52.741 ( 0.000 -6.732 0.000) 6.732 53.066 ( 0.000 -2.811 0.000) 2.811 53.219 ( 0.000 -3.328 0.000) 3.328 53.798 ( 0.000 0.790 0.000) 0.790 53.829 ( 0.000 0.419 0.000) 0.419 54.167 ( 0.000 -0.101 0.000) 0.101 54.356 ( 0.000 -1.592 0.000) 1.592 55.699 ( 0.000 0.571 0.000) 0.571 55.777 ( 0.000 0.594 0.000) 0.594 56.008 ( 0.000 -2.040 0.000) 2.040 56.702 ( 0.000 -13.816 0.000) 13.816 57.413 ( 0.000 3.360 0.000) 3.360 57.460 ( 0.000 6.349 0.000) 6.349 57.507 ( 0.000 9.225 0.000) 9.225 58.108 ( 0.000 -0.091 0.000) 0.091 58.326 ( 0.000 -2.764 0.000) 2.764 58.375 ( 0.000 -1.191 0.000) 1.191 58.486 ( 0.000 -3.867 0.000) 3.867 58.663 ( 0.000 -5.061 0.000) 5.061 60.926 ( 0.000 1.497 0.000) 1.497 60.949 ( 0.000 0.958 0.000) 0.958 61.016 ( 0.000 4.922 0.000) 4.922 61.520 ( 0.000 -1.159 0.000) 1.159 ======================= Grid point 10 (7/90) ======================= q-point: ( 0.12 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.076 ( 25.218 26.358 8.515) 37.459 1.370 ( 35.486 26.159 20.514) 48.625 2.459 ( 58.256 51.251 0.453) 77.593 2.807 ( 4.538 -2.722 -0.945) 5.376 3.116 ( 8.427 13.423 -0.193) 15.850 3.480 ( 1.618 17.642 7.513) 19.244 3.738 ( 5.643 27.008 -12.530) 30.303 3.877 ( -4.119 12.487 -7.135) 14.960 4.075 ( 0.104 9.901 6.965) 12.106 4.343 ( 13.646 9.965 4.446) 17.472 4.430 ( 13.738 14.241 6.627) 20.868 4.681 ( 17.162 22.155 -2.718) 28.156 4.984 ( 6.223 -1.655 -2.271) 6.828 5.233 ( 4.138 12.589 -1.571) 13.344 5.271 ( -6.279 0.432 -3.524) 7.213 5.499 ( 2.047 -1.223 -5.144) 5.670 5.700 ( 3.622 4.241 -9.709) 11.197 5.802 ( 9.042 5.309 -3.261) 10.981 6.105 ( -1.732 -4.363 6.052) 7.660 6.274 ( 11.400 2.801 10.306) 15.621 6.440 ( -1.266 2.178 -4.764) 5.390 6.592 ( 1.696 -9.471 -5.653) 11.159 6.679 ( -3.372 -11.362 -0.678) 11.871 6.868 ( -0.706 -2.859 -4.516) 5.391 7.014 ( 0.126 -6.415 -3.740) 7.427 7.087 ( 6.468 -1.825 -9.797) 11.880 7.158 ( 2.469 -8.460 0.928) 8.862 7.314 ( 1.150 1.336 -8.850) 9.024 7.379 ( -3.243 -8.405 1.926) 9.212 7.555 ( -3.377 6.656 1.608) 7.635 7.626 ( 2.527 -1.939 7.377) 8.036 7.766 ( -2.120 -1.515 17.140) 17.337 7.832 ( -1.849 -0.610 -0.884) 2.139 7.954 ( 0.792 8.329 -3.094) 8.921 8.051 ( -4.465 2.028 2.024) 5.305 8.176 ( 1.260 4.444 0.828) 4.693 8.253 ( 0.931 -3.909 -3.526) 5.347 8.417 ( 6.436 -2.423 0.467) 6.893 8.465 ( 3.700 -6.544 -1.048) 7.590 8.670 ( 1.129 3.617 3.060) 4.871 8.941 ( -0.537 -6.113 2.388) 6.585 9.026 ( 3.497 -3.949 2.992) 6.064 9.160 ( -0.390 -11.126 -6.788) 13.039 9.325 ( 3.123 -3.512 7.932) 9.220 9.508 ( -6.025 -5.556 4.850) 9.524 9.576 ( 1.338 -3.768 2.732) 4.843 9.884 ( 0.930 0.044 0.724) 1.180 9.958 ( -4.406 10.021 -4.981) 12.027 10.051 ( -2.304 8.761 5.838) 10.777 10.170 ( 1.726 -10.699 -2.433) 11.107 10.394 ( 1.617 -4.308 -4.030) 6.117 10.491 ( 1.607 -3.457 -2.138) 4.371 10.559 ( 3.236 -2.357 -3.916) 5.600 10.742 ( -6.003 -1.484 -4.844) 7.855 11.025 ( -1.912 8.093 0.561) 8.334 11.093 ( 1.382 3.984 -1.089) 4.355 11.188 ( 3.652 1.702 5.204) 6.582 11.251 ( 4.605 5.556 11.029) 13.180 11.343 ( -7.527 -1.688 -3.321) 8.398 11.471 ( -12.339 5.488 0.404) 13.511 11.752 ( -1.194 1.623 -1.018) 2.257 11.828 ( -2.597 -3.203 -4.691) 6.246 11.981 ( 4.229 -3.679 0.447) 5.623 12.125 ( -0.540 0.600 -1.732) 1.911 12.252 ( -2.362 -4.876 -5.263) 7.553 12.362 ( 7.325 -1.569 3.003) 8.071 12.649 ( -4.617 -0.998 0.310) 4.734 12.684 ( 0.495 -5.232 4.995) 7.251 12.739 ( 2.097 -8.639 0.203) 8.892 12.887 ( 0.702 -3.141 0.120) 3.220 13.003 ( 4.276 -6.396 -0.197) 7.697 13.083 ( 5.080 -10.936 3.732) 12.623 13.576 ( -3.183 -7.291 -0.806) 7.996 13.714 ( -0.255 -9.547 6.454) 11.526 13.744 ( -3.870 -3.695 -2.007) 5.715 13.851 ( -3.158 1.657 2.168) 4.174 13.974 ( 3.227 -3.909 8.726) 10.092 14.067 ( 0.767 -7.035 -2.815) 7.616 14.250 ( 2.802 -0.043 -0.843) 2.927 14.294 ( 4.541 1.818 2.431) 5.462 16.423 ( -0.086 -12.929 0.123) 12.930 16.602 ( 4.533 -8.739 0.836) 9.880 17.003 ( 4.274 -15.881 -1.980) 16.565 17.203 ( 5.173 -19.255 1.219) 19.975 18.044 ( 0.714 6.395 1.035) 6.518 18.166 ( -1.096 1.445 -1.983) 2.688 18.432 ( -1.304 16.935 1.255) 17.031 18.567 ( -2.581 13.375 0.377) 13.627 20.241 ( 0.637 -0.364 2.908) 2.999 20.353 ( -1.959 2.866 0.928) 3.593 20.406 ( -1.346 3.693 -0.918) 4.036 20.562 ( 1.924 -9.760 -1.536) 10.066 20.992 ( -2.410 -2.576 -1.044) 3.678 21.140 ( -1.447 -4.455 1.521) 4.924 21.435 ( 5.638 -0.156 1.253) 5.778 21.465 ( -0.063 0.933 -1.319) 1.616 22.522 ( 1.593 -1.605 1.958) 2.991 22.544 ( -0.826 -2.323 -0.969) 2.649 22.710 ( -0.328 -0.650 -0.348) 0.807 22.815 ( 0.517 -2.180 0.355) 2.269 23.185 ( -0.895 24.801 -2.119) 24.908 23.805 ( -35.829 39.502 12.795) 54.844 24.111 ( -1.756 5.945 -1.650) 6.415 24.164 ( -5.020 7.570 2.579) 9.442 24.471 ( 0.679 3.039 -3.735) 4.862 24.676 ( -7.523 3.002 3.801) 8.947 25.240 ( -5.249 -2.232 -2.993) 6.441 25.342 ( -9.316 -1.505 1.262) 9.521 26.845 ( 2.543 -1.343 -0.051) 2.877 26.911 ( 4.372 -4.533 -3.875) 7.395 26.974 ( 4.611 -4.646 -7.095) 9.653 27.187 ( 2.396 -4.642 -0.978) 5.314 27.251 ( -2.369 -1.927 1.164) 3.269 27.534 ( -4.329 -13.523 4.937) 15.032 27.563 ( 0.649 -8.488 -2.363) 8.834 27.704 ( -4.094 -7.038 1.861) 8.352 27.887 ( 0.817 4.070 -5.981) 7.280 27.991 ( -3.921 3.141 5.090) 7.152 28.192 ( 3.706 2.765 -4.101) 6.181 28.356 ( -7.477 11.214 -7.209) 15.285 28.497 ( 0.184 3.823 4.385) 5.821 28.611 ( -3.046 3.026 -0.248) 4.301 28.656 ( 4.020 0.347 -0.700) 4.095 28.828 ( -7.061 17.646 -5.243) 19.716 29.053 ( 7.414 -3.853 -1.841) 8.556 29.237 ( 1.118 -1.109 -2.298) 2.786 29.363 ( 0.908 4.212 -0.049) 4.309 29.674 ( -4.211 17.807 -9.647) 20.685 30.570 ( -0.217 -1.914 -0.200) 1.937 30.669 ( -0.126 1.215 -0.262) 1.249 30.753 ( -1.506 6.790 0.034) 6.955 30.914 ( -9.877 13.803 -8.065) 18.792 33.857 ( 0.564 0.493 -1.482) 1.661 33.936 ( -3.059 -0.200 0.193) 3.071 33.958 ( -0.457 -0.416 0.439) 0.758 34.045 ( 1.191 -1.184 0.859) 1.886 37.210 ( 0.508 -0.646 -0.081) 0.826 37.237 ( -0.296 -1.763 0.143) 1.794 37.266 ( 1.679 -0.875 -0.509) 1.961 37.365 ( -0.067 -0.592 -0.157) 0.616 37.544 ( -0.875 3.007 -0.437) 3.162 37.648 ( 0.793 1.175 -1.111) 1.801 37.768 ( 2.746 0.544 -1.283) 3.079 37.831 ( 1.529 -2.529 8.750) 9.236 48.888 ( 10.125 -0.748 -1.996) 10.347 48.941 ( 5.073 -1.636 -0.425) 5.347 48.981 ( 6.685 -0.762 1.796) 6.964 49.525 ( 25.852 -26.472 -13.248) 39.301 50.527 ( 1.288 -1.005 0.118) 1.639 50.623 ( -0.783 -0.648 0.205) 1.037 50.802 ( 10.395 -18.919 37.463) 43.237 51.292 ( -7.285 -5.963 -4.576) 10.467 51.770 ( 0.300 3.960 0.127) 3.974 51.848 ( -2.677 5.447 1.313) 6.210 52.309 ( 0.648 2.724 -0.243) 2.811 52.333 ( 0.270 4.128 -0.079) 4.137 52.691 ( -3.279 -5.518 -5.213) 8.269 52.753 ( 9.953 -15.564 15.975) 24.423 53.123 ( 4.195 -3.591 0.446) 5.540 53.254 ( 3.094 -3.547 0.553) 4.739 53.803 ( 0.563 0.760 -0.348) 1.008 53.847 ( 1.567 0.305 0.178) 1.606 54.160 ( -0.407 -0.488 -3.243) 3.305 54.353 ( -0.205 -1.599 -0.096) 1.615 55.704 ( 0.542 0.445 -0.204) 0.731 55.790 ( 1.139 0.530 0.155) 1.266 55.992 ( -1.190 -2.251 -3.800) 4.574 56.638 ( -5.920 -12.430 -0.299) 13.771 57.413 ( 0.037 3.394 0.107) 3.396 57.460 ( 0.022 6.215 -0.413) 6.229 57.494 ( -1.047 8.598 -0.341) 8.668 57.866 ( -16.868 18.014 8.619) 26.141 58.248 ( -6.390 -1.752 -0.324) 6.633 58.336 ( 0.435 -2.716 2.474) 3.700 58.480 ( 0.511 -1.373 -21.564) 21.614 58.701 ( 4.291 -6.661 3.910) 8.836 60.926 ( -0.015 1.438 0.016) 1.438 60.950 ( 0.115 1.052 0.162) 1.071 61.011 ( -0.506 4.620 0.044) 4.648 61.200 ( -14.131 13.976 -2.785) 20.069 ======================= Grid point 11 (8/90) ======================= q-point: ( 0.25 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.843 ( 39.497 2.546 3.237) 39.711 2.248 ( 36.902 13.019 23.606) 45.700 2.898 ( 3.968 -2.038 2.367) 5.050 3.058 ( -5.461 25.315 -1.175) 25.925 3.530 ( 2.090 15.723 -15.286) 22.028 3.691 ( 37.860 13.408 4.191) 40.382 3.815 ( 16.496 18.744 -1.977) 25.047 4.072 ( 17.313 21.374 -10.060) 29.288 4.222 ( 15.726 13.759 15.248) 25.867 4.638 ( 7.046 12.610 2.481) 14.656 4.811 ( 18.473 9.269 10.399) 23.137 4.924 ( 4.681 5.541 5.119) 8.879 5.027 ( 5.151 2.200 -5.445) 7.811 5.262 ( 5.062 12.329 -1.418) 13.403 5.379 ( 4.859 6.728 -7.647) 11.285 5.619 ( 12.223 -0.932 -4.898) 13.201 5.831 ( 1.295 -0.324 -1.013) 1.675 5.870 ( 11.254 3.242 -5.853) 13.093 6.244 ( 8.777 -1.490 -4.960) 10.191 6.373 ( -2.349 1.974 -4.692) 5.606 6.453 ( -1.209 -2.877 -3.331) 4.564 6.523 ( -2.726 -3.753 -5.254) 7.009 6.589 ( -1.195 -10.016 5.359) 11.422 6.869 ( -5.817 -10.979 0.695) 12.445 6.916 ( 0.032 -8.188 -1.802) 8.384 7.171 ( -0.730 -2.584 -5.953) 6.531 7.244 ( 4.349 2.844 -1.063) 5.303 7.274 ( 1.816 -4.665 -6.048) 7.851 7.344 ( 0.653 2.817 0.544) 2.942 7.485 ( -2.012 9.895 -2.145) 10.323 7.736 ( 1.080 -8.331 -2.544) 8.778 7.797 ( 0.978 -2.517 4.266) 5.049 7.839 ( 4.497 5.399 20.564) 21.731 7.925 ( -1.893 5.182 -12.588) 13.743 7.999 ( -1.715 12.392 2.167) 12.696 8.196 ( 0.141 -2.800 8.498) 8.948 8.253 ( 2.035 0.464 4.354) 4.829 8.533 ( 3.364 3.187 -8.163) 9.387 8.586 ( 6.396 -16.593 -0.075) 17.784 8.691 ( 2.717 5.752 3.085) 7.070 8.934 ( -0.745 -1.550 6.258) 6.490 9.120 ( 4.008 -11.239 -1.878) 12.079 9.177 ( 2.611 -11.624 -1.192) 11.973 9.381 ( -1.863 1.686 2.934) 3.863 9.452 ( 0.662 -12.116 2.514) 12.392 9.503 ( -4.869 5.169 6.449) 9.593 9.793 ( -9.516 0.499 2.952) 9.976 9.940 ( -1.699 9.652 9.904) 13.933 10.029 ( 0.568 -6.882 -3.322) 7.663 10.243 ( 6.594 -1.210 -8.130) 10.538 10.401 ( -0.866 2.783 -5.576) 6.292 10.497 ( -0.715 -1.162 0.589) 1.486 10.614 ( 2.220 -0.026 -3.348) 4.018 10.702 ( 4.269 -3.504 -2.050) 5.891 10.992 ( -0.958 4.762 -0.097) 4.859 11.092 ( -3.553 6.822 -1.532) 7.843 11.175 ( -6.612 0.646 -3.194) 7.371 11.205 ( -5.272 5.982 -0.899) 8.024 11.341 ( 0.340 0.870 9.352) 9.399 11.351 ( 2.353 2.364 8.444) 9.078 11.676 ( -2.369 4.058 -1.068) 4.819 11.739 ( -4.041 -4.338 -10.489) 12.048 11.986 ( -3.071 2.362 -1.741) 4.247 12.078 ( -9.065 1.233 -8.721) 12.639 12.203 ( 2.205 -3.050 2.717) 4.642 12.504 ( 2.833 -0.747 3.759) 4.766 12.551 ( -4.392 -0.709 -0.214) 4.454 12.584 ( -4.290 -0.983 -0.891) 4.490 12.763 ( -0.359 -10.071 1.086) 10.136 12.893 ( 0.818 -5.209 1.491) 5.480 13.079 ( 4.170 -7.004 -1.695) 8.326 13.116 ( -1.667 -5.876 0.107) 6.109 13.463 ( -7.078 -5.093 -1.042) 8.782 13.648 ( -6.074 -7.606 8.760) 13.095 13.720 ( 0.565 -8.020 -2.424) 8.397 13.818 ( -0.475 -0.747 3.419) 3.532 14.007 ( -1.393 -3.970 1.687) 4.533 14.046 ( -1.524 -7.320 -0.252) 7.481 14.282 ( 0.272 0.194 -2.905) 2.924 14.388 ( 2.579 -0.838 3.254) 4.236 16.395 ( -2.042 -12.260 2.106) 12.606 16.654 ( 0.606 -9.668 -1.577) 9.814 17.141 ( 8.275 -18.236 -0.759) 20.040 17.325 ( 5.023 -18.554 0.901) 19.243 18.081 ( 2.041 6.435 1.511) 6.918 18.135 ( -0.678 6.875 -2.369) 7.304 18.401 ( -2.097 13.874 1.902) 14.160 18.492 ( -4.300 13.373 -0.183) 14.049 20.236 ( -1.487 4.093 -0.293) 4.364 20.328 ( -2.315 6.361 2.863) 7.349 20.389 ( 2.026 -0.051 1.052) 2.284 20.588 ( 1.343 -7.707 -2.721) 8.283 20.924 ( -3.979 -5.035 -0.486) 6.436 21.093 ( -3.713 -4.742 1.916) 6.320 21.555 ( 8.331 -1.611 -0.067) 8.486 21.611 ( 9.992 -2.696 0.123) 10.350 22.474 ( -1.860 0.099 -3.191) 3.695 22.605 ( 2.111 -2.835 4.397) 5.642 22.703 ( -0.062 -0.727 -0.962) 1.207 22.823 ( 0.113 -2.592 -0.080) 2.595 23.168 ( 0.315 19.375 -1.848) 19.465 23.354 ( -11.496 29.236 4.819) 31.782 24.004 ( -9.409 6.300 1.485) 11.420 24.056 ( -5.272 7.146 -1.955) 9.092 24.480 ( 0.406 3.778 -3.997) 5.515 24.489 ( -9.592 3.962 4.354) 11.254 25.090 ( -11.331 -1.914 1.676) 11.614 25.117 ( -7.492 -0.801 -2.135) 7.831 26.912 ( 3.637 -2.043 -0.272) 4.181 26.966 ( 1.611 -3.176 -0.124) 3.564 27.040 ( 4.163 -5.382 -6.508) 9.415 27.195 ( -2.542 -1.370 2.264) 3.669 27.242 ( 1.616 -5.075 -1.081) 5.434 27.434 ( -5.058 -10.785 2.578) 12.188 27.520 ( -5.639 -6.029 1.495) 8.389 27.651 ( 0.265 -8.631 0.728) 8.666 27.891 ( 1.023 2.896 -8.570) 9.104 27.965 ( -0.449 1.910 4.492) 4.902 28.222 ( -2.968 11.491 -2.969) 12.234 28.255 ( 0.670 9.575 -8.998) 13.156 28.364 ( -7.881 8.481 1.261) 11.646 28.549 ( 1.052 2.137 2.780) 3.661 28.774 ( 5.583 2.124 -0.742) 6.019 28.854 ( 5.475 5.210 1.496) 7.704 29.128 ( 2.762 -4.371 -3.073) 6.015 29.349 ( 5.082 -2.642 1.343) 5.883 29.436 ( 4.571 3.496 0.554) 5.781 29.654 ( 0.580 12.386 -0.276) 12.402 30.576 ( 0.894 -2.573 -0.244) 2.735 30.676 ( 0.544 0.486 0.101) 0.737 30.743 ( 0.199 4.658 0.813) 4.733 30.811 ( -2.072 6.836 -2.331) 7.514 33.867 ( 0.707 0.039 -1.548) 1.703 33.883 ( -2.084 0.010 0.524) 2.149 33.952 ( -0.437 -0.504 1.136) 1.317 34.057 ( -0.120 -1.257 0.510) 1.362 37.232 ( 1.309 -0.702 0.092) 1.488 37.246 ( 1.107 -1.311 0.168) 1.724 37.293 ( 1.130 -0.959 -0.949) 1.759 37.367 ( 0.220 0.077 -0.078) 0.246 37.539 ( 0.393 2.903 -0.468) 2.967 37.661 ( 0.792 1.460 -1.275) 2.094 37.818 ( 2.138 -0.254 -1.542) 2.649 37.866 ( 0.416 -1.600 5.183) 5.440 49.075 ( 7.881 -2.177 -0.869) 8.223 49.138 ( 11.300 -1.017 -3.229) 11.797 49.179 ( 11.998 -1.938 4.851) 13.086 49.753 ( 5.410 -11.157 -11.769) 17.095 50.562 ( 1.874 -1.584 -1.574) 2.916 50.602 ( -0.804 -0.078 -0.720) 1.082 50.944 ( -3.886 -13.897 23.046) 27.191 51.110 ( -7.498 -4.195 -5.669) 10.294 51.777 ( 0.315 3.750 -0.001) 3.763 51.813 ( -0.807 5.438 0.521) 5.522 52.318 ( 0.396 3.345 -0.319) 3.384 52.340 ( 0.448 4.292 -0.148) 4.318 52.598 ( -3.817 -4.094 -6.346) 8.462 52.953 ( 4.321 -16.278 16.503) 23.579 53.205 ( 3.237 -4.011 -0.223) 5.159 53.337 ( 4.096 -4.157 2.074) 6.193 53.822 ( 1.424 0.603 -0.064) 1.548 53.888 ( 2.052 0.062 0.038) 2.053 54.127 ( -1.708 -0.510 -4.159) 4.525 54.348 ( -0.227 -1.737 -0.039) 1.752 55.721 ( 1.183 0.163 -0.208) 1.212 55.825 ( 2.145 0.265 0.165) 2.168 55.939 ( -2.707 -1.787 -3.497) 4.770 56.471 ( -9.381 -8.942 0.182) 12.962 57.415 ( 0.100 3.516 0.126) 3.519 57.457 ( -0.104 5.922 -1.372) 6.080 57.471 ( -0.973 6.942 0.872) 7.063 57.633 ( -7.075 16.912 1.948) 18.435 58.157 ( -2.307 -1.121 1.085) 2.785 58.357 ( 0.542 -3.079 4.359) 5.365 58.447 ( 0.936 -3.322 -14.346) 14.755 58.771 ( 0.904 -7.542 4.311) 8.734 60.927 ( 0.171 1.375 0.062) 1.387 60.954 ( 0.186 1.333 0.078) 1.349 60.996 ( -0.920 3.864 -0.001) 3.972 61.028 ( -3.908 8.099 -0.697) 9.020 ======================= Grid point 12 (9/90) ======================= q-point: ( 0.38 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.578 ( 27.380 -2.111 -0.451) 27.465 2.652 ( -3.002 20.737 10.862) 23.601 2.969 ( 2.158 -0.117 2.716) 3.471 3.272 ( 23.688 22.181 0.136) 32.452 3.397 ( -2.570 7.041 -6.140) 9.689 3.990 ( 3.679 3.391 3.882) 6.333 4.276 ( 17.824 7.435 7.587) 20.749 4.312 ( 6.020 13.286 -14.542) 20.597 4.654 ( -1.510 17.282 1.531) 17.415 4.803 ( 6.077 14.811 11.256) 19.570 5.017 ( 4.312 -1.653 0.898) 4.704 5.167 ( 20.619 11.917 2.173) 23.914 5.258 ( 13.787 6.805 13.589) 20.520 5.384 ( 6.086 8.581 -3.820) 11.192 5.463 ( 14.224 8.864 -4.567) 17.371 5.815 ( 5.822 -5.929 3.867) 9.165 5.892 ( -3.119 -7.600 -15.009) 17.110 6.055 ( -4.989 -4.064 -10.393) 12.223 6.166 ( -2.440 -3.596 -7.649) 8.797 6.296 ( 7.084 -4.583 2.656) 8.845 6.451 ( 9.232 5.335 1.012) 10.711 6.580 ( -5.577 -5.045 -4.380) 8.703 6.659 ( 6.434 1.584 -2.470) 7.071 6.767 ( 0.063 -7.059 3.180) 7.743 6.968 ( 0.745 -9.809 5.896) 11.469 7.079 ( 0.382 -2.036 -4.152) 4.640 7.271 ( -2.576 7.647 -2.143) 8.349 7.324 ( 1.206 4.234 1.595) 4.682 7.419 ( 4.212 2.345 -1.078) 4.940 7.469 ( 1.310 7.502 -0.830) 7.660 7.656 ( -4.916 -3.575 -6.463) 8.872 7.745 ( -7.761 -1.461 -6.531) 10.248 7.853 ( -5.597 11.187 -2.358) 12.729 7.916 ( 1.461 6.756 4.712) 8.366 7.991 ( 0.089 1.445 -7.157) 7.302 8.249 ( 4.121 0.654 7.037) 8.181 8.404 ( 4.862 -5.486 10.429) 12.748 8.574 ( 1.688 -6.286 9.104) 11.191 8.692 ( 4.844 -6.459 -0.983) 8.133 8.801 ( 7.778 -1.101 -6.930) 10.476 8.949 ( 0.161 -5.459 5.377) 7.665 9.172 ( 1.927 -11.050 -2.108) 11.413 9.196 ( -2.931 -2.030 2.597) 4.411 9.311 ( -4.194 4.995 -0.539) 6.544 9.416 ( -0.393 1.300 6.286) 6.431 9.572 ( 6.054 -3.213 4.984) 8.475 9.643 ( -4.856 -2.130 5.976) 7.990 9.909 ( -1.648 5.672 2.393) 6.373 10.082 ( 4.271 -1.305 5.916) 7.412 10.270 ( -0.741 -1.201 -10.924) 11.015 10.359 ( -0.839 1.708 -3.852) 4.296 10.575 ( 5.906 -1.187 -0.623) 6.056 10.627 ( -4.221 -0.989 -3.808) 5.770 10.753 ( 3.966 0.085 2.373) 4.622 10.972 ( -1.204 2.232 -1.780) 3.099 11.021 ( -1.307 4.946 0.189) 5.119 11.045 ( -4.393 4.777 -2.047) 6.805 11.116 ( -4.150 3.341 -2.552) 5.907 11.264 ( -7.920 7.476 1.606) 11.009 11.455 ( 5.106 -0.178 1.800) 5.417 11.544 ( -9.244 1.765 -10.198) 13.877 11.720 ( 4.635 -5.475 1.993) 7.445 11.871 ( -7.402 4.506 -3.527) 9.356 11.901 ( -3.429 5.765 0.729) 6.747 12.211 ( -5.138 -0.351 5.388) 7.454 12.392 ( -3.887 1.355 -0.317) 4.129 12.476 ( -2.215 1.478 -1.302) 2.964 12.657 ( 2.087 -2.544 0.469) 3.323 12.752 ( 1.436 -5.174 -1.129) 5.487 12.949 ( 3.063 -9.796 5.713) 11.746 13.084 ( -0.626 -7.083 -4.016) 8.166 13.141 ( 1.606 -7.705 -1.236) 7.967 13.305 ( -6.847 -4.705 -0.372) 8.316 13.548 ( -4.733 -5.001 6.805) 9.681 13.760 ( 3.940 -8.985 -2.617) 10.154 13.832 ( 0.320 -0.954 4.910) 5.012 13.954 ( -1.964 -7.652 -5.819) 9.812 14.014 ( -2.750 -6.191 4.859) 8.337 14.251 ( -1.684 0.652 -3.726) 4.141 14.424 ( 0.629 -0.595 1.198) 1.478 16.363 ( -1.364 -11.269 1.541) 11.455 16.651 ( -0.025 -10.782 -1.354) 10.867 17.295 ( 5.967 -17.119 -0.026) 18.129 17.393 ( 1.267 -17.421 0.112) 17.467 18.084 ( -0.767 9.145 -1.487) 9.297 18.179 ( 3.727 10.001 1.689) 10.805 18.351 ( -3.080 9.746 0.365) 10.227 18.412 ( -2.714 13.434 0.007) 13.706 20.203 ( -1.189 6.561 -0.550) 6.691 20.281 ( -1.879 9.400 0.690) 9.610 20.492 ( 6.428 -2.751 2.859) 7.554 20.614 ( 1.946 -7.163 -2.634) 7.876 20.814 ( -6.532 -4.911 -0.431) 8.184 21.002 ( -4.813 -4.631 1.418) 6.827 21.745 ( 8.215 -6.340 -0.109) 10.378 21.814 ( 8.200 -6.105 0.059) 10.224 22.445 ( -0.333 0.131 -1.799) 1.834 22.643 ( 0.631 -1.815 3.316) 3.832 22.704 ( 0.450 -0.985 -1.371) 1.747 22.821 ( -0.119 -2.523 -0.224) 2.536 23.210 ( 4.394 15.033 -0.726) 15.679 23.265 ( 0.655 17.069 1.222) 17.125 23.769 ( -12.468 6.788 0.697) 14.213 23.877 ( -10.813 8.116 -1.217) 13.575 24.327 ( -4.948 5.559 2.884) 7.981 24.505 ( 2.002 4.651 -4.201) 6.579 24.856 ( -9.658 -1.092 3.766) 10.424 25.009 ( -3.204 -0.177 -2.192) 3.886 26.970 ( 0.980 -4.203 -0.713) 4.375 26.999 ( 2.905 -2.044 -0.024) 3.552 27.108 ( 2.068 -4.101 -2.177) 5.083 27.163 ( -0.100 -1.393 -0.213) 1.413 27.230 ( -2.245 -3.764 1.801) 4.738 27.375 ( -1.260 -7.788 -2.537) 8.288 27.407 ( -4.335 -4.972 4.229) 7.836 27.678 ( 1.256 -9.525 1.690) 9.755 27.867 ( -1.074 1.859 -7.767) 8.058 27.975 ( 0.203 1.764 2.277) 2.887 28.094 ( -4.198 15.071 -3.630) 16.060 28.278 ( 1.007 5.159 2.224) 5.707 28.323 ( 0.620 2.590 -2.065) 3.370 28.579 ( 0.959 2.143 1.989) 3.077 28.859 ( 2.722 3.503 -0.696) 4.491 28.973 ( 4.571 3.276 2.323) 6.085 29.173 ( 1.928 -4.438 -1.497) 5.065 29.423 ( 2.006 -3.109 0.524) 3.737 29.524 ( 3.572 5.982 0.022) 6.967 29.649 ( -1.230 7.286 0.675) 7.420 30.602 ( 1.544 -2.034 -0.170) 2.559 30.675 ( -0.876 0.462 0.160) 1.003 30.755 ( 0.535 3.333 0.867) 3.486 30.780 ( -0.568 4.328 -1.112) 4.504 33.852 ( -1.008 0.098 0.385) 1.083 33.877 ( 0.536 -0.466 -1.138) 1.342 33.946 ( -0.330 -0.235 1.004) 1.083 34.051 ( -0.388 -1.059 0.063) 1.130 37.254 ( 0.802 -0.813 -0.160) 1.153 37.279 ( 1.506 -1.020 0.949) 2.052 37.308 ( 0.541 -1.287 -0.968) 1.699 37.371 ( 0.176 0.320 -0.090) 0.376 37.550 ( 0.618 2.907 -0.206) 2.979 37.672 ( 0.534 1.521 -0.843) 1.819 37.845 ( 0.842 -0.756 -0.762) 1.364 37.884 ( 0.316 -0.917 2.139) 2.349 49.232 ( 6.458 -2.957 -0.533) 7.123 49.318 ( 6.563 -0.650 -0.807) 6.645 49.438 ( 9.519 -3.901 3.064) 10.734 49.790 ( 1.227 -5.615 -5.477) 7.939 50.556 ( -1.215 -0.336 -0.424) 1.330 50.633 ( 3.839 -1.242 -4.141) 5.781 50.852 ( -7.967 -6.328 11.902) 15.658 50.977 ( -3.804 -3.028 -3.248) 5.847 51.782 ( 0.181 3.361 -0.061) 3.366 51.811 ( 0.201 4.683 0.365) 4.702 52.325 ( 0.244 3.522 -0.188) 3.535 52.349 ( 0.347 4.495 -0.100) 4.509 52.510 ( -2.748 -3.191 -4.409) 6.097 53.040 ( 1.233 -12.178 8.194) 14.730 53.252 ( 1.417 -4.030 -0.305) 4.283 53.418 ( 2.688 -4.567 2.329) 5.789 53.864 ( 2.339 0.152 1.110) 2.593 53.923 ( 1.207 -0.182 -0.193) 1.235 54.069 ( -2.557 -0.066 -3.785) 4.568 54.344 ( -0.136 -1.835 0.084) 1.842 55.753 ( 1.910 -0.177 0.134) 1.923 55.867 ( -2.593 -1.031 -1.801) 3.321 55.879 ( 2.179 -0.305 -0.318) 2.223 56.283 ( -7.787 -5.587 0.549) 9.600 57.419 ( 0.207 3.735 0.070) 3.742 57.446 ( -0.499 5.246 -0.654) 5.311 57.464 ( -0.116 5.850 0.555) 5.878 57.546 ( -2.294 11.969 0.333) 12.192 58.143 ( 0.134 -1.109 0.586) 1.261 58.381 ( 0.410 -3.526 5.235) 6.325 58.430 ( 0.445 -3.875 -9.063) 9.867 58.775 ( -0.935 -7.452 2.254) 7.841 60.934 ( 0.388 1.569 0.057) 1.617 60.958 ( 0.277 1.965 -0.116) 1.988 60.971 ( -1.153 3.306 -0.002) 3.501 60.984 ( -0.970 3.664 -0.034) 3.790 ======================= Grid point 13 (10/90) ======================= q-point: (-0.50 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.599 ( 0.000 23.279 -0.000) 23.279 2.933 ( 0.000 -0.392 0.000) 0.392 2.952 ( 0.000 5.524 -0.000) 5.524 3.270 ( 0.000 4.149 0.000) 4.149 3.718 ( 0.000 12.514 0.000) 12.514 4.004 ( 0.000 0.207 -0.000) 0.207 4.370 ( -0.000 16.356 0.000) 16.356 4.450 ( 0.000 9.267 -0.000) 9.267 4.563 ( 0.000 21.294 -0.000) 21.294 4.796 ( 0.000 13.722 0.000) 13.722 5.108 ( 0.000 5.186 0.000) 5.186 5.400 ( 0.000 8.331 0.000) 8.331 5.500 ( -0.000 0.757 -0.000) 0.757 5.534 ( 0.000 -2.429 0.000) 2.429 5.668 ( 0.000 -7.585 0.000) 7.585 5.687 ( -0.000 -8.367 -0.000) 8.367 5.767 ( 0.000 -2.388 0.000) 2.388 6.000 ( 0.000 -5.910 0.000) 5.910 6.257 ( 0.000 4.142 0.000) 4.142 6.387 ( 0.000 -20.086 0.000) 20.086 6.436 ( 0.000 -2.939 -0.000) 2.939 6.693 ( 0.000 5.088 -0.000) 5.088 6.755 ( 0.000 5.193 -0.000) 5.193 6.856 ( 0.000 15.759 0.000) 15.759 6.881 ( -0.000 1.813 -0.000) 1.813 7.019 ( 0.000 -12.181 -0.000) 12.181 7.248 ( 0.000 8.287 0.000) 8.287 7.369 ( 0.000 5.152 0.000) 5.152 7.439 ( 0.000 2.411 -0.000) 2.411 7.507 ( 0.000 -7.186 0.000) 7.186 7.543 ( 0.000 10.409 -0.000) 10.409 7.651 ( 0.000 -4.377 -0.000) 4.377 7.741 ( 0.000 18.110 0.000) 18.110 7.939 ( 0.000 0.527 -0.000) 0.527 7.969 ( 0.000 4.016 0.000) 4.016 8.321 ( 0.000 0.233 0.000) 0.233 8.457 ( 0.000 -3.966 0.000) 3.966 8.589 ( 0.000 -17.447 -0.000) 17.447 8.747 ( 0.000 -1.797 -0.000) 1.797 8.940 ( -0.000 -16.408 0.000) 16.408 8.958 ( 0.000 -5.339 -0.000) 5.339 9.119 ( 0.000 -1.048 0.000) 1.048 9.225 ( 0.000 11.258 -0.000) 11.258 9.225 ( -0.000 0.750 0.000) 0.750 9.457 ( 0.000 -0.150 0.000) 0.150 9.570 ( 0.000 0.194 -0.000) 0.194 9.722 ( 0.000 -3.186 0.000) 3.186 9.882 ( 0.000 2.029 -0.000) 2.029 10.163 ( -0.000 4.525 -0.000) 4.525 10.246 ( 0.000 10.886 0.000) 10.886 10.396 ( -0.000 -14.253 -0.000) 14.253 10.431 ( 0.000 -6.643 0.000) 6.643 10.703 ( 0.000 1.593 0.000) 1.593 10.855 ( 0.000 3.683 -0.000) 3.683 10.917 ( 0.000 3.629 0.000) 3.629 10.974 ( 0.000 -4.570 -0.000) 4.570 10.990 ( -0.000 10.363 0.000) 10.363 11.058 ( 0.000 -3.230 0.000) 3.230 11.148 ( 0.000 13.542 -0.000) 13.542 11.435 ( 0.000 7.183 0.000) 7.183 11.547 ( 0.000 0.570 -0.000) 0.570 11.739 ( 0.000 -4.911 0.000) 4.911 11.795 ( 0.000 0.001 0.000) 0.001 11.904 ( 0.000 11.789 -0.000) 11.789 12.090 ( 0.000 -2.483 0.000) 2.483 12.380 ( 0.000 -0.278 -0.000) 0.278 12.456 ( 0.000 3.495 0.000) 3.495 12.645 ( 0.000 -2.311 0.000) 2.311 12.803 ( 0.000 -2.518 0.000) 2.518 13.026 ( -0.000 -15.013 -0.000) 15.013 13.039 ( 0.000 -5.676 0.000) 5.676 13.148 ( 0.000 -8.870 0.000) 8.870 13.227 ( 0.000 -1.674 0.000) 1.674 13.508 ( 0.000 -4.796 0.000) 4.796 13.814 ( 0.000 -5.497 -0.000) 5.497 13.862 ( -0.000 -3.189 -0.000) 3.189 13.913 ( 0.000 -12.489 0.000) 12.489 13.974 ( 0.000 -4.845 0.000) 4.845 14.223 ( 0.000 1.078 0.000) 1.078 14.431 ( 0.000 -0.683 -0.000) 0.683 16.351 ( 0.000 -10.969 -0.000) 10.969 16.650 ( 0.000 -11.280 0.000) 11.280 17.379 ( 0.000 -16.739 0.000) 16.739 17.384 ( -0.000 -16.417 -0.000) 16.417 18.073 ( 0.000 11.935 -0.000) 11.935 18.242 ( 0.000 8.735 0.000) 8.735 18.298 ( 0.000 10.862 -0.000) 10.862 18.384 ( 0.000 11.262 0.000) 11.262 20.189 ( 0.000 7.178 -0.000) 7.178 20.262 ( 0.000 9.985 0.000) 9.985 20.635 ( 0.000 -4.005 0.000) 4.005 20.637 ( -0.000 -7.079 -0.000) 7.079 20.675 ( -0.000 -3.641 -0.000) 3.641 20.943 ( 0.000 -4.607 0.000) 4.607 21.839 ( 0.000 -8.243 -0.000) 8.243 21.907 ( 0.000 -7.406 0.000) 7.406 22.441 ( 0.000 -0.207 -0.000) 0.207 22.654 ( 0.000 -1.346 0.000) 1.346 22.708 ( 0.000 -1.251 0.000) 1.251 22.820 ( 0.000 -2.364 0.000) 2.364 23.295 ( 0.000 12.420 0.000) 12.420 23.309 ( 0.000 12.421 0.000) 12.421 23.587 ( 0.000 7.453 -0.000) 7.453 23.719 ( 0.000 10.121 0.000) 10.121 24.285 ( 0.000 6.269 0.000) 6.269 24.527 ( 0.000 5.266 -0.000) 5.266 24.751 ( 0.000 -1.068 -0.000) 1.068 24.972 ( 0.000 0.183 -0.000) 0.183 26.975 ( 0.000 -3.938 -0.000) 3.938 27.052 ( 0.000 -3.102 -0.000) 3.102 27.095 ( -0.000 -2.077 0.000) 2.077 27.174 ( 0.000 -5.027 0.000) 5.027 27.217 ( 0.000 -1.602 0.000) 1.602 27.333 ( 0.000 -3.556 -0.000) 3.556 27.388 ( 0.000 -7.106 0.000) 7.106 27.697 ( 0.000 -9.369 -0.000) 9.369 27.834 ( 0.000 1.873 0.000) 1.873 27.981 ( 0.000 1.655 -0.000) 1.655 28.050 ( 0.000 12.672 -0.000) 12.672 28.294 ( 0.000 4.612 -0.000) 4.612 28.328 ( 0.000 2.058 0.000) 2.058 28.593 ( 0.000 2.179 -0.000) 2.179 28.886 ( 0.000 3.929 0.000) 3.929 29.029 ( 0.000 3.286 -0.000) 3.286 29.192 ( 0.000 -4.485 -0.000) 4.485 29.443 ( 0.000 -3.792 0.000) 3.792 29.572 ( 0.000 9.745 -0.000) 9.745 29.625 ( 0.000 3.291 -0.000) 3.291 30.628 ( 0.000 -1.096 0.000) 1.096 30.654 ( 0.000 -0.128 -0.000) 0.128 30.764 ( 0.000 2.833 0.000) 2.833 30.773 ( 0.000 3.629 -0.000) 3.629 33.842 ( 0.000 0.122 0.000) 0.122 33.881 ( 0.000 -0.722 -0.000) 0.722 33.944 ( 0.000 -0.057 0.000) 0.057 34.046 ( 0.000 -0.958 -0.000) 0.958 37.263 ( 0.000 -0.875 -0.000) 0.875 37.300 ( 0.000 -0.389 -0.000) 0.389 37.311 ( 0.000 -1.925 0.000) 1.925 37.373 ( 0.000 0.395 0.000) 0.395 37.557 ( 0.000 2.851 -0.000) 2.851 37.677 ( 0.000 1.536 0.000) 1.536 37.852 ( 0.000 -0.880 0.000) 0.880 37.890 ( 0.000 -0.718 0.000) 0.718 49.305 ( 0.000 -3.493 0.000) 3.493 49.389 ( 0.000 -0.569 -0.000) 0.569 49.546 ( 0.000 -4.695 0.000) 4.695 49.793 ( 0.000 -4.044 -0.000) 4.044 50.541 ( 0.000 0.121 0.000) 0.121 50.722 ( 0.000 -1.623 -0.000) 1.623 50.724 ( -0.000 -3.855 0.000) 3.855 50.934 ( 0.000 -2.685 0.000) 2.685 51.784 ( 0.000 3.136 0.000) 3.136 51.814 ( 0.000 4.527 -0.000) 4.527 52.327 ( 0.000 3.527 0.000) 3.527 52.352 ( 0.000 4.581 0.000) 4.581 52.473 ( 0.000 -2.847 0.000) 2.847 53.063 ( 0.000 -10.749 0.000) 10.749 53.266 ( 0.000 -4.028 0.000) 4.028 53.451 ( 0.000 -4.586 0.000) 4.586 53.903 ( 0.000 -0.356 0.000) 0.356 53.933 ( 0.000 -0.478 0.000) 0.478 54.026 ( 0.000 0.593 -0.000) 0.593 54.343 ( 0.000 -1.855 -0.000) 1.855 55.800 ( -0.000 -0.805 -0.000) 0.805 55.805 ( 0.000 -0.341 0.000) 0.341 55.915 ( 0.000 -0.609 0.000) 0.609 56.191 ( 0.000 -4.172 -0.000) 4.172 57.422 ( 0.000 3.942 0.000) 3.942 57.439 ( 0.000 4.722 -0.000) 4.722 57.464 ( 0.000 5.657 0.000) 5.657 57.524 ( 0.000 10.274 -0.000) 10.274 58.148 ( 0.000 -1.185 -0.000) 1.185 58.396 ( 0.000 -3.731 0.000) 3.731 58.418 ( 0.000 -3.952 -0.000) 3.952 58.765 ( 0.000 -7.312 0.000) 7.312 60.940 ( 0.000 2.112 -0.000) 2.112 60.958 ( 0.000 1.996 -0.000) 1.996 60.963 ( 0.000 3.127 0.000) 3.127 60.972 ( 0.000 2.066 -0.000) 2.066 ======================= Grid point 18 (11/90) ======================= q-point: ( 0.00 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.721 ( 0.000 42.279 0.000) 42.279 2.162 ( 0.000 50.523 0.000) 50.523 2.629 ( 0.000 35.682 0.000) 35.682 2.846 ( 0.000 11.360 0.000) 11.360 3.458 ( 0.000 22.309 0.000) 22.309 3.698 ( 0.000 15.446 0.000) 15.446 4.057 ( 0.000 17.576 0.000) 17.576 4.081 ( 0.000 -5.925 0.000) 5.925 4.378 ( 0.000 5.370 0.000) 5.370 4.564 ( 0.000 34.622 0.000) 34.622 4.677 ( 0.000 5.922 0.000) 5.922 5.002 ( 0.000 11.696 0.000) 11.696 5.041 ( 0.000 24.400 0.000) 24.400 5.243 ( 0.000 -8.705 0.000) 8.705 5.417 ( 0.000 2.270 0.000) 2.270 5.676 ( 0.000 20.907 0.000) 20.907 5.829 ( 0.000 9.448 0.000) 9.448 5.846 ( 0.000 -16.569 0.000) 16.569 5.913 ( 0.000 5.631 0.000) 5.631 6.093 ( 0.000 -0.526 0.000) 0.526 6.413 ( 0.000 -6.579 0.000) 6.579 6.548 ( 0.000 1.133 0.000) 1.133 6.700 ( 0.000 16.940 0.000) 16.940 6.826 ( 0.000 -1.637 0.000) 1.637 6.939 ( 0.000 -2.029 0.000) 2.029 6.953 ( 0.000 -6.174 0.000) 6.174 7.035 ( 0.000 7.859 0.000) 7.859 7.219 ( 0.000 -8.380 0.000) 8.380 7.313 ( 0.000 0.942 0.000) 0.942 7.464 ( 0.000 1.116 0.000) 1.116 7.706 ( 0.000 -5.895 0.000) 5.895 7.746 ( 0.000 2.080 0.000) 2.080 7.887 ( 0.000 8.178 0.000) 8.178 8.009 ( 0.000 0.620 0.000) 0.620 8.104 ( 0.000 -0.933 0.000) 0.933 8.132 ( 0.000 -13.510 0.000) 13.510 8.294 ( 0.000 3.427 0.000) 3.427 8.415 ( 0.000 15.684 0.000) 15.684 8.468 ( 0.000 -5.739 0.000) 5.739 8.644 ( 0.000 11.460 0.000) 11.460 8.688 ( 0.000 -15.757 0.000) 15.757 8.966 ( 0.000 -4.528 0.000) 4.528 9.097 ( 0.000 -8.201 0.000) 8.201 9.179 ( 0.000 4.844 0.000) 4.844 9.378 ( 0.000 -4.262 0.000) 4.262 9.715 ( 0.000 -19.979 0.000) 19.979 9.768 ( 0.000 24.882 0.000) 24.882 9.858 ( 0.000 -10.078 0.000) 10.078 10.045 ( 0.000 -19.739 0.000) 19.739 10.203 ( 0.000 4.520 0.000) 4.520 10.302 ( 0.000 11.040 0.000) 11.040 10.419 ( 0.000 -7.700 0.000) 7.700 10.522 ( 0.000 -8.363 0.000) 8.363 10.808 ( 0.000 3.392 0.000) 3.392 10.988 ( 0.000 -7.969 0.000) 7.969 11.043 ( 0.000 -11.452 0.000) 11.452 11.213 ( 0.000 -2.050 0.000) 2.050 11.331 ( 0.000 2.740 0.000) 2.740 11.441 ( 0.000 -1.931 0.000) 1.931 11.473 ( 0.000 -7.185 0.000) 7.185 11.731 ( 0.000 -1.450 0.000) 1.450 11.840 ( 0.000 2.648 0.000) 2.648 12.054 ( 0.000 12.626 0.000) 12.626 12.113 ( 0.000 -4.420 0.000) 4.420 12.134 ( 0.000 -1.633 0.000) 1.633 12.325 ( 0.000 -3.040 0.000) 3.040 12.340 ( 0.000 6.927 0.000) 6.927 12.569 ( 0.000 -11.248 0.000) 11.248 12.752 ( 0.000 0.566 0.000) 0.566 12.857 ( 0.000 -0.654 0.000) 0.654 12.859 ( 0.000 2.294 0.000) 2.294 13.013 ( 0.000 0.770 0.000) 0.770 13.411 ( 0.000 -9.503 0.000) 9.503 13.618 ( 0.000 -6.732 0.000) 6.732 13.687 ( 0.000 -9.083 0.000) 9.083 13.797 ( 0.000 -9.034 0.000) 9.034 13.959 ( 0.000 2.445 0.000) 2.445 14.073 ( 0.000 7.021 0.000) 7.021 14.215 ( 0.000 -0.235 0.000) 0.235 14.267 ( 0.000 -0.625 0.000) 0.625 16.247 ( 0.000 -7.098 0.000) 7.098 16.324 ( 0.000 -10.617 0.000) 10.617 16.672 ( 0.000 -15.641 0.000) 15.641 16.689 ( 0.000 -21.229 0.000) 21.229 18.195 ( 0.000 7.994 0.000) 7.994 18.235 ( 0.000 4.593 0.000) 4.593 18.783 ( 0.000 14.280 0.000) 14.280 18.867 ( 0.000 12.044 0.000) 12.044 20.215 ( 0.000 0.037 0.000) 0.037 20.343 ( 0.000 -5.706 0.000) 5.706 20.495 ( 0.000 7.315 0.000) 7.315 20.528 ( 0.000 6.271 0.000) 6.271 20.942 ( 0.000 -5.579 0.000) 5.579 21.038 ( 0.000 -6.676 0.000) 6.676 21.298 ( 0.000 -6.787 0.000) 6.787 21.350 ( 0.000 -9.964 0.000) 9.964 22.469 ( 0.000 -0.028 0.000) 0.028 22.528 ( 0.000 -2.035 0.000) 2.035 22.698 ( 0.000 -0.866 0.000) 0.866 22.761 ( 0.000 -2.483 0.000) 2.483 23.854 ( 0.000 32.545 0.000) 32.545 24.268 ( 0.000 8.426 0.000) 8.426 24.390 ( 0.000 10.549 0.000) 10.549 24.507 ( 0.000 3.838 0.000) 3.838 24.664 ( 0.000 10.742 0.000) 10.742 24.839 ( 0.000 3.475 0.000) 3.475 25.227 ( 0.000 -5.242 0.000) 5.242 25.397 ( 0.000 -3.085 0.000) 3.085 26.791 ( 0.000 -1.839 0.000) 1.839 26.793 ( 0.000 -1.571 0.000) 1.571 26.914 ( 0.000 -0.842 0.000) 0.842 27.069 ( 0.000 -5.228 0.000) 5.228 27.212 ( 0.000 -2.886 0.000) 2.886 27.358 ( 0.000 -7.744 0.000) 7.744 27.378 ( 0.000 -7.541 0.000) 7.541 27.567 ( 0.000 -8.696 0.000) 8.696 27.962 ( 0.000 2.521 0.000) 2.521 28.085 ( 0.000 -1.469 0.000) 1.469 28.216 ( 0.000 6.268 0.000) 6.268 28.482 ( 0.000 1.838 0.000) 1.838 28.621 ( 0.000 0.156 0.000) 0.156 28.631 ( 0.000 2.837 0.000) 2.837 28.669 ( 0.000 0.008 0.000) 0.008 28.861 ( 0.000 2.542 0.000) 2.542 29.026 ( 0.000 1.955 0.000) 1.955 29.240 ( 0.000 -1.689 0.000) 1.689 29.525 ( 0.000 5.137 0.000) 5.137 29.811 ( 0.000 -4.879 0.000) 4.879 30.580 ( 0.000 2.562 0.000) 2.562 30.717 ( 0.000 2.346 0.000) 2.346 30.936 ( 0.000 8.080 0.000) 8.080 31.330 ( 0.000 -1.344 0.000) 1.344 33.874 ( 0.000 1.264 0.000) 1.264 33.961 ( 0.000 -0.466 0.000) 0.466 33.983 ( 0.000 -1.207 0.000) 1.207 33.986 ( 0.000 -0.664 0.000) 0.664 37.181 ( 0.000 -2.661 0.000) 2.661 37.190 ( 0.000 -1.841 0.000) 1.841 37.215 ( 0.000 -1.132 0.000) 1.132 37.300 ( 0.000 -3.900 0.000) 3.900 37.654 ( 0.000 3.898 0.000) 3.898 37.656 ( 0.000 2.226 0.000) 2.226 37.760 ( 0.000 1.140 0.000) 1.140 37.788 ( 0.000 0.958 0.000) 0.958 48.777 ( 0.000 0.027 0.000) 0.027 48.830 ( 0.000 0.168 0.000) 0.168 48.863 ( 0.000 -1.622 0.000) 1.622 48.889 ( 0.000 -0.996 0.000) 0.996 50.506 ( 0.000 -0.781 0.000) 0.781 50.521 ( 0.000 -1.238 0.000) 1.238 50.626 ( 0.000 0.673 0.000) 0.673 51.197 ( 0.000 -10.700 0.000) 10.700 51.878 ( 0.000 6.597 0.000) 6.597 51.974 ( 0.000 5.318 0.000) 5.318 52.364 ( 0.000 3.051 0.000) 3.051 52.439 ( 0.000 5.820 0.000) 5.820 52.519 ( 0.000 -2.586 0.000) 2.586 52.582 ( 0.000 -7.532 0.000) 7.532 52.983 ( 0.000 -5.244 0.000) 5.244 53.120 ( 0.000 -6.164 0.000) 6.164 53.820 ( 0.000 1.283 0.000) 1.283 53.842 ( 0.000 0.810 0.000) 0.810 54.165 ( 0.000 -0.056 0.000) 0.056 54.310 ( 0.000 -2.773 0.000) 2.773 55.717 ( 0.000 1.210 0.000) 1.210 55.798 ( 0.000 1.442 0.000) 1.442 55.954 ( 0.000 -3.015 0.000) 3.015 56.406 ( 0.000 -14.049 0.000) 14.049 57.511 ( 0.000 6.060 0.000) 6.060 57.619 ( 0.000 8.559 0.000) 8.559 57.684 ( 0.000 7.409 0.000) 7.409 58.104 ( 0.000 -0.350 0.000) 0.350 58.245 ( 0.000 -5.121 0.000) 5.121 58.350 ( 0.000 -0.913 0.000) 0.913 58.361 ( 0.000 -8.090 0.000) 8.090 58.551 ( 0.000 -5.165 0.000) 5.165 60.965 ( 0.000 2.059 0.000) 2.059 60.978 ( 0.000 1.680 0.000) 1.680 61.135 ( 0.000 6.197 0.000) 6.197 61.486 ( 0.000 -2.215 0.000) 2.215 ======================= Grid point 19 (12/90) ======================= q-point: ( 0.12 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.850 ( -0.290 42.146 15.087) 44.766 2.027 ( 16.393 35.443 9.035) 40.082 2.831 ( 1.157 7.654 -2.580) 8.160 3.243 ( 31.378 21.222 1.039) 37.895 3.582 ( 14.002 25.221 -7.557) 29.821 3.848 ( 9.475 16.861 2.926) 19.561 3.955 ( -3.425 1.103 -4.295) 5.603 4.196 ( 7.657 12.094 4.355) 14.962 4.352 ( 2.126 17.613 0.022) 17.741 4.685 ( 8.845 18.006 -0.681) 20.072 4.777 ( 9.831 11.637 -1.479) 15.306 5.079 ( 8.973 17.141 -4.407) 19.843 5.111 ( -0.930 11.917 9.599) 15.330 5.249 ( 5.023 -4.729 -6.807) 9.692 5.452 ( 2.665 0.601 0.563) 2.789 5.573 ( -4.114 4.871 -3.542) 7.294 5.847 ( 6.361 13.886 -4.339) 15.878 5.918 ( 2.246 4.811 -1.681) 5.570 6.056 ( 2.664 0.084 2.237) 3.480 6.150 ( 12.796 -5.132 6.838) 15.389 6.411 ( -2.458 -5.252 3.320) 6.682 6.516 ( 0.172 2.197 -4.585) 5.087 6.718 ( -5.344 4.620 -4.338) 8.289 6.806 ( -0.654 3.684 1.648) 4.088 6.844 ( -3.939 -2.384 -4.049) 6.131 7.021 ( 5.818 -3.669 -6.413) 9.404 7.132 ( 1.804 -1.063 -4.015) 4.528 7.203 ( 3.970 2.082 -3.736) 5.836 7.341 ( 2.475 -0.740 1.892) 3.202 7.505 ( 2.532 0.161 0.848) 2.675 7.660 ( -4.634 -3.311 13.411) 14.570 7.743 ( 1.051 0.858 -4.728) 4.919 7.925 ( 2.388 5.402 7.194) 9.308 8.006 ( 2.312 1.103 1.686) 3.067 8.055 ( -2.122 -2.010 -5.632) 6.345 8.220 ( -2.788 3.080 -3.907) 5.703 8.260 ( 2.634 -4.370 8.467) 9.886 8.388 ( -0.123 8.451 -1.893) 8.661 8.549 ( 6.228 -3.863 4.785) 8.753 8.671 ( -0.377 -10.661 2.349) 10.923 8.702 ( 3.542 8.675 -0.176) 9.372 8.983 ( 0.367 0.451 0.829) 1.012 9.040 ( -0.013 -8.743 -9.064) 12.594 9.261 ( 3.321 -0.499 9.105) 9.705 9.345 ( -2.857 -2.635 -2.456) 4.597 9.668 ( -4.028 -6.373 6.383) 9.879 9.763 ( -3.237 -3.835 -3.358) 6.039 9.879 ( 6.613 3.905 -5.846) 9.652 10.085 ( 1.623 -14.316 2.150) 14.567 10.194 ( -2.024 2.836 -3.177) 4.716 10.328 ( 3.128 8.798 8.313) 12.502 10.470 ( 2.682 -3.717 -3.805) 5.957 10.487 ( 0.773 -7.159 -0.891) 7.256 10.774 ( -3.819 3.747 -0.382) 5.363 11.004 ( -0.259 -10.067 -2.693) 10.424 11.071 ( 4.173 -10.801 -0.583) 11.594 11.195 ( -1.864 -6.196 -4.158) 7.691 11.319 ( 0.386 -0.608 -1.149) 1.356 11.350 ( -0.128 10.682 5.690) 12.104 11.637 ( -10.222 4.399 1.683) 11.255 11.695 ( 7.357 -5.622 0.631) 9.281 11.790 ( 0.870 -2.454 3.441) 4.315 11.989 ( -2.512 7.505 -2.950) 8.446 12.047 ( -4.436 -2.872 -2.251) 5.744 12.223 ( 3.100 0.284 -1.507) 3.459 12.393 ( 3.684 4.900 -0.918) 6.199 12.468 ( 7.959 -9.661 6.288) 14.008 12.550 ( -1.280 -11.228 -1.659) 11.422 12.666 ( -6.384 -1.104 1.270) 6.602 12.839 ( -1.597 1.096 -1.039) 2.198 12.893 ( 1.858 -2.670 0.892) 3.373 12.984 ( -2.139 -0.210 -0.847) 2.310 13.408 ( -0.978 -8.498 2.177) 8.827 13.572 ( -2.768 -8.014 -4.862) 9.774 13.653 ( -4.041 -5.846 2.715) 7.607 13.777 ( -1.772 -8.762 -1.336) 9.039 13.936 ( -2.046 -0.766 4.083) 4.631 14.042 ( -2.432 5.021 -0.900) 5.651 14.227 ( 1.298 -2.383 -0.786) 2.825 14.312 ( 2.682 -0.730 0.986) 2.950 16.186 ( -2.903 -10.175 -0.029) 10.581 16.412 ( 3.206 -9.701 0.115) 10.217 16.632 ( 2.743 -17.634 -0.266) 17.848 16.815 ( 7.034 -17.467 0.126) 18.830 18.206 ( 0.963 8.054 0.797) 8.151 18.243 ( 1.054 5.295 -1.262) 5.544 18.760 ( -2.273 14.055 0.918) 14.267 18.836 ( -2.887 11.829 -0.146) 12.177 20.230 ( 1.413 -0.331 1.051) 1.792 20.342 ( 0.248 -4.654 -1.056) 4.778 20.489 ( -0.702 7.078 0.190) 7.115 20.537 ( 0.762 5.688 -0.024) 5.739 20.907 ( -3.133 -5.364 -1.489) 6.387 21.020 ( -1.878 -6.876 1.436) 7.271 21.351 ( 3.561 -7.757 0.976) 8.591 21.368 ( 3.447 -8.111 -1.142) 8.887 22.501 ( 2.093 -0.652 1.827) 2.854 22.510 ( -0.882 -1.213 -1.838) 2.373 22.693 ( -0.396 -0.896 -0.234) 1.008 22.764 ( 0.185 -2.659 0.354) 2.689 23.774 ( -6.264 29.301 -2.796) 30.093 24.259 ( -2.670 10.620 0.743) 10.976 24.302 ( -9.962 11.372 2.860) 15.387 24.422 ( -14.497 16.829 4.426) 22.649 24.553 ( 0.581 4.878 -4.026) 6.352 24.747 ( -7.227 3.290 3.906) 8.850 25.170 ( -4.427 -4.631 -3.130) 7.130 25.294 ( -9.415 -3.311 1.604) 10.108 26.808 ( 1.692 -2.014 1.119) 2.859 26.838 ( 4.141 -2.937 -5.256) 7.307 26.909 ( -0.453 -2.166 1.020) 2.436 27.102 ( 2.239 -4.709 0.677) 5.258 27.197 ( -0.745 -2.829 -0.223) 2.934 27.313 ( -3.605 -7.117 2.456) 8.348 27.398 ( 0.962 -7.193 -1.333) 7.378 27.543 ( -2.545 -8.301 0.805) 8.720 27.947 ( -0.760 1.748 -3.410) 3.907 28.020 ( -3.911 0.290 4.038) 5.629 28.270 ( 3.129 4.530 -2.294) 5.965 28.486 ( -1.747 3.083 -3.600) 5.052 28.575 ( -1.749 3.163 3.028) 4.715 28.636 ( -0.084 0.541 0.822) 0.988 28.684 ( 5.332 2.701 1.196) 6.095 28.997 ( 5.389 -2.128 -0.168) 5.796 29.043 ( -0.136 4.789 0.109) 4.792 29.207 ( -0.620 -1.659 -2.346) 2.940 29.473 ( -1.084 5.858 0.005) 5.957 29.836 ( 1.903 0.103 -3.300) 3.811 30.581 ( -0.147 2.901 0.279) 2.918 30.706 ( -0.857 2.176 -0.100) 2.341 30.906 ( -2.556 7.767 -0.074) 8.177 31.134 ( -11.441 6.585 -5.892) 14.456 33.873 ( -0.090 0.957 -0.415) 1.047 33.930 ( -2.509 -0.400 0.070) 2.542 33.954 ( -0.706 -0.045 -0.173) 0.728 34.015 ( 0.893 -1.569 0.535) 1.883 37.184 ( 0.584 -1.943 0.075) 2.030 37.197 ( 0.735 -1.391 -0.256) 1.594 37.244 ( 1.662 -1.689 0.183) 2.377 37.313 ( 1.121 -3.658 0.197) 3.831 37.625 ( -0.911 4.210 -0.035) 4.308 37.684 ( 1.155 2.374 -0.983) 2.817 37.780 ( 1.678 0.524 -0.797) 1.930 37.807 ( 1.023 -0.242 3.091) 3.265 48.869 ( 8.324 -0.941 -1.310) 8.479 48.900 ( 5.204 -2.086 0.054) 5.607 48.960 ( 6.579 -1.094 1.355) 6.806 49.144 ( 20.724 -10.921 -1.552) 23.477 50.507 ( 0.544 -0.772 1.942) 2.159 50.606 ( 4.816 -4.691 10.885) 12.794 50.620 ( -0.415 0.696 -0.553) 0.981 51.129 ( -5.233 -9.283 -3.962) 11.369 51.880 ( 0.090 6.483 0.305) 6.491 51.958 ( -1.267 5.731 0.028) 5.869 52.388 ( 1.694 4.094 0.332) 4.444 52.443 ( 0.346 5.580 -0.326) 5.600 52.553 ( 2.962 -6.182 3.966) 7.920 52.556 ( -1.836 -6.268 -2.863) 7.131 53.023 ( 3.268 -5.964 0.086) 6.801 53.150 ( 2.627 -6.483 0.243) 6.999 53.824 ( 0.490 1.259 -0.357) 1.397 53.857 ( 1.288 0.621 0.134) 1.436 54.154 ( -0.842 -0.097 -1.410) 1.645 54.306 ( -0.360 -2.840 0.259) 2.875 55.719 ( 0.247 1.026 -0.208) 1.076 55.808 ( 0.888 1.245 0.161) 1.537 55.938 ( -1.306 -2.833 -1.277) 3.371 56.366 ( -3.710 -13.034 0.406) 13.558 57.513 ( 0.117 6.117 0.255) 6.123 57.617 ( -0.089 8.476 -1.164) 8.556 57.668 ( -1.471 7.662 0.093) 7.803 58.054 ( -5.451 3.624 4.902) 8.178 58.197 ( -5.218 -3.492 -1.114) 6.377 58.263 ( -0.314 -3.906 1.517) 4.202 58.436 ( -0.985 -2.957 -6.346) 7.070 58.532 ( 1.498 -8.629 0.901) 8.804 60.963 ( -0.092 2.030 0.076) 2.033 60.981 ( 0.242 1.720 0.176) 1.746 61.122 ( -1.200 5.805 0.263) 5.934 61.357 ( -9.392 2.914 -1.730) 9.985 ======================= Grid point 20 (13/90) ======================= q-point: ( 0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.115 ( 21.227 21.407 12.927) 32.802 2.601 ( 27.095 19.530 19.479) 38.666 2.886 ( 6.183 4.989 -4.045) 8.915 3.501 ( 0.023 14.099 1.444) 14.173 3.729 ( -6.685 5.061 -19.020) 20.786 3.988 ( 16.278 9.209 1.000) 18.729 4.173 ( 11.020 18.608 8.871) 23.375 4.460 ( 8.903 13.183 -13.918) 21.137 4.629 ( 28.179 19.408 9.243) 35.443 4.791 ( 2.585 -1.607 3.962) 4.996 5.024 ( 6.902 17.803 -2.208) 19.221 5.124 ( 10.394 7.997 1.894) 13.250 5.341 ( 12.013 11.641 1.066) 16.762 5.371 ( 8.577 8.177 -3.433) 12.338 5.491 ( 4.727 -0.051 -1.137) 4.862 5.675 ( 1.713 0.449 -2.394) 2.978 5.791 ( -0.176 0.844 7.352) 7.402 6.002 ( 7.802 8.415 -5.772) 12.845 6.273 ( 3.355 -1.026 -0.433) 3.535 6.356 ( -2.509 2.740 6.378) 7.381 6.406 ( 0.885 -3.281 -2.246) 4.074 6.479 ( 3.127 6.177 -5.301) 8.720 6.534 ( -6.645 -9.093 -2.037) 11.445 6.632 ( -1.789 5.124 0.243) 5.432 6.908 ( 2.694 4.886 -0.471) 5.599 6.995 ( -0.237 -5.473 -11.283) 12.543 7.266 ( 10.238 0.575 -4.890) 11.360 7.292 ( 2.024 -0.292 -5.929) 6.272 7.417 ( 4.910 6.796 5.086) 9.806 7.529 ( -1.538 0.543 -2.126) 2.679 7.673 ( 1.732 -4.118 5.386) 6.997 7.717 ( -1.902 -0.325 -2.521) 3.175 7.930 ( -1.536 -0.968 -6.181) 6.442 8.006 ( 1.602 2.847 0.001) 3.266 8.109 ( 0.086 -4.068 -3.822) 5.582 8.222 ( 3.757 9.127 18.447) 20.921 8.320 ( 3.375 -6.867 -0.030) 7.652 8.379 ( -1.120 12.659 2.339) 12.922 8.673 ( 1.201 -6.435 8.447) 10.686 8.760 ( 6.338 13.083 -4.571) 15.239 8.818 ( 11.785 -4.004 4.691) 13.301 8.941 ( -2.593 -2.904 0.827) 3.980 9.097 ( 4.005 -5.712 -4.666) 8.393 9.221 ( -5.864 -2.980 -1.956) 6.862 9.349 ( 2.693 -3.677 6.945) 8.307 9.656 ( 1.809 0.590 3.797) 4.247 9.709 ( -1.969 0.624 -1.196) 2.387 9.932 ( -1.033 -2.211 2.079) 3.206 10.108 ( -5.460 3.588 -1.472) 6.697 10.166 ( 6.458 -2.398 -3.158) 7.578 10.405 ( 0.580 -0.670 6.868) 6.925 10.475 ( 1.045 -3.455 -2.496) 4.389 10.609 ( 7.319 -0.688 -0.003) 7.351 10.663 ( -4.810 -1.044 -2.772) 5.649 10.976 ( -0.407 -7.671 -6.926) 10.343 11.117 ( -0.199 -11.993 -6.908) 13.842 11.197 ( 2.476 2.790 -0.418) 3.753 11.364 ( 0.997 -1.233 5.974) 6.181 11.383 ( 0.107 8.546 5.922) 10.398 11.414 ( -8.260 5.840 2.638) 10.454 11.639 ( -6.345 2.992 -5.730) 9.058 11.809 ( -3.437 5.801 -1.376) 6.882 11.963 ( -2.634 -5.585 -3.005) 6.867 12.089 ( 8.044 -5.745 3.398) 10.452 12.194 ( -3.954 5.052 -1.888) 6.688 12.433 ( 0.926 -2.800 -1.967) 3.544 12.486 ( -4.246 -4.933 -0.191) 6.512 12.562 ( -0.075 -9.595 3.661) 10.270 12.596 ( -0.248 -2.813 1.500) 3.197 12.789 ( -2.415 -0.347 -0.266) 2.455 12.896 ( -1.232 -6.218 -1.408) 6.493 12.969 ( 0.702 -6.074 0.618) 6.146 13.357 ( -5.104 -5.058 3.019) 7.794 13.510 ( -1.520 -9.799 -4.709) 10.978 13.554 ( -4.872 -4.289 2.939) 7.125 13.719 ( -3.060 -9.482 -1.669) 10.103 13.907 ( -2.148 -5.323 4.571) 7.337 13.983 ( -2.877 2.008 -0.637) 3.565 14.236 ( -0.451 -4.494 -1.996) 4.938 14.353 ( 0.711 -3.648 1.401) 3.972 16.140 ( -1.708 -11.266 0.673) 11.414 16.411 ( -1.325 -13.416 -0.778) 13.504 16.793 ( 9.982 -13.594 0.107) 16.866 16.957 ( 6.050 -16.159 0.056) 17.255 18.236 ( 1.647 8.051 0.301) 8.224 18.286 ( 3.559 7.274 -0.795) 8.137 18.691 ( -4.771 13.085 1.595) 14.019 18.757 ( -4.238 11.412 -0.549) 12.186 20.283 ( 3.340 -0.412 1.041) 3.522 20.359 ( 1.977 -3.018 -1.016) 3.748 20.468 ( -1.281 6.525 0.349) 6.659 20.549 ( 0.213 6.352 0.004) 6.356 20.813 ( -5.011 -5.388 -2.122) 7.658 20.968 ( -3.742 -6.972 2.058) 8.176 21.438 ( 5.565 -9.058 -0.525) 10.644 21.495 ( 7.210 -8.391 0.534) 11.076 22.477 ( -1.039 0.344 -2.441) 2.675 22.562 ( 2.301 -1.571 2.788) 3.942 22.684 ( -0.261 -0.978 -0.552) 1.153 22.766 ( -0.059 -2.857 0.069) 2.859 23.630 ( -5.523 23.289 -2.987) 24.121 23.914 ( -18.715 23.355 5.740) 30.474 24.172 ( -9.436 9.474 0.955) 13.405 24.243 ( -5.592 10.193 -1.901) 11.781 24.575 ( -2.886 5.014 -0.343) 5.795 24.590 ( -3.313 5.372 0.496) 6.330 25.038 ( -10.009 -3.130 1.834) 10.646 25.086 ( -6.475 -2.333 -1.894) 7.138 26.850 ( 1.648 -3.413 0.038) 3.791 26.906 ( 1.320 -2.351 -0.013) 2.696 26.924 ( 4.012 -5.433 -4.241) 7.975 27.124 ( -1.086 -5.445 2.205) 5.974 27.200 ( 0.400 -0.901 0.418) 1.071 27.248 ( -2.059 -5.919 1.763) 6.510 27.385 ( -2.572 -6.077 0.119) 6.600 27.493 ( -1.041 -7.075 0.642) 7.180 27.921 ( -0.668 0.223 -5.056) 5.105 27.976 ( -1.436 -0.210 3.309) 3.613 28.310 ( 1.045 3.332 -0.459) 3.522 28.427 ( -1.993 3.957 -1.575) 4.702 28.550 ( -6.093 6.732 -4.205) 10.006 28.605 ( 0.755 2.979 2.132) 3.741 28.832 ( 7.209 3.451 1.138) 8.073 28.989 ( -0.128 5.685 0.915) 5.759 29.068 ( 3.018 -1.106 -1.924) 3.746 29.288 ( 4.672 -3.136 0.428) 5.643 29.522 ( 4.549 5.028 0.282) 6.787 29.847 ( -0.548 4.459 -1.092) 4.623 30.571 ( -0.410 2.335 -0.082) 2.372 30.694 ( -0.281 1.161 0.156) 1.205 30.859 ( -1.476 6.273 0.152) 6.446 30.958 ( -4.962 6.690 -2.353) 8.655 33.869 ( -0.105 0.186 -0.715) 0.746 33.883 ( -1.857 -0.003 0.268) 1.876 33.945 ( -0.236 -0.056 0.417) 0.483 34.025 ( 0.033 -1.705 0.334) 1.738 37.208 ( 1.578 -1.741 0.511) 2.405 37.218 ( 1.246 -0.767 -0.354) 1.505 37.270 ( 0.976 -1.612 -0.940) 2.106 37.340 ( 1.150 -2.485 0.463) 2.777 37.619 ( 0.237 4.411 -0.021) 4.417 37.701 ( 0.862 2.376 -1.152) 2.778 37.810 ( 1.087 -0.519 -0.176) 1.217 37.839 ( 1.214 -0.949 2.166) 2.658 49.024 ( 7.236 -2.497 -0.510) 7.671 49.101 ( 12.045 -2.689 -2.111) 12.521 49.138 ( 9.118 -1.462 3.209) 9.776 49.486 ( 11.751 -12.858 -4.601) 18.017 50.532 ( 1.289 -1.080 0.389) 1.726 50.606 ( -0.467 0.793 -0.978) 1.343 50.718 ( 1.407 -7.676 12.723) 14.926 50.995 ( -5.571 -6.655 -4.759) 9.898 51.881 ( -0.073 6.134 0.111) 6.136 51.934 ( -0.813 6.325 0.235) 6.381 52.416 ( 0.842 5.528 -0.401) 5.606 52.445 ( -0.153 2.474 -1.793) 3.059 52.504 ( -1.773 -1.027 -2.423) 3.173 52.658 ( 4.839 -11.887 7.346) 14.788 53.093 ( 2.975 -6.741 -0.364) 7.378 53.219 ( 3.535 -7.227 0.668) 8.073 53.840 ( 1.137 1.081 -0.258) 1.591 53.890 ( 1.705 0.186 -0.040) 1.716 54.122 ( -1.749 -0.002 -2.268) 2.864 54.298 ( -0.461 -3.017 0.469) 3.088 55.728 ( 0.754 0.569 -0.232) 0.972 55.834 ( 1.590 0.642 0.140) 1.721 55.895 ( -2.254 -2.216 -1.615) 3.550 56.264 ( -5.878 -10.302 0.728) 11.883 57.518 ( 0.296 6.302 0.357) 6.319 57.606 ( -0.514 7.882 -3.266) 8.547 57.633 ( -1.662 8.375 2.264) 8.833 57.922 ( -7.277 10.242 3.331) 12.998 58.120 ( -1.782 -2.570 -0.396) 3.152 58.270 ( 0.056 -5.109 3.068) 5.960 58.372 ( -1.328 -3.597 -8.852) 9.647 58.573 ( 0.644 -10.928 2.805) 11.301 60.964 ( 0.239 2.071 0.091) 2.087 60.989 ( 0.462 1.838 0.186) 1.904 61.089 ( -1.940 4.849 0.262) 5.229 61.177 ( -6.610 5.483 -1.157) 8.666 ======================= Grid point 21 (14/90) ======================= q-point: ( 0.38 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.627 ( 21.097 5.514 8.786) 23.509 2.953 ( 6.479 -0.214 0.363) 6.493 3.073 ( 3.296 18.440 7.831) 20.303 3.457 ( -5.690 -0.297 -8.676) 10.379 3.751 ( 17.307 21.909 1.097) 27.942 4.142 ( -3.906 9.076 6.653) 11.912 4.399 ( 12.391 6.894 1.292) 14.239 4.575 ( 10.611 9.348 -9.646) 17.118 4.941 ( 11.489 -3.267 1.762) 12.074 5.026 ( -6.065 11.804 5.927) 14.534 5.186 ( 15.015 16.043 -0.484) 21.978 5.394 ( 2.762 -0.841 -1.616) 3.309 5.449 ( -3.628 14.060 0.560) 14.531 5.498 ( 13.623 7.605 2.420) 15.788 5.652 ( 6.574 -1.091 -3.669) 7.607 5.697 ( 7.677 -2.286 5.086) 9.488 5.830 ( -7.066 5.871 -5.744) 10.835 5.934 ( -16.935 -3.931 -10.911) 20.526 6.156 ( 0.008 2.615 -0.756) 2.723 6.344 ( 3.142 11.101 4.190) 12.275 6.386 ( 0.908 -13.224 -3.179) 13.631 6.423 ( 1.857 -11.185 6.555) 13.096 6.724 ( 7.474 6.088 -0.423) 9.649 6.773 ( 11.505 11.165 -2.672) 16.253 6.983 ( 8.823 5.634 1.236) 10.541 7.101 ( 6.781 -1.583 -0.689) 6.998 7.291 ( -0.843 2.286 -1.615) 2.923 7.384 ( -5.258 -4.465 -1.498) 7.059 7.415 ( 1.978 2.826 -1.308) 3.689 7.506 ( 1.005 7.133 0.068) 7.204 7.696 ( 0.352 -0.589 -6.877) 6.911 7.719 ( 0.694 -1.087 -2.352) 2.683 7.912 ( 2.746 3.051 -3.462) 5.370 7.996 ( -4.201 1.879 -3.337) 5.685 8.142 ( 6.902 -6.426 2.163) 9.675 8.287 ( -3.274 12.210 0.485) 12.651 8.321 ( -1.145 2.584 4.158) 5.027 8.423 ( 1.307 -1.836 4.743) 5.251 8.715 ( -3.268 -1.259 0.237) 3.510 8.815 ( -1.552 -1.209 0.481) 2.025 8.905 ( 4.246 10.735 1.947) 11.708 9.000 ( 0.470 -4.491 -1.856) 4.882 9.188 ( 7.101 1.628 1.098) 7.368 9.300 ( 12.005 -0.383 2.507) 12.270 9.442 ( 5.558 -3.434 10.741) 12.572 9.649 ( -3.168 1.147 3.988) 5.221 9.690 ( -1.061 13.094 1.825) 13.263 9.956 ( 0.418 0.058 -3.252) 3.279 10.004 ( 0.696 -3.666 6.111) 7.160 10.230 ( 0.055 0.695 -3.484) 3.553 10.418 ( -1.155 0.736 1.301) 1.889 10.462 ( -4.273 -6.639 -3.000) 8.446 10.573 ( 0.050 -5.504 -0.823) 5.566 10.760 ( 5.775 -1.582 -3.573) 6.973 10.954 ( -0.501 -3.434 -7.488) 8.253 11.067 ( -2.136 -4.144 -4.000) 6.143 11.180 ( -9.898 3.495 -0.917) 10.537 11.219 ( -0.689 4.389 2.067) 4.900 11.425 ( 1.527 -1.090 7.741) 7.966 11.450 ( 0.521 0.132 -0.746) 0.920 11.536 ( 0.365 9.175 -0.973) 9.233 11.679 ( -6.184 6.000 -3.773) 9.406 11.932 ( 0.628 -5.417 0.035) 5.453 12.021 ( -6.597 5.679 -4.584) 9.838 12.228 ( -2.431 2.367 3.788) 5.086 12.423 ( -0.408 -2.781 2.597) 3.827 12.474 ( 1.221 -10.266 0.287) 10.343 12.534 ( -0.052 -2.615 1.643) 3.089 12.621 ( 2.081 -4.369 0.223) 4.845 12.729 ( -3.078 -5.639 -1.461) 6.588 12.880 ( 0.100 -9.271 -0.681) 9.297 12.996 ( 1.238 -5.800 -1.541) 6.128 13.236 ( -5.215 -1.737 3.106) 6.314 13.455 ( -3.891 -4.514 0.157) 5.961 13.520 ( 1.365 -12.633 -0.610) 12.721 13.661 ( -1.742 -12.492 -1.015) 12.654 13.868 ( -2.254 -6.516 2.254) 7.254 13.921 ( -2.886 0.377 0.469) 2.948 14.201 ( -1.796 -5.341 -2.271) 6.075 14.354 ( -0.595 -6.844 0.841) 6.921 16.113 ( -1.030 -11.379 0.605) 11.441 16.389 ( -0.474 -13.591 -0.594) 13.612 16.977 ( 6.878 -12.635 -0.038) 14.386 17.053 ( 2.839 -14.407 -0.012) 14.684 18.280 ( 2.578 9.912 -0.245) 10.245 18.375 ( 4.503 8.425 0.019) 9.553 18.581 ( -5.480 11.322 1.233) 12.639 18.668 ( -3.921 10.546 -0.524) 11.264 20.362 ( 3.326 4.516 -0.706) 5.653 20.428 ( 4.553 -4.349 0.526) 6.318 20.452 ( 0.426 4.101 1.057) 4.257 20.541 ( -0.995 8.392 -0.330) 8.457 20.695 ( -5.729 -5.881 -1.719) 8.388 20.878 ( -4.794 -6.808 1.502) 8.461 21.559 ( 5.264 -11.290 -0.293) 12.460 21.641 ( 5.864 -10.588 0.318) 12.107 22.455 ( -0.490 0.957 -1.512) 1.855 22.605 ( 1.078 -1.821 2.267) 3.101 22.681 ( 0.099 -1.146 -0.826) 1.416 22.764 ( -0.102 -2.913 -0.078) 2.916 23.564 ( 0.226 17.679 -1.764) 17.768 23.653 ( -7.162 18.873 2.477) 20.338 23.939 ( -11.787 8.859 0.722) 14.762 24.076 ( -9.189 9.984 -1.293) 13.630 24.471 ( -2.958 7.779 2.417) 8.666 24.622 ( 2.800 5.974 -4.560) 8.020 24.831 ( -8.776 -0.921 4.376) 9.849 25.002 ( -2.262 -0.613 -1.923) 3.031 26.870 ( 0.543 -4.818 -0.385) 4.863 26.939 ( 1.774 -3.623 0.153) 4.037 26.991 ( 2.549 -6.789 -2.913) 7.815 27.081 ( -2.809 -6.010 1.551) 6.813 27.184 ( -0.542 -1.012 1.465) 1.861 27.265 ( 1.499 -2.852 -1.237) 3.451 27.318 ( -3.019 -3.255 2.226) 4.966 27.505 ( 1.154 -7.222 1.121) 7.399 27.883 ( -1.480 -0.058 -4.987) 5.202 27.970 ( -0.154 -1.488 2.112) 2.588 28.297 ( -2.448 3.711 -0.622) 4.489 28.377 ( -2.204 2.603 1.768) 3.842 28.445 ( -0.945 10.213 -5.386) 11.585 28.634 ( 1.019 2.715 1.343) 3.196 28.950 ( 3.560 5.008 0.474) 6.162 29.055 ( 4.068 3.985 3.688) 6.784 29.116 ( 1.958 -0.989 -1.767) 2.817 29.348 ( 1.201 -3.911 -0.652) 4.143 29.627 ( 4.927 4.830 0.494) 6.917 29.808 ( -2.757 6.143 -0.317) 6.741 30.581 ( 1.391 0.293 -0.204) 1.436 30.681 ( -1.338 0.199 0.256) 1.377 30.843 ( -0.396 4.876 0.605) 4.929 30.884 ( -1.904 5.256 -1.049) 5.688 33.855 ( -0.918 0.131 0.241) 0.958 33.866 ( -0.045 -0.502 -0.535) 0.735 33.944 ( -0.035 0.045 0.411) 0.415 34.023 ( -0.190 -1.533 0.061) 1.546 37.237 ( 0.893 -1.007 -0.253) 1.369 37.249 ( 1.515 -1.353 0.968) 2.251 37.282 ( 0.442 -1.424 -1.111) 1.860 37.359 ( 0.590 -1.498 0.167) 1.619 37.628 ( 0.451 4.276 -0.002) 4.299 37.714 ( 0.526 2.358 -0.718) 2.520 37.825 ( 0.408 -1.080 0.277) 1.187 37.864 ( 0.737 -1.018 0.704) 1.440 49.164 ( 5.600 -3.172 -0.392) 6.448 49.301 ( 7.023 -0.890 -2.084) 7.379 49.335 ( 7.550 -5.533 3.449) 9.975 49.636 ( 4.500 -8.630 -2.993) 10.182 50.550 ( 0.155 -0.235 -0.221) 0.358 50.611 ( 1.755 -0.425 -2.453) 3.046 50.724 ( -3.033 -5.461 8.053) 10.192 50.894 ( -2.935 -4.876 -2.692) 6.296 51.877 ( -0.213 5.634 -0.140) 5.640 51.929 ( 0.123 6.705 0.517) 6.726 52.401 ( -1.654 -3.100 -2.762) 4.469 52.437 ( 0.322 5.292 -0.694) 5.347 52.489 ( 0.118 6.802 0.014) 6.803 52.762 ( 2.904 -13.666 5.162) 14.894 53.137 ( 1.378 -7.013 -0.424) 7.160 53.288 ( 2.494 -7.987 0.852) 8.410 53.871 ( 1.712 0.526 0.416) 1.839 53.919 ( 0.881 -0.251 -0.373) 0.989 54.073 ( -2.022 0.576 -2.075) 2.954 54.291 ( -0.273 -3.203 0.425) 3.242 55.751 ( 1.412 -0.032 -0.002) 1.413 55.840 ( -2.437 -1.512 -1.237) 3.123 55.873 ( 1.946 -0.060 0.056) 1.948 56.145 ( -5.105 -7.216 0.676) 8.865 57.527 ( 0.502 6.616 0.248) 6.639 57.579 ( -1.028 7.229 -1.676) 7.491 57.619 ( -0.469 8.746 1.314) 8.857 57.804 ( -4.136 11.733 0.887) 12.472 58.107 ( 0.161 -2.392 -0.133) 2.402 58.281 ( 0.064 -6.037 3.615) 7.036 58.336 ( -0.368 -4.787 -5.989) 7.676 58.575 ( -0.724 -11.342 1.509) 11.465 60.976 ( 0.842 2.341 0.065) 2.488 61.002 ( 0.854 2.167 0.102) 2.331 61.046 ( -2.174 3.812 0.054) 4.388 61.076 ( -3.125 4.334 -0.383) 5.357 ======================= Grid point 22 (15/90) ======================= q-point: (-0.50 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 74 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.918 ( 0.000 -1.507 0.000) 1.507 2.986 ( 0.000 4.300 -0.000) 4.300 3.110 ( 0.000 16.434 0.000) 16.434 3.336 ( 0.000 2.541 0.000) 2.541 4.028 ( 0.000 16.927 0.000) 16.927 4.063 ( 0.000 4.670 -0.000) 4.670 4.682 ( -0.000 12.327 0.000) 12.327 4.705 ( 0.000 13.454 0.000) 13.454 4.886 ( 0.000 2.198 -0.000) 2.198 5.096 ( -0.000 8.242 0.000) 8.242 5.237 ( 0.000 10.446 0.000) 10.446 5.405 ( -0.000 -1.624 -0.000) 1.624 5.499 ( 0.000 -1.166 0.000) 1.166 5.517 ( 0.000 -2.639 -0.000) 2.639 5.665 ( -0.000 9.098 -0.000) 9.098 5.673 ( 0.000 2.933 0.000) 2.933 5.825 ( 0.000 -8.634 0.000) 8.634 5.862 ( 0.000 7.518 -0.000) 7.518 6.106 ( 0.000 -0.837 0.000) 0.837 6.280 ( 0.000 -0.110 0.000) 0.110 6.444 ( 0.000 2.576 0.000) 2.576 6.540 ( 0.000 -13.600 -0.000) 13.600 6.871 ( 0.000 3.001 0.000) 3.001 6.927 ( 0.000 3.583 -0.000) 3.583 7.095 ( -0.000 15.614 -0.000) 15.614 7.149 ( 0.000 -10.021 0.000) 10.021 7.231 ( 0.000 -16.571 0.000) 16.571 7.347 ( 0.000 17.652 0.000) 17.652 7.487 ( 0.000 10.621 0.000) 10.621 7.511 ( -0.000 7.731 -0.000) 7.731 7.616 ( 0.000 -3.589 -0.000) 3.589 7.710 ( 0.000 4.345 0.000) 4.345 7.953 ( 0.000 -2.740 -0.000) 2.740 8.014 ( -0.000 7.344 0.000) 7.344 8.139 ( 0.000 16.562 0.000) 16.562 8.329 ( 0.000 0.514 -0.000) 0.514 8.342 ( -0.000 -8.784 -0.000) 8.784 8.357 ( 0.000 -0.330 0.000) 0.330 8.604 ( 0.000 -9.547 -0.000) 9.547 8.831 ( 0.000 10.889 -0.000) 10.889 8.957 ( 0.000 6.419 -0.000) 6.419 9.000 ( 0.000 -8.959 -0.000) 8.959 9.297 ( 0.000 3.050 0.000) 3.050 9.457 ( 0.000 0.360 0.000) 0.360 9.499 ( -0.000 9.442 -0.000) 9.442 9.588 ( 0.000 7.186 0.000) 7.186 9.815 ( 0.000 9.875 0.000) 9.875 9.875 ( 0.000 -2.087 -0.000) 2.087 10.138 ( -0.000 -10.243 -0.000) 10.243 10.221 ( 0.000 1.882 -0.000) 1.882 10.286 ( 0.000 -7.556 0.000) 7.556 10.384 ( 0.000 1.556 0.000) 1.556 10.628 ( 0.000 -7.981 0.000) 7.981 10.809 ( 0.000 -4.306 -0.000) 4.306 10.931 ( 0.000 -0.541 0.000) 0.541 11.003 ( 0.000 1.526 0.000) 1.526 11.071 ( 0.000 5.376 0.000) 5.376 11.213 ( 0.000 1.990 -0.000) 1.990 11.435 ( 0.000 4.609 -0.000) 4.609 11.482 ( 0.000 -0.896 0.000) 0.896 11.515 ( 0.000 2.239 -0.000) 2.239 11.660 ( 0.000 7.126 0.000) 7.126 11.911 ( 0.000 6.941 0.000) 6.941 11.962 ( 0.000 -8.240 -0.000) 8.240 12.154 ( 0.000 6.314 0.000) 6.314 12.457 ( -0.000 -2.852 -0.000) 2.852 12.459 ( 0.000 4.447 0.000) 4.447 12.545 ( 0.000 -10.448 -0.000) 10.448 12.658 ( 0.000 -11.957 0.000) 11.957 12.693 ( 0.000 -8.159 0.000) 8.159 12.923 ( 0.000 -4.506 0.000) 4.506 12.946 ( -0.000 -7.574 0.000) 7.574 13.214 ( 0.000 0.949 0.000) 0.949 13.392 ( 0.000 -6.676 0.000) 6.676 13.550 ( 0.000 -14.901 -0.000) 14.901 13.641 ( 0.000 -12.946 0.000) 12.946 13.844 ( 0.000 -7.237 -0.000) 7.237 13.884 ( 0.000 0.765 0.000) 0.765 14.175 ( 0.000 -5.484 0.000) 5.484 14.347 ( 0.000 -8.165 -0.000) 8.165 16.103 ( 0.000 -11.331 -0.000) 11.331 16.384 ( 0.000 -13.416 0.000) 13.416 17.066 ( 0.000 -12.712 -0.000) 12.712 17.067 ( -0.000 -13.137 0.000) 13.137 18.318 ( 0.000 11.805 0.000) 11.805 18.436 ( 0.000 9.507 0.000) 9.507 18.511 ( 0.000 9.483 0.000) 9.483 18.614 ( 0.000 9.532 0.000) 9.532 20.390 ( 0.000 11.066 -0.000) 11.066 20.478 ( 0.000 -7.200 0.000) 7.200 20.511 ( 0.000 12.590 -0.000) 12.590 20.542 ( 0.000 -3.078 0.000) 3.078 20.580 ( 0.000 -5.152 -0.000) 5.152 20.818 ( 0.000 -6.818 -0.000) 6.818 21.620 ( 0.000 -12.546 -0.000) 12.546 21.708 ( 0.000 -11.688 0.000) 11.688 22.448 ( 0.000 0.979 -0.000) 0.979 22.620 ( 0.000 -1.897 0.000) 1.897 22.681 ( 0.000 -1.232 -0.000) 1.232 22.763 ( 0.000 -2.916 0.000) 2.916 23.591 ( 0.000 14.900 0.000) 14.900 23.603 ( 0.000 14.982 0.000) 14.982 23.773 ( 0.000 9.562 -0.000) 9.562 23.953 ( 0.000 11.106 0.000) 11.106 24.448 ( 0.000 8.880 0.000) 8.880 24.666 ( 0.000 7.732 -0.000) 7.732 24.724 ( 0.000 -1.387 0.000) 1.387 24.975 ( 0.000 0.030 -0.000) 0.030 26.875 ( 0.000 -5.109 -0.000) 5.109 26.966 ( 0.000 -4.803 -0.000) 4.803 27.002 ( 0.000 -6.749 0.000) 6.749 27.053 ( 0.000 -6.295 0.000) 6.295 27.188 ( 0.000 -0.760 0.000) 0.760 27.266 ( 0.000 -2.629 -0.000) 2.629 27.299 ( 0.000 -1.637 0.000) 1.637 27.523 ( 0.000 -7.395 -0.000) 7.395 27.854 ( 0.000 0.245 0.000) 0.245 27.973 ( 0.000 -1.860 -0.000) 1.860 28.259 ( 0.000 5.642 0.000) 5.642 28.363 ( 0.000 1.769 -0.000) 1.769 28.434 ( 0.000 8.592 -0.000) 8.592 28.647 ( 0.000 2.576 -0.000) 2.576 28.988 ( 0.000 5.619 -0.000) 5.619 29.111 ( 0.000 3.849 0.000) 3.849 29.137 ( 0.000 -0.624 0.000) 0.624 29.354 ( 0.000 -4.646 -0.000) 4.646 29.704 ( 0.000 4.299 0.000) 4.299 29.753 ( 0.000 7.192 -0.000) 7.192 30.609 ( 0.000 -0.489 -0.000) 0.489 30.652 ( 0.000 -0.034 0.000) 0.034 30.841 ( 0.000 4.329 0.000) 4.329 30.864 ( 0.000 4.785 -0.000) 4.785 33.845 ( 0.000 0.166 -0.000) 0.166 33.865 ( 0.000 -0.755 -0.000) 0.755 33.944 ( 0.000 0.100 0.000) 0.100 34.021 ( 0.000 -1.431 -0.000) 1.431 37.246 ( 0.000 -0.783 0.000) 0.783 37.270 ( -0.000 -1.906 -0.000) 1.906 37.283 ( 0.000 -1.028 0.000) 1.028 37.366 ( 0.000 -1.173 0.000) 1.173 37.633 ( 0.000 4.188 0.000) 4.188 37.718 ( 0.000 2.344 0.000) 2.344 37.830 ( 0.000 -1.207 0.000) 1.207 37.873 ( 0.000 -1.024 0.000) 1.024 49.227 ( 0.000 -3.616 0.000) 3.616 49.375 ( 0.000 -0.556 -0.000) 0.556 49.423 ( 0.000 -6.827 0.000) 6.827 49.677 ( 0.000 -6.808 -0.000) 6.808 50.548 ( 0.000 0.604 0.000) 0.604 50.649 ( 0.000 -2.770 -0.000) 2.770 50.678 ( -0.000 -2.528 0.000) 2.528 50.860 ( 0.000 -4.323 0.000) 4.323 51.875 ( 0.000 5.410 0.000) 5.410 51.933 ( 0.000 6.863 -0.000) 6.863 52.376 ( 0.000 -4.276 0.000) 4.276 52.440 ( 0.000 6.239 0.000) 6.239 52.491 ( 0.000 7.694 0.000) 7.694 52.800 ( 0.000 -13.735 0.000) 13.735 53.150 ( 0.000 -7.080 0.000) 7.080 53.317 ( 0.000 -8.289 0.000) 8.289 53.898 ( 0.000 -0.082 0.000) 0.082 53.923 ( 0.000 -0.478 0.000) 0.478 54.044 ( 0.000 1.250 0.000) 1.250 54.289 ( 0.000 -3.281 -0.000) 3.281 55.782 ( -0.000 -0.852 -0.000) 0.852 55.796 ( 0.000 -0.514 0.000) 0.514 55.901 ( 0.000 -0.660 0.000) 0.660 56.084 ( 0.000 -5.757 -0.000) 5.757 57.535 ( 0.000 6.867 0.000) 6.867 57.564 ( 0.000 7.005 -0.000) 7.005 57.616 ( 0.000 8.712 0.000) 8.712 57.761 ( 0.000 11.554 -0.000) 11.554 58.111 ( 0.000 -2.389 -0.000) 2.389 58.289 ( 0.000 -6.578 0.000) 6.578 58.322 ( 0.000 -4.956 -0.000) 4.956 58.567 ( 0.000 -11.349 0.000) 11.349 60.995 ( 0.000 2.971 -0.000) 2.971 61.011 ( 0.000 2.915 -0.000) 2.915 61.022 ( 0.000 2.551 0.000) 2.551 61.035 ( 0.000 3.381 0.000) 3.381 ======================= Grid point 27 (16/90) ======================= q-point: ( 0.00 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.555 ( 0.000 37.079 0.000) 37.079 3.072 ( 0.000 32.821 0.000) 32.821 3.075 ( 0.000 10.993 0.000) 10.993 3.256 ( 0.000 33.258 0.000) 33.258 3.721 ( 0.000 2.382 0.000) 2.382 3.900 ( 0.000 -3.703 0.000) 3.703 4.069 ( 0.000 14.651 0.000) 14.651 4.393 ( 0.000 -2.292 0.000) 2.292 4.480 ( 0.000 -9.733 0.000) 9.733 4.635 ( 0.000 7.195 0.000) 7.195 4.916 ( 0.000 -12.899 0.000) 12.899 5.047 ( 0.000 -3.219 0.000) 3.219 5.103 ( 0.000 15.176 0.000) 15.176 5.364 ( 0.000 10.075 0.000) 10.075 5.417 ( 0.000 2.223 0.000) 2.223 5.682 ( 0.000 -0.182 0.000) 0.182 5.797 ( 0.000 -10.044 0.000) 10.044 5.962 ( 0.000 -11.819 0.000) 11.819 6.153 ( 0.000 13.532 0.000) 13.532 6.191 ( 0.000 7.675 0.000) 7.675 6.269 ( 0.000 4.136 0.000) 4.136 6.538 ( 0.000 -3.107 0.000) 3.107 6.719 ( 0.000 -9.994 0.000) 9.994 6.723 ( 0.000 -5.703 0.000) 5.703 6.989 ( 0.000 16.851 0.000) 16.851 7.077 ( 0.000 -2.461 0.000) 2.461 7.238 ( 0.000 7.641 0.000) 7.641 7.368 ( 0.000 2.198 0.000) 2.198 7.465 ( 0.000 13.368 0.000) 13.368 7.621 ( 0.000 10.247 0.000) 10.247 7.665 ( 0.000 23.090 0.000) 23.090 7.818 ( 0.000 -6.414 0.000) 6.414 7.867 ( 0.000 -5.009 0.000) 5.009 8.078 ( 0.000 25.667 0.000) 25.667 8.101 ( 0.000 -0.727 0.000) 0.727 8.141 ( 0.000 2.313 0.000) 2.313 8.339 ( 0.000 -9.844 0.000) 9.844 8.365 ( 0.000 4.667 0.000) 4.667 8.472 ( 0.000 8.107 0.000) 8.107 8.695 ( 0.000 8.526 0.000) 8.526 8.841 ( 0.000 10.355 0.000) 10.355 8.879 ( 0.000 -4.810 0.000) 4.810 9.047 ( 0.000 2.472 0.000) 2.472 9.331 ( 0.000 4.750 0.000) 4.750 9.384 ( 0.000 -3.785 0.000) 3.785 9.394 ( 0.000 -14.493 0.000) 14.493 9.558 ( 0.000 -15.120 0.000) 15.120 9.626 ( 0.000 -12.383 0.000) 12.383 10.061 ( 0.000 -20.942 0.000) 20.942 10.231 ( 0.000 -6.738 0.000) 6.738 10.287 ( 0.000 11.821 0.000) 11.821 10.288 ( 0.000 -5.389 0.000) 5.389 10.478 ( 0.000 -1.047 0.000) 1.047 10.545 ( 0.000 -13.577 0.000) 13.577 10.758 ( 0.000 -9.888 0.000) 9.888 11.017 ( 0.000 5.008 0.000) 5.008 11.047 ( 0.000 -13.640 0.000) 13.640 11.217 ( 0.000 -2.854 0.000) 2.854 11.231 ( 0.000 -12.280 0.000) 12.280 11.577 ( 0.000 -10.904 0.000) 10.904 11.659 ( 0.000 13.295 0.000) 13.295 11.959 ( 0.000 7.334 0.000) 7.334 12.077 ( 0.000 -4.333 0.000) 4.333 12.135 ( 0.000 0.131 0.000) 0.131 12.333 ( 0.000 4.515 0.000) 4.515 12.367 ( 0.000 12.508 0.000) 12.508 12.412 ( 0.000 -2.349 0.000) 2.349 12.451 ( 0.000 5.400 0.000) 5.400 12.724 ( 0.000 -2.514 0.000) 2.514 12.900 ( 0.000 0.975 0.000) 0.975 12.917 ( 0.000 7.062 0.000) 7.062 13.054 ( 0.000 2.274 0.000) 2.274 13.253 ( 0.000 -4.932 0.000) 4.932 13.443 ( 0.000 -9.423 0.000) 9.423 13.493 ( 0.000 -9.169 0.000) 9.169 13.544 ( 0.000 -13.790 0.000) 13.790 14.026 ( 0.000 2.813 0.000) 2.813 14.157 ( 0.000 -1.163 0.000) 1.163 14.237 ( 0.000 2.426 0.000) 2.426 14.254 ( 0.000 1.604 0.000) 1.604 16.130 ( 0.000 -3.791 0.000) 3.791 16.155 ( 0.000 -5.295 0.000) 5.295 16.334 ( 0.000 -12.463 0.000) 12.463 16.375 ( 0.000 -12.294 0.000) 12.294 18.332 ( 0.000 4.824 0.000) 4.824 18.332 ( 0.000 4.117 0.000) 4.117 19.013 ( 0.000 8.002 0.000) 8.002 19.057 ( 0.000 6.060 0.000) 6.060 20.233 ( 0.000 1.752 0.000) 1.752 20.285 ( 0.000 -0.691 0.000) 0.691 20.670 ( 0.000 9.298 0.000) 9.298 20.674 ( 0.000 7.804 0.000) 7.804 20.820 ( 0.000 -5.480 0.000) 5.480 20.904 ( 0.000 -5.257 0.000) 5.257 21.122 ( 0.000 -9.790 0.000) 9.790 21.125 ( 0.000 -11.500 0.000) 11.500 22.471 ( 0.000 0.203 0.000) 0.203 22.495 ( 0.000 -1.170 0.000) 1.170 22.684 ( 0.000 -0.391 0.000) 0.391 22.714 ( 0.000 -1.924 0.000) 1.924 24.439 ( 0.000 7.454 0.000) 7.454 24.439 ( 0.000 23.277 0.000) 23.277 24.567 ( 0.000 1.832 0.000) 1.832 24.608 ( 0.000 9.978 0.000) 9.978 24.845 ( 0.000 2.663 0.000) 2.663 24.936 ( 0.000 9.235 0.000) 9.235 25.086 ( 0.000 -8.730 0.000) 8.730 25.306 ( 0.000 -5.994 0.000) 5.994 26.752 ( 0.000 -1.753 0.000) 1.753 26.753 ( 0.000 -1.909 0.000) 1.909 26.903 ( 0.000 0.005 0.000) 0.005 26.975 ( 0.000 -3.696 0.000) 3.696 27.192 ( 0.000 1.198 0.000) 1.198 27.244 ( 0.000 -3.826 0.000) 3.826 27.251 ( 0.000 -4.531 0.000) 4.531 27.395 ( 0.000 -7.750 0.000) 7.750 28.001 ( 0.000 1.468 0.000) 1.468 28.055 ( 0.000 -1.396 0.000) 1.396 28.336 ( 0.000 5.374 0.000) 5.374 28.490 ( 0.000 -1.353 0.000) 1.353 28.629 ( 0.000 0.983 0.000) 0.983 28.663 ( 0.000 -0.178 0.000) 0.178 28.711 ( 0.000 4.299 0.000) 4.299 28.863 ( 0.000 -1.772 0.000) 1.772 29.073 ( 0.000 2.544 0.000) 2.544 29.194 ( 0.000 -2.746 0.000) 2.746 29.592 ( 0.000 1.812 0.000) 1.812 29.708 ( 0.000 -4.768 0.000) 4.768 30.663 ( 0.000 4.726 0.000) 4.726 30.755 ( 0.000 0.907 0.000) 0.907 31.093 ( 0.000 6.908 0.000) 6.908 31.289 ( 0.000 -2.802 0.000) 2.802 33.902 ( 0.000 1.359 0.000) 1.359 33.947 ( 0.000 -0.816 0.000) 0.816 33.966 ( 0.000 -0.471 0.000) 0.471 33.972 ( 0.000 -0.616 0.000) 0.616 37.143 ( 0.000 -0.859 0.000) 0.859 37.165 ( 0.000 -0.547 0.000) 0.547 37.180 ( 0.000 -1.953 0.000) 1.953 37.223 ( 0.000 -3.345 0.000) 3.345 37.710 ( 0.000 2.632 0.000) 2.632 37.725 ( 0.000 2.851 0.000) 2.851 37.775 ( 0.000 0.170 0.000) 0.170 37.797 ( 0.000 -0.176 0.000) 0.176 48.782 ( 0.000 0.548 0.000) 0.548 48.829 ( 0.000 -1.623 0.000) 1.623 48.836 ( 0.000 0.433 0.000) 0.433 48.867 ( 0.000 -1.041 0.000) 1.041 50.490 ( 0.000 -0.624 0.000) 0.624 50.498 ( 0.000 -0.958 0.000) 0.958 50.672 ( 0.000 3.961 0.000) 3.961 50.975 ( 0.000 -10.341 0.000) 10.341 52.027 ( 0.000 7.736 0.000) 7.736 52.097 ( 0.000 6.602 0.000) 6.602 52.332 ( 0.000 -5.711 0.000) 5.711 52.392 ( 0.000 -7.619 0.000) 7.619 52.560 ( 0.000 6.079 0.000) 6.079 52.618 ( 0.000 8.124 0.000) 8.124 52.857 ( 0.000 -6.951 0.000) 6.951 52.972 ( 0.000 -8.110 0.000) 8.110 53.846 ( 0.000 1.175 0.000) 1.175 53.859 ( 0.000 0.643 0.000) 0.643 54.169 ( 0.000 0.614 0.000) 0.614 54.249 ( 0.000 -3.011 0.000) 3.011 55.749 ( 0.000 1.929 0.000) 1.929 55.827 ( 0.000 0.423 0.000) 0.423 55.907 ( 0.000 -0.191 0.000) 0.191 56.151 ( 0.000 -10.528 0.000) 10.528 57.652 ( 0.000 7.363 0.000) 7.363 57.794 ( 0.000 8.256 0.000) 8.256 57.796 ( 0.000 3.134 0.000) 3.134 58.093 ( 0.000 -0.583 0.000) 0.583 58.115 ( 0.000 -7.548 0.000) 7.548 58.193 ( 0.000 -7.120 0.000) 7.120 58.348 ( 0.000 0.815 0.000) 0.815 58.457 ( 0.000 -4.123 0.000) 4.123 61.003 ( 0.000 1.477 0.000) 1.477 61.009 ( 0.000 1.162 0.000) 1.162 61.256 ( 0.000 5.418 0.000) 5.418 61.430 ( 0.000 -3.190 0.000) 3.190 ======================= Grid point 28 (17/90) ======================= q-point: ( 0.12 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.641 ( -6.342 31.386 14.739) 35.250 2.710 ( 1.199 27.263 0.574) 27.296 3.122 ( -0.876 22.182 0.078) 22.199 3.599 ( 11.489 13.861 1.753) 18.089 3.807 ( 10.337 1.129 -6.548) 12.289 3.888 ( -1.066 -0.791 -3.865) 4.086 4.188 ( 12.943 14.861 5.084) 20.353 4.464 ( 6.712 -5.219 -3.660) 9.257 4.555 ( 5.982 -3.900 2.743) 7.649 4.764 ( 10.637 5.245 0.156) 11.861 4.984 ( 5.558 -9.060 3.112) 11.075 5.056 ( 1.489 -0.912 -0.867) 1.949 5.139 ( 2.164 7.574 0.031) 7.877 5.360 ( -0.371 7.435 1.423) 7.579 5.451 ( 3.555 2.520 -3.113) 5.355 5.662 ( 2.749 4.948 -6.138) 8.350 5.890 ( 8.691 -13.295 -6.090) 17.011 5.959 ( -2.239 -12.902 -2.159) 13.272 6.141 ( -0.912 9.839 5.039) 11.092 6.266 ( 6.724 8.202 9.101) 13.975 6.331 ( 3.319 4.496 3.712) 6.709 6.580 ( -0.444 1.555 6.402) 6.603 6.664 ( -1.618 -1.632 -8.425) 8.733 6.675 ( -0.525 -6.887 -2.201) 7.249 7.010 ( 0.825 9.786 1.193) 9.893 7.149 ( 1.741 5.515 -3.030) 6.529 7.264 ( 4.267 -0.713 -3.790) 5.752 7.363 ( -2.041 7.030 -2.618) 7.774 7.462 ( 3.292 15.386 -3.270) 16.070 7.616 ( 0.524 11.540 -6.584) 13.297 7.680 ( -0.468 4.194 3.838) 5.704 7.824 ( -3.425 -1.845 0.981) 4.012 7.836 ( 4.074 6.743 -2.846) 8.376 7.996 ( -4.826 -0.612 0.181) 4.868 8.158 ( 2.005 12.444 -0.293) 12.608 8.208 ( 6.313 3.827 -9.790) 12.262 8.398 ( 2.374 -6.436 3.554) 7.726 8.450 ( 4.520 13.701 23.763) 27.799 8.467 ( 3.759 5.244 0.341) 6.462 8.647 ( -1.621 6.746 0.465) 6.953 8.887 ( 4.689 -2.612 -6.061) 8.096 8.962 ( 2.811 9.798 2.549) 10.507 9.015 ( -0.203 1.182 -1.483) 1.908 9.242 ( -4.458 -1.818 5.966) 7.667 9.311 ( -5.028 -10.807 -4.804) 12.851 9.523 ( 7.616 -5.421 -0.827) 9.385 9.588 ( 3.606 -1.798 -0.229) 4.036 9.709 ( 4.616 -16.935 3.222) 17.846 10.048 ( 2.395 -7.454 -6.996) 10.500 10.233 ( -0.733 -9.117 2.874) 9.588 10.313 ( 2.176 -8.969 1.387) 9.333 10.383 ( 6.656 9.210 0.872) 11.397 10.466 ( -1.299 -0.356 0.356) 1.393 10.539 ( -0.325 -16.054 -1.326) 16.112 10.774 ( 1.178 -10.829 -1.897) 11.057 10.992 ( -2.746 6.962 -0.946) 7.543 11.095 ( 3.095 -9.518 1.645) 10.143 11.168 ( 1.843 -6.337 -2.503) 7.059 11.384 ( 7.619 -12.328 1.928) 14.620 11.563 ( -0.083 -11.843 -0.838) 11.872 11.633 ( -2.413 11.239 3.793) 12.105 11.852 ( -6.182 5.179 0.312) 8.070 12.087 ( -4.499 3.289 -4.657) 7.263 12.163 ( 2.434 -0.610 1.163) 2.766 12.299 ( -4.584 4.517 -0.189) 6.439 12.316 ( 0.263 4.082 0.232) 4.097 12.415 ( -0.857 -0.597 0.466) 1.144 12.501 ( 3.712 3.437 1.578) 5.299 12.677 ( -5.307 0.708 -0.819) 5.416 12.798 ( -4.624 -1.140 0.779) 4.826 12.954 ( 0.058 5.680 -0.884) 5.748 13.018 ( -3.031 2.871 -0.839) 4.258 13.256 ( -0.385 -5.761 2.643) 6.350 13.400 ( -2.843 -7.281 -3.726) 8.659 13.487 ( -1.219 -10.371 1.650) 10.572 13.539 ( -0.796 -12.497 -0.777) 12.547 13.974 ( -4.762 3.143 1.257) 5.843 14.150 ( -1.846 1.200 -0.503) 2.259 14.156 ( -4.196 -0.834 0.162) 4.281 14.280 ( -0.228 -1.895 0.474) 1.967 16.029 ( -3.905 -4.469 -0.110) 5.936 16.191 ( -2.539 -11.157 -0.076) 11.443 16.386 ( 9.309 -5.688 -0.072) 10.910 16.514 ( 8.542 -11.378 -0.006) 14.228 18.342 ( 1.185 4.807 -0.346) 4.963 18.351 ( 1.781 4.446 0.003) 4.790 18.987 ( -2.611 7.813 0.774) 8.274 19.024 ( -3.164 6.072 0.088) 6.847 20.239 ( 0.729 1.253 0.011) 1.450 20.286 ( 0.218 -0.905 -0.398) 1.012 20.661 ( -1.104 6.134 -0.726) 6.274 20.667 ( -0.515 7.763 1.076) 7.854 20.804 ( -1.163 -3.209 -1.638) 3.785 20.893 ( -1.032 -3.512 1.333) 3.895 21.146 ( 2.336 -11.254 -0.720) 11.516 21.177 ( 4.427 -10.238 0.579) 11.169 22.492 ( 1.656 -0.281 0.989) 1.950 22.493 ( 0.020 -0.469 -1.051) 1.151 22.679 ( -0.416 -0.353 -0.123) 0.560 22.714 ( -0.056 -2.098 0.186) 2.107 24.276 ( -10.145 17.702 -1.872) 20.489 24.482 ( -0.217 11.467 -0.312) 11.474 24.484 ( -6.829 5.216 1.911) 8.803 24.655 ( 2.814 6.722 -3.791) 8.214 24.748 ( -16.351 11.998 2.543) 20.440 24.790 ( -5.740 1.751 4.094) 7.264 25.050 ( -2.250 -6.881 -3.400) 7.999 25.197 ( -9.546 -6.342 1.821) 11.605 26.766 ( 1.194 -1.891 -0.036) 2.236 26.778 ( 2.341 -2.568 -1.795) 3.911 26.895 ( -0.884 0.616 1.444) 1.802 26.998 ( 1.216 -4.634 0.824) 4.862 27.164 ( -0.702 -0.285 -0.419) 0.866 27.219 ( -2.101 -2.956 1.466) 3.912 27.286 ( 1.737 -3.420 -1.417) 4.089 27.381 ( -1.209 -7.069 -0.191) 7.175 27.972 ( -2.211 0.976 -1.611) 2.904 28.013 ( -3.081 -0.814 1.865) 3.693 28.365 ( 1.785 4.591 -1.217) 5.074 28.503 ( -0.208 -1.230 -1.873) 2.251 28.621 ( -0.082 1.726 1.438) 2.248 28.648 ( 0.440 0.477 0.741) 0.985 28.764 ( 4.822 4.826 2.485) 7.261 28.948 ( 4.584 -3.002 1.276) 5.626 29.095 ( 1.642 1.527 -0.695) 2.348 29.169 ( -0.542 -1.988 -2.356) 3.129 29.577 ( 0.625 4.366 -0.015) 4.410 29.771 ( 4.257 -4.980 -1.012) 6.629 30.665 ( -0.149 4.438 0.620) 4.484 30.744 ( -1.072 1.030 0.178) 1.497 31.056 ( -3.249 6.453 -0.268) 7.230 31.198 ( -6.803 0.239 -2.602) 7.287 33.893 ( -0.762 0.975 -0.068) 1.239 33.921 ( -1.902 -0.439 -0.021) 1.952 33.956 ( -0.406 0.237 -0.245) 0.530 33.986 ( 0.517 -1.239 0.252) 1.366 37.155 ( 0.996 -0.604 0.181) 1.179 37.177 ( 1.210 -0.456 -0.365) 1.343 37.202 ( 1.547 -2.148 0.251) 2.659 37.239 ( 1.503 -3.248 0.139) 3.582 37.703 ( -0.273 3.281 0.116) 3.294 37.736 ( 0.796 2.385 -0.450) 2.554 37.784 ( 0.789 -0.239 -0.380) 0.907 37.803 ( 0.474 -0.397 0.930) 1.117 48.854 ( 6.051 -0.486 -0.397) 6.083 48.866 ( 5.298 -1.125 0.126) 5.417 48.943 ( 7.050 -0.426 0.653) 7.093 49.004 ( 12.380 -4.097 -0.651) 13.057 50.498 ( 0.730 -0.099 1.880) 2.019 50.539 ( 2.669 -2.270 4.194) 5.465 50.663 ( -0.676 3.624 -0.950) 3.807 50.936 ( -3.058 -9.144 -2.808) 10.043 52.026 ( -0.146 7.602 0.245) 7.607 52.085 ( -0.892 6.543 -0.411) 6.617 52.354 ( 1.338 -6.850 1.287) 7.097 52.382 ( -0.353 -7.047 -0.845) 7.106 52.566 ( 0.589 6.513 -0.066) 6.540 52.625 ( 0.657 8.437 0.336) 8.470 52.884 ( 2.404 -7.420 -0.362) 7.808 52.996 ( 2.050 -8.434 0.063) 8.680 53.851 ( 0.467 1.215 -0.324) 1.341 53.869 ( 0.926 0.432 0.008) 1.022 54.159 ( -0.867 0.700 -0.596) 1.264 54.243 ( -0.522 -3.106 0.330) 3.166 55.748 ( -0.084 1.775 -0.230) 1.792 55.829 ( 0.120 -0.279 -0.145) 0.337 55.898 ( -0.761 0.350 -0.223) 0.867 56.129 ( -2.047 -9.788 0.469) 10.011 57.654 ( 0.182 7.388 0.482) 7.406 57.776 ( -0.578 5.188 -4.093) 6.633 57.805 ( -0.199 6.841 3.412) 7.647 58.073 ( -1.369 -2.661 -2.082) 3.645 58.096 ( -1.908 -4.150 2.585) 5.249 58.186 ( -0.648 -4.389 1.221) 4.601 58.359 ( 0.391 -3.028 1.215) 3.286 58.406 ( -3.860 -3.573 -2.834) 5.975 61.001 ( -0.052 1.542 0.127) 1.548 61.012 ( 0.229 1.099 0.147) 1.132 61.234 ( -1.979 4.917 0.136) 5.302 61.368 ( -5.189 -1.237 -0.814) 5.397 ======================= Grid point 29 (18/90) ======================= q-point: ( 0.25 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.575 ( 2.464 20.390 15.324) 25.625 2.869 ( 4.207 6.341 2.983) 8.173 3.239 ( 11.497 25.537 2.716) 28.137 3.588 ( -6.829 -0.779 -3.393) 7.665 3.869 ( 5.625 5.949 -4.581) 9.381 4.136 ( 14.593 10.455 0.653) 17.963 4.512 ( 10.154 8.090 0.709) 13.002 4.611 ( 11.586 -0.493 -2.855) 11.943 4.662 ( -0.611 -3.982 -0.959) 4.141 4.982 ( 9.197 -0.760 1.555) 9.359 5.056 ( 2.886 2.352 4.273) 5.667 5.157 ( 7.438 -11.655 -0.656) 13.842 5.258 ( 10.376 1.529 -4.677) 11.483 5.444 ( 9.347 -0.358 6.225) 11.236 5.560 ( 5.816 1.841 -0.290) 6.107 5.804 ( 9.194 5.442 -2.643) 11.006 5.845 ( -3.957 -4.974 3.970) 7.494 6.083 ( -0.925 5.041 -1.999) 5.501 6.134 ( 6.965 -8.350 -3.120) 11.312 6.315 ( -2.954 -1.256 -1.929) 3.745 6.408 ( -12.020 1.613 -7.428) 14.222 6.458 ( 4.197 2.520 10.651) 11.723 6.741 ( 10.388 10.568 -0.190) 14.820 6.791 ( 6.573 -1.889 4.834) 8.375 6.960 ( -5.894 -0.605 -8.878) 10.673 7.110 ( -0.711 18.699 -0.896) 18.734 7.283 ( 1.505 2.163 -7.653) 8.094 7.460 ( 7.931 -2.409 -2.540) 8.669 7.502 ( 1.642 6.745 0.610) 6.969 7.583 ( -5.617 4.935 -1.996) 7.739 7.704 ( -2.301 -0.356 -6.821) 7.207 7.742 ( 5.991 7.948 0.953) 9.998 7.886 ( -2.314 5.458 5.186) 7.876 8.015 ( 7.326 6.024 -3.230) 10.020 8.177 ( -0.403 8.056 1.611) 8.225 8.300 ( 3.569 5.283 -6.383) 9.022 8.452 ( 2.381 8.352 0.488) 8.698 8.521 ( 6.529 3.308 2.013) 7.591 8.647 ( 0.747 6.975 4.167) 8.159 8.814 ( 16.243 2.573 21.361) 26.958 8.931 ( -1.028 1.378 -6.620) 6.839 8.980 ( 2.638 -3.289 -2.140) 4.728 9.077 ( 5.566 16.743 2.374) 17.803 9.182 ( -2.540 -7.075 -1.398) 7.646 9.259 ( 2.492 -1.981 3.636) 4.833 9.676 ( 5.081 -0.829 0.971) 5.239 9.681 ( 5.300 0.557 -0.085) 5.330 9.797 ( 4.005 -11.851 3.804) 13.075 10.113 ( 3.671 0.827 -8.282) 9.097 10.245 ( 1.848 -5.255 -0.681) 5.612 10.361 ( 0.323 -5.471 8.295) 9.942 10.418 ( -1.883 3.763 -1.446) 4.449 10.493 ( -1.362 -19.009 -2.625) 19.238 10.565 ( 7.492 -1.346 -0.209) 7.615 10.763 ( -2.181 -12.459 -4.798) 13.528 10.881 ( -4.994 3.860 -1.175) 6.420 11.193 ( 4.656 -12.543 1.351) 13.447 11.256 ( 4.918 1.220 -0.498) 5.091 11.409 ( -4.834 -11.008 -1.339) 12.097 11.575 ( -0.962 7.854 5.398) 9.579 11.661 ( 2.742 -3.803 -0.784) 4.753 11.757 ( -1.994 -3.249 2.163) 4.383 11.956 ( -5.420 3.506 -5.570) 8.526 12.110 ( -4.032 5.079 1.401) 6.635 12.239 ( -4.877 2.257 -0.939) 5.455 12.312 ( -0.776 -4.741 1.209) 4.954 12.385 ( -0.961 -5.370 0.171) 5.458 12.526 ( -6.273 4.653 -2.987) 8.362 12.595 ( 4.299 2.756 2.139) 5.537 12.737 ( -2.844 -5.495 1.432) 6.351 12.917 ( -2.673 1.660 -0.724) 3.229 12.948 ( -2.770 7.875 -0.550) 8.366 13.242 ( -1.557 -6.424 1.738) 6.835 13.334 ( -2.406 -4.919 -1.925) 5.804 13.445 ( -2.939 -8.527 1.374) 9.123 13.495 ( -3.149 -10.596 -2.315) 11.294 13.861 ( -5.758 1.384 1.685) 6.157 14.036 ( -6.004 2.271 0.990) 6.495 14.114 ( -2.499 -6.549 -1.128) 7.100 14.239 ( -3.565 -6.679 0.524) 7.589 15.973 ( -1.634 -4.332 0.027) 4.630 16.145 ( -1.311 -11.410 -0.259) 11.488 16.607 ( 10.623 -4.944 -0.187) 11.718 16.692 ( 8.000 -9.329 -0.015) 12.290 18.383 ( 2.983 5.777 -0.297) 6.508 18.411 ( 4.071 4.485 -0.011) 6.057 18.905 ( -5.529 7.434 1.290) 9.354 18.935 ( -4.982 5.740 -0.164) 7.602 20.272 ( 2.540 -0.018 0.225) 2.550 20.300 ( 1.413 -1.478 -0.571) 2.123 20.628 ( -1.830 2.810 -1.084) 3.524 20.649 ( -1.691 2.331 0.866) 3.007 20.774 ( -0.849 3.876 -1.462) 4.228 20.869 ( -1.700 1.573 1.585) 2.807 21.215 ( 4.211 -12.055 -0.666) 12.787 21.286 ( 5.435 -11.522 0.611) 12.754 22.490 ( -0.009 0.892 -1.350) 1.618 22.535 ( 1.827 -1.197 1.365) 2.576 22.669 ( -0.375 -0.310 -0.165) 0.514 22.712 ( -0.183 -2.337 0.074) 2.345 24.046 ( -10.132 16.290 -2.302) 19.321 24.266 ( -14.784 8.948 3.535) 17.639 24.377 ( -15.081 10.698 0.386) 18.494 24.430 ( -7.228 7.231 -1.857) 10.391 24.667 ( -5.254 3.544 3.739) 7.358 24.692 ( 1.448 4.367 -2.855) 5.415 24.969 ( -7.417 -3.280 2.241) 8.414 25.020 ( -3.424 -4.013 -2.138) 5.692 26.789 ( 0.863 -2.191 -0.650) 2.443 26.827 ( 2.414 -3.853 -1.255) 4.717 26.877 ( -0.817 -0.138 0.391) 0.916 27.000 ( -1.549 -5.649 1.670) 6.091 27.181 ( 0.120 -0.949 0.854) 1.282 27.182 ( 0.473 -1.589 0.415) 1.709 27.297 ( -0.287 -2.252 -0.728) 2.384 27.364 ( 0.200 -5.188 -0.223) 5.197 27.922 ( -1.852 0.240 -1.984) 2.725 27.960 ( -2.280 -1.209 1.353) 2.914 28.377 ( -0.479 3.111 -0.530) 3.192 28.459 ( -2.980 -0.244 -0.178) 2.995 28.640 ( -0.043 2.672 -1.828) 3.238 28.656 ( 0.509 1.774 0.372) 1.883 28.908 ( 7.307 3.721 3.308) 8.842 29.014 ( 2.381 -1.221 2.176) 3.449 29.107 ( 1.579 2.922 -2.553) 4.189 29.224 ( 3.958 -3.094 -1.234) 5.173 29.633 ( 4.212 5.599 -0.021) 7.006 29.843 ( 2.517 -3.506 -0.590) 4.356 30.647 ( -1.756 4.045 0.382) 4.427 30.716 ( -1.457 0.692 0.323) 1.645 30.982 ( -3.040 5.295 -0.320) 6.114 31.056 ( -5.394 2.553 -1.659) 6.194 33.874 ( -0.903 0.297 -0.220) 0.976 33.883 ( -1.624 -0.072 0.057) 1.627 33.950 ( -0.107 0.542 0.017) 0.553 33.992 ( 0.070 -1.466 0.182) 1.479 37.183 ( 1.565 -0.541 0.269) 1.678 37.206 ( 1.459 -0.429 -0.428) 1.579 37.233 ( 1.444 -1.556 -0.372) 2.156 37.281 ( 2.068 -2.901 0.510) 3.599 37.704 ( 0.284 3.633 0.033) 3.644 37.751 ( 0.701 2.221 -0.441) 2.370 37.797 ( 0.460 -0.781 -0.041) 0.908 37.821 ( 0.942 -0.938 0.687) 1.497 48.987 ( 6.947 -0.849 -0.117) 7.000 49.040 ( 9.576 -2.917 -0.159) 10.012 49.127 ( 9.508 0.420 0.624) 9.538 49.273 ( 12.091 -7.726 -1.364) 14.413 50.524 ( 1.200 0.379 1.491) 1.951 50.606 ( 1.804 -3.847 5.769) 7.165 50.643 ( -0.779 2.940 -1.274) 3.297 50.854 ( -3.430 -6.818 -3.394) 8.353 52.019 ( -0.614 7.065 -0.266) 7.097 52.071 ( -0.168 6.992 0.460) 7.009 52.335 ( -1.840 -6.824 -2.604) 7.532 52.426 ( 2.954 -8.681 3.231) 9.722 52.582 ( 0.885 7.373 -0.100) 7.427 52.646 ( 1.171 9.131 0.621) 9.226 52.937 ( 2.444 -8.218 -0.785) 8.610 53.049 ( 2.755 -9.199 0.196) 9.604 53.864 ( 0.882 1.180 -0.378) 1.521 53.893 ( 1.224 -0.055 -0.190) 1.240 54.131 ( -1.504 1.061 -0.917) 2.057 54.231 ( -0.728 -3.371 0.570) 3.495 55.747 ( 0.183 1.308 -0.288) 1.352 55.827 ( -0.349 -1.963 -0.627) 2.090 55.881 ( -0.589 1.682 0.072) 1.784 56.074 ( -3.201 -7.862 0.700) 8.518 57.663 ( 0.455 7.464 0.675) 7.508 57.749 ( -0.971 5.390 -3.156) 6.321 57.806 ( -0.381 8.209 2.311) 8.537 58.045 ( -0.568 -3.057 -1.188) 3.329 58.054 ( -2.911 0.808 2.487) 3.913 58.171 ( -1.218 -3.704 1.460) 4.163 58.307 ( -3.501 -2.790 -4.389) 6.269 58.361 ( -0.969 -8.495 1.695) 8.716 61.004 ( 0.381 1.676 0.128) 1.724 61.020 ( 0.564 1.044 0.185) 1.201 61.181 ( -3.009 3.816 0.160) 4.862 61.245 ( -5.676 1.294 -0.791) 5.875 ======================= Grid point 30 (19/90) ======================= q-point: ( 0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.754 ( 8.317 6.221 11.608) 15.576 2.945 ( 2.885 -1.455 1.787) 3.692 3.384 ( 0.370 10.199 -0.296) 10.210 3.441 ( -4.059 0.109 -8.662) 9.566 4.133 ( 14.816 17.273 8.581) 24.321 4.322 ( -0.093 9.097 1.564) 9.231 4.597 ( 3.046 0.747 -7.531) 8.158 4.643 ( 12.080 8.686 1.271) 14.933 4.950 ( 14.836 2.976 -0.971) 15.163 5.097 ( -1.942 -4.759 -0.328) 5.150 5.199 ( 9.001 -9.230 7.645) 14.988 5.268 ( 0.245 -8.834 1.624) 8.985 5.458 ( 6.965 -3.745 -10.788) 13.376 5.600 ( 1.303 -4.944 5.911) 7.815 5.646 ( 5.147 1.154 7.566) 9.223 5.838 ( -15.935 0.257 -6.441) 17.189 5.925 ( 5.988 12.164 5.241) 14.535 5.968 ( 3.183 1.519 2.993) 4.625 6.084 ( -5.199 -2.563 -15.688) 16.724 6.308 ( 5.638 2.211 2.440) 6.529 6.376 ( 1.346 9.298 -0.760) 9.426 6.475 ( -0.667 -1.701 0.717) 1.963 6.774 ( -4.643 -8.924 -4.641) 11.079 6.877 ( 0.363 -8.783 -2.097) 9.037 6.981 ( 7.644 4.544 3.180) 9.444 7.127 ( 0.342 11.042 0.700) 11.070 7.343 ( 2.185 1.113 -1.494) 2.871 7.367 ( -3.791 0.955 -4.927) 6.289 7.553 ( 2.256 2.774 -2.697) 4.479 7.612 ( 1.136 -0.549 -0.615) 1.403 7.733 ( 2.420 -3.935 0.751) 4.680 7.884 ( 5.464 10.692 11.463) 16.600 7.899 ( 8.236 14.221 -4.104) 16.938 8.083 ( -2.837 10.578 -2.819) 11.309 8.203 ( 4.901 9.319 -2.847) 10.907 8.355 ( 3.211 4.463 -1.322) 5.655 8.503 ( 0.178 9.473 1.512) 9.594 8.557 ( -2.420 10.353 1.097) 10.688 8.721 ( 2.963 -1.258 -2.063) 3.824 8.806 ( -4.584 4.511 -6.090) 8.857 9.031 ( 1.955 4.737 5.383) 7.432 9.138 ( 2.385 2.896 0.332) 3.766 9.211 ( 11.425 2.516 -1.719) 11.824 9.365 ( 6.404 3.778 -0.354) 7.444 9.389 ( 19.648 5.630 18.155) 27.338 9.675 ( -3.776 2.288 0.324) 4.427 9.802 ( 6.391 -0.832 0.246) 6.449 9.946 ( 6.822 -2.407 3.763) 8.154 10.075 ( -5.924 7.820 -3.618) 10.457 10.267 ( -2.888 -11.567 -4.634) 12.791 10.322 ( -3.021 5.819 1.843) 6.811 10.404 ( -1.755 -5.495 1.873) 6.065 10.416 ( -2.932 -8.877 0.779) 9.381 10.664 ( -2.542 -12.514 -6.938) 14.533 10.763 ( 10.835 -4.217 -5.489) 12.857 10.845 ( -0.019 -10.239 2.260) 10.486 11.221 ( -7.678 -3.063 6.172) 10.317 11.297 ( -1.509 5.732 -2.679) 6.505 11.315 ( 3.122 -9.479 -1.144) 10.045 11.598 ( 0.755 7.408 2.353) 7.809 11.660 ( 1.031 -0.070 1.286) 1.650 11.714 ( -3.232 -5.535 -3.072) 7.107 11.829 ( -6.102 3.201 -3.421) 7.693 12.055 ( -4.694 -4.514 3.095) 7.210 12.158 ( -0.058 -5.045 1.113) 5.167 12.255 ( -3.655 -5.484 -2.134) 6.927 12.400 ( 1.849 -1.692 -1.428) 2.885 12.461 ( 0.538 1.464 3.709) 4.023 12.636 ( -2.899 -1.501 -1.690) 3.676 12.674 ( -1.271 1.306 -0.341) 1.854 12.876 ( -1.078 -0.221 -0.418) 1.177 12.922 ( 0.583 5.166 -0.022) 5.199 13.217 ( -1.057 -1.871 4.007) 4.547 13.288 ( -0.850 -5.408 -2.263) 5.923 13.385 ( -5.187 -3.931 -0.861) 6.566 13.415 ( -1.013 -10.681 -0.908) 10.767 13.762 ( -3.892 -2.037 1.383) 4.606 13.925 ( -4.369 -0.223 0.605) 4.417 14.055 ( -2.400 -8.244 -0.857) 8.629 14.152 ( -4.195 -11.552 0.254) 12.292 15.951 ( -0.612 -3.706 0.051) 3.757 16.132 ( -0.089 -10.844 -0.204) 10.847 16.794 ( 6.729 -5.414 -0.241) 8.639 16.829 ( 4.670 -7.326 -0.026) 8.688 18.465 ( 4.644 7.410 0.192) 8.747 18.515 ( 5.623 4.923 -0.232) 7.477 18.773 ( -6.958 6.895 1.129) 9.861 18.824 ( -5.411 4.508 -0.447) 7.057 20.340 ( 2.889 -1.851 -0.566) 3.477 20.349 ( 4.030 -2.086 0.811) 4.610 20.567 ( -3.891 -3.123 -1.193) 5.130 20.605 ( -2.105 0.724 -0.150) 2.231 20.766 ( -0.136 8.420 0.152) 8.423 20.835 ( -1.507 9.685 0.716) 9.827 21.301 ( 3.559 -13.587 -0.286) 14.048 21.392 ( 4.126 -13.405 0.306) 14.029 22.484 ( -0.194 1.798 -0.953) 2.044 22.567 ( 0.873 -1.934 0.941) 2.321 22.664 ( -0.047 -0.308 -0.125) 0.336 22.708 ( -0.101 -2.369 0.057) 2.372 23.884 ( -4.083 12.801 -1.713) 13.545 23.981 ( -10.656 11.879 2.493) 16.152 24.095 ( -11.557 6.036 -0.221) 13.040 24.231 ( -9.612 3.936 -0.787) 10.416 24.618 ( -0.873 5.970 1.809) 6.299 24.705 ( 0.473 1.455 -2.118) 2.613 24.850 ( -3.671 3.225 2.280) 5.392 24.980 ( -0.964 -1.668 -1.476) 2.427 26.795 ( -0.101 -2.251 -0.324) 2.276 26.859 ( 0.798 -5.434 -1.547) 5.706 26.872 ( 0.275 -2.231 0.572) 2.320 26.957 ( -2.277 -5.564 1.063) 6.105 27.177 ( 0.467 0.231 0.917) 1.055 27.219 ( 1.147 -1.806 -0.150) 2.145 27.289 ( -0.042 0.068 0.052) 0.095 27.382 ( 1.094 -4.731 0.286) 4.864 27.881 ( -1.511 0.121 -2.387) 2.828 27.931 ( -0.892 -2.060 1.208) 2.549 28.349 ( -1.785 1.983 -0.072) 2.669 28.398 ( -2.397 -0.126 0.801) 2.531 28.611 ( -0.899 5.377 -3.250) 6.347 28.675 ( 0.731 1.152 0.050) 1.365 29.044 ( 4.199 3.604 3.529) 6.563 29.104 ( 4.964 0.806 4.429) 6.701 29.136 ( 1.292 2.588 -3.407) 4.469 29.272 ( 0.816 -3.446 -2.298) 4.221 29.729 ( 4.422 4.923 0.170) 6.620 29.866 ( -0.204 -0.272 -0.287) 0.445 30.615 ( -0.764 2.583 -0.063) 2.694 30.682 ( -1.966 -0.244 0.284) 2.002 30.938 ( -1.274 3.988 0.168) 4.190 30.972 ( -2.412 2.848 -0.718) 3.800 33.857 ( -0.802 0.050 0.086) 0.808 33.859 ( -0.533 -0.179 -0.181) 0.591 33.950 ( 0.019 0.548 0.089) 0.555 33.992 ( -0.061 -1.428 0.055) 1.430 37.215 ( 1.244 -0.759 0.274) 1.483 37.229 ( 0.786 -0.914 -0.253) 1.232 37.259 ( 1.087 -0.327 -0.338) 1.185 37.317 ( 1.178 -2.365 0.220) 2.651 37.712 ( 0.368 3.655 -0.046) 3.674 37.762 ( 0.428 2.224 -0.174) 2.271 37.804 ( 0.185 -1.050 0.116) 1.072 37.840 ( 0.617 -1.399 0.236) 1.547 49.120 ( 5.134 -0.828 -0.169) 5.203 49.217 ( 6.525 -5.074 0.089) 8.267 49.305 ( 6.574 0.937 0.424) 6.654 49.468 ( 6.578 -7.224 -1.072) 9.828 50.550 ( 0.893 0.514 0.594) 1.189 50.625 ( -0.035 0.123 -1.931) 1.935 50.637 ( -0.537 -1.548 4.511) 4.799 50.789 ( -1.887 -5.109 -1.941) 5.782 52.004 ( -0.567 6.523 -0.419) 6.561 52.081 ( 0.647 7.922 1.005) 8.012 52.287 ( -1.797 -6.162 -2.302) 6.819 52.491 ( 2.109 -10.858 2.501) 11.340 52.598 ( 0.594 7.992 -0.086) 8.014 52.672 ( 0.996 9.683 0.556) 9.750 52.974 ( 1.184 -8.745 -0.735) 8.855 53.101 ( 1.936 -10.009 0.260) 10.198 53.885 ( 1.075 0.769 -0.054) 1.323 53.912 ( 0.581 -0.430 -0.437) 0.845 54.097 ( -1.366 1.783 -0.720) 2.359 54.219 ( -0.495 -3.703 0.492) 3.768 55.756 ( 0.695 0.592 -0.140) 0.924 55.807 ( -1.229 -1.650 -0.681) 2.167 55.882 ( 0.570 1.031 0.184) 1.192 56.010 ( -2.839 -5.619 0.563) 6.321 57.677 ( 0.735 7.552 0.456) 7.601 57.722 ( -0.926 6.158 -1.461) 6.397 57.804 ( -0.256 8.849 1.081) 8.918 57.993 ( -2.909 5.942 1.087) 6.704 58.046 ( 0.705 -3.283 -0.989) 3.500 58.149 ( -1.116 -5.837 1.675) 6.174 58.247 ( -1.396 -3.895 -2.937) 5.074 58.340 ( -1.212 -10.785 1.034) 10.902 61.021 ( 1.195 1.876 0.075) 2.225 61.038 ( 1.194 1.165 0.135) 1.674 61.117 ( -3.003 2.838 0.055) 4.132 61.142 ( -3.841 1.956 -0.385) 4.327 ======================= Grid point 31 (20/90) ======================= q-point: (-0.50 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.887 ( 0.000 -0.804 0.000) 0.804 2.970 ( -0.000 -3.183 -0.000) 3.183 3.372 ( 0.000 6.620 0.000) 6.620 3.380 ( 0.000 1.824 -0.000) 1.824 4.213 ( 0.000 10.688 -0.000) 10.688 4.364 ( 0.000 13.740 0.000) 13.740 4.835 ( 0.000 2.105 -0.000) 2.105 4.837 ( -0.000 -0.267 0.000) 0.267 4.965 ( -0.000 9.977 -0.000) 9.977 5.120 ( 0.000 -0.660 0.000) 0.660 5.202 ( 0.000 -6.071 0.000) 6.071 5.406 ( 0.000 -10.313 0.000) 10.313 5.436 ( -0.000 -12.407 -0.000) 12.407 5.519 ( 0.000 10.832 -0.000) 10.832 5.676 ( 0.000 -8.336 0.000) 8.336 5.700 ( 0.000 10.023 0.000) 10.023 5.933 ( 0.000 7.834 0.000) 7.834 6.005 ( 0.000 2.021 -0.000) 2.021 6.174 ( -0.000 -6.163 0.000) 6.163 6.275 ( 0.000 12.241 0.000) 12.241 6.393 ( 0.000 -7.923 0.000) 7.923 6.479 ( 0.000 8.364 -0.000) 8.364 6.790 ( -0.000 -15.872 -0.000) 15.872 6.804 ( 0.000 -12.301 0.000) 12.301 7.087 ( 0.000 3.410 0.000) 3.410 7.111 ( 0.000 7.888 -0.000) 7.888 7.324 ( 0.000 10.404 0.000) 10.404 7.419 ( 0.000 -8.027 0.000) 8.027 7.460 ( -0.000 -7.521 -0.000) 7.521 7.684 ( 0.000 6.373 -0.000) 6.373 7.777 ( 0.000 -3.111 0.000) 3.111 7.949 ( 0.000 11.574 -0.000) 11.574 7.962 ( 0.000 11.877 0.000) 11.877 8.132 ( -0.000 7.643 -0.000) 7.643 8.290 ( 0.000 12.637 -0.000) 12.637 8.366 ( 0.000 8.957 0.000) 8.957 8.433 ( 0.000 9.507 -0.000) 9.507 8.578 ( 0.000 2.133 0.000) 2.133 8.654 ( -0.000 24.149 -0.000) 24.149 8.801 ( 0.000 -9.432 0.000) 9.432 9.031 ( 0.000 2.677 -0.000) 2.677 9.241 ( 0.000 21.270 0.000) 21.270 9.300 ( 0.000 -2.251 -0.000) 2.251 9.471 ( 0.000 0.117 0.000) 0.117 9.599 ( 0.000 7.311 -0.000) 7.311 9.810 ( 0.000 2.378 0.000) 2.378 9.846 ( -0.000 0.231 -0.000) 0.231 9.942 ( -0.000 2.877 0.000) 2.877 10.056 ( 0.000 3.446 -0.000) 3.446 10.091 ( 0.000 -11.213 -0.000) 11.213 10.298 ( 0.000 6.837 -0.000) 6.837 10.369 ( 0.000 -2.753 0.000) 2.753 10.388 ( 0.000 -15.498 0.000) 15.498 10.688 ( 0.000 -7.589 -0.000) 7.589 10.815 ( 0.000 -16.976 0.000) 16.976 10.917 ( 0.000 -6.699 -0.000) 6.699 11.113 ( 0.000 2.931 0.000) 2.931 11.227 ( 0.000 6.886 0.000) 6.886 11.393 ( 0.000 -3.451 0.000) 3.451 11.579 ( 0.000 4.039 -0.000) 4.039 11.701 ( 0.000 -7.743 0.000) 7.743 11.707 ( -0.000 8.268 -0.000) 8.268 11.727 ( 0.000 -5.499 -0.000) 5.499 11.974 ( 0.000 -3.425 0.000) 3.425 12.165 ( 0.000 -12.157 -0.000) 12.157 12.204 ( 0.000 -4.791 0.000) 4.791 12.441 ( 0.000 2.857 -0.000) 2.857 12.501 ( 0.000 -0.848 0.000) 0.848 12.570 ( 0.000 0.338 -0.000) 0.338 12.648 ( 0.000 0.174 0.000) 0.174 12.868 ( 0.000 -0.998 0.000) 0.998 12.933 ( 0.000 3.492 -0.000) 3.492 13.257 ( 0.000 2.385 0.000) 2.385 13.263 ( -0.000 -3.144 0.000) 3.144 13.287 ( 0.000 -8.326 -0.000) 8.326 13.416 ( 0.000 -9.221 0.000) 9.221 13.719 ( 0.000 -3.358 0.000) 3.358 13.876 ( 0.000 -1.166 -0.000) 1.166 14.026 ( 0.000 -7.864 0.000) 7.864 14.101 ( 0.000 -14.788 -0.000) 14.788 15.945 ( 0.000 -3.353 -0.000) 3.353 16.132 ( 0.000 -10.670 0.000) 10.670 16.870 ( 0.000 -6.047 0.000) 6.047 16.875 ( 0.000 -6.044 0.000) 6.044 18.540 ( 0.000 9.332 0.000) 9.332 18.613 ( 0.000 7.406 -0.000) 7.406 18.660 ( 0.000 4.392 0.000) 4.392 18.743 ( 0.000 2.747 0.000) 2.747 20.377 ( 0.000 -2.363 -0.000) 2.363 20.429 ( 0.000 -3.605 0.000) 3.605 20.490 ( 0.000 -2.884 -0.000) 2.884 20.577 ( 0.000 -1.744 0.000) 1.744 20.762 ( 0.000 9.487 -0.000) 9.487 20.821 ( 0.000 14.264 -0.000) 14.264 21.341 ( 0.000 -14.396 0.000) 14.396 21.439 ( 0.000 -14.334 0.000) 14.334 22.480 ( 0.000 2.047 -0.000) 2.047 22.577 ( 0.000 -2.280 0.000) 2.280 22.664 ( 0.000 -0.270 -0.000) 0.270 22.708 ( 0.000 -2.325 0.000) 2.325 23.852 ( 0.000 9.779 0.000) 9.779 23.890 ( 0.000 12.388 0.000) 12.388 23.936 ( 0.000 5.508 -0.000) 5.508 24.115 ( 0.000 3.621 0.000) 3.621 24.614 ( 0.000 6.569 0.000) 6.569 24.705 ( 0.000 -0.264 -0.000) 0.264 24.818 ( 0.000 6.566 -0.000) 6.566 24.967 ( 0.000 -1.015 0.000) 1.015 26.792 ( 0.000 -2.557 -0.000) 2.557 26.863 ( 0.000 -5.876 0.000) 5.876 26.879 ( 0.000 -3.163 0.000) 3.163 26.932 ( 0.000 -5.204 0.000) 5.204 27.188 ( 0.000 0.596 -0.000) 0.596 27.227 ( 0.000 -1.340 -0.000) 1.340 27.292 ( 0.000 0.554 -0.000) 0.554 27.397 ( 0.000 -4.926 -0.000) 4.926 27.858 ( 0.000 0.460 0.000) 0.460 27.924 ( 0.000 -2.507 0.000) 2.507 28.325 ( 0.000 2.032 0.000) 2.032 28.374 ( 0.000 -0.332 -0.000) 0.332 28.597 ( 0.000 6.008 -0.000) 6.008 28.683 ( 0.000 0.787 -0.000) 0.787 29.100 ( 0.000 4.974 -0.000) 4.974 29.137 ( 0.000 1.334 0.000) 1.334 29.183 ( 0.000 1.853 0.000) 1.853 29.262 ( 0.000 -4.156 -0.000) 4.156 29.791 ( 0.000 3.832 0.000) 3.832 29.849 ( 0.000 2.139 -0.000) 2.139 30.615 ( 0.000 1.003 -0.000) 1.003 30.651 ( -0.000 -0.200 0.000) 0.200 30.925 ( 0.000 3.507 0.000) 3.507 30.947 ( 0.000 2.851 -0.000) 2.851 33.848 ( 0.000 0.090 -0.000) 0.090 33.853 ( 0.000 -0.352 0.000) 0.352 33.950 ( 0.000 0.523 0.000) 0.523 33.991 ( 0.000 -1.379 -0.000) 1.379 37.230 ( 0.000 -0.734 -0.000) 0.734 37.237 ( 0.000 -1.251 -0.000) 1.251 37.271 ( 0.000 0.133 0.000) 0.133 37.330 ( 0.000 -2.117 0.000) 2.117 37.716 ( 0.000 3.630 0.000) 3.630 37.766 ( 0.000 2.257 0.000) 2.257 37.806 ( 0.000 -1.166 0.000) 1.166 37.847 ( 0.000 -1.538 0.000) 1.538 49.177 ( 0.000 -0.924 0.000) 0.924 49.288 ( 0.000 -5.890 -0.000) 5.890 49.378 ( 0.000 1.091 0.000) 1.091 49.536 ( 0.000 -6.480 -0.000) 6.480 50.561 ( 0.000 0.622 0.000) 0.622 50.625 ( 0.000 -2.480 -0.000) 2.480 50.631 ( -0.000 1.128 0.000) 1.128 50.766 ( 0.000 -4.536 0.000) 4.536 51.997 ( 0.000 6.353 0.000) 6.353 52.092 ( 0.000 8.615 -0.000) 8.615 52.262 ( 0.000 -6.203 0.000) 6.203 52.518 ( 0.000 -11.489 0.000) 11.489 52.605 ( 0.000 8.167 0.000) 8.167 52.684 ( 0.000 9.830 0.000) 9.830 52.984 ( 0.000 -8.936 0.000) 8.936 53.123 ( 0.000 -10.374 0.000) 10.374 53.900 ( 0.000 0.239 0.000) 0.239 53.914 ( 0.000 -0.383 0.000) 0.383 54.080 ( 0.000 2.277 0.000) 2.277 54.214 ( 0.000 -3.866 -0.000) 3.866 55.770 ( -0.000 -0.192 0.000) 0.192 55.785 ( 0.000 -0.553 0.000) 0.553 55.893 ( 0.000 0.055 0.000) 0.055 55.976 ( 0.000 -4.448 -0.000) 4.448 57.690 ( 0.000 7.700 0.000) 7.700 57.706 ( 0.000 6.404 -0.000) 6.404 57.803 ( 0.000 9.035 -0.000) 9.035 57.960 ( 0.000 7.150 -0.000) 7.150 58.055 ( 0.000 -2.536 -0.000) 2.536 58.139 ( 0.000 -7.459 0.000) 7.459 58.228 ( 0.000 -4.123 -0.000) 4.123 58.327 ( 0.000 -11.401 -0.000) 11.401 61.050 ( 0.000 2.127 -0.000) 2.127 61.062 ( -0.000 1.631 -0.000) 1.631 61.071 ( 0.000 2.175 0.000) 2.175 61.088 ( 0.000 1.679 0.000) 1.679 ======================= Grid point 36 (21/90) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.083 ( 0.000 -12.035 0.000) 12.035 3.083 ( 0.000 12.035 0.000) 12.035 3.657 ( 0.000 -15.581 0.000) 15.581 3.657 ( 0.000 15.581 0.000) 15.581 3.848 ( 0.000 -22.946 0.000) 22.946 3.848 ( 0.000 22.946 0.000) 22.946 4.040 ( 0.000 -27.876 0.000) 27.876 4.040 ( 0.000 27.876 0.000) 27.876 4.457 ( 0.000 -21.315 0.000) 21.315 4.457 ( 0.000 21.315 0.000) 21.315 5.105 ( 0.000 -16.636 0.000) 16.636 5.105 ( 0.000 16.636 0.000) 16.636 5.353 ( 0.000 -18.205 0.000) 18.205 5.353 ( 0.000 18.205 0.000) 18.205 5.494 ( 0.000 -8.373 0.000) 8.373 5.494 ( 0.000 8.373 0.000) 8.373 5.693 ( 0.000 -2.943 0.000) 2.943 5.693 ( 0.000 2.943 0.000) 2.943 6.304 ( 0.000 -0.890 0.000) 0.890 6.304 ( 0.000 0.890 0.000) 0.890 6.429 ( 0.000 -7.762 0.000) 7.762 6.429 ( 0.000 7.762 0.000) 7.762 6.637 ( 0.000 -1.522 0.000) 1.522 6.637 ( 0.000 1.522 0.000) 1.522 7.137 ( 0.000 -7.179 0.000) 7.179 7.137 ( 0.000 7.179 0.000) 7.179 7.337 ( 0.000 -3.312 0.000) 3.312 7.337 ( 0.000 3.312 0.000) 3.312 7.552 ( 0.000 -5.580 0.000) 5.580 7.552 ( 0.000 5.580 0.000) 5.580 7.797 ( 0.000 -0.352 0.000) 0.352 7.797 ( 0.000 0.352 0.000) 0.352 8.066 ( 0.000 -0.344 0.000) 0.344 8.066 ( 0.000 0.344 0.000) 0.344 8.379 ( 0.000 -6.426 0.000) 6.426 8.379 ( 0.000 6.426 0.000) 6.426 8.515 ( 0.000 -22.329 0.000) 22.329 8.515 ( 0.000 22.329 0.000) 22.329 8.659 ( 0.000 -1.875 0.000) 1.875 8.659 ( 0.000 1.875 0.000) 1.875 8.824 ( 0.000 -19.175 0.000) 19.175 8.824 ( 0.000 19.175 0.000) 19.175 9.152 ( 0.000 -4.203 0.000) 4.203 9.152 ( 0.000 4.203 0.000) 4.203 9.340 ( 0.000 -30.566 0.000) 30.566 9.340 ( 0.000 30.566 0.000) 30.566 9.376 ( 0.000 -3.970 0.000) 3.970 9.376 ( 0.000 3.970 0.000) 3.970 9.923 ( 0.000 -18.446 0.000) 18.446 9.923 ( 0.000 18.446 0.000) 18.446 10.183 ( 0.000 -1.376 0.000) 1.376 10.183 ( 0.000 1.376 0.000) 1.376 10.625 ( 0.000 -6.052 0.000) 6.052 10.625 ( 0.000 6.052 0.000) 6.052 10.725 ( 0.000 -16.501 0.000) 16.501 10.725 ( 0.000 16.501 0.000) 16.501 11.067 ( 0.000 -3.321 0.000) 3.321 11.067 ( 0.000 3.321 0.000) 3.321 11.337 ( 0.000 -11.505 0.000) 11.505 11.337 ( 0.000 11.505 0.000) 11.505 11.912 ( 0.000 -10.880 0.000) 10.880 11.912 ( 0.000 10.880 0.000) 10.880 12.086 ( 0.000 -4.506 0.000) 4.506 12.086 ( 0.000 4.506 0.000) 4.506 12.400 ( 0.000 -2.304 0.000) 2.304 12.400 ( 0.000 2.304 0.000) 2.304 12.497 ( 0.000 -5.902 0.000) 5.902 12.497 ( 0.000 5.902 0.000) 5.902 12.825 ( 0.000 -9.454 0.000) 9.454 12.825 ( 0.000 9.454 0.000) 9.454 13.066 ( 0.000 -3.421 0.000) 3.421 13.066 ( 0.000 3.421 0.000) 3.421 13.256 ( 0.000 -7.105 0.000) 7.105 13.256 ( 0.000 7.105 0.000) 7.105 13.369 ( 0.000 -0.506 0.000) 0.506 13.369 ( 0.000 0.506 0.000) 0.506 14.088 ( 0.000 -3.639 0.000) 3.639 14.088 ( 0.000 3.639 0.000) 3.639 14.279 ( 0.000 -0.623 0.000) 0.623 14.279 ( 0.000 0.623 0.000) 0.623 16.101 ( 0.000 -0.711 0.000) 0.711 16.101 ( 0.000 0.711 0.000) 0.711 16.216 ( 0.000 -1.746 0.000) 1.746 16.216 ( 0.000 1.746 0.000) 1.746 18.380 ( 0.000 -0.161 0.000) 0.161 18.380 ( 0.000 0.161 0.000) 0.161 19.107 ( 0.000 -1.170 0.000) 1.170 19.107 ( 0.000 1.170 0.000) 1.170 20.272 ( 0.000 -1.401 0.000) 1.401 20.272 ( 0.000 1.401 0.000) 1.401 20.755 ( 0.000 -0.906 0.000) 0.906 20.755 ( 0.000 0.906 0.000) 0.906 20.888 ( 0.000 -11.284 0.000) 11.284 20.888 ( 0.000 11.284 0.000) 11.284 20.928 ( 0.000 -8.013 0.000) 8.013 20.928 ( 0.000 8.013 0.000) 8.013 22.478 ( 0.000 -0.557 0.000) 0.557 22.478 ( 0.000 0.557 0.000) 0.557 22.686 ( 0.000 -0.723 0.000) 0.723 22.686 ( 0.000 0.723 0.000) 0.723 24.550 ( 0.000 -3.032 0.000) 3.032 24.550 ( 0.000 3.032 0.000) 3.032 24.752 ( 0.000 -0.290 0.000) 0.290 24.752 ( 0.000 0.290 0.000) 0.290 24.876 ( 0.000 -9.031 0.000) 9.031 24.876 ( 0.000 9.031 0.000) 9.031 25.147 ( 0.000 -9.567 0.000) 9.567 25.147 ( 0.000 9.567 0.000) 9.567 26.731 ( 0.000 -0.020 0.000) 0.020 26.731 ( 0.000 0.020 0.000) 0.020 26.920 ( 0.000 -1.698 0.000) 1.698 26.920 ( 0.000 1.698 0.000) 1.698 27.202 ( 0.000 -0.101 0.000) 0.101 27.202 ( 0.000 0.101 0.000) 0.101 27.260 ( 0.000 -5.181 0.000) 5.181 27.260 ( 0.000 5.181 0.000) 5.181 28.028 ( 0.000 -1.298 0.000) 1.298 28.028 ( 0.000 1.298 0.000) 1.298 28.433 ( 0.000 -3.978 0.000) 3.978 28.433 ( 0.000 3.978 0.000) 3.978 28.652 ( 0.000 -0.930 0.000) 0.930 28.652 ( 0.000 0.930 0.000) 0.930 28.800 ( 0.000 -4.042 0.000) 4.042 28.800 ( 0.000 4.042 0.000) 4.042 29.132 ( 0.000 -3.152 0.000) 3.152 29.132 ( 0.000 3.152 0.000) 3.152 29.631 ( 0.000 -2.613 0.000) 2.613 29.631 ( 0.000 2.613 0.000) 2.613 30.741 ( 0.000 -2.378 0.000) 2.378 30.741 ( 0.000 2.378 0.000) 2.378 31.212 ( 0.000 -4.727 0.000) 4.727 31.212 ( 0.000 4.727 0.000) 4.727 33.928 ( 0.000 -1.118 0.000) 1.118 33.928 ( 0.000 1.118 0.000) 1.118 33.963 ( 0.000 -0.206 0.000) 0.206 33.963 ( 0.000 0.206 0.000) 0.206 37.147 ( 0.000 -1.091 0.000) 1.091 37.147 ( 0.000 1.091 0.000) 1.091 37.173 ( 0.000 -1.445 0.000) 1.445 37.173 ( 0.000 1.445 0.000) 1.445 37.751 ( 0.000 -0.971 0.000) 0.971 37.751 ( 0.000 0.971 0.000) 0.971 37.781 ( 0.000 -1.107 0.000) 1.107 37.781 ( 0.000 1.107 0.000) 1.107 48.800 ( 0.000 -1.184 0.000) 1.184 48.800 ( 0.000 1.184 0.000) 1.184 48.848 ( 0.000 -0.781 0.000) 0.781 48.848 ( 0.000 0.781 0.000) 0.781 50.485 ( 0.000 -0.191 0.000) 0.191 50.485 ( 0.000 0.191 0.000) 0.191 50.790 ( 0.000 -7.513 0.000) 7.513 50.790 ( 0.000 7.513 0.000) 7.513 52.188 ( 0.000 -7.785 0.000) 7.785 52.188 ( 0.000 7.785 0.000) 7.785 52.239 ( 0.000 -7.194 0.000) 7.194 52.239 ( 0.000 7.194 0.000) 7.194 52.706 ( 0.000 -7.564 0.000) 7.564 52.706 ( 0.000 7.564 0.000) 7.564 52.796 ( 0.000 -8.907 0.000) 8.907 52.796 ( 0.000 8.907 0.000) 8.907 53.863 ( 0.000 -0.314 0.000) 0.314 53.863 ( 0.000 0.314 0.000) 0.314 54.195 ( 0.000 -2.018 0.000) 2.018 54.195 ( 0.000 2.018 0.000) 2.018 55.795 ( 0.000 -2.429 0.000) 2.429 55.795 ( 0.000 2.429 0.000) 2.429 55.979 ( 0.000 -6.287 0.000) 6.287 55.979 ( 0.000 6.287 0.000) 6.287 57.785 ( 0.000 -4.471 0.000) 4.471 57.785 ( 0.000 4.471 0.000) 4.471 57.955 ( 0.000 -7.684 0.000) 7.684 57.955 ( 0.000 7.684 0.000) 7.684 58.098 ( 0.000 -1.912 0.000) 1.912 58.098 ( 0.000 1.912 0.000) 1.912 58.385 ( 0.000 -2.762 0.000) 2.762 58.385 ( 0.000 2.762 0.000) 2.762 61.020 ( 0.000 -0.150 0.000) 0.150 61.020 ( 0.000 0.150 0.000) 0.150 61.354 ( 0.000 -4.229 0.000) 4.229 61.354 ( 0.000 4.229 0.000) 4.229 ======================= Grid point 38 (22/90) ======================= q-point: ( 0.12 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.988 ( -7.936 -1.300 4.990) 9.464 2.988 ( -7.936 1.300 4.990) 9.464 3.641 ( -0.862 -11.350 -6.524) 13.120 3.641 ( -0.862 11.350 -6.524) 13.120 3.899 ( 5.888 -24.714 9.376) 27.081 3.899 ( 5.888 24.714 9.376) 27.081 4.181 ( 10.846 -19.953 -2.556) 22.854 4.181 ( 10.846 19.953 -2.556) 22.854 4.592 ( 10.796 -18.825 3.673) 22.009 4.592 ( 10.796 18.825 3.673) 22.009 5.124 ( 1.190 -13.446 -4.902) 14.361 5.124 ( 1.190 13.446 -4.902) 14.361 5.376 ( -0.029 -13.200 1.180) 13.253 5.376 ( -0.029 13.200 1.180) 13.253 5.488 ( 1.466 -12.902 1.752) 13.103 5.488 ( 1.466 12.902 1.752) 13.103 5.744 ( 7.495 -4.566 -8.160) 11.983 5.744 ( 7.495 4.566 -8.160) 11.983 6.304 ( -0.853 -3.953 4.212) 5.839 6.304 ( -0.853 3.953 4.212) 5.839 6.492 ( 1.925 -7.512 7.956) 11.110 6.492 ( 1.925 7.512 7.956) 11.110 6.641 ( 2.922 -0.743 -4.347) 5.290 6.641 ( 2.922 0.743 -4.347) 5.290 7.152 ( 1.215 -6.008 -3.431) 7.025 7.152 ( 1.215 6.008 -3.431) 7.025 7.375 ( 1.835 -15.330 -3.688) 15.874 7.375 ( 1.835 15.330 -3.688) 15.874 7.544 ( 1.496 -7.578 0.023) 7.725 7.544 ( 1.496 7.578 0.023) 7.725 7.772 ( -2.912 -2.400 0.199) 3.779 7.772 ( -2.912 2.400 0.199) 3.779 8.061 ( 0.356 -8.211 -1.836) 8.422 8.061 ( 0.356 8.211 -1.836) 8.422 8.389 ( 0.487 -10.545 2.475) 10.842 8.389 ( 0.487 10.545 2.475) 10.842 8.546 ( 3.589 -15.311 -7.119) 17.262 8.546 ( 3.589 15.311 -7.119) 17.262 8.681 ( 1.109 -6.212 7.735) 9.982 8.681 ( 1.109 6.212 7.735) 9.982 8.844 ( 2.994 -15.016 -3.454) 15.696 8.844 ( 2.994 15.016 -3.454) 15.696 9.113 ( -2.523 -8.461 6.591) 11.018 9.113 ( -2.523 8.461 6.591) 11.018 9.354 ( 3.539 -17.694 5.998) 19.015 9.354 ( 3.539 17.694 5.998) 19.015 9.539 ( 10.628 -15.266 -4.682) 19.182 9.539 ( 10.628 15.266 -4.682) 19.182 9.935 ( 1.752 -16.352 -3.919) 16.906 9.935 ( 1.752 16.352 -3.919) 16.906 10.214 ( 2.395 -4.351 1.254) 5.122 10.214 ( 2.395 4.351 1.254) 5.122 10.590 ( -2.022 -5.673 -2.075) 6.370 10.590 ( -2.022 5.673 -2.075) 6.370 10.767 ( 2.447 -14.767 2.344) 15.151 10.767 ( 2.447 14.767 2.344) 15.151 11.149 ( 6.090 -6.222 0.029) 8.706 11.149 ( 6.090 6.222 0.029) 8.706 11.300 ( -2.224 -11.330 -0.225) 11.549 11.300 ( -2.224 11.330 -0.225) 11.549 11.844 ( -4.637 -7.316 0.488) 8.675 11.844 ( -4.637 7.316 0.488) 8.675 12.108 ( -0.208 -1.694 0.100) 1.710 12.108 ( -0.208 1.694 0.100) 1.710 12.358 ( -3.515 -3.190 -1.009) 4.853 12.358 ( -3.515 3.190 -1.009) 4.853 12.502 ( 0.575 -4.684 -0.089) 4.720 12.502 ( 0.575 4.684 -0.089) 4.720 12.756 ( -5.799 -6.570 0.802) 8.800 12.756 ( -5.799 6.570 0.802) 8.800 13.052 ( -1.270 -3.430 -0.559) 3.700 13.052 ( -1.270 3.430 -0.559) 3.700 13.251 ( -0.636 -8.554 0.182) 8.579 13.251 ( -0.636 8.554 0.182) 8.579 13.358 ( -0.869 -3.948 -0.346) 4.057 13.358 ( -0.869 3.948 -0.346) 4.057 14.053 ( -3.380 -4.627 0.159) 5.733 14.053 ( -3.380 4.627 0.159) 5.733 14.234 ( -4.153 -2.923 0.287) 5.087 14.234 ( -4.153 2.923 0.287) 5.087 16.024 ( -3.630 -4.228 -0.110) 5.574 16.024 ( -3.630 4.228 -0.110) 5.574 16.364 ( 9.998 -3.180 -0.072) 10.492 16.364 ( 9.998 3.180 -0.072) 10.492 18.396 ( 1.643 -0.286 -0.172) 1.676 18.396 ( 1.643 0.286 -0.172) 1.676 19.077 ( -2.992 -0.937 0.519) 3.178 19.077 ( -2.992 0.937 0.519) 3.178 20.271 ( 0.095 -1.277 -0.367) 1.332 20.271 ( 0.095 1.277 -0.367) 1.332 20.707 ( -3.545 -1.807 0.181) 3.983 20.707 ( -3.545 1.807 0.181) 3.983 20.913 ( 2.020 -11.000 -0.746) 11.209 20.913 ( 2.020 11.000 -0.746) 11.209 20.971 ( 3.294 -9.044 0.599) 9.643 20.971 ( 3.294 9.044 0.599) 9.643 22.489 ( 0.942 -0.016 -0.005) 0.943 22.489 ( 0.942 0.016 -0.005) 0.943 22.683 ( -0.292 -0.854 0.005) 0.903 22.683 ( -0.292 0.854 0.005) 0.903 24.489 ( -6.583 -4.521 -0.640) 8.011 24.489 ( -6.583 4.521 -0.640) 8.011 24.687 ( -5.002 -6.488 1.893) 8.408 24.687 ( -5.002 6.488 1.893) 8.408 24.854 ( -3.464 -7.483 -3.019) 8.781 24.854 ( -3.464 7.483 -3.019) 8.781 25.032 ( -8.355 -9.164 1.963) 12.555 25.032 ( -8.355 9.164 1.963) 12.555 26.747 ( 1.361 -0.289 -0.365) 1.439 26.747 ( 1.361 0.289 -0.365) 1.439 26.926 ( 0.043 -2.442 0.593) 2.513 26.926 ( 0.043 2.442 0.593) 2.513 27.177 ( -1.574 -1.299 1.090) 2.314 27.177 ( -1.574 1.299 1.090) 2.314 27.275 ( 1.049 -2.632 -1.424) 3.171 27.275 ( 1.049 2.632 -1.424) 3.171 27.993 ( -2.777 -1.065 0.076) 2.975 27.993 ( -2.777 1.065 0.076) 2.975 28.451 ( 0.739 -3.580 -1.117) 3.822 28.451 ( 0.739 3.580 -1.117) 3.822 28.647 ( 0.544 -0.682 1.003) 1.329 28.647 ( 0.544 0.682 1.003) 1.329 28.867 ( 4.484 -4.795 2.303) 6.957 28.867 ( 4.484 4.795 2.303) 6.957 29.129 ( 0.644 -1.863 -1.996) 2.805 29.129 ( 0.644 1.863 -1.996) 2.805 29.667 ( 3.223 -4.755 -0.303) 5.753 29.667 ( 3.223 4.755 -0.303) 5.753 30.735 ( -0.727 -2.027 0.472) 2.204 30.735 ( -0.727 2.027 0.472) 2.204 31.161 ( -4.301 -3.637 -0.967) 5.715 31.161 ( -4.301 3.637 -0.967) 5.715 33.910 ( -1.385 -0.668 -0.029) 1.538 33.910 ( -1.385 0.668 -0.029) 1.538 33.965 ( 0.112 -0.728 -0.026) 0.737 33.965 ( 0.112 0.728 -0.026) 0.737 37.161 ( 1.162 -1.148 0.034) 1.634 37.161 ( 1.162 1.148 0.034) 1.634 37.190 ( 1.618 -1.357 0.036) 2.112 37.190 ( 1.618 1.357 0.036) 2.112 37.754 ( 0.281 -1.412 0.021) 1.440 37.754 ( 0.281 1.412 0.021) 1.440 37.786 ( 0.432 -1.091 0.021) 1.174 37.786 ( 0.432 1.091 0.021) 1.174 48.852 ( 5.105 -0.295 0.066) 5.114 48.852 ( 5.105 0.295 0.066) 5.114 48.951 ( 8.673 -1.348 -0.141) 8.778 48.951 ( 8.673 1.348 -0.141) 8.778 50.506 ( 1.513 -0.977 2.270) 2.898 50.506 ( 1.513 0.977 2.270) 2.898 50.770 ( -1.510 -6.781 -1.694) 7.151 50.770 ( -1.510 6.781 -1.694) 7.151 52.175 ( -0.899 -4.720 -0.713) 4.857 52.175 ( -0.899 4.720 -0.713) 4.857 52.248 ( 0.544 -3.841 0.857) 3.973 52.248 ( 0.544 3.841 0.857) 3.973 52.719 ( 1.117 -7.377 0.440) 7.474 52.719 ( 1.117 7.377 0.440) 7.474 52.815 ( 1.723 -8.590 -0.567) 8.780 52.815 ( 1.723 8.590 -0.567) 8.780 53.869 ( 0.607 -0.468 -0.192) 0.790 53.869 ( 0.607 0.468 -0.192) 0.790 54.188 ( -0.705 -2.148 0.015) 2.261 54.188 ( -0.705 2.148 0.015) 2.261 55.791 ( -0.316 -2.374 -0.301) 2.414 55.791 ( -0.316 2.374 -0.301) 2.414 55.969 ( -0.877 -5.841 0.308) 5.915 55.969 ( -0.877 5.841 0.308) 5.915 57.786 ( 0.010 -4.085 0.276) 4.094 57.786 ( 0.010 4.085 0.276) 4.094 57.949 ( -0.297 -6.529 -1.328) 6.669 57.949 ( -0.297 6.529 -1.328) 6.669 58.097 ( -0.342 -2.676 1.709) 3.194 58.097 ( -0.342 2.676 1.709) 3.194 58.353 ( -2.811 -1.654 -0.662) 3.328 58.353 ( -2.811 1.654 -0.662) 3.328 61.021 ( 0.091 -0.265 0.144) 0.315 61.021 ( 0.091 0.265 0.144) 0.315 61.319 ( -3.092 -3.337 -0.249) 4.556 61.319 ( -3.092 3.337 -0.249) 4.556 ======================= Grid point 40 (23/90) ======================= q-point: ( 0.25 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 82 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.870 ( -3.918 -7.383 9.066) 12.331 2.870 ( -3.918 7.383 9.066) 12.331 3.570 ( -3.575 -4.239 -9.721) 11.191 3.570 ( -3.575 4.239 -9.721) 11.191 4.162 ( 15.366 -26.491 12.786) 33.187 4.162 ( 15.366 26.491 12.786) 33.187 4.410 ( 10.273 -11.806 -1.757) 15.748 4.410 ( 10.273 11.806 -1.757) 15.748 4.828 ( 8.357 -12.730 0.323) 15.231 4.828 ( 8.357 12.730 0.323) 15.231 5.081 ( -0.577 -3.071 -5.403) 6.241 5.081 ( -0.577 3.071 -5.403) 6.241 5.455 ( 5.665 -11.843 -4.322) 13.822 5.455 ( 5.665 11.843 -4.322) 13.822 5.527 ( 3.309 -11.286 8.178) 14.325 5.527 ( 3.309 11.286 8.178) 14.325 5.964 ( 11.266 -6.696 -3.079) 13.462 5.964 ( 11.266 6.696 -3.079) 13.462 6.290 ( 0.492 -6.190 0.474) 6.228 6.290 ( 0.492 6.190 0.474) 6.228 6.438 ( -6.667 -4.212 -0.301) 7.892 6.438 ( -6.667 4.212 -0.301) 7.892 6.763 ( 4.577 -1.354 -0.771) 4.835 6.763 ( 4.577 1.354 -0.771) 4.835 7.107 ( -3.084 -10.513 -3.591) 11.530 7.107 ( -3.084 10.513 -3.591) 11.530 7.419 ( 3.964 -5.590 -1.897) 7.110 7.419 ( 3.964 5.590 -1.897) 7.110 7.637 ( 4.819 -8.314 5.110) 10.883 7.637 ( 4.819 8.314 5.110) 10.883 7.659 ( -6.226 -1.136 -4.927) 8.020 7.659 ( -6.226 1.136 -4.927) 8.020 8.106 ( 4.628 -11.925 -2.381) 13.011 8.106 ( 4.628 11.925 -2.381) 13.011 8.414 ( 1.382 -8.617 2.358) 9.040 8.414 ( 1.382 8.617 2.358) 9.040 8.605 ( 3.612 -4.019 -9.348) 10.797 8.605 ( 3.612 4.019 -9.348) 10.797 8.738 ( 1.955 -9.231 6.822) 11.644 8.738 ( 1.955 9.231 6.822) 11.644 8.948 ( 7.244 -6.102 -1.521) 9.593 8.948 ( 7.244 6.102 -1.521) 9.593 9.142 ( 3.953 -12.336 9.009) 15.779 9.142 ( 3.953 12.336 9.009) 15.779 9.491 ( 7.374 -14.126 6.745) 17.304 9.491 ( 7.374 14.126 6.745) 17.304 9.746 ( 9.679 -13.632 -3.301) 17.041 9.746 ( 9.679 13.632 -3.301) 17.041 9.974 ( 3.086 -9.049 -6.262) 11.429 9.974 ( 3.086 9.049 -6.262) 11.429 10.269 ( 2.091 -5.088 1.605) 5.731 10.269 ( 2.091 5.088 1.605) 5.731 10.539 ( -2.885 -7.062 -0.360) 7.637 10.539 ( -2.885 7.062 -0.360) 7.637 10.811 ( 0.657 -14.813 1.858) 14.943 10.811 ( 0.657 14.813 1.858) 14.943 11.139 ( -4.172 -12.956 -2.792) 13.894 11.139 ( -4.172 12.956 -2.792) 13.894 11.391 ( 7.764 -11.333 0.786) 13.760 11.391 ( 7.764 11.333 0.786) 13.760 11.763 ( -3.035 -4.241 2.025) 5.594 11.763 ( -3.035 4.241 2.025) 5.594 12.035 ( -6.106 -5.797 -0.888) 8.466 12.035 ( -6.106 5.797 -0.888) 8.466 12.277 ( -3.869 -3.802 -0.320) 5.434 12.277 ( -3.869 3.802 -0.320) 5.434 12.478 ( -3.846 -9.446 -1.662) 10.334 12.478 ( -3.846 9.446 -1.662) 10.334 12.662 ( -1.516 -2.934 1.442) 3.603 12.662 ( -1.516 2.934 1.442) 3.603 13.011 ( -2.585 -5.883 -0.626) 6.456 13.011 ( -2.585 5.883 -0.626) 6.456 13.230 ( -1.066 -8.733 0.061) 8.798 13.230 ( -1.066 8.733 0.061) 8.798 13.334 ( -1.278 -4.636 -0.123) 4.810 13.334 ( -1.278 4.636 -0.123) 4.810 13.953 ( -5.879 -6.705 0.318) 8.923 13.953 ( -5.879 6.705 0.318) 8.923 14.119 ( -6.595 -4.498 0.294) 7.988 14.119 ( -6.595 4.498 0.294) 7.988 15.976 ( -1.092 -4.544 -0.166) 4.677 15.976 ( -1.092 4.544 -0.166) 4.677 16.578 ( 9.802 -1.989 -0.149) 10.003 16.578 ( 9.802 1.989 -0.149) 10.003 18.453 ( 3.909 -0.707 -0.155) 3.976 18.453 ( 3.909 0.707 -0.155) 3.976 18.988 ( -5.561 -0.633 0.675) 5.637 18.988 ( -5.561 0.633 0.675) 5.637 20.283 ( 1.382 -0.755 -0.419) 1.629 20.283 ( 1.382 0.755 -0.419) 1.629 20.629 ( -3.842 -1.905 -0.020) 4.288 20.629 ( -3.842 1.905 -0.020) 4.288 20.963 ( 2.732 -12.111 -0.457) 12.424 20.963 ( 2.732 12.111 -0.457) 12.424 21.044 ( 3.314 -11.530 0.494) 12.007 21.044 ( 3.314 11.530 0.494) 12.007 22.511 ( 1.017 -1.126 -0.054) 1.518 22.511 ( 1.017 1.126 -0.054) 1.518 22.676 ( -0.325 -1.057 0.036) 1.107 22.676 ( -0.325 1.057 0.036) 1.107 24.280 ( -11.737 -6.175 -0.499) 13.271 24.280 ( -11.737 6.175 -0.499) 13.271 24.513 ( -13.906 -0.549 -0.315) 13.921 24.513 ( -13.906 0.549 -0.315) 13.921 24.728 ( -3.709 -1.940 1.752) 4.538 24.728 ( -3.709 1.940 1.752) 4.538 24.944 ( -1.278 -2.081 -0.760) 2.558 24.944 ( -1.278 2.081 -0.760) 2.558 26.775 ( 1.164 -0.984 -0.573) 1.629 26.775 ( 1.164 0.984 -0.573) 1.629 26.908 ( -1.853 -3.126 0.763) 3.713 26.908 ( -1.853 3.126 0.763) 3.713 27.168 ( 0.480 -0.148 0.918) 1.046 27.168 ( 0.480 0.148 0.918) 1.046 27.292 ( 1.030 -1.698 -1.070) 2.256 27.292 ( 1.030 1.698 -1.070) 2.256 27.935 ( -2.435 -1.052 -0.101) 2.654 27.935 ( -2.435 1.052 -0.101) 2.654 28.432 ( -2.048 -2.137 -0.355) 2.981 28.432 ( -2.048 2.137 -0.355) 2.981 28.671 ( 0.857 -0.378 -0.554) 1.088 28.671 ( 0.857 0.378 -0.554) 1.088 28.975 ( 5.154 -2.610 3.847) 6.941 28.975 ( 5.154 2.610 3.847) 6.941 29.163 ( 2.862 -2.793 -2.824) 4.896 29.163 ( 2.862 2.793 -2.824) 4.896 29.746 ( 4.024 -5.361 -0.260) 6.708 29.746 ( 4.024 5.361 -0.260) 6.708 30.708 ( -1.973 -1.660 0.469) 2.621 30.708 ( -1.973 1.660 0.469) 2.621 31.060 ( -4.343 -2.056 -0.844) 4.878 31.060 ( -4.343 2.056 -0.844) 4.878 33.880 ( -1.368 -0.220 -0.062) 1.387 33.880 ( -1.368 0.220 -0.062) 1.387 33.966 ( -0.000 -1.024 0.036) 1.025 33.966 ( -0.000 1.024 0.036) 1.025 37.188 ( 1.320 -0.934 -0.124) 1.622 37.188 ( 1.320 0.934 -0.124) 1.622 37.234 ( 2.250 -1.488 0.135) 2.701 37.234 ( 2.250 1.488 0.135) 2.701 37.762 ( 0.448 -1.873 0.069) 1.927 37.762 ( 0.448 1.873 0.069) 1.927 37.797 ( 0.532 -1.346 -0.004) 1.447 37.797 ( 0.532 1.346 -0.004) 1.447 48.993 ( 7.631 -1.421 0.076) 7.762 48.993 ( 7.631 1.421 0.076) 7.762 49.163 ( 10.623 -3.321 -0.299) 11.134 49.163 ( 10.623 3.321 -0.299) 11.134 50.548 ( 1.504 -1.957 2.813) 3.742 50.548 ( 1.504 1.957 2.813) 3.742 50.728 ( -1.760 -5.269 -2.117) 5.945 50.728 ( -1.760 5.269 -2.117) 5.945 52.153 ( -0.882 -4.307 -0.795) 4.468 52.153 ( -0.882 4.307 -0.795) 4.468 52.263 ( 0.641 -5.238 1.112) 5.393 52.263 ( 0.641 5.238 1.112) 5.393 52.750 ( 1.563 -7.631 0.713) 7.822 52.750 ( 1.563 7.631 0.713) 7.822 52.855 ( 2.082 -8.745 -0.914) 9.036 52.855 ( 2.082 8.745 -0.914) 9.036 53.885 ( 0.874 -0.745 -0.356) 1.202 53.885 ( 0.874 0.745 -0.356) 1.202 54.168 ( -1.079 -2.550 0.085) 2.770 54.168 ( -1.079 2.550 0.085) 2.770 55.782 ( -0.352 -2.080 -0.440) 2.155 55.782 ( -0.352 2.080 -0.440) 2.155 55.946 ( -1.326 -4.643 0.454) 4.850 55.946 ( -1.326 4.643 0.454) 4.850 57.787 ( 0.070 -2.927 0.215) 2.935 57.787 ( 0.070 2.927 0.215) 2.935 57.942 ( 0.094 -4.880 -1.240) 5.036 57.942 ( 0.094 4.880 -1.240) 5.036 58.091 ( -0.776 -3.895 2.049) 4.469 58.091 ( -0.776 3.895 2.049) 4.469 58.276 ( -3.995 -0.994 -1.037) 4.245 58.276 ( -3.995 0.994 -1.037) 4.245 61.027 ( 0.513 -0.411 0.165) 0.678 61.027 ( 0.513 0.411 0.165) 0.678 61.239 ( -4.204 -1.714 -0.265) 4.547 61.239 ( -4.204 1.714 -0.265) 4.547 ======================= Grid point 42 (24/90) ======================= q-point: ( 0.38 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.873 ( 1.003 -5.196 7.476) 9.159 2.873 ( 1.003 5.196 7.476) 9.159 3.464 ( -3.554 -1.033 -7.235) 8.126 3.464 ( -3.554 1.033 -7.235) 8.126 4.457 ( 1.717 -10.545 2.927) 11.078 4.457 ( 1.717 10.545 2.927) 11.078 4.610 ( 15.610 -19.860 4.051) 25.583 4.610 ( 15.610 19.860 4.051) 25.583 4.966 ( 8.330 -2.952 1.710) 9.002 4.966 ( 8.330 2.952 1.710) 9.002 5.156 ( 4.184 -4.799 2.000) 6.673 5.156 ( 4.184 4.799 2.000) 6.673 5.434 ( -2.253 -3.613 -8.147) 9.193 5.434 ( -2.253 3.613 -8.147) 9.193 5.746 ( 9.209 -7.140 8.496) 14.421 5.746 ( 9.209 7.140 8.496) 14.421 6.021 ( -1.576 -3.141 -5.769) 6.755 6.021 ( -1.576 3.141 -5.769) 6.755 6.222 ( -10.606 -13.771 -1.436) 17.440 6.222 ( -10.606 13.771 -1.436) 17.440 6.475 ( 11.811 -4.262 -1.609) 12.659 6.475 ( 11.811 4.262 -1.609) 12.659 6.693 ( -7.235 -4.805 -3.137) 9.235 6.693 ( -7.235 4.805 -3.137) 9.235 7.126 ( 2.529 -6.780 3.515) 8.045 7.126 ( 2.529 6.780 3.515) 8.045 7.411 ( -6.890 -8.998 -0.904) 11.369 7.411 ( -6.890 8.998 -0.904) 11.369 7.553 ( 2.322 -9.223 -7.928) 12.382 7.553 ( 2.322 9.223 -7.928) 12.382 7.775 ( 4.382 -9.309 7.325) 12.630 7.775 ( 4.382 9.309 7.325) 12.630 8.212 ( 5.215 -4.278 -0.069) 6.746 8.212 ( 5.215 4.278 -0.069) 6.746 8.457 ( 1.790 -6.950 0.783) 7.219 8.457 ( 1.790 6.950 0.783) 7.219 8.621 ( 0.366 -4.433 -8.077) 9.221 8.621 ( 0.366 4.433 -8.077) 9.221 8.790 ( 1.495 -12.942 3.562) 13.506 8.790 ( 1.495 12.942 3.562) 13.506 9.096 ( 6.296 -6.635 -0.201) 9.149 9.096 ( 6.296 6.635 -0.201) 9.149 9.331 ( 10.646 -7.470 6.640) 14.602 9.331 ( 10.646 7.470 6.640) 14.602 9.679 ( 8.331 -11.153 4.471) 14.621 9.679 ( 8.331 11.153 4.471) 14.621 9.890 ( 3.519 -10.311 -0.813) 10.925 9.890 ( 3.519 10.311 -0.813) 10.925 10.008 ( 1.785 -6.701 -5.907) 9.109 10.008 ( 1.785 6.701 -5.907) 9.109 10.288 ( -1.658 -8.101 -0.071) 8.269 10.288 ( -1.658 8.101 -0.071) 8.269 10.460 ( -3.798 -7.334 0.449) 8.271 10.460 ( -3.798 7.334 0.449) 8.271 10.781 ( -3.640 -2.119 2.371) 4.833 10.781 ( -3.640 2.119 2.371) 4.833 11.133 ( 5.860 -0.818 -1.945) 6.228 11.133 ( 5.860 0.818 -1.945) 6.228 11.472 ( -1.062 -12.191 -0.652) 12.255 11.472 ( -1.062 12.191 -0.652) 12.255 11.737 ( -0.079 -1.752 1.237) 2.147 11.737 ( -0.079 1.752 1.237) 2.147 11.889 ( -7.193 -7.185 0.236) 10.170 11.889 ( -7.193 7.185 0.236) 10.170 12.168 ( -5.869 -2.507 -1.713) 6.607 12.168 ( -5.869 2.507 -1.713) 6.607 12.432 ( 1.608 -4.565 1.831) 5.175 12.432 ( 1.608 4.565 1.831) 5.175 12.660 ( -0.371 -2.069 -1.573) 2.625 12.660 ( -0.371 2.069 -1.573) 2.625 12.942 ( -3.497 -5.781 -0.291) 6.763 12.942 ( -3.497 5.781 -0.291) 6.763 13.229 ( 1.205 -6.830 0.335) 6.944 13.229 ( 1.205 6.830 0.335) 6.944 13.308 ( -1.185 -3.385 0.211) 3.593 13.308 ( -1.185 3.385 0.211) 3.593 13.835 ( -4.759 -8.469 0.412) 9.723 13.835 ( -4.759 8.469 0.412) 9.723 13.981 ( -5.909 -3.796 -0.077) 7.023 13.981 ( -5.909 3.796 -0.077) 7.023 15.967 ( -0.052 -4.862 -0.122) 4.863 15.967 ( -0.052 4.862 -0.122) 4.863 16.748 ( 6.009 -0.787 -0.164) 6.063 16.748 ( 6.009 0.787 -0.164) 6.063 18.558 ( 5.989 -1.221 0.065) 6.113 18.558 ( 5.989 1.221 0.065) 6.113 18.856 ( -6.971 -1.230 0.318) 7.086 18.856 ( -6.971 1.230 0.318) 7.086 20.328 ( 2.840 -0.267 -0.092) 2.854 20.328 ( 2.840 0.267 -0.092) 2.854 20.547 ( -3.923 -2.167 -0.242) 4.489 20.547 ( -3.923 2.167 -0.242) 4.489 21.015 ( 2.098 -13.955 -0.137) 14.112 21.015 ( 2.098 13.955 -0.137) 14.112 21.106 ( 2.320 -14.198 0.263) 14.388 21.106 ( 2.320 14.198 0.263) 14.388 22.525 ( 0.339 -2.105 -0.179) 2.140 22.525 ( 0.339 2.105 -0.179) 2.140 22.672 ( -0.066 -1.099 0.156) 1.112 22.672 ( -0.066 1.099 0.156) 1.112 24.060 ( -7.967 -3.692 -0.297) 8.786 24.060 ( -7.967 3.692 -0.297) 8.786 24.217 ( -11.768 -4.791 0.104) 12.707 24.217 ( -11.768 4.791 0.104) 12.707 24.699 ( -0.481 -1.917 0.915) 2.178 24.699 ( -0.481 1.917 0.915) 2.178 24.928 ( -0.373 -3.470 -0.641) 3.548 24.928 ( -0.373 3.470 -0.641) 3.548 26.786 ( 0.035 -1.517 -0.526) 1.606 26.786 ( 0.035 1.517 -0.526) 1.606 26.872 ( -1.404 -2.337 0.549) 2.781 26.872 ( -1.404 2.337 0.549) 2.781 27.191 ( 1.127 -1.009 0.569) 1.616 27.191 ( 1.127 1.009 0.569) 1.616 27.312 ( 0.890 -2.207 -0.437) 2.419 27.312 ( 0.890 2.207 -0.437) 2.419 27.895 ( -1.356 -1.307 -0.265) 1.902 27.895 ( -1.356 1.307 -0.265) 1.902 28.382 ( -2.217 -1.253 0.282) 2.562 28.382 ( -2.217 1.253 0.282) 2.562 28.676 ( 0.119 -1.295 -1.393) 1.905 28.676 ( 0.119 1.295 -1.393) 1.905 29.094 ( 4.617 -1.589 4.958) 6.958 29.094 ( 4.617 1.589 4.958) 6.958 29.203 ( 1.282 -3.454 -3.781) 5.279 29.203 ( 1.282 3.454 -3.781) 5.279 29.820 ( 2.764 -3.706 -0.104) 4.625 29.820 ( 2.764 3.706 -0.104) 4.625 30.663 ( -2.071 -1.727 0.167) 2.702 30.663 ( -2.071 1.727 0.167) 2.702 30.991 ( -2.050 -0.977 -0.281) 2.288 30.991 ( -2.050 0.977 -0.281) 2.288 33.857 ( -0.737 -0.042 -0.034) 0.739 33.857 ( -0.737 0.042 -0.034) 0.739 33.966 ( -0.011 -1.044 0.034) 1.044 33.966 ( -0.011 1.044 0.034) 1.044 37.212 ( 0.924 -0.471 -0.069) 1.039 37.212 ( 0.924 0.471 -0.069) 1.039 37.274 ( 1.427 -1.585 0.038) 2.133 37.274 ( 1.427 1.585 0.038) 2.133 37.771 ( 0.343 -2.032 0.079) 2.062 37.771 ( 0.343 2.032 0.079) 2.062 37.806 ( 0.329 -1.793 -0.030) 1.824 37.806 ( 0.329 1.793 -0.030) 1.824 49.137 ( 5.389 -2.499 0.043) 5.940 49.137 ( 5.389 2.499 0.043) 5.940 49.353 ( 6.900 -3.911 -0.228) 7.935 49.353 ( 6.900 3.911 -0.228) 7.935 50.576 ( 0.518 -2.004 1.599) 2.616 50.576 ( 0.518 2.004 1.599) 2.616 50.694 ( -0.957 -4.016 -1.224) 4.306 50.694 ( -0.957 4.016 -1.224) 4.306 52.136 ( -0.524 -5.943 -0.590) 5.995 52.136 ( -0.524 5.943 -0.590) 5.995 52.279 ( 0.534 -8.974 0.909) 9.036 52.279 ( 0.534 8.974 0.909) 9.036 52.781 ( 1.057 -8.778 0.568) 8.860 52.781 ( 1.057 8.778 0.568) 8.860 52.889 ( 1.285 -10.062 -0.730) 10.170 52.889 ( 1.285 10.062 -0.730) 10.170 53.900 ( 0.634 -0.711 -0.329) 1.008 53.900 ( 0.634 0.711 -0.329) 1.008 54.147 ( -0.833 -3.108 0.124) 3.220 54.147 ( -0.833 3.108 0.124) 3.220 55.776 ( -0.151 -1.343 -0.332) 1.391 55.776 ( -0.151 1.343 -0.332) 1.391 55.922 ( -1.026 -3.011 0.345) 3.200 55.922 ( -1.026 3.011 0.345) 3.200 57.790 ( 0.118 -1.353 0.040) 1.359 57.790 ( 0.118 1.353 0.040) 1.359 57.948 ( 0.612 -5.161 -0.557) 5.227 57.948 ( 0.612 5.161 -0.557) 5.227 58.077 ( -0.985 -4.077 1.349) 4.406 58.077 ( -0.985 4.077 1.349) 4.406 58.198 ( -2.826 -1.848 -0.844) 3.480 58.198 ( -2.826 1.848 -0.844) 3.480 61.046 ( 1.312 -0.468 0.112) 1.398 61.046 ( 1.312 0.468 0.112) 1.398 61.155 ( -3.599 -0.722 -0.157) 3.674 61.155 ( -3.599 0.722 -0.157) 3.674 ======================= Grid point 44 (25/90) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 46 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.903 ( 0.000 -2.470 0.000) 2.470 2.903 ( 0.000 2.470 0.000) 2.470 3.412 ( 0.000 -0.973 0.000) 0.973 3.412 ( 0.000 0.973 0.000) 0.973 4.439 ( 0.000 -7.585 -0.000) 7.585 4.439 ( 0.000 7.585 0.000) 7.585 4.870 ( 0.000 -3.298 0.000) 3.298 4.870 ( 0.000 3.298 -0.000) 3.298 5.092 ( 0.000 -2.695 0.000) 2.695 5.092 ( 0.000 2.695 0.000) 2.695 5.152 ( -0.000 -7.364 -0.000) 7.364 5.152 ( 0.000 7.364 0.000) 7.364 5.427 ( -0.000 -10.634 -0.000) 10.634 5.427 ( 0.000 10.634 -0.000) 10.634 5.796 ( 0.000 -7.010 0.000) 7.010 5.796 ( 0.000 7.010 -0.000) 7.010 6.017 ( 0.000 -0.676 0.000) 0.676 6.017 ( 0.000 0.676 -0.000) 0.676 6.103 ( 0.000 -3.098 0.000) 3.098 6.103 ( 0.000 3.098 -0.000) 3.098 6.524 ( 0.000 -8.063 0.000) 8.063 6.524 ( 0.000 8.064 -0.000) 8.064 6.691 ( 0.000 -6.026 0.000) 6.026 6.691 ( 0.000 6.026 -0.000) 6.026 7.136 ( 0.000 -0.958 0.000) 0.958 7.136 ( 0.000 0.958 0.000) 0.958 7.320 ( 0.000 -1.145 0.000) 1.145 7.320 ( -0.000 1.145 -0.000) 1.145 7.583 ( 0.000 -11.650 -0.000) 11.650 7.583 ( 0.000 11.650 -0.000) 11.650 7.831 ( 0.000 -7.879 -0.000) 7.879 7.831 ( 0.000 7.879 -0.000) 7.879 8.281 ( 0.000 -12.844 -0.000) 12.844 8.281 ( 0.000 12.844 -0.000) 12.844 8.474 ( 0.000 -6.120 -0.000) 6.120 8.474 ( 0.000 6.120 0.000) 6.120 8.606 ( 0.000 -8.655 0.000) 8.655 8.606 ( 0.000 8.655 -0.000) 8.655 8.813 ( 0.000 -14.076 0.000) 14.076 8.813 ( 0.000 14.076 -0.000) 14.076 9.170 ( 0.000 -13.149 -0.000) 13.149 9.170 ( 0.000 13.149 0.000) 13.149 9.497 ( 0.000 -2.481 0.000) 2.481 9.497 ( 0.000 2.481 0.000) 2.481 9.804 ( 0.000 -12.002 0.000) 12.002 9.804 ( 0.000 12.002 -0.000) 12.002 9.872 ( 0.000 -6.900 -0.000) 6.900 9.872 ( 0.000 6.900 -0.000) 6.900 10.051 ( 0.000 -10.748 -0.000) 10.748 10.051 ( 0.000 10.748 -0.000) 10.748 10.215 ( -0.000 -14.186 0.000) 14.186 10.215 ( 0.000 14.186 0.000) 14.186 10.428 ( 0.000 -9.293 -0.000) 9.293 10.428 ( 0.000 9.293 -0.000) 9.293 10.737 ( 0.000 -10.576 0.000) 10.576 10.737 ( 0.000 10.576 -0.000) 10.576 11.282 ( 0.000 -0.579 0.000) 0.579 11.282 ( 0.000 0.579 0.000) 0.579 11.390 ( 0.000 -13.878 0.000) 13.878 11.390 ( -0.000 13.878 -0.000) 13.878 11.745 ( 0.000 -5.154 0.000) 5.154 11.745 ( 0.000 5.154 0.000) 5.154 11.788 ( 0.000 -10.378 0.000) 10.378 11.788 ( 0.000 10.378 0.000) 10.378 12.096 ( 0.000 -2.609 0.000) 2.609 12.096 ( 0.000 2.609 -0.000) 2.609 12.488 ( 0.000 -1.394 -0.000) 1.394 12.488 ( -0.000 1.394 0.000) 1.394 12.633 ( 0.000 -1.524 0.000) 1.524 12.633 ( 0.000 1.524 0.000) 1.524 12.898 ( 0.000 -4.348 0.000) 4.348 12.898 ( 0.000 4.348 0.000) 4.348 13.257 ( 0.000 -4.900 0.000) 4.900 13.257 ( 0.000 4.900 0.000) 4.900 13.290 ( -0.000 -0.797 0.000) 0.797 13.290 ( 0.000 0.797 -0.000) 0.797 13.782 ( 0.000 -9.693 0.000) 9.693 13.782 ( 0.000 9.693 -0.000) 9.693 13.911 ( 0.000 -1.779 0.000) 1.779 13.911 ( 0.000 1.779 0.000) 1.779 15.967 ( 0.000 -5.035 0.000) 5.035 15.967 ( 0.000 5.035 0.000) 5.035 16.812 ( 0.000 -0.168 0.000) 0.168 16.812 ( 0.000 0.168 0.000) 0.168 18.674 ( 0.000 -3.126 -0.000) 3.126 18.674 ( 0.000 3.126 0.000) 3.126 18.729 ( -0.000 -3.678 -0.000) 3.678 18.729 ( -0.000 3.678 0.000) 3.678 20.373 ( 0.000 -1.544 -0.000) 1.544 20.373 ( 0.000 1.544 -0.000) 1.544 20.490 ( 0.000 -3.121 0.000) 3.121 20.490 ( 0.000 3.121 -0.000) 3.121 21.039 ( 0.000 -14.874 -0.000) 14.874 21.039 ( 0.000 14.874 0.000) 14.874 21.132 ( 0.000 -15.364 0.000) 15.364 21.132 ( 0.000 15.364 0.000) 15.364 22.528 ( 0.000 -2.473 -0.000) 2.473 22.528 ( 0.000 2.473 0.000) 2.473 22.672 ( 0.000 -1.083 0.000) 1.083 22.672 ( 0.000 1.083 0.000) 1.083 23.975 ( 0.000 -2.039 -0.000) 2.039 23.975 ( 0.000 2.039 -0.000) 2.039 24.086 ( -0.000 -6.129 0.000) 6.129 24.086 ( 0.000 6.129 -0.000) 6.129 24.697 ( 0.000 -1.523 0.000) 1.523 24.697 ( 0.000 1.523 -0.000) 1.523 24.923 ( 0.000 -3.562 -0.000) 3.562 24.923 ( 0.000 3.562 0.000) 3.562 26.782 ( 0.000 -1.752 -0.000) 1.752 26.782 ( 0.000 1.752 0.000) 1.752 26.858 ( 0.000 -1.460 -0.000) 1.460 26.858 ( 0.000 1.460 -0.000) 1.460 27.205 ( 0.000 -0.913 -0.000) 0.913 27.205 ( 0.000 0.913 -0.000) 0.913 27.321 ( 0.000 -2.474 0.000) 2.474 27.321 ( 0.000 2.474 -0.000) 2.474 27.880 ( 0.000 -1.693 0.000) 1.693 27.880 ( 0.000 1.693 0.000) 1.693 28.358 ( 0.000 -1.196 -0.000) 1.196 28.358 ( 0.000 1.196 -0.000) 1.196 28.674 ( 0.000 -1.822 -0.000) 1.822 28.674 ( 0.000 1.822 -0.000) 1.822 29.169 ( 0.000 -0.392 -0.000) 0.392 29.169 ( 0.000 0.392 0.000) 0.392 29.195 ( 0.000 -1.321 -0.000) 1.321 29.195 ( -0.000 1.321 -0.000) 1.321 29.850 ( 0.000 -1.723 0.000) 1.723 29.850 ( 0.000 1.723 -0.000) 1.723 30.639 ( 0.000 -1.022 -0.000) 1.022 30.639 ( 0.000 1.022 0.000) 1.022 30.970 ( 0.000 -0.630 0.000) 0.630 30.970 ( 0.000 0.630 -0.000) 0.630 33.849 ( 0.000 -0.078 -0.000) 0.078 33.849 ( 0.000 0.078 0.000) 0.078 33.966 ( 0.000 -1.019 0.000) 1.019 33.966 ( 0.000 1.019 -0.000) 1.019 37.222 ( 0.000 -0.127 0.000) 0.127 37.222 ( 0.000 0.127 0.000) 0.127 37.289 ( 0.000 -1.580 0.000) 1.580 37.289 ( 0.000 1.580 -0.000) 1.580 37.775 ( 0.000 -2.079 0.000) 2.079 37.775 ( 0.000 2.079 -0.000) 2.079 37.810 ( 0.000 -2.003 0.000) 2.003 37.810 ( 0.000 2.003 -0.000) 2.003 49.196 ( 0.000 -2.838 0.000) 2.838 49.196 ( 0.000 2.838 -0.000) 2.838 49.428 ( 0.000 -3.887 0.000) 3.887 49.428 ( 0.000 3.887 -0.000) 3.887 50.582 ( 0.000 -1.598 0.000) 1.598 50.582 ( 0.000 1.598 0.000) 1.598 50.682 ( 0.000 -3.525 0.000) 3.525 50.682 ( 0.000 3.525 0.000) 3.525 52.130 ( 0.000 -6.561 0.000) 6.561 52.130 ( 0.000 6.561 0.000) 6.561 52.286 ( 0.000 -10.440 -0.000) 10.440 52.286 ( 0.000 10.440 0.000) 10.440 52.793 ( 0.000 -9.538 0.000) 9.538 52.793 ( 0.000 9.538 0.000) 9.538 52.902 ( 0.000 -10.961 0.000) 10.961 52.902 ( 0.000 10.961 0.000) 10.961 53.907 ( 0.000 -0.364 0.000) 0.364 53.907 ( 0.000 0.364 0.000) 0.364 54.138 ( 0.000 -3.399 0.000) 3.399 54.138 ( 0.000 3.399 -0.000) 3.399 55.774 ( 0.000 -0.442 0.000) 0.442 55.774 ( 0.000 0.442 -0.000) 0.442 55.911 ( 0.000 -1.881 0.000) 1.881 55.911 ( 0.000 1.881 -0.000) 1.881 57.791 ( 0.000 -0.151 -0.000) 0.151 57.791 ( 0.000 0.151 0.000) 0.151 57.956 ( 0.000 -6.091 0.000) 6.091 57.956 ( 0.000 6.091 -0.000) 6.091 58.065 ( -0.000 -2.913 0.000) 2.913 58.065 ( 0.000 2.913 -0.000) 2.913 58.166 ( 0.000 -0.360 -0.000) 0.360 58.166 ( 0.000 0.360 -0.000) 0.360 61.075 ( -0.000 -0.313 -0.000) 0.313 61.075 ( -0.000 0.313 -0.000) 0.313 61.100 ( 0.000 -0.515 0.000) 0.515 61.100 ( 0.000 0.515 0.000) 0.515 ======================= Grid point 81 (26/90) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.882 ( 2.829 0.000 44.995) 45.084 0.904 ( -9.263 0.000 45.698) 46.627 1.730 ( 6.101 0.000 86.532) 86.747 2.442 ( -3.466 0.000 -31.044) 31.237 2.455 ( 11.055 0.000 -28.894) 30.937 3.331 ( -8.024 0.000 14.363) 16.452 3.699 ( 17.617 0.000 -1.423) 17.675 3.733 ( -11.188 0.000 -3.656) 11.771 3.807 ( 7.389 0.000 -7.704) 10.675 4.043 ( -20.698 0.000 9.799) 22.900 4.118 ( 9.623 0.000 11.032) 14.639 4.293 ( 7.537 0.000 4.087) 8.574 4.809 ( -3.733 0.000 -56.758) 56.880 4.880 ( -9.049 0.000 -12.884) 15.744 4.978 ( -1.298 0.000 2.988) 3.257 5.302 ( 1.615 0.000 -10.078) 10.206 5.747 ( -2.960 0.000 12.224) 12.577 5.852 ( 2.441 0.000 16.369) 16.549 6.142 ( 2.799 0.000 10.998) 11.349 6.255 ( 4.365 0.000 1.236) 4.537 6.362 ( 3.548 0.000 -11.599) 12.130 6.612 ( -4.264 0.000 -13.675) 14.324 6.782 ( -5.009 0.000 3.823) 6.301 6.941 ( -2.986 0.000 2.699) 4.025 7.045 ( -11.248 0.000 -1.694) 11.375 7.071 ( -1.022 0.000 -12.463) 12.505 7.286 ( -18.341 0.000 8.296) 20.130 7.376 ( 5.536 0.000 3.176) 6.382 7.438 ( -2.103 0.000 2.812) 3.512 7.489 ( 0.995 0.000 1.405) 1.722 7.634 ( -7.597 0.000 -9.878) 12.461 7.692 ( 11.867 0.000 -5.702) 13.166 7.851 ( -0.136 0.000 2.496) 2.500 8.069 ( 1.989 0.000 6.080) 6.397 8.089 ( -0.858 0.000 -3.724) 3.822 8.171 ( -7.137 0.000 10.186) 12.437 8.316 ( -2.016 0.000 8.709) 8.939 8.485 ( 3.486 0.000 -8.567) 9.249 8.774 ( -9.586 0.000 19.446) 21.680 8.975 ( -3.970 0.000 1.287) 4.174 9.021 ( 13.944 0.000 0.953) 13.977 9.028 ( 7.797 0.000 -0.369) 7.806 9.164 ( 7.003 0.000 5.269) 8.764 9.423 ( 1.233 0.000 -2.445) 2.738 9.512 ( -4.018 0.000 -8.745) 9.624 9.544 ( 5.402 0.000 3.254) 6.306 9.667 ( -4.080 0.000 -2.262) 4.665 9.759 ( 7.279 0.000 -6.815) 9.971 10.095 ( 1.304 0.000 13.484) 13.546 10.210 ( -4.964 0.000 -7.028) 8.605 10.472 ( -3.583 0.000 2.315) 4.266 10.566 ( -1.653 0.000 -11.333) 11.453 10.593 ( -1.783 0.000 -5.079) 5.383 10.677 ( -6.844 0.000 -7.925) 10.471 11.042 ( -3.549 0.000 2.116) 4.132 11.100 ( 2.773 0.000 2.114) 3.486 11.232 ( 8.418 0.000 11.998) 14.657 11.299 ( 2.025 0.000 9.827) 10.034 11.444 ( -1.949 0.000 0.037) 1.949 11.639 ( -6.978 0.000 -2.879) 7.549 11.757 ( -0.120 0.000 -0.300) 0.323 11.764 ( -0.219 0.000 -1.959) 1.971 12.000 ( 3.300 0.000 -3.390) 4.731 12.053 ( -6.108 0.000 -4.720) 7.719 12.299 ( 14.091 0.000 2.129) 14.251 12.365 ( -5.826 0.000 -0.299) 5.833 12.591 ( 29.404 0.000 1.156) 29.427 12.643 ( -2.477 0.000 -3.639) 4.402 12.769 ( 1.309 0.000 3.130) 3.393 12.907 ( 1.073 0.000 3.372) 3.538 12.993 ( 1.887 0.000 -0.619) 1.986 13.042 ( -1.758 0.000 -8.011) 8.201 13.762 ( -3.635 0.000 -2.399) 4.356 13.782 ( 4.489 0.000 -2.057) 4.938 13.836 ( -3.334 0.000 6.659) 7.447 13.980 ( 20.654 0.000 -1.451) 20.705 14.008 ( -0.665 0.000 4.810) 4.856 14.163 ( 1.872 0.000 3.419) 3.898 14.173 ( 13.858 0.000 -1.713) 13.964 14.314 ( 6.750 0.000 -2.896) 7.345 16.485 ( -5.682 0.000 2.319) 6.137 16.621 ( 5.068 0.000 -3.481) 6.148 17.142 ( -4.533 0.000 5.036) 6.776 17.369 ( 2.919 0.000 -4.480) 5.347 18.033 ( 0.460 0.000 2.132) 2.181 18.144 ( -1.898 0.000 -2.446) 3.096 18.261 ( 1.207 0.000 2.672) 2.932 18.391 ( 1.743 0.000 -2.715) 3.227 20.324 ( 1.044 0.000 0.169) 1.057 20.335 ( 0.282 0.000 -0.290) 0.404 20.736 ( -2.442 0.000 0.210) 2.451 20.749 ( 8.622 0.000 -0.352) 8.629 21.021 ( -1.470 0.000 1.829) 2.347 21.125 ( 1.778 0.000 -3.055) 3.534 21.242 ( -0.409 0.000 2.765) 2.795 21.324 ( -0.125 0.000 -1.205) 1.212 22.607 ( 19.912 0.000 -1.418) 19.962 22.609 ( -4.648 0.000 -1.035) 4.762 22.757 ( 2.547 0.000 2.712) 3.720 22.824 ( -0.155 0.000 -0.500) 0.523 22.871 ( 0.160 0.000 0.096) 0.186 22.871 ( 0.021 0.000 0.073) 0.076 24.075 ( -1.363 0.000 0.787) 1.574 24.130 ( 3.057 0.000 -1.673) 3.485 24.483 ( -3.800 0.000 4.001) 5.518 24.674 ( 3.697 0.000 -4.104) 5.523 25.359 ( -2.865 0.000 2.629) 3.889 25.465 ( 1.812 0.000 -1.828) 2.574 26.845 ( -0.624 0.000 1.597) 1.715 26.921 ( 0.346 0.000 -1.445) 1.485 27.204 ( 0.604 0.000 1.038) 1.201 27.275 ( 1.898 0.000 -2.300) 2.981 27.448 ( -0.541 0.000 3.294) 3.338 27.587 ( -13.933 0.000 -3.226) 14.302 27.689 ( -13.085 0.000 2.812) 13.384 27.843 ( 2.284 0.000 -3.389) 4.087 27.890 ( -4.613 0.000 1.568) 4.872 27.987 ( 7.237 0.000 -4.221) 8.378 28.115 ( -44.024 0.000 3.367) 44.153 28.196 ( 0.518 0.000 2.638) 2.689 28.410 ( 5.150 0.000 1.378) 5.331 28.548 ( -0.886 0.000 -3.174) 3.295 28.695 ( -16.485 0.000 0.096) 16.485 28.702 ( -1.836 0.000 -0.573) 1.923 28.944 ( 4.420 0.000 2.274) 4.971 29.023 ( -17.447 0.000 -1.161) 17.486 29.283 ( -1.111 0.000 1.222) 1.652 29.348 ( 0.781 0.000 -1.404) 1.607 30.618 ( 0.336 0.000 -0.099) 0.350 30.630 ( -1.713 0.000 -0.712) 1.855 30.666 ( -0.270 0.000 0.501) 0.569 30.668 ( 0.138 0.000 0.297) 0.327 33.972 ( 0.497 0.000 0.375) 0.623 33.994 ( -1.724 0.000 -0.601) 1.826 34.017 ( 3.550 0.000 0.471) 3.582 34.033 ( -10.168 0.000 -0.260) 10.171 37.216 ( -0.156 0.000 0.335) 0.369 37.235 ( 0.269 0.000 -0.436) 0.512 37.288 ( -1.124 0.000 0.190) 1.139 37.295 ( 5.394 0.000 -0.106) 5.395 37.546 ( -1.717 0.000 0.963) 1.969 37.605 ( 6.586 0.000 -1.787) 6.824 37.681 ( 13.241 0.000 1.305) 13.306 37.716 ( -1.620 0.000 -0.453) 1.682 48.788 ( -3.000 0.000 0.758) 3.094 48.828 ( 11.705 0.000 -0.937) 11.743 48.907 ( -2.586 0.000 0.185) 2.593 48.910 ( 1.818 0.000 0.013) 1.818 50.539 ( -0.764 0.000 1.628) 1.798 50.623 ( 0.859 0.000 -1.826) 2.018 51.483 ( -5.525 0.000 2.508) 6.067 51.610 ( 35.094 0.000 -2.898) 35.214 51.723 ( -0.061 0.000 0.436) 0.440 51.730 ( 2.663 0.000 0.372) 2.689 52.271 ( -0.330 0.000 -0.057) 0.335 52.279 ( -0.020 0.000 -0.357) 0.357 52.783 ( 32.070 0.000 0.398) 32.072 52.809 ( -7.720 0.000 -0.705) 7.752 53.121 ( 1.296 0.000 2.420) 2.745 53.232 ( -0.665 0.000 -2.153) 2.253 53.796 ( -0.272 0.000 0.580) 0.641 53.821 ( 0.282 0.000 -0.443) 0.525 54.370 ( -0.479 0.000 0.117) 0.493 54.376 ( 2.528 0.000 -0.149) 2.533 55.705 ( -0.251 0.000 1.179) 1.206 55.761 ( 0.267 0.000 -1.078) 1.111 56.857 ( 10.373 0.000 0.411) 10.381 56.876 ( -1.817 0.000 -0.360) 1.852 57.379 ( -0.046 0.000 0.007) 0.047 57.379 ( 0.045 0.000 -0.013) 0.047 57.388 ( 0.045 0.000 0.023) 0.050 57.389 ( -0.116 0.000 -0.025) 0.119 58.360 ( 1.030 0.000 0.446) 1.123 58.383 ( -1.194 0.000 -0.522) 1.303 58.665 ( 9.673 0.000 0.200) 9.675 58.673 ( -53.134 0.000 -0.140) 53.134 60.911 ( -0.039 0.000 0.127) 0.133 60.917 ( 0.036 0.000 -0.088) 0.096 60.949 ( -0.083 0.000 -0.012) 0.084 60.950 ( 0.093 0.000 -0.030) 0.098 ======================= Grid point 82 (27/90) ======================= q-point: ( 0.12 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.369 ( 33.099 0.000 23.382) 40.525 1.564 ( 34.019 0.000 34.520) 48.466 2.507 ( 42.940 0.000 65.095) 77.982 2.608 ( 23.970 0.000 -30.775) 39.009 2.773 ( 25.282 0.000 -29.401) 38.776 3.199 ( -2.995 0.000 18.189) 18.434 3.463 ( -8.168 0.000 -14.026) 16.231 3.586 ( -20.007 0.000 15.801) 25.494 4.027 ( 13.750 0.000 -4.027) 14.328 4.217 ( 24.298 0.000 -7.781) 25.513 4.424 ( 9.647 0.000 5.856) 11.285 4.565 ( 11.249 0.000 -2.659) 11.559 4.737 ( 20.323 0.000 -28.620) 35.101 4.834 ( 9.533 0.000 -17.125) 19.600 5.056 ( 6.964 0.000 5.953) 9.162 5.389 ( 8.792 0.000 -10.149) 13.428 5.573 ( -14.975 0.000 13.033) 19.852 6.015 ( 7.078 0.000 12.939) 14.749 6.167 ( -11.559 0.000 -8.090) 14.108 6.226 ( 1.344 0.000 -0.854) 1.593 6.425 ( 3.234 0.000 1.927) 3.765 6.502 ( -2.970 0.000 -14.451) 14.753 6.739 ( 6.989 0.000 1.996) 7.269 6.907 ( -0.869 0.000 5.466) 5.535 7.012 ( 3.091 0.000 2.502) 3.977 7.049 ( 2.218 0.000 -10.142) 10.381 7.232 ( -0.282 0.000 4.620) 4.629 7.380 ( -4.725 0.000 2.817) 5.501 7.397 ( -4.354 0.000 0.948) 4.456 7.480 ( -2.957 0.000 -11.642) 12.012 7.514 ( 1.685 0.000 1.026) 1.972 7.799 ( -4.865 0.000 2.226) 5.350 7.876 ( 5.310 0.000 -3.924) 6.603 8.002 ( -6.187 0.000 2.600) 6.711 8.057 ( -5.435 0.000 -2.940) 6.179 8.121 ( 2.296 0.000 7.431) 7.778 8.362 ( 4.724 0.000 8.819) 10.005 8.487 ( -0.100 0.000 -4.156) 4.157 8.694 ( -2.330 0.000 26.611) 26.712 8.955 ( 0.919 0.000 2.786) 2.933 9.078 ( -0.170 0.000 -8.047) 8.049 9.096 ( -3.297 0.000 6.385) 7.185 9.299 ( 3.283 0.000 1.620) 3.661 9.447 ( 1.760 0.000 -0.672) 1.884 9.472 ( 4.369 0.000 -13.709) 14.388 9.631 ( 2.248 0.000 5.737) 6.162 9.736 ( 9.851 0.000 -7.087) 12.136 9.858 ( -0.411 0.000 5.430) 5.446 10.110 ( 0.008 0.000 -10.337) 10.337 10.143 ( -0.906 0.000 15.966) 15.992 10.442 ( -6.492 0.000 -0.201) 6.495 10.449 ( -4.002 0.000 -11.345) 12.030 10.542 ( 2.619 0.000 -1.963) 3.273 10.588 ( -0.745 0.000 -0.676) 1.006 10.963 ( -2.940 0.000 0.333) 2.959 11.083 ( -2.072 0.000 1.983) 2.868 11.288 ( -8.842 0.000 -3.118) 9.375 11.397 ( -7.397 0.000 -0.248) 7.401 11.442 ( 2.554 0.000 11.965) 12.235 11.446 ( 3.955 0.000 12.485) 13.096 11.672 ( -5.223 0.000 -11.242) 12.396 11.709 ( -7.066 0.000 1.667) 7.260 11.934 ( -1.012 0.000 -4.347) 4.463 12.104 ( 1.045 0.000 -2.423) 2.639 12.240 ( -2.228 0.000 -1.739) 2.827 12.452 ( 5.773 0.000 2.580) 6.323 12.551 ( -4.828 0.000 -6.089) 7.771 12.711 ( -3.063 0.000 -0.799) 3.166 12.949 ( 2.516 0.000 4.542) 5.192 12.963 ( 3.089 0.000 -2.653) 4.072 13.015 ( 1.477 0.000 -7.056) 7.209 13.064 ( 2.785 0.000 -3.436) 4.423 13.631 ( -8.766 0.000 -2.464) 9.106 13.763 ( -1.908 0.000 2.042) 2.795 13.811 ( 0.293 0.000 0.116) 0.315 14.033 ( 2.215 0.000 2.284) 3.182 14.059 ( -0.147 0.000 -6.757) 6.758 14.201 ( -3.762 0.000 0.245) 3.770 14.240 ( 2.440 0.000 4.137) 4.803 14.617 ( -3.012 0.000 -12.478) 12.837 16.597 ( 8.110 0.000 -9.102) 12.191 16.687 ( 0.182 0.000 2.264) 2.271 17.152 ( 5.229 0.000 0.875) 5.302 17.463 ( 7.145 0.000 -3.266) 7.856 18.040 ( -0.240 0.000 2.683) 2.694 18.079 ( -3.643 0.000 -2.079) 4.195 18.273 ( -0.455 0.000 1.616) 1.679 18.370 ( -2.673 0.000 -2.938) 3.972 20.288 ( -3.703 0.000 -0.349) 3.719 20.299 ( -3.189 0.000 -0.259) 3.199 20.640 ( -9.532 0.000 11.508) 14.943 20.665 ( -3.318 0.000 -2.807) 4.346 21.045 ( 1.712 0.000 0.651) 1.831 21.179 ( 1.604 0.000 -2.818) 3.242 21.308 ( 7.273 0.000 2.895) 7.827 21.401 ( 7.459 0.000 -1.062) 7.534 22.483 ( -4.770 0.000 -3.231) 5.761 22.696 ( -1.307 0.000 -1.286) 1.833 22.836 ( 0.750 0.000 -1.215) 1.428 22.880 ( 0.951 0.000 0.583) 1.115 22.896 ( 2.091 0.000 -0.153) 2.097 22.910 ( -1.585 0.000 0.713) 1.738 24.031 ( -2.950 0.000 -0.535) 2.998 24.128 ( -3.635 0.000 1.101) 3.798 24.402 ( -3.735 0.000 0.159) 3.738 24.675 ( -3.099 0.000 -0.654) 3.167 25.231 ( -8.765 0.000 0.058) 8.765 25.380 ( -8.189 0.000 1.176) 8.273 26.866 ( -3.994 0.000 8.141) 9.068 26.867 ( 2.275 0.000 1.267) 2.603 26.945 ( 2.037 0.000 -1.196) 2.362 27.255 ( 3.293 0.000 -2.256) 3.992 27.280 ( -1.049 0.000 -1.342) 1.703 27.429 ( -1.700 0.000 2.839) 3.309 27.686 ( 2.691 0.000 -0.877) 2.831 27.804 ( -1.101 0.000 1.289) 1.695 27.857 ( -0.256 0.000 -1.818) 1.836 27.860 ( -5.925 0.000 4.637) 7.524 28.077 ( 1.956 0.000 -5.107) 5.469 28.132 ( -3.655 0.000 7.677) 8.503 28.465 ( -9.149 0.000 6.308) 11.112 28.531 ( -0.180 0.000 -0.206) 0.274 28.633 ( 4.353 0.000 -0.098) 4.354 28.645 ( 8.624 0.000 -0.181) 8.626 29.081 ( 5.457 0.000 0.310) 5.466 29.293 ( 14.148 0.000 5.189) 15.069 29.304 ( 2.955 0.000 0.262) 2.967 29.385 ( 4.951 0.000 0.791) 5.014 30.638 ( 1.021 0.000 0.503) 1.139 30.649 ( 1.796 0.000 -1.972) 2.667 30.665 ( -0.009 0.000 0.290) 0.290 30.675 ( 0.880 0.000 0.742) 1.151 33.877 ( -3.340 0.000 2.301) 4.056 33.943 ( -2.506 0.000 0.192) 2.513 33.988 ( 0.200 0.000 1.319) 1.334 34.076 ( 1.067 0.000 0.780) 1.322 37.221 ( 0.604 0.000 0.118) 0.615 37.234 ( 0.146 0.000 -0.239) 0.280 37.282 ( 0.737 0.000 -0.772) 1.067 37.338 ( 0.727 0.000 -0.676) 0.992 37.505 ( -1.189 0.000 -0.351) 1.240 37.617 ( 0.007 0.000 -1.161) 1.161 37.732 ( 2.411 0.000 -1.695) 2.947 37.924 ( 4.056 0.000 -4.236) 5.865 48.872 ( 9.902 0.000 -0.078) 9.902 48.938 ( 4.667 0.000 -0.990) 4.771 49.037 ( 10.187 0.000 3.116) 10.653 49.326 ( 21.893 0.000 -18.759) 28.831 50.530 ( -0.164 0.000 0.764) 0.782 50.623 ( -0.595 0.000 -1.501) 1.615 51.269 ( -12.500 0.000 -4.981) 13.455 51.679 ( -6.576 0.000 -1.620) 6.772 51.728 ( 0.476 0.000 0.223) 0.526 51.768 ( -4.899 0.000 0.090) 4.900 52.275 ( 0.473 0.000 -0.450) 0.653 52.279 ( 0.101 0.000 -0.216) 0.238 52.648 ( -6.024 0.000 -4.540) 7.543 53.191 ( 3.803 0.000 2.311) 4.450 53.205 ( 1.181 0.000 -6.242) 6.353 53.454 ( 16.301 0.000 -16.737) 23.363 53.805 ( 1.106 0.000 0.662) 1.289 53.842 ( 1.686 0.000 -0.449) 1.745 54.321 ( -8.352 0.000 7.560) 11.265 54.359 ( -0.392 0.000 -0.545) 0.671 55.713 ( 0.607 0.000 1.217) 1.360 55.775 ( 1.385 0.000 -1.055) 1.741 56.411 ( -32.582 0.000 28.905) 43.555 56.749 ( -8.839 0.000 -3.316) 9.441 57.378 ( -0.008 0.000 0.004) 0.009 57.381 ( 0.130 0.000 -0.013) 0.131 57.390 ( 0.219 0.000 -0.036) 0.222 57.392 ( 0.260 0.000 0.030) 0.262 58.121 ( 3.345 0.000 -2.407) 4.121 58.282 ( -5.396 0.000 0.659) 5.436 58.434 ( 2.303 0.000 4.518) 5.071 58.882 ( 6.299 0.000 5.736) 8.519 60.912 ( 0.073 0.000 0.105) 0.128 60.918 ( 0.126 0.000 -0.063) 0.141 60.946 ( -0.186 0.000 -0.064) 0.197 60.951 ( 0.024 0.000 0.016) 0.028 ======================= Grid point 83 (28/90) ======================= q-point: ( 0.25 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.105 ( 30.385 0.000 4.712) 30.748 2.329 ( 31.154 0.000 24.540) 39.659 2.916 ( 7.118 0.000 -28.889) 29.753 2.946 ( -10.368 0.000 16.588) 19.562 3.170 ( 4.520 0.000 0.110) 4.522 3.423 ( 20.129 0.000 4.257) 20.575 3.502 ( 17.559 0.000 -13.207) 21.972 3.994 ( 57.442 0.000 35.514) 67.534 4.361 ( 16.077 0.000 6.158) 17.216 4.566 ( 1.275 0.000 -0.836) 1.524 4.690 ( 22.862 0.000 -6.075) 23.656 4.779 ( 22.187 0.000 -19.220) 29.354 5.021 ( 5.220 0.000 -12.128) 13.203 5.152 ( 4.886 0.000 11.702) 12.681 5.256 ( 0.204 0.000 11.810) 11.812 5.448 ( 17.262 0.000 -3.548) 17.623 5.591 ( 12.686 0.000 -10.184) 16.268 5.871 ( -8.162 0.000 -16.817) 18.693 6.116 ( -0.275 0.000 3.642) 3.652 6.185 ( -1.223 0.000 -1.881) 2.244 6.367 ( -7.887 0.000 -10.960) 13.503 6.550 ( 6.472 0.000 6.158) 8.933 6.900 ( 3.763 0.000 -0.571) 3.806 6.931 ( 0.477 0.000 8.141) 8.155 7.070 ( 4.257 0.000 -0.264) 4.265 7.095 ( 4.472 0.000 -10.959) 11.836 7.173 ( -5.022 0.000 2.596) 5.654 7.287 ( -4.360 0.000 -0.272) 4.368 7.329 ( -0.769 0.000 5.796) 5.847 7.460 ( 1.643 0.000 -10.975) 11.097 7.554 ( -1.872 0.000 7.637) 7.863 7.665 ( -2.800 0.000 -9.845) 10.235 7.867 ( -7.171 0.000 -0.573) 7.194 7.916 ( -6.042 0.000 -5.220) 7.985 7.918 ( -0.687 0.000 2.246) 2.349 8.230 ( 5.085 0.000 7.134) 8.761 8.491 ( 1.219 0.000 0.148) 1.228 8.536 ( 8.863 0.000 3.401) 9.493 8.802 ( 4.156 0.000 25.033) 25.376 8.947 ( -2.414 0.000 -2.717) 3.634 9.022 ( -3.430 0.000 1.185) 3.629 9.103 ( 4.865 0.000 -5.756) 7.536 9.326 ( -0.321 0.000 4.798) 4.809 9.495 ( 2.558 0.000 1.942) 3.212 9.525 ( 1.655 0.000 -5.883) 6.112 9.645 ( -4.665 0.000 0.864) 4.745 9.819 ( -1.804 0.000 16.483) 16.581 9.898 ( 6.727 0.000 -16.397) 17.723 10.105 ( -2.328 0.000 -6.456) 6.863 10.141 ( -3.299 0.000 13.767) 14.156 10.324 ( -0.073 0.000 0.610) 0.615 10.379 ( 1.126 0.000 -3.631) 3.802 10.561 ( -1.336 0.000 -0.655) 1.487 10.680 ( 9.255 0.000 -1.360) 9.354 10.933 ( -0.721 0.000 -2.065) 2.187 11.043 ( -3.075 0.000 -5.497) 6.298 11.074 ( -8.433 0.000 -2.891) 8.915 11.184 ( -9.398 0.000 2.733) 9.787 11.399 ( -9.561 0.000 1.556) 9.687 11.466 ( -7.128 0.000 -13.227) 15.026 11.594 ( 1.545 0.000 6.085) 6.278 11.627 ( -2.043 0.000 7.949) 8.207 11.962 ( 2.899 0.000 3.768) 4.754 11.996 ( -5.951 0.000 -2.111) 6.315 12.304 ( 4.661 0.000 4.258) 6.313 12.408 ( -7.149 0.000 -5.948) 9.299 12.574 ( 2.357 0.000 -2.631) 3.532 12.597 ( -4.442 0.000 1.851) 4.812 12.883 ( -7.074 0.000 -2.975) 7.674 13.041 ( 2.576 0.000 -0.916) 2.734 13.054 ( 5.024 0.000 1.856) 5.356 13.141 ( 4.109 0.000 -2.001) 4.570 13.432 ( -8.445 0.000 -4.905) 9.766 13.770 ( 1.718 0.000 0.953) 1.965 13.807 ( -0.979 0.000 1.722) 1.981 13.977 ( -8.101 0.000 -4.314) 9.178 14.095 ( 2.809 0.000 2.999) 4.109 14.097 ( -3.968 0.000 -1.942) 4.418 14.258 ( -1.831 0.000 2.763) 3.314 14.462 ( -4.399 0.000 -2.221) 4.928 16.647 ( -4.129 0.000 5.776) 7.100 16.670 ( 2.516 0.000 -6.571) 7.037 17.331 ( 10.325 0.000 -1.257) 10.401 17.594 ( 4.893 0.000 -2.060) 5.309 17.989 ( -4.156 0.000 -1.075) 4.293 18.051 ( 0.897 0.000 2.569) 2.721 18.260 ( -0.844 0.000 0.324) 0.904 18.286 ( -4.288 0.000 -2.694) 5.064 20.203 ( -3.772 0.000 0.122) 3.774 20.224 ( -3.478 0.000 -0.266) 3.488 20.568 ( -0.944 0.000 9.688) 9.734 20.609 ( -0.510 0.000 -4.640) 4.668 21.025 ( -4.183 0.000 1.411) 4.414 21.139 ( -3.808 0.000 -2.488) 4.549 21.550 ( 13.651 0.000 1.566) 13.741 21.618 ( 12.696 0.000 -0.931) 12.730 22.423 ( -0.569 0.000 -1.168) 1.299 22.661 ( -1.209 0.000 -2.327) 2.622 22.824 ( -4.037 0.000 5.592) 6.897 22.842 ( 0.170 0.000 -1.391) 1.401 22.939 ( 3.506 0.000 0.106) 3.507 22.952 ( 3.546 0.000 -0.450) 3.574 23.940 ( -5.904 0.000 -1.742) 6.156 23.982 ( -10.857 0.000 2.644) 11.174 24.354 ( -0.220 0.000 -3.643) 3.650 24.540 ( -9.792 0.000 3.961) 10.563 25.050 ( -6.811 0.000 -3.283) 7.561 25.169 ( -11.700 0.000 2.530) 11.970 26.939 ( 4.008 0.000 1.062) 4.146 26.957 ( 5.429 0.000 -4.164) 6.841 26.994 ( 3.778 0.000 -1.825) 4.195 27.232 ( -2.996 0.000 -0.084) 2.997 27.322 ( 3.356 0.000 -6.544) 7.354 27.385 ( -3.378 0.000 1.242) 3.599 27.661 ( -5.849 0.000 3.385) 6.757 27.797 ( 2.176 0.000 -0.455) 2.223 27.816 ( -2.688 0.000 -1.661) 3.159 27.837 ( 1.624 0.000 3.088) 3.490 28.023 ( -3.482 0.000 2.057) 4.044 28.178 ( 3.621 0.000 0.540) 3.661 28.328 ( -4.317 0.000 4.710) 6.389 28.543 ( 0.968 0.000 -1.348) 1.659 28.733 ( 4.745 0.000 -0.269) 4.753 28.832 ( 7.721 0.000 1.086) 7.797 29.178 ( 3.814 0.000 1.902) 4.262 29.390 ( 1.766 0.000 0.084) 1.768 29.392 ( 4.677 0.000 0.374) 4.692 29.561 ( 4.178 0.000 3.234) 5.283 30.645 ( -0.137 0.000 0.103) 0.171 30.657 ( -0.126 0.000 -0.407) 0.426 30.686 ( 1.578 0.000 -1.148) 1.952 30.714 ( 1.730 0.000 1.818) 2.509 33.851 ( -0.133 0.000 0.054) 0.143 33.896 ( -2.071 0.000 0.673) 2.177 33.991 ( -0.356 0.000 1.769) 1.805 34.071 ( -1.017 0.000 -0.803) 1.296 37.240 ( 1.153 0.000 -0.046) 1.154 37.258 ( 1.800 0.000 0.469) 1.860 37.305 ( 1.405 0.000 -0.339) 1.445 37.348 ( 0.449 0.000 -0.372) 0.583 37.505 ( 0.907 0.000 0.615) 1.096 37.619 ( 0.571 0.000 -1.589) 1.689 37.781 ( 2.604 0.000 -2.070) 3.327 37.942 ( -0.373 0.000 -0.275) 0.464 49.077 ( 8.351 0.000 -1.039) 8.415 49.101 ( 10.654 0.000 -1.318) 10.735 49.346 ( 15.509 0.000 10.371) 18.657 49.598 ( 10.219 0.000 -12.408) 16.075 50.540 ( 1.099 0.000 -0.864) 1.398 50.583 ( -2.651 0.000 -2.515) 3.654 51.031 ( -7.158 0.000 -7.203) 10.155 51.399 ( -16.064 0.000 3.370) 16.414 51.742 ( 0.725 0.000 0.141) 0.739 51.745 ( 0.217 0.000 0.107) 0.242 52.284 ( 0.355 0.000 0.038) 0.357 52.285 ( 0.541 0.000 -0.345) 0.642 52.540 ( -3.270 0.000 -3.142) 4.535 53.185 ( -1.292 0.000 -7.783) 7.890 53.270 ( 2.943 0.000 2.330) 3.754 53.562 ( 1.131 0.000 -4.537) 4.676 53.844 ( 2.268 0.000 1.474) 2.705 53.881 ( 2.035 0.000 -0.755) 2.171 54.180 ( -6.475 0.000 10.237) 12.112 54.351 ( -0.165 0.000 -1.190) 1.201 55.738 ( 1.443 0.000 1.655) 2.196 55.811 ( 2.351 0.000 -1.241) 2.658 56.056 ( -11.247 0.000 14.279) 18.176 56.524 ( -10.878 0.000 -4.823) 11.899 57.379 ( 0.081 0.000 0.031) 0.086 57.384 ( 0.142 0.000 -0.048) 0.150 57.396 ( 0.279 0.000 0.003) 0.279 57.398 ( 0.291 0.000 0.005) 0.291 58.203 ( -2.431 0.000 1.985) 3.138 58.227 ( 5.743 0.000 -8.690) 10.416 58.493 ( 1.824 0.000 5.948) 6.221 58.934 ( -1.564 0.000 2.915) 3.308 60.914 ( 0.128 0.000 0.085) 0.154 60.921 ( 0.176 0.000 -0.053) 0.184 60.942 ( -0.207 0.000 -0.047) 0.212 60.951 ( -0.046 0.000 0.009) 0.047 ======================= Grid point 84 (29/90) ======================= q-point: ( 0.38 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.609 ( 17.575 0.000 -3.466) 17.914 2.657 ( -14.024 0.000 14.890) 20.455 2.906 ( 10.201 0.000 10.226) 14.444 2.935 ( 5.456 0.000 -21.112) 21.806 3.365 ( 19.508 0.000 12.500) 23.169 3.845 ( 14.521 0.000 -14.534) 20.545 3.963 ( 24.359 0.000 -1.047) 24.381 4.430 ( -10.493 0.000 18.017) 20.849 4.634 ( -22.462 0.000 -9.182) 24.266 4.645 ( 6.632 0.000 2.941) 7.255 5.037 ( 15.859 0.000 -7.475) 17.532 5.139 ( -0.785 0.000 7.592) 7.633 5.344 ( 22.504 0.000 -15.586) 27.374 5.416 ( 44.803 0.000 33.728) 56.080 5.535 ( 23.959 0.000 7.699) 25.166 5.581 ( -0.742 0.000 -6.267) 6.311 5.802 ( 8.335 0.000 -15.698) 17.773 5.881 ( 7.606 0.000 -11.601) 13.872 6.078 ( -16.984 0.000 -4.841) 17.660 6.159 ( 9.443 0.000 0.664) 9.467 6.403 ( 17.942 0.000 9.524) 20.313 6.622 ( 0.241 0.000 0.912) 0.944 6.870 ( -4.739 0.000 2.986) 5.601 6.941 ( -1.124 0.000 2.018) 2.310 7.045 ( -9.032 0.000 -1.978) 9.246 7.128 ( -2.295 0.000 -9.576) 9.847 7.212 ( 2.800 0.000 -3.363) 4.376 7.232 ( 0.470 0.000 3.023) 3.060 7.274 ( -3.594 0.000 2.636) 4.457 7.437 ( -6.117 0.000 1.956) 6.423 7.445 ( -0.430 0.000 -4.179) 4.201 7.700 ( 4.376 0.000 -9.851) 10.779 7.721 ( -5.617 0.000 -1.758) 5.886 7.853 ( 2.604 0.000 0.432) 2.640 7.888 ( -2.381 0.000 7.038) 7.430 8.321 ( 1.307 0.000 1.587) 2.056 8.527 ( 1.635 0.000 0.344) 1.671 8.684 ( 3.878 0.000 -1.784) 4.269 8.871 ( -3.192 0.000 -7.910) 8.530 8.872 ( -3.786 0.000 -6.659) 7.659 9.024 ( 3.294 0.000 12.012) 12.456 9.185 ( 2.072 0.000 -0.888) 2.255 9.338 ( -0.356 0.000 6.872) 6.881 9.475 ( -7.905 0.000 0.698) 7.936 9.487 ( -4.482 0.000 2.547) 5.156 9.559 ( 2.466 0.000 3.673) 4.424 9.890 ( 2.780 0.000 9.919) 10.301 9.912 ( -0.341 0.000 -16.678) 16.681 9.997 ( -5.496 0.000 3.025) 6.274 10.132 ( 0.359 0.000 12.011) 12.016 10.430 ( 8.009 0.000 -1.150) 8.091 10.492 ( 6.218 0.000 4.280) 7.549 10.557 ( 6.214 0.000 -7.901) 10.052 10.797 ( -7.996 0.000 -0.227) 7.999 10.869 ( -5.954 0.000 -0.161) 5.956 10.916 ( 5.644 0.000 -6.101) 8.311 11.028 ( -6.907 0.000 0.595) 6.932 11.041 ( 2.576 0.000 -4.469) 5.158 11.210 ( -7.731 0.000 3.619) 8.537 11.283 ( -3.299 0.000 -6.692) 7.461 11.580 ( -2.638 0.000 1.862) 3.229 11.628 ( -0.463 0.000 3.640) 3.669 11.896 ( -3.696 0.000 4.029) 5.468 12.012 ( -2.397 0.000 9.136) 9.446 12.237 ( -6.478 0.000 -6.801) 9.392 12.394 ( -8.017 0.000 -5.411) 9.672 12.420 ( 3.930 0.000 8.107) 9.009 12.691 ( 2.503 0.000 2.177) 3.317 12.753 ( -1.542 0.000 -4.043) 4.327 13.057 ( -0.247 0.000 -5.545) 5.551 13.171 ( 4.244 0.000 2.941) 5.164 13.189 ( 1.068 0.000 -1.965) 2.236 13.281 ( -3.992 0.000 -3.062) 5.031 13.700 ( -11.301 0.000 -1.858) 11.452 13.814 ( -1.837 0.000 -1.148) 2.166 13.823 ( 3.039 0.000 -2.961) 4.243 14.072 ( 1.187 0.000 -2.028) 2.350 14.167 ( 2.605 0.000 4.683) 5.359 14.187 ( -4.734 0.000 3.554) 5.920 14.426 ( -0.111 0.000 -0.323) 0.342 16.575 ( -3.948 0.000 5.697) 6.931 16.702 ( 2.406 0.000 -5.272) 5.795 17.521 ( 7.269 0.000 -0.862) 7.320 17.641 ( 0.371 0.000 -0.738) 0.826 17.917 ( -2.268 0.000 0.964) 2.465 18.093 ( 2.184 0.000 1.459) 2.626 18.187 ( -4.208 0.000 -2.651) 4.974 18.245 ( -0.418 0.000 -1.059) 1.138 20.143 ( -1.949 0.000 0.232) 1.963 20.164 ( -2.051 0.000 -0.292) 2.072 20.626 ( 3.794 0.000 6.404) 7.443 20.630 ( 3.534 0.000 -3.838) 5.217 20.890 ( -8.617 0.000 1.267) 8.710 21.035 ( -4.821 0.000 -2.876) 5.614 21.823 ( 10.513 0.000 1.319) 10.596 21.869 ( 10.061 0.000 -0.924) 10.103 22.434 ( 1.294 0.000 0.830) 1.538 22.635 ( -0.723 0.000 -3.456) 3.531 22.782 ( -1.447 0.000 4.193) 4.436 22.839 ( 0.013 0.000 -1.057) 1.057 23.045 ( 6.656 0.000 0.393) 6.667 23.053 ( 6.358 0.000 -0.495) 6.378 23.716 ( -14.053 0.000 1.677) 14.153 23.757 ( -10.824 0.000 -1.923) 10.993 24.348 ( -8.201 0.000 4.981) 9.596 24.365 ( 2.233 0.000 -4.785) 5.281 24.946 ( -9.704 0.000 4.052) 10.516 24.951 ( -1.807 0.000 -3.715) 4.132 27.006 ( 1.372 0.000 -0.007) 1.372 27.029 ( 4.087 0.000 1.072) 4.225 27.106 ( 6.102 0.000 -3.472) 7.021 27.167 ( -3.075 0.000 -0.026) 3.075 27.299 ( -4.544 0.000 -0.018) 4.544 27.327 ( -1.345 0.000 -7.289) 7.412 27.580 ( -2.074 0.000 6.195) 6.533 27.767 ( -1.117 0.000 -2.366) 2.616 27.846 ( 2.324 0.000 -0.991) 2.527 27.900 ( 2.970 0.000 4.940) 5.765 27.960 ( -3.170 0.000 1.771) 3.631 28.236 ( 0.772 0.000 0.804) 1.114 28.301 ( 0.756 0.000 2.056) 2.191 28.549 ( -0.062 0.000 -2.792) 2.793 28.817 ( 3.047 0.000 0.661) 3.118 28.954 ( 3.527 0.000 -0.382) 3.547 29.256 ( 3.036 0.000 2.122) 3.704 29.417 ( 0.690 0.000 -0.114) 0.699 29.475 ( 2.654 0.000 0.984) 2.830 29.584 ( -0.746 0.000 -0.991) 1.241 30.643 ( 0.000 0.000 0.136) 0.136 30.654 ( -0.026 0.000 -0.231) 0.233 30.713 ( 1.210 0.000 -0.629) 1.363 30.740 ( 0.305 0.000 0.991) 1.037 33.858 ( 0.771 0.000 -0.890) 1.178 33.862 ( -1.326 0.000 0.718) 1.508 33.983 ( -0.812 0.000 1.950) 2.113 34.049 ( -0.494 0.000 -1.445) 1.527 37.264 ( 1.008 0.000 0.014) 1.008 37.289 ( 0.902 0.000 -0.065) 0.905 37.332 ( 1.029 0.000 0.432) 1.116 37.355 ( 0.292 0.000 -0.226) 0.369 37.532 ( 1.032 0.000 1.874) 2.139 37.630 ( 0.910 0.000 -1.766) 1.987 37.826 ( 2.155 0.000 -1.339) 2.537 37.924 ( -1.301 0.000 0.087) 1.304 49.249 ( 7.333 0.000 -0.885) 7.387 49.285 ( 6.925 0.000 -2.020) 7.214 49.630 ( 6.988 0.000 10.981) 13.016 49.734 ( 5.957 0.000 -5.492) 8.102 50.526 ( -1.182 0.000 -3.027) 3.249 50.569 ( 2.176 0.000 -3.027) 3.728 50.937 ( -0.949 0.000 -4.136) 4.244 51.092 ( -13.701 0.000 4.091) 14.299 51.752 ( 0.313 0.000 -0.052) 0.318 51.755 ( 0.461 0.000 -0.008) 0.461 52.291 ( 0.253 0.000 0.186) 0.314 52.295 ( 0.427 0.000 -0.205) 0.474 52.504 ( 0.424 0.000 1.018) 1.102 53.111 ( -3.209 0.000 -10.405) 10.888 53.323 ( 1.395 0.000 2.963) 3.275 53.550 ( -1.013 0.000 -1.647) 1.934 53.895 ( 1.673 0.000 0.601) 1.778 53.916 ( 1.423 0.000 -0.923) 1.696 54.110 ( -2.637 0.000 9.000) 9.378 54.345 ( -0.023 0.000 -1.811) 1.811 55.785 ( 2.528 0.000 2.259) 3.391 55.864 ( 2.988 0.000 -1.596) 3.387 55.919 ( -5.561 0.000 6.965) 8.912 56.300 ( -8.532 0.000 -4.921) 9.849 57.381 ( 0.083 0.000 0.059) 0.102 57.386 ( 0.096 0.000 -0.098) 0.137 57.401 ( 0.183 0.000 0.040) 0.187 57.403 ( 0.186 0.000 -0.018) 0.187 58.182 ( -0.504 0.000 2.106) 2.166 58.295 ( 3.052 0.000 -7.285) 7.898 58.544 ( 1.490 0.000 6.694) 6.858 58.877 ( -3.354 0.000 -0.579) 3.404 60.917 ( 0.110 0.000 0.074) 0.132 60.924 ( 0.120 0.000 -0.104) 0.159 60.939 ( -0.096 0.000 0.077) 0.123 60.949 ( -0.091 0.000 -0.051) 0.104 ======================= Grid point 85 (30/90) ======================= q-point: (-0.50 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.436 ( -9.332 0.000 11.903) 15.125 2.840 ( 5.861 0.000 -2.862) 6.523 2.962 ( -3.337 0.000 -0.474) 3.371 3.062 ( 10.798 0.000 -11.071) 15.465 3.734 ( -16.297 0.000 16.547) 23.225 3.954 ( -0.838 0.000 -6.208) 6.264 4.131 ( 6.052 0.000 -13.380) 14.685 4.332 ( 8.628 0.000 5.206) 10.077 4.385 ( 1.130 0.000 5.998) 6.103 4.632 ( -6.488 0.000 3.086) 7.184 5.077 ( -8.087 0.000 3.112) 8.665 5.260 ( -10.044 0.000 -18.265) 20.845 5.266 ( 6.091 0.000 -3.618) 7.084 5.677 ( -13.433 0.000 3.182) 13.805 5.764 ( -12.521 0.000 -16.429) 20.656 5.835 ( -4.889 0.000 13.288) 14.159 5.924 ( 18.018 0.000 14.912) 23.388 6.092 ( 5.349 0.000 -7.420) 9.147 6.185 ( 27.060 0.000 8.127) 28.254 6.460 ( 14.186 0.000 9.151) 16.881 6.613 ( -18.898 0.000 -12.988) 22.930 6.632 ( -6.494 0.000 1.377) 6.639 6.824 ( 6.808 0.000 6.908) 9.699 6.839 ( 3.741 0.000 7.784) 8.636 6.888 ( 0.123 0.000 1.305) 1.311 7.050 ( 1.329 0.000 -1.907) 2.324 7.203 ( 2.852 0.000 8.218) 8.699 7.279 ( -10.494 0.000 -4.635) 11.472 7.305 ( 0.892 0.000 -3.862) 3.963 7.318 ( 6.065 0.000 -1.854) 6.342 7.450 ( 6.025 0.000 -7.121) 9.328 7.662 ( 2.206 0.000 3.697) 4.305 7.744 ( 2.422 0.000 -7.772) 8.140 7.911 ( 2.027 0.000 8.398) 8.639 7.999 ( 7.709 0.000 7.337) 10.642 8.244 ( -9.051 0.000 -7.378) 11.677 8.533 ( -15.491 0.000 -20.538) 25.725 8.542 ( -0.607 0.000 0.517) 0.797 8.771 ( -3.294 0.000 -12.495) 12.922 8.793 ( 1.099 0.000 -6.074) 6.173 9.131 ( 4.367 0.000 8.253) 9.338 9.174 ( -1.251 0.000 4.753) 4.915 9.323 ( -3.166 0.000 5.395) 6.255 9.390 ( -1.456 0.000 -3.622) 3.904 9.402 ( -4.248 0.000 11.547) 12.303 9.600 ( -0.143 0.000 3.787) 3.790 9.835 ( -2.728 0.000 -9.391) 9.779 9.856 ( -6.475 0.000 -1.763) 6.711 9.984 ( 0.935 0.000 11.626) 11.663 10.226 ( 5.888 0.000 6.172) 8.530 10.547 ( 3.697 0.000 -9.257) 9.968 10.563 ( -0.386 0.000 -8.290) 8.299 10.653 ( 1.178 0.000 4.152) 4.316 10.710 ( -8.405 0.000 3.570) 9.131 10.823 ( 3.876 0.000 1.089) 4.026 10.929 ( -0.005 0.000 -4.019) 4.019 10.932 ( 6.020 0.000 4.506) 7.519 11.109 ( -2.817 0.000 1.552) 3.216 11.178 ( 5.102 0.000 2.512) 5.687 11.332 ( 6.792 0.000 -0.149) 6.793 11.591 ( 3.806 0.000 -3.066) 4.887 11.612 ( -0.306 0.000 -0.866) 0.918 11.850 ( -1.322 0.000 6.777) 6.904 11.896 ( -7.030 0.000 7.427) 10.226 12.148 ( -0.002 0.000 -3.151) 3.151 12.288 ( -0.923 0.000 -6.981) 7.042 12.495 ( 1.168 0.000 7.752) 7.840 12.698 ( 0.774 0.000 2.003) 2.148 12.795 ( 1.907 0.000 -2.117) 2.849 12.989 ( -3.751 0.000 -8.185) 9.003 13.205 ( 1.910 0.000 -0.276) 1.930 13.219 ( -0.328 0.000 -1.690) 1.721 13.286 ( 4.426 0.000 3.464) 5.620 13.485 ( -7.287 0.000 -7.343) 10.345 13.791 ( -0.602 0.000 -1.016) 1.181 13.861 ( 1.603 0.000 -5.874) 6.089 14.073 ( -5.619 0.000 2.768) 6.264 14.115 ( 2.901 0.000 0.792) 3.007 14.256 ( 3.056 0.000 7.485) 8.085 14.420 ( -0.720 0.000 -0.806) 1.081 16.522 ( -2.446 0.000 4.497) 5.119 16.739 ( 2.276 0.000 -4.142) 4.726 17.607 ( 1.113 0.000 -0.238) 1.138 17.626 ( -1.366 0.000 -0.914) 1.643 17.917 ( 1.744 0.000 3.511) 3.920 18.088 ( -3.359 0.000 -3.609) 4.931 18.153 ( 2.170 0.000 1.090) 2.428 18.233 ( -0.467 0.000 -2.092) 2.144 20.124 ( 0.005 0.000 0.309) 0.309 20.140 ( -0.107 0.000 -0.362) 0.377 20.683 ( -8.327 0.000 0.591) 8.348 20.716 ( 4.189 0.000 -0.578) 4.228 20.757 ( 4.469 0.000 4.114) 6.074 20.951 ( -1.389 0.000 -4.003) 4.237 21.940 ( -0.270 0.000 1.081) 1.114 21.983 ( 0.358 0.000 -0.700) 0.786 22.468 ( 1.197 0.000 2.136) 2.448 22.605 ( -1.160 0.000 -4.316) 4.469 22.775 ( -0.593 0.000 3.055) 3.112 22.842 ( 0.516 0.000 -0.575) 0.772 23.155 ( -0.559 0.000 0.135) 0.575 23.163 ( 0.502 0.000 -0.194) 0.538 23.518 ( -0.083 0.000 1.259) 1.262 23.587 ( 0.358 0.000 -1.562) 1.603 24.248 ( -2.735 0.000 3.077) 4.117 24.420 ( 4.178 0.000 -4.440) 6.097 24.810 ( -3.900 0.000 4.070) 5.636 24.949 ( 2.340 0.000 -2.110) 3.151 27.032 ( 0.997 0.000 1.534) 1.829 27.087 ( -1.507 0.000 0.076) 1.509 27.120 ( 0.695 0.000 0.963) 1.188 27.210 ( 2.750 0.000 -0.900) 2.894 27.223 ( -1.594 0.000 -2.110) 2.644 27.259 ( -0.383 0.000 -7.025) 7.036 27.599 ( 1.589 0.000 5.312) 5.545 27.756 ( 0.718 0.000 -3.103) 3.184 27.884 ( 1.330 0.000 0.679) 1.493 27.899 ( -3.021 0.000 0.674) 3.095 27.984 ( 3.421 0.000 8.023) 8.722 28.208 ( -2.706 0.000 -2.263) 3.527 28.343 ( 1.639 0.000 3.128) 3.531 28.524 ( -1.290 0.000 -4.376) 4.562 28.861 ( 0.817 0.000 1.921) 2.087 28.970 ( -1.517 0.000 -2.351) 2.798 29.312 ( 1.616 0.000 2.913) 3.331 29.411 ( -0.976 0.000 -1.351) 1.667 29.500 ( -0.484 0.000 1.040) 1.147 29.567 ( -0.409 0.000 -1.587) 1.639 30.644 ( 0.027 0.000 0.195) 0.197 30.654 ( 0.020 0.000 -0.203) 0.204 30.734 ( 0.820 0.000 0.097) 0.826 30.735 ( -0.847 0.000 0.047) 0.848 33.845 ( -0.485 0.000 0.414) 0.638 33.875 ( 1.048 0.000 -1.060) 1.490 33.969 ( -1.036 0.000 2.008) 2.260 34.044 ( 0.270 0.000 -1.270) 1.299 37.278 ( 0.203 0.000 0.226) 0.304 37.294 ( -0.382 0.000 -0.493) 0.624 37.345 ( 0.111 0.000 0.473) 0.486 37.358 ( 0.045 0.000 -0.157) 0.163 37.548 ( -0.054 0.000 2.086) 2.087 37.644 ( 0.836 0.000 -1.681) 1.878 37.863 ( 1.425 0.000 0.156) 1.434 37.887 ( -2.111 0.000 -0.984) 2.330 49.335 ( 0.493 0.000 -0.838) 0.972 49.358 ( 0.362 0.000 -2.366) 2.394 49.676 ( -4.429 0.000 6.544) 7.902 49.840 ( 5.331 0.000 -0.135) 5.332 50.524 ( 1.116 0.000 -1.275) 1.695 50.610 ( 2.889 0.000 -6.987) 7.560 50.867 ( -8.774 0.000 4.328) 9.784 50.955 ( 3.303 0.000 -0.820) 3.404 51.755 ( -0.024 0.000 -0.033) 0.041 51.758 ( -0.138 0.000 -0.158) 0.210 52.294 ( -0.024 0.000 0.166) 0.168 52.301 ( 0.160 0.000 -0.115) 0.197 52.563 ( 3.994 0.000 6.108) 7.298 52.997 ( -4.351 0.000 -14.360) 15.005 53.346 ( -0.097 0.000 3.698) 3.699 53.513 ( -2.165 0.000 -1.539) 2.657 53.897 ( -1.369 0.000 0.179) 1.381 53.932 ( 0.273 0.000 -0.731) 0.781 54.127 ( 1.509 0.000 8.186) 8.323 54.341 ( 0.280 0.000 -2.302) 2.319 55.822 ( -1.914 0.000 1.918) 2.710 55.883 ( 2.513 0.000 6.473) 6.944 55.906 ( 0.436 0.000 -1.530) 1.591 56.180 ( -0.146 0.000 -5.634) 5.636 57.382 ( 0.009 0.000 0.083) 0.083 57.387 ( -0.014 0.000 -0.131) 0.131 57.403 ( 0.005 0.000 0.056) 0.056 57.405 ( -0.006 0.000 -0.032) 0.032 58.176 ( -0.837 0.000 1.732) 1.924 58.318 ( 1.021 0.000 -5.766) 5.855 58.599 ( 2.005 0.000 7.597) 7.857 58.815 ( -1.869 0.000 -2.946) 3.489 60.919 ( 0.011 0.000 0.090) 0.091 60.925 ( -0.060 0.000 -0.166) 0.176 60.939 ( 0.120 0.000 0.212) 0.244 60.947 ( -0.073 0.000 -0.139) 0.157 ======================= Grid point 86 (31/90) ======================= q-point: (-0.38 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.323 ( -6.786 0.000 4.295) 8.031 2.772 ( -13.762 0.000 -12.326) 18.475 2.818 ( -10.258 0.000 4.945) 11.388 3.124 ( -27.409 0.000 21.123) 34.604 3.300 ( 12.232 0.000 -4.148) 12.916 3.816 ( -8.714 0.000 -14.792) 17.168 4.189 ( -15.564 0.000 -3.993) 16.068 4.298 ( -9.971 0.000 11.705) 15.376 4.405 ( -13.446 0.000 0.748) 13.466 4.684 ( 1.543 0.000 11.912) 12.012 4.845 ( -7.996 0.000 -14.101) 16.211 4.984 ( -12.956 0.000 4.742) 13.796 5.082 ( -18.484 0.000 -4.477) 19.018 5.346 ( -5.712 0.000 2.897) 6.405 5.448 ( -10.043 0.000 7.103) 12.301 5.777 ( -3.289 0.000 -6.257) 7.069 6.048 ( -6.050 0.000 -6.218) 8.675 6.171 ( -9.743 0.000 3.144) 10.237 6.311 ( -7.323 0.000 -12.568) 14.546 6.501 ( 11.287 0.000 13.925) 17.925 6.621 ( -7.573 0.000 3.977) 8.554 6.626 ( 5.955 0.000 8.861) 10.676 6.786 ( -10.867 0.000 -8.136) 13.575 6.845 ( 4.244 0.000 5.151) 6.675 6.928 ( 6.551 0.000 -1.518) 6.724 7.060 ( -2.500 0.000 -10.366) 10.663 7.134 ( 4.741 0.000 -2.301) 5.269 7.204 ( -4.633 0.000 2.722) 5.373 7.406 ( 5.231 0.000 5.421) 7.534 7.433 ( 3.431 0.000 -0.944) 3.558 7.561 ( 4.799 0.000 -4.331) 6.465 7.617 ( -14.626 0.000 -20.058) 24.824 7.910 ( 0.070 0.000 -3.113) 3.114 7.974 ( 16.018 0.000 13.828) 21.161 8.052 ( -4.595 0.000 -2.893) 5.430 8.142 ( 3.742 0.000 9.454) 10.167 8.254 ( -4.260 0.000 -4.980) 6.553 8.500 ( -3.236 0.000 5.777) 6.622 8.707 ( 1.427 0.000 -17.562) 17.620 8.805 ( 1.221 0.000 -4.773) 4.927 9.208 ( -9.261 0.000 12.847) 15.837 9.217 ( 4.338 0.000 3.760) 5.740 9.224 ( -0.754 0.000 9.782) 9.811 9.341 ( -2.428 0.000 -2.513) 3.494 9.445 ( 7.207 0.000 4.731) 8.621 9.559 ( -4.385 0.000 2.483) 5.039 9.695 ( -7.424 0.000 -1.809) 7.641 9.763 ( -1.797 0.000 -6.125) 6.383 10.060 ( 4.773 0.000 9.802) 10.902 10.367 ( 3.791 0.000 0.275) 3.800 10.472 ( -3.209 0.000 -0.256) 3.219 10.540 ( -5.363 0.000 -2.015) 5.729 10.612 ( 2.504 0.000 -3.664) 4.438 10.741 ( 3.474 0.000 -7.868) 8.601 10.801 ( 2.067 0.000 4.530) 4.979 10.944 ( 0.113 0.000 -2.534) 2.536 11.094 ( 1.704 0.000 3.731) 4.102 11.129 ( 4.918 0.000 4.556) 6.704 11.212 ( -0.860 0.000 -4.098) 4.187 11.349 ( -6.091 0.000 -10.310) 11.975 11.626 ( 1.044 0.000 2.598) 2.800 11.694 ( 7.849 0.000 -1.090) 7.924 11.927 ( 6.105 0.000 7.121) 9.380 12.015 ( 14.241 0.000 12.774) 19.131 12.190 ( 3.290 0.000 1.030) 3.447 12.298 ( 3.877 0.000 -10.006) 10.731 12.528 ( 0.720 0.000 5.661) 5.706 12.672 ( -4.368 0.000 -2.470) 5.018 12.847 ( 4.327 0.000 3.028) 5.281 12.881 ( -3.985 0.000 -7.482) 8.477 13.179 ( -2.652 0.000 -0.680) 2.737 13.262 ( -0.083 0.000 1.274) 1.277 13.368 ( 1.193 0.000 -13.304) 13.358 13.438 ( 8.400 0.000 5.107) 9.831 13.780 ( -0.044 0.000 -2.125) 2.125 13.862 ( -0.057 0.000 -1.839) 1.840 13.980 ( -3.748 0.000 0.357) 3.765 14.189 ( 3.457 0.000 3.258) 4.751 14.320 ( 0.833 0.000 5.753) 5.813 14.383 ( -2.484 0.000 -3.231) 4.076 16.499 ( -0.671 0.000 2.655) 2.739 16.770 ( 1.507 0.000 -2.169) 2.641 17.576 ( -3.187 0.000 -3.475) 4.715 17.577 ( -4.066 0.000 1.776) 4.437 17.996 ( 4.275 0.000 4.510) 6.215 18.014 ( -2.406 0.000 -2.786) 3.681 18.211 ( -0.844 0.000 -2.710) 2.838 18.212 ( 3.249 0.000 -0.249) 3.258 20.143 ( 1.712 0.000 0.409) 1.760 20.158 ( 1.896 0.000 -0.455) 1.950 20.505 ( -7.341 0.000 1.320) 7.459 20.752 ( -0.526 0.000 1.576) 1.661 20.887 ( 5.783 0.000 2.477) 6.291 20.991 ( 5.459 0.000 -4.338) 6.973 21.822 ( -10.542 0.000 1.124) 10.601 21.874 ( -9.964 0.000 -0.749) 9.992 22.496 ( 1.128 0.000 3.312) 3.499 22.566 ( -1.213 0.000 -5.319) 5.455 22.766 ( -0.922 0.000 2.711) 2.864 22.858 ( 1.087 0.000 -0.199) 1.105 23.038 ( -6.414 0.000 0.115) 6.415 23.060 ( -6.471 0.000 -0.215) 6.475 23.697 ( 11.667 0.000 0.739) 11.691 23.787 ( 14.089 0.000 -1.013) 14.125 24.241 ( 1.786 0.000 0.512) 1.857 24.496 ( 2.978 0.000 -0.342) 2.997 24.832 ( 6.085 0.000 0.337) 6.095 25.034 ( 5.902 0.000 0.041) 5.902 27.020 ( -3.661 0.000 0.319) 3.675 27.047 ( -0.632 0.000 1.455) 1.586 27.126 ( -0.268 0.000 -2.284) 2.299 27.162 ( -2.136 0.000 -1.388) 2.547 27.246 ( 3.498 0.000 -2.188) 4.127 27.360 ( 7.337 0.000 -3.404) 8.088 27.656 ( 2.480 0.000 3.397) 4.206 27.781 ( 2.740 0.000 -3.914) 4.777 27.836 ( -3.034 0.000 -0.434) 3.065 27.900 ( -0.365 0.000 2.738) 2.762 28.093 ( 4.616 0.000 11.583) 12.469 28.125 ( -3.850 0.000 -5.036) 6.339 28.373 ( 0.177 0.000 4.586) 4.589 28.478 ( -1.477 0.000 -5.588) 5.779 28.857 ( -1.963 0.000 2.914) 3.513 28.893 ( -4.714 0.000 -2.652) 5.409 29.345 ( 0.741 0.000 5.277) 5.329 29.377 ( -1.704 0.000 -2.511) 3.034 29.466 ( -2.847 0.000 1.372) 3.160 29.536 ( -2.663 0.000 -2.138) 3.415 30.645 ( 0.007 0.000 0.182) 0.182 30.653 ( -0.019 0.000 -0.270) 0.271 30.708 ( -1.593 0.000 -0.379) 1.638 30.748 ( 0.514 0.000 0.741) 0.902 33.846 ( 0.552 0.000 -0.111) 0.563 33.895 ( 1.064 0.000 -0.548) 1.197 33.954 ( -0.822 0.000 2.163) 2.313 34.049 ( 0.479 0.000 -1.164) 1.259 37.273 ( -0.724 0.000 0.447) 0.851 37.273 ( -1.285 0.000 -0.450) 1.362 37.341 ( -0.536 0.000 0.469) 0.713 37.355 ( -0.340 0.000 -0.323) 0.469 37.546 ( -0.570 0.000 2.022) 2.101 37.652 ( 0.315 0.000 -1.680) 1.710 37.829 ( -3.029 0.000 -2.961) 4.236 37.881 ( -0.083 0.000 1.471) 1.473 49.267 ( -6.279 0.000 -0.348) 6.288 49.286 ( -6.277 0.000 -3.018) 6.965 49.517 ( -11.507 0.000 5.129) 12.598 49.957 ( 5.436 0.000 2.832) 6.129 50.550 ( 1.483 0.000 -1.041) 1.812 50.621 ( -0.207 0.000 -14.919) 14.920 50.754 ( -3.401 0.000 4.754) 5.845 51.071 ( 7.480 0.000 2.893) 8.019 51.750 ( -0.582 0.000 -0.115) 0.594 51.750 ( -0.403 0.000 0.062) 0.407 52.291 ( -0.249 0.000 0.071) 0.259 52.301 ( -0.122 0.000 -0.091) 0.152 52.685 ( 5.071 0.000 9.271) 10.567 52.852 ( -5.036 0.000 -17.777) 18.477 53.338 ( -1.819 0.000 4.158) 4.539 53.451 ( -3.325 0.000 -1.282) 3.564 53.861 ( -1.860 0.000 1.117) 2.169 53.920 ( -1.264 0.000 -0.562) 1.383 54.191 ( 2.298 0.000 6.256) 6.664 54.347 ( 0.878 0.000 -2.024) 2.206 55.776 ( -2.287 0.000 2.034) 3.061 55.866 ( -2.896 0.000 -1.448) 3.238 55.997 ( 5.789 0.000 8.446) 10.240 56.279 ( 10.212 0.000 -6.480) 12.095 57.381 ( -0.069 0.000 0.098) 0.119 57.385 ( -0.121 0.000 -0.134) 0.180 57.402 ( -0.162 0.000 0.056) 0.172 57.403 ( -0.202 0.000 -0.036) 0.206 58.154 ( -1.457 0.000 0.873) 1.698 58.314 ( 0.178 0.000 -4.793) 4.796 58.677 ( 3.270 0.000 9.749) 10.283 58.780 ( -0.700 0.000 -4.897) 4.947 60.918 ( -0.113 0.000 0.124) 0.168 60.922 ( -0.126 0.000 -0.143) 0.191 60.943 ( 0.188 0.000 0.219) 0.288 60.946 ( 0.005 0.000 -0.204) 0.204 ======================= Grid point 87 (32/90) ======================= q-point: (-0.25 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.899 ( -32.026 0.000 13.871) 34.901 2.336 ( -37.996 0.000 16.406) 41.387 2.603 ( -1.078 0.000 -15.539) 15.576 2.852 ( -6.043 0.000 22.235) 23.042 3.346 ( -63.572 0.000 7.958) 64.068 3.361 ( -8.444 0.000 -20.897) 22.539 3.686 ( -4.210 0.000 -6.691) 7.905 3.891 ( -1.641 0.000 -7.490) 7.667 4.069 ( -17.532 0.000 16.165) 23.847 4.452 ( -17.141 0.000 -4.752) 17.787 4.605 ( -17.057 0.000 4.407) 17.617 4.878 ( -14.782 0.000 -1.915) 14.906 5.016 ( 7.874 0.000 9.481) 12.324 5.258 ( -9.570 0.000 7.065) 11.896 5.396 ( 2.337 0.000 2.749) 3.608 5.628 ( -7.134 0.000 -8.268) 10.921 5.893 ( -16.427 0.000 -3.472) 16.790 5.894 ( -4.639 0.000 -5.623) 7.290 6.126 ( -9.386 0.000 -6.711) 11.539 6.246 ( -13.283 0.000 -20.503) 24.429 6.395 ( -6.137 0.000 -0.313) 6.145 6.793 ( 7.796 0.000 0.874) 7.845 6.917 ( 6.500 0.000 13.583) 15.059 6.949 ( -1.950 0.000 -3.374) 3.897 7.004 ( -0.064 0.000 -13.079) 13.079 7.117 ( 11.222 0.000 2.166) 11.430 7.125 ( -0.692 0.000 -0.388) 0.793 7.220 ( 4.031 0.000 -7.032) 8.106 7.332 ( -3.097 0.000 -5.675) 6.465 7.455 ( 0.782 0.000 8.351) 8.388 7.489 ( 0.855 0.000 0.835) 1.195 7.716 ( 8.878 0.000 -1.401) 8.988 7.851 ( -6.596 0.000 -3.692) 7.559 7.979 ( 2.381 0.000 -3.291) 4.062 8.096 ( -1.759 0.000 7.452) 7.657 8.264 ( 2.364 0.000 7.863) 8.210 8.278 ( 2.212 0.000 6.864) 7.211 8.499 ( 1.415 0.000 4.429) 4.650 8.663 ( -4.133 0.000 -4.809) 6.341 8.825 ( 1.779 0.000 -2.878) 3.384 9.033 ( -10.149 0.000 20.762) 23.110 9.179 ( -4.458 0.000 1.104) 4.593 9.264 ( -5.219 0.000 0.430) 5.237 9.355 ( 6.609 0.000 -2.452) 7.049 9.468 ( -2.510 0.000 -2.525) 3.561 9.592 ( -1.466 0.000 1.689) 2.237 9.604 ( 2.901 0.000 -1.094) 3.100 9.767 ( 4.699 0.000 -0.219) 4.704 10.240 ( 7.550 0.000 7.025) 10.313 10.258 ( -10.610 0.000 -1.666) 10.740 10.462 ( 3.302 0.000 1.246) 3.529 10.498 ( 1.401 0.000 -4.169) 4.399 10.742 ( -1.204 0.000 -9.754) 9.828 10.748 ( 8.722 0.000 6.639) 10.962 10.872 ( -4.027 0.000 -1.179) 4.196 10.914 ( 3.517 0.000 -2.011) 4.051 11.092 ( -5.584 0.000 -8.716) 10.351 11.139 ( -0.633 0.000 0.481) 0.795 11.234 ( 6.147 0.000 -0.914) 6.215 11.285 ( 4.670 0.000 4.437) 6.441 11.716 ( 5.178 0.000 6.535) 8.338 11.838 ( 5.440 0.000 -1.329) 5.600 12.055 ( 3.364 0.000 5.435) 6.391 12.169 ( -2.715 0.000 -1.595) 3.149 12.350 ( 2.173 0.000 -12.813) 12.995 12.363 ( 7.728 0.000 10.502) 13.039 12.559 ( -3.472 0.000 -5.827) 6.783 12.583 ( 4.012 0.000 1.196) 4.187 12.823 ( 0.735 0.000 -1.535) 1.702 12.941 ( 2.338 0.000 -0.801) 2.471 13.127 ( -1.728 0.000 -1.376) 2.209 13.172 ( -5.430 0.000 -0.899) 5.504 13.452 ( 6.713 0.000 -13.583) 15.152 13.642 ( 8.495 0.000 9.245) 12.555 13.779 ( 0.567 0.000 -1.553) 1.653 13.871 ( 0.877 0.000 4.517) 4.601 13.909 ( -2.722 0.000 -3.593) 4.508 14.267 ( 2.619 0.000 4.023) 4.801 14.294 ( -4.769 0.000 -6.336) 7.930 14.313 ( -2.868 0.000 3.980) 4.906 16.507 ( 0.966 0.000 0.090) 0.970 16.783 ( -0.375 0.000 -0.677) 0.774 17.452 ( -8.357 0.000 4.073) 9.297 17.465 ( -5.512 0.000 -7.385) 9.215 17.987 ( 0.299 0.000 -0.677) 0.740 18.105 ( 4.651 0.000 4.528) 6.491 18.189 ( -0.370 0.000 -3.177) 3.198 18.282 ( 3.511 0.000 -1.289) 3.740 20.191 ( 2.517 0.000 0.835) 2.652 20.214 ( 3.507 0.000 -0.497) 3.542 20.413 ( -1.665 0.000 4.150) 4.471 20.746 ( 0.015 0.000 1.277) 1.277 20.995 ( 3.672 0.000 2.171) 4.266 21.087 ( 3.893 0.000 -3.378) 5.154 21.560 ( -13.440 0.000 1.618) 13.537 21.616 ( -12.918 0.000 -1.057) 12.961 22.521 ( -1.678 0.000 -6.301) 6.521 22.544 ( 2.557 0.000 3.775) 4.560 22.757 ( -0.658 0.000 2.715) 2.794 22.878 ( 0.461 0.000 0.643) 0.791 22.938 ( -3.401 0.000 0.128) 3.404 22.954 ( -3.640 0.000 -0.399) 3.662 23.913 ( 8.470 0.000 -0.544) 8.487 24.017 ( 6.210 0.000 1.513) 6.392 24.351 ( 9.382 0.000 -3.965) 10.186 24.530 ( 0.017 0.000 4.153) 4.153 25.051 ( 13.733 0.000 -2.957) 14.047 25.183 ( 7.526 0.000 2.165) 7.831 26.945 ( -3.627 0.000 1.061) 3.779 27.001 ( -3.045 0.000 -1.049) 3.221 27.136 ( 2.928 0.000 -5.120) 5.898 27.156 ( 0.748 0.000 2.279) 2.399 27.318 ( 3.908 0.000 -3.568) 5.292 27.509 ( 7.173 0.000 -4.229) 8.327 27.718 ( 2.771 0.000 2.437) 3.690 27.771 ( -2.081 0.000 -3.180) 3.800 27.850 ( 3.992 0.000 -2.688) 4.812 27.884 ( -1.955 0.000 4.629) 5.025 28.048 ( -0.940 0.000 -6.790) 6.855 28.250 ( 7.252 0.000 11.212) 13.353 28.380 ( -0.718 0.000 5.494) 5.541 28.450 ( 0.922 0.000 -4.135) 4.236 28.772 ( -5.976 0.000 -1.612) 6.190 28.791 ( -5.171 0.000 2.912) 5.934 29.321 ( -3.673 0.000 -3.688) 5.205 29.378 ( -0.957 0.000 2.066) 2.277 29.421 ( 0.355 0.000 10.662) 10.667 29.433 ( -5.921 0.000 -2.065) 6.271 30.643 ( -0.391 0.000 0.019) 0.391 30.652 ( 0.010 0.000 -0.307) 0.307 30.674 ( -1.215 0.000 -0.203) 1.232 30.761 ( 0.473 0.000 0.947) 1.058 33.870 ( 2.012 0.000 -0.650) 2.114 33.918 ( 1.209 0.000 0.861) 1.484 33.954 ( 0.276 0.000 3.008) 3.020 34.052 ( -0.052 0.000 -1.271) 1.272 37.246 ( -1.097 0.000 -0.228) 1.120 37.253 ( -1.216 0.000 0.561) 1.339 37.328 ( -0.847 0.000 0.617) 1.048 37.340 ( -0.983 0.000 -1.157) 1.519 37.542 ( -0.215 0.000 2.045) 2.056 37.643 ( -0.884 0.000 -3.523) 3.633 37.742 ( -4.231 0.000 -4.417) 6.116 37.862 ( -2.362 0.000 2.293) 3.291 49.107 ( -8.128 0.000 -0.289) 8.133 49.108 ( -8.896 0.000 -3.016) 9.394 49.254 ( -14.500 0.000 6.166) 15.756 50.063 ( 2.485 0.000 -6.688) 7.135 50.497 ( -6.192 0.000 -18.461) 19.472 50.578 ( 1.562 0.000 -1.804) 2.386 50.714 ( -2.212 0.000 5.117) 5.574 51.268 ( 9.578 0.000 5.891) 11.244 51.736 ( -0.656 0.000 0.085) 0.661 51.740 ( -0.581 0.000 0.126) 0.594 52.285 ( -0.281 0.000 -0.080) 0.292 52.295 ( -0.350 0.000 -0.240) 0.424 52.700 ( -4.495 0.000 -16.274) 16.883 52.809 ( 3.887 0.000 9.769) 10.513 53.286 ( -4.465 0.000 3.865) 5.905 53.370 ( -4.028 0.000 -1.053) 4.164 53.830 ( -1.450 0.000 1.312) 1.956 53.879 ( -2.237 0.000 -0.666) 2.334 54.251 ( 2.009 0.000 4.769) 5.175 54.363 ( 0.917 0.000 -0.797) 1.215 55.740 ( -1.656 0.000 1.685) 2.363 55.807 ( -2.154 0.000 -1.384) 2.560 56.171 ( 8.266 0.000 13.006) 15.410 56.531 ( 14.549 0.000 -5.368) 15.508 57.380 ( -0.084 0.000 0.095) 0.127 57.382 ( -0.142 0.000 -0.110) 0.180 57.397 ( -0.310 0.000 -0.038) 0.312 57.397 ( -0.244 0.000 0.043) 0.247 58.142 ( 1.184 0.000 -1.074) 1.599 58.308 ( 0.559 0.000 -3.658) 3.700 58.741 ( -1.993 0.000 -6.311) 6.618 58.800 ( 5.931 0.000 12.892) 14.191 60.915 ( -0.166 0.000 0.146) 0.221 60.919 ( -0.109 0.000 -0.117) 0.160 60.946 ( 0.077 0.000 -0.195) 0.210 60.948 ( 0.142 0.000 0.161) 0.214 ======================= Grid point 88 (33/90) ======================= q-point: (-0.12 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.322 ( -30.710 0.000 33.961) 45.787 1.483 ( -45.168 0.000 28.555) 53.438 1.996 ( -55.022 0.000 48.601) 73.413 2.466 ( -3.828 0.000 -21.554) 21.891 2.865 ( -24.832 0.000 -25.885) 35.870 3.130 ( 16.918 0.000 1.675) 17.001 3.657 ( 4.703 0.000 -4.546) 6.541 3.739 ( -16.917 0.000 16.749) 23.806 3.979 ( -4.331 0.000 2.045) 4.790 4.108 ( -4.758 0.000 -9.062) 10.235 4.269 ( -12.897 0.000 3.416) 13.342 4.484 ( -21.556 0.000 3.797) 21.888 5.006 ( -6.378 0.000 -7.629) 9.944 5.138 ( -7.537 0.000 -16.739) 18.358 5.172 ( -16.291 0.000 -3.340) 16.630 5.426 ( -9.337 0.000 -12.557) 15.648 5.661 ( 3.187 0.000 -3.344) 4.619 5.854 ( -5.088 0.000 11.747) 12.802 6.082 ( 9.541 0.000 -4.912) 10.731 6.119 ( -2.674 0.000 9.381) 9.755 6.364 ( 0.943 0.000 -7.327) 7.387 6.754 ( -5.672 0.000 -9.369) 10.953 6.834 ( -4.880 0.000 1.197) 5.024 6.988 ( -1.640 0.000 5.454) 5.695 7.078 ( 6.529 0.000 -12.704) 14.283 7.117 ( -0.312 0.000 -2.086) 2.110 7.286 ( -0.217 0.000 -1.572) 1.587 7.332 ( 7.448 0.000 -0.708) 7.482 7.377 ( 10.733 0.000 -3.682) 11.347 7.519 ( 2.634 0.000 0.785) 2.748 7.572 ( 6.163 0.000 -2.063) 6.499 7.808 ( 2.303 0.000 1.449) 2.721 7.871 ( 3.845 0.000 1.251) 4.043 8.021 ( 1.552 0.000 1.434) 2.113 8.087 ( -0.057 0.000 -0.440) 0.444 8.244 ( -2.856 0.000 -6.098) 6.734 8.326 ( -0.029 0.000 7.815) 7.815 8.463 ( -7.811 0.000 4.128) 8.834 8.624 ( 4.833 0.000 19.935) 20.513 8.838 ( -1.267 0.000 9.554) 9.638 8.968 ( -1.775 0.000 15.266) 15.369 9.079 ( -1.941 0.000 -5.913) 6.224 9.119 ( -7.958 0.000 1.216) 8.050 9.409 ( 0.802 0.000 -2.859) 2.970 9.479 ( 2.330 0.000 -4.546) 5.109 9.585 ( -1.793 0.000 -4.612) 4.949 9.647 ( 5.523 0.000 -2.186) 5.940 9.830 ( -4.193 0.000 0.498) 4.222 10.064 ( -4.481 0.000 6.478) 7.876 10.304 ( -1.183 0.000 -3.531) 3.724 10.536 ( 2.907 0.000 -4.157) 5.073 10.583 ( -1.166 0.000 2.706) 2.947 10.639 ( 1.445 0.000 -2.321) 2.734 10.760 ( -8.473 0.000 -11.547) 14.322 10.922 ( 8.540 0.000 2.120) 8.799 10.982 ( 9.710 0.000 4.063) 10.526 11.096 ( 1.009 0.000 6.204) 6.286 11.162 ( 3.269 0.000 8.109) 8.743 11.371 ( 6.086 0.000 0.735) 6.130 11.488 ( 12.085 0.000 4.688) 12.962 11.798 ( -0.230 0.000 0.601) 0.643 11.876 ( -3.304 0.000 -0.787) 3.397 12.039 ( -5.323 0.000 -6.307) 8.253 12.084 ( -0.617 0.000 -3.474) 3.528 12.279 ( -6.103 0.000 -4.251) 7.438 12.436 ( -1.204 0.000 4.560) 4.716 12.500 ( -2.548 0.000 -16.097) 16.298 12.659 ( 1.870 0.000 -0.810) 2.038 12.866 ( -8.469 0.000 -4.904) 9.787 12.871 ( 1.848 0.000 3.370) 3.844 13.046 ( -6.057 0.000 -1.390) 6.215 13.095 ( -1.109 0.000 -4.343) 4.482 13.557 ( 7.395 0.000 -2.621) 7.846 13.798 ( 1.453 0.000 0.487) 1.533 13.803 ( 3.332 0.000 9.123) 9.712 13.839 ( -2.832 0.000 -2.027) 3.483 13.942 ( 4.111 0.000 6.752) 7.905 14.168 ( -4.397 0.000 -5.587) 7.110 14.226 ( -5.999 0.000 3.209) 6.803 14.307 ( 0.178 0.000 2.659) 2.664 16.542 ( 3.026 0.000 -3.057) 4.301 16.705 ( -8.042 0.000 -2.789) 8.512 17.276 ( -8.927 0.000 5.330) 10.397 17.358 ( -1.363 0.000 -7.012) 7.143 18.009 ( 1.299 0.000 1.069) 1.683 18.174 ( -0.456 0.000 -2.036) 2.086 18.204 ( 3.365 0.000 2.880) 4.429 18.344 ( 2.786 0.000 -1.549) 3.188 20.255 ( 3.518 0.000 2.620) 4.386 20.291 ( 3.520 0.000 -0.419) 3.544 20.479 ( 7.095 0.000 8.661) 11.196 20.755 ( 0.097 0.000 1.427) 1.431 21.040 ( -0.277 0.000 2.739) 2.753 21.122 ( 0.620 0.000 -3.652) 3.704 21.324 ( -8.583 0.000 2.391) 8.909 21.394 ( -6.822 0.000 -1.038) 6.901 22.461 ( -1.892 0.000 -4.117) 4.531 22.615 ( 2.663 0.000 2.764) 3.838 22.752 ( -0.570 0.000 2.550) 2.613 22.867 ( -2.018 0.000 0.813) 2.175 22.887 ( -1.587 0.000 0.127) 1.592 22.890 ( -2.395 0.000 -0.291) 2.412 24.049 ( 5.139 0.000 -1.464) 5.343 24.081 ( 0.591 0.000 1.892) 1.982 24.526 ( -1.670 0.000 5.198) 5.459 24.549 ( 9.253 0.000 -5.482) 10.755 25.321 ( 11.472 0.000 -2.845) 11.820 25.327 ( 4.607 0.000 3.299) 5.667 26.879 ( -2.847 0.000 1.633) 3.282 26.942 ( -1.915 0.000 -1.592) 2.491 27.182 ( 0.860 0.000 2.861) 2.988 27.216 ( 4.578 0.000 -3.157) 5.561 27.400 ( 4.764 0.000 -2.537) 5.398 27.599 ( 2.471 0.000 -4.706) 5.315 27.763 ( 3.882 0.000 -6.667) 7.714 27.770 ( 0.489 0.000 0.804) 0.941 27.875 ( 0.810 0.000 5.163) 5.226 27.895 ( 1.516 0.000 -2.522) 2.943 28.094 ( 6.504 0.000 -6.770) 9.388 28.375 ( 2.026 0.000 -3.418) 3.973 28.384 ( -0.240 0.000 4.925) 4.930 28.575 ( 9.769 0.000 3.404) 10.345 28.663 ( -2.585 0.000 -0.293) 2.602 28.673 ( -4.941 0.000 1.890) 5.291 29.138 ( -12.285 0.000 -2.239) 12.487 29.320 ( -2.986 0.000 0.850) 3.105 29.354 ( -1.173 0.000 -1.674) 2.044 29.553 ( 4.331 0.000 6.950) 8.189 30.626 ( -0.877 0.000 -0.207) 0.901 30.654 ( 0.215 0.000 -0.087) 0.232 30.664 ( 0.041 0.000 0.159) 0.164 30.759 ( -1.932 0.000 -2.826) 3.423 33.929 ( 3.733 0.000 -0.673) 3.793 33.951 ( 1.385 0.000 -0.170) 1.395 34.013 ( 5.288 0.000 7.740) 9.374 34.036 ( -1.203 0.000 -1.159) 1.670 37.229 ( -1.154 0.000 0.311) 1.195 37.232 ( -0.116 0.000 -0.296) 0.318 37.291 ( -3.901 0.000 -3.906) 5.520 37.310 ( -1.016 0.000 0.720) 1.246 37.550 ( 0.301 0.000 1.890) 1.914 37.556 ( -5.385 0.000 -7.523) 9.252 37.663 ( -2.040 0.000 1.152) 2.343 37.793 ( -4.553 0.000 1.917) 4.940 48.936 ( -7.287 0.000 0.237) 7.291 48.953 ( -5.956 0.000 -1.634) 6.176 48.980 ( -11.045 0.000 2.931) 11.428 49.605 ( -42.211 0.000 -50.991) 66.196 50.506 ( 5.640 0.000 5.916) 8.174 50.604 ( 1.427 0.000 -2.135) 2.568 50.791 ( 14.560 0.000 23.153) 27.350 51.460 ( 5.718 0.000 6.311) 8.517 51.726 ( -0.366 0.000 0.404) 0.545 51.729 ( -0.450 0.000 0.072) 0.456 52.281 ( -0.073 0.000 -0.271) 0.281 52.285 ( -0.552 0.000 -0.565) 0.790 52.595 ( -1.764 0.000 -5.922) 6.179 52.885 ( 0.258 0.000 7.526) 7.530 53.174 ( -6.224 0.000 1.954) 6.523 53.285 ( -3.521 0.000 -1.362) 3.775 53.808 ( -0.990 0.000 0.937) 1.364 53.835 ( -1.504 0.000 -0.660) 1.642 54.307 ( 2.547 0.000 3.388) 4.239 54.374 ( 0.097 0.000 0.215) 0.236 55.716 ( -1.060 0.000 1.355) 1.720 55.771 ( -0.935 0.000 -1.214) 1.532 56.445 ( 15.194 0.000 17.058) 22.844 56.795 ( 9.708 0.000 -1.170) 9.778 57.379 ( -0.024 0.000 0.060) 0.064 57.379 ( -0.059 0.000 -0.063) 0.086 57.391 ( -0.250 0.000 -0.026) 0.251 57.393 ( -0.197 0.000 0.012) 0.198 58.239 ( 9.080 0.000 -2.188) 9.340 58.322 ( 1.599 0.000 -1.707) 2.338 58.658 ( -3.813 0.000 -6.114) 7.206 58.999 ( 8.396 0.000 8.333) 11.829 60.913 ( -0.124 0.000 0.150) 0.195 60.917 ( -0.051 0.000 -0.104) 0.115 60.948 ( 0.106 0.000 -0.120) 0.161 60.950 ( 0.039 0.000 0.073) 0.083 ======================= Grid point 89 (34/90) ======================= q-point: ( 0.00 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.370 ( 13.283 39.184 26.662) 49.221 1.550 ( -6.781 37.380 36.330) 52.565 2.088 ( 0.564 35.432 57.725) 67.734 2.524 ( -7.179 11.758 -18.677) 23.208 2.774 ( 11.671 23.528 -23.956) 35.548 3.407 ( -3.604 6.487 7.851) 10.803 3.846 ( -3.308 15.458 -0.753) 15.826 3.991 ( 0.511 14.212 -0.189) 14.222 4.084 ( 1.382 20.492 -6.550) 21.558 4.203 ( -2.404 8.990 5.376) 10.747 4.290 ( 11.376 15.472 -0.391) 19.208 4.433 ( -1.780 18.775 4.536) 19.398 4.816 ( -5.938 0.725 -23.844) 24.583 4.938 ( -3.901 9.824 -27.675) 29.625 5.140 ( -1.802 13.324 0.255) 13.448 5.404 ( -0.384 8.758 -12.922) 15.615 5.767 ( -8.680 -0.456 13.066) 15.693 5.815 ( 4.252 1.626 12.935) 13.712 6.149 ( 4.547 -0.898 6.106) 7.666 6.217 ( 7.608 -3.560 1.423) 8.519 6.393 ( -2.165 2.381 -6.439) 7.198 6.559 ( -7.706 -6.217 -7.275) 12.286 6.744 ( 1.776 -7.089 5.099) 8.911 6.837 ( -4.747 -1.724 -1.175) 5.185 6.932 ( 1.377 -6.318 -2.454) 6.916 7.060 ( -7.006 -7.866 -1.616) 10.657 7.187 ( -4.831 -8.636 7.621) 12.490 7.213 ( -3.723 -0.437 -0.715) 3.816 7.388 ( -1.090 -10.319 -4.936) 11.491 7.576 ( 9.143 -1.761 -8.699) 12.742 7.673 ( 2.368 9.240 2.100) 9.767 7.711 ( 1.001 1.868 8.129) 8.401 7.841 ( 2.077 -0.602 -1.467) 2.613 7.992 ( 0.349 -1.677 0.127) 1.717 8.183 ( -0.099 -1.045 2.742) 2.937 8.212 ( -5.794 1.957 6.588) 8.988 8.336 ( 7.975 -10.250 9.287) 15.966 8.389 ( -0.449 8.399 0.744) 8.444 8.606 ( -1.770 -5.724 6.317) 8.707 8.711 ( -1.990 -9.980 16.514) 19.397 8.931 ( -0.926 -5.671 1.182) 5.867 9.002 ( 6.824 -4.213 -3.015) 8.567 9.033 ( -2.266 0.446 -7.251) 7.610 9.341 ( 6.299 -0.497 -5.649) 8.475 9.469 ( -3.935 -10.639 4.652) 12.260 9.612 ( 4.992 -6.621 0.772) 8.328 9.843 ( -5.040 7.446 -3.190) 9.540 9.972 ( 7.867 13.798 -4.046) 16.390 10.180 ( -4.051 -7.397 3.688) 9.205 10.191 ( 1.874 -2.960 2.890) 4.541 10.341 ( -6.713 -3.087 -4.372) 8.586 10.404 ( 1.610 -0.557 -0.370) 1.744 10.544 ( -3.427 -6.140 -2.809) 7.572 10.729 ( -4.161 3.922 -8.546) 10.282 11.045 ( 4.605 -0.569 1.684) 4.936 11.094 ( -3.594 2.352 -0.242) 4.302 11.229 ( 5.268 -2.332 7.602) 9.539 11.303 ( 4.136 3.473 9.770) 11.164 11.456 ( -6.255 0.181 -2.260) 6.653 11.580 ( 0.462 -5.120 -4.276) 6.687 11.774 ( 6.191 0.501 2.579) 6.726 11.827 ( -4.058 4.343 1.746) 6.195 11.961 ( -3.454 -1.983 -0.479) 4.011 12.094 ( -2.364 3.409 -7.082) 8.208 12.219 ( 11.883 -4.371 3.547) 13.149 12.293 ( -5.478 -5.174 0.403) 7.546 12.520 ( 13.107 -5.476 7.131) 15.895 12.668 ( -1.910 1.880 -3.149) 4.135 12.749 ( -0.912 -1.765 0.527) 2.055 12.871 ( 0.636 -8.077 -0.978) 8.161 12.913 ( 1.533 -2.271 1.012) 2.921 12.993 ( -0.673 -2.050 -4.480) 4.972 13.615 ( 1.046 -9.084 1.154) 9.217 13.684 ( -0.506 -6.114 -2.609) 6.667 13.856 ( 0.525 -3.481 4.323) 5.575 13.919 ( 3.294 -0.631 0.511) 3.393 13.977 ( -1.629 0.486 5.526) 5.781 14.059 ( 4.082 -6.216 1.744) 7.638 14.222 ( 1.499 2.132 1.136) 2.843 14.266 ( -1.941 0.255 1.090) 2.240 16.411 ( -3.185 -6.502 1.954) 7.499 16.520 ( 3.798 -8.997 -2.676) 10.126 16.997 ( -2.975 -13.057 3.083) 13.742 17.125 ( 1.829 -19.940 -2.214) 20.145 18.054 ( 0.723 5.241 1.605) 5.529 18.156 ( -1.244 1.144 -2.496) 3.014 18.467 ( 0.507 16.373 2.232) 16.532 18.574 ( 0.552 13.499 -1.983) 13.655 20.293 ( 2.484 -4.169 4.625) 6.704 20.372 ( -0.342 3.203 -0.615) 3.279 20.443 ( -0.885 -0.544 2.028) 2.278 20.524 ( -0.939 -11.863 -0.963) 11.939 21.040 ( -1.426 -1.681 1.902) 2.911 21.135 ( 1.628 -3.765 -1.789) 4.475 21.373 ( 1.101 0.921 0.454) 1.505 21.456 ( -1.154 -0.235 -4.156) 4.320 22.487 ( 3.921 -1.626 1.487) 4.498 22.560 ( -2.929 -2.966 -1.756) 4.524 22.739 ( -0.473 -0.929 2.197) 2.432 22.804 ( 0.550 -1.720 -0.504) 1.875 23.243 ( -3.416 30.374 4.807) 30.941 23.868 ( 16.905 39.470 -33.132) 54.235 24.144 ( -1.268 7.273 -0.009) 7.382 24.198 ( 3.609 6.381 -2.251) 7.668 24.515 ( -3.779 2.917 3.841) 6.127 24.705 ( 3.819 2.737 -4.523) 6.522 25.338 ( -2.795 -2.078 2.835) 4.491 25.441 ( 1.546 -1.957 -1.122) 2.735 26.823 ( -1.123 -2.266 1.602) 2.994 26.897 ( 0.298 -1.953 -0.784) 2.126 27.027 ( -10.027 -9.444 10.770) 17.485 27.166 ( -0.658 -4.158 0.105) 4.211 27.289 ( -0.127 -3.002 1.786) 3.496 27.511 ( 4.280 -10.788 -5.720) 12.939 27.570 ( -3.072 -8.606 1.579) 9.273 27.704 ( 2.982 -8.489 -3.543) 9.670 27.918 ( -3.774 3.056 2.300) 5.373 28.012 ( 3.871 4.845 -3.117) 6.940 28.200 ( -4.045 0.816 4.448) 6.067 28.352 ( -2.630 4.527 -5.931) 7.911 28.555 ( 5.242 5.583 -0.331) 7.665 28.590 ( -0.129 1.548 -0.476) 1.624 28.731 ( -13.997 2.604 3.660) 14.700 28.772 ( 11.103 4.601 1.444) 12.105 29.014 ( 2.046 2.179 1.728) 3.453 29.234 ( -6.098 0.828 -4.356) 7.540 29.401 ( 0.986 5.316 -0.804) 5.466 29.567 ( -17.046 20.464 -20.799) 33.793 30.581 ( -0.093 -1.329 0.654) 1.484 30.655 ( -0.470 2.044 -2.325) 3.131 30.775 ( 0.356 7.181 -0.155) 7.191 30.890 ( -6.985 17.178 -15.732) 24.318 33.944 ( -1.549 -3.409 3.476) 5.109 33.973 ( -1.446 -0.567 0.723) 1.713 33.991 ( -1.574 -0.575 -0.333) 1.709 34.011 ( 1.682 -1.321 -0.100) 2.141 37.214 ( -0.940 -0.712 -0.021) 1.180 37.229 ( 0.841 -1.421 -0.320) 1.682 37.262 ( 0.243 -1.782 1.289) 2.213 37.329 ( 0.921 0.247 -2.691) 2.855 37.571 ( -1.115 2.987 0.259) 3.199 37.615 ( 1.724 0.943 -1.416) 2.422 37.725 ( 7.424 2.857 -0.908) 8.006 37.732 ( -0.686 1.419 -0.340) 1.612 48.786 ( -2.625 -0.175 0.726) 2.729 48.823 ( 7.349 -0.299 -0.741) 7.393 48.896 ( -1.623 -0.984 0.322) 1.925 48.905 ( 0.671 -0.605 -0.087) 0.908 50.531 ( -0.206 -0.691 1.589) 1.745 50.612 ( 0.692 -0.868 -1.722) 2.049 51.061 ( 19.233 -25.210 25.856) 40.915 51.384 ( -5.118 -8.922 -0.422) 10.294 51.776 ( -0.012 4.427 1.044) 4.549 51.856 ( 2.072 4.586 -2.510) 5.623 52.298 ( -0.126 2.771 0.270) 2.787 52.322 ( 0.063 3.861 -0.732) 3.931 52.640 ( 10.285 -6.914 4.012) 13.026 52.730 ( -5.873 -6.846 -1.065) 9.083 53.089 ( 0.758 -3.000 2.193) 3.793 53.195 ( 0.074 -3.331 -2.242) 4.016 53.801 ( -0.362 0.651 0.462) 0.876 53.826 ( 0.291 0.471 -0.424) 0.697 54.257 ( -1.719 -4.727 5.530) 7.475 54.350 ( 0.010 -2.005 -0.624) 2.100 55.711 ( -0.305 0.564 1.172) 1.336 55.766 ( 0.290 0.583 -1.085) 1.265 56.245 ( -4.186 -17.054 17.502) 24.793 56.660 ( 0.235 -15.454 -4.449) 16.084 57.415 ( 0.079 3.496 0.244) 3.505 57.440 ( -0.050 5.107 -1.169) 5.239 57.560 ( -1.622 11.711 4.642) 12.701 57.908 ( 11.415 13.065 -14.026) 22.309 58.339 ( 2.051 -2.232 0.741) 3.120 58.368 ( -1.903 -1.348 -0.611) 2.411 58.540 ( -8.812 -6.853 3.333) 11.650 58.636 ( -7.581 -5.085 -2.133) 9.374 60.932 ( -0.058 1.659 0.561) 1.752 60.950 ( 0.133 1.115 0.038) 1.124 61.021 ( 0.071 5.690 0.708) 5.735 61.247 ( -1.368 13.342 -15.665) 20.622 ======================= Grid point 90 (35/90) ======================= q-point: ( 0.12 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.557 ( 15.424 26.081 33.161) 44.919 2.050 ( 27.732 28.879 30.858) 50.550 2.521 ( 12.589 0.892 -26.483) 29.337 2.786 ( 38.826 25.715 39.807) 61.264 3.117 ( 22.474 19.507 -18.015) 34.787 3.330 ( -0.827 11.661 5.750) 13.028 3.646 ( -8.377 19.428 -8.585) 22.832 3.858 ( -8.980 17.411 6.510) 20.643 4.253 ( 8.492 16.361 8.390) 20.253 4.354 ( 18.367 14.170 -2.784) 23.364 4.564 ( 11.974 13.152 -4.506) 18.348 4.609 ( 8.524 5.817 -4.420) 11.226 4.825 ( 19.522 9.562 -23.614) 32.096 4.924 ( 11.280 9.236 -12.359) 19.112 5.185 ( 4.569 11.618 3.066) 12.855 5.475 ( 9.129 8.277 -9.522) 15.573 5.550 ( -14.639 -1.436 12.137) 19.070 5.958 ( 3.833 -3.369 11.686) 12.752 6.145 ( -8.173 -0.628 -5.563) 9.906 6.282 ( 0.211 2.602 -2.929) 3.923 6.393 ( 4.960 -3.126 1.669) 6.096 6.460 ( -0.312 -0.366 -9.834) 9.845 6.750 ( -2.120 -10.140 6.438) 12.197 6.815 ( 3.438 2.059 0.114) 4.009 6.957 ( 0.099 -10.179 -1.469) 10.285 7.018 ( 3.741 1.074 1.940) 4.349 7.116 ( -3.116 -6.952 -5.393) 9.334 7.240 ( -1.872 -10.034 -1.914) 10.385 7.337 ( 2.087 -1.565 -3.436) 4.314 7.590 ( -4.512 4.853 2.876) 7.224 7.716 ( 1.124 8.210 -3.646) 9.053 7.739 ( 0.134 -0.119 1.961) 1.969 7.867 ( -1.710 -0.703 -2.746) 3.311 7.985 ( -0.034 0.436 -1.416) 1.482 8.082 ( -4.010 -5.991 2.968) 7.796 8.193 ( 0.534 5.255 2.610) 5.892 8.407 ( 1.323 12.051 2.762) 12.434 8.483 ( 3.057 -5.971 13.099) 14.717 8.599 ( -0.145 -15.031 7.518) 16.807 8.773 ( 1.826 0.905 11.512) 11.691 8.950 ( 2.596 -5.081 -0.504) 5.728 9.013 ( 3.073 -13.610 -7.393) 15.790 9.117 ( 2.306 -6.452 3.516) 7.701 9.421 ( 2.604 -10.374 -6.692) 12.616 9.445 ( -0.548 3.964 -1.108) 4.153 9.643 ( 1.408 -5.200 2.155) 5.803 9.778 ( 0.158 5.238 -4.249) 6.747 10.030 ( -4.159 3.625 2.112) 5.907 10.111 ( -2.866 -12.089 -2.410) 12.655 10.210 ( -0.479 7.405 4.461) 8.658 10.267 ( 2.470 3.775 0.863) 4.593 10.496 ( 5.797 -2.585 -1.392) 6.498 10.538 ( 3.371 -3.570 4.120) 6.409 10.598 ( -5.411 6.688 -7.618) 11.491 10.981 ( -4.636 0.350 -4.194) 6.261 11.116 ( 1.431 3.358 2.838) 4.624 11.251 ( -9.371 -4.707 -5.493) 11.838 11.343 ( -0.520 -1.920 6.879) 7.160 11.428 ( 3.781 0.374 6.046) 7.141 11.542 ( -2.990 6.380 4.635) 8.434 11.654 ( -5.242 -1.373 -6.071) 8.138 11.788 ( -8.190 3.718 0.847) 9.034 11.975 ( 1.971 4.529 -1.539) 5.174 12.075 ( 0.629 -1.050 -2.710) 2.974 12.185 ( -1.064 -5.626 -1.182) 5.847 12.417 ( 6.987 -3.866 2.268) 8.301 12.580 ( -4.335 1.615 -5.051) 6.850 12.706 ( -2.635 -0.783 -1.196) 2.997 12.776 ( 2.081 -10.470 1.837) 10.832 12.887 ( 0.241 -5.596 -0.767) 5.653 12.983 ( 3.112 -5.674 -1.018) 6.551 13.045 ( 5.280 -4.325 -5.026) 8.477 13.577 ( -4.961 -4.463 -0.420) 6.686 13.672 ( -0.293 -8.365 -1.254) 8.464 13.856 ( -1.236 -11.324 3.347) 11.873 13.896 ( -2.605 3.373 1.736) 4.602 13.951 ( -0.514 -6.619 -3.550) 7.529 14.168 ( -1.428 -8.026 2.794) 8.618 14.256 ( 2.002 -0.762 1.906) 2.868 14.349 ( 6.905 -4.019 1.229) 8.083 16.409 ( 1.933 -11.491 -1.177) 11.711 16.616 ( 3.518 -8.116 0.449) 8.857 16.979 ( 2.548 -15.187 -0.027) 15.399 17.210 ( 6.001 -19.079 -0.525) 20.008 18.078 ( 1.211 5.827 2.367) 6.405 18.117 ( -1.568 2.856 -2.847) 4.327 18.465 ( -1.241 15.602 1.919) 15.769 18.549 ( -2.441 12.958 -2.299) 13.384 20.284 ( -2.869 0.588 0.309) 2.945 20.388 ( -1.134 5.937 -0.684) 6.083 20.432 ( 1.357 -8.817 5.845) 10.665 20.528 ( 0.511 -7.842 -1.568) 8.014 20.992 ( -2.933 -3.174 0.952) 4.425 21.145 ( -0.602 -4.308 -1.062) 4.478 21.421 ( 3.296 1.354 -1.810) 3.996 21.466 ( 4.611 0.244 0.837) 4.692 22.476 ( -3.359 -0.618 -2.863) 4.457 22.585 ( 3.699 -4.149 1.477) 5.752 22.732 ( -0.628 -1.269 2.323) 2.721 22.813 ( 0.305 -1.932 -0.759) 2.098 23.178 ( -2.852 25.439 1.505) 25.642 23.752 ( -17.120 38.949 -15.357) 45.232 24.092 ( -3.068 5.940 -0.143) 6.687 24.204 ( -3.538 7.100 0.537) 7.951 24.433 ( -3.458 2.851 0.237) 4.488 24.708 ( -2.805 2.974 -0.720) 4.151 25.211 ( -8.793 -2.119 0.243) 9.048 25.365 ( -7.901 -1.478 0.893) 8.087 26.825 ( 1.552 -2.546 1.003) 3.146 26.883 ( -0.316 0.320 4.901) 4.921 26.931 ( 1.138 -1.089 -0.936) 1.832 27.169 ( 1.295 -3.508 -0.596) 3.787 27.274 ( -1.533 -2.452 0.605) 2.954 27.527 ( -0.816 -5.492 -3.142) 6.380 27.550 ( 0.344 -12.384 -2.442) 12.627 27.712 ( -3.251 -8.502 -0.811) 9.138 27.801 ( -4.899 6.431 0.625) 8.108 28.041 ( 1.490 11.471 -3.820) 12.181 28.121 ( -2.985 0.452 3.391) 4.540 28.252 ( -3.403 9.771 -1.809) 10.504 28.565 ( -1.468 3.431 1.878) 4.178 28.600 ( -7.068 3.005 -1.455) 7.817 28.642 ( 4.839 1.598 -0.213) 5.101 28.791 ( -1.424 17.141 2.162) 17.335 29.046 ( 5.323 -2.216 1.036) 5.858 29.236 ( 6.862 -2.604 1.553) 7.502 29.365 ( 2.441 3.545 0.314) 4.315 29.579 ( 7.044 14.428 -0.088) 16.056 30.569 ( -0.540 -1.286 0.139) 1.401 30.653 ( 1.006 0.897 -1.060) 1.715 30.753 ( -0.676 6.019 0.065) 6.057 30.805 ( -0.801 9.371 -1.985) 9.613 33.879 ( -2.622 0.197 2.060) 3.340 33.939 ( -2.395 -0.431 0.041) 2.434 33.975 ( 0.269 -0.935 1.186) 1.534 34.057 ( 1.034 -1.661 0.292) 1.978 37.213 ( 0.699 -0.768 0.407) 1.116 37.238 ( -0.646 -1.548 -0.097) 1.680 37.253 ( 1.181 -0.552 -0.764) 1.511 37.350 ( 0.842 -0.135 -1.006) 1.319 37.538 ( -0.924 3.250 -0.071) 3.380 37.628 ( 0.383 1.217 -1.013) 1.629 37.742 ( 1.968 0.906 -1.494) 2.632 37.880 ( 4.200 -3.079 -1.827) 5.519 48.866 ( 9.292 -0.533 -0.147) 9.308 48.926 ( 4.508 -1.142 -0.737) 4.709 49.024 ( 9.664 -1.217 2.749) 10.121 49.229 ( 21.403 -7.922 -12.404) 25.975 50.527 ( -0.085 -0.190 0.792) 0.818 50.610 ( -0.598 -1.062 -1.629) 2.034 51.191 ( -10.484 -6.897 -6.421) 14.096 51.338 ( 0.390 -24.139 12.981) 27.411 51.777 ( -0.016 4.468 0.573) 4.505 51.848 ( -1.993 4.156 -1.500) 4.847 52.304 ( 0.499 3.095 -0.056) 3.135 52.324 ( 0.351 3.985 -0.636) 4.051 52.603 ( -4.976 -4.074 -3.823) 7.482 52.955 ( 11.775 -21.933 1.534) 24.941 53.149 ( 3.543 -3.899 2.105) 5.674 53.253 ( 6.775 -6.133 -1.986) 9.352 53.805 ( 0.732 0.475 0.709) 1.124 53.846 ( 1.579 0.343 -0.401) 1.665 54.214 ( -3.896 -3.969 6.741) 8.739 54.345 ( -0.289 -1.602 -0.776) 1.803 55.715 ( 0.433 0.329 1.208) 1.324 55.781 ( 1.333 0.561 -1.024) 1.772 56.140 ( -9.118 -10.571 15.852) 21.123 56.588 ( -5.504 -12.549 -4.829) 14.529 57.417 ( 0.014 3.609 0.235) 3.616 57.437 ( 0.046 4.863 -1.044) 4.974 57.528 ( -2.053 10.425 2.876) 11.007 57.937 ( -17.770 24.236 -9.846) 31.624 58.114 ( 1.982 -0.613 -1.427) 2.518 58.275 ( -4.674 -0.434 -0.339) 4.706 58.399 ( 2.120 -3.353 4.064) 5.679 58.783 ( 5.745 -8.774 4.076) 11.251 60.931 ( -0.114 1.560 0.505) 1.643 60.952 ( 0.048 1.337 -0.091) 1.341 61.017 ( -0.698 5.563 0.771) 5.660 61.097 ( -5.868 11.516 -5.446) 14.026 ======================= Grid point 91 (36/90) ======================= q-point: ( 0.25 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.120 ( 26.387 10.473 20.797) 35.192 2.726 ( 28.118 25.327 15.605) 40.934 2.777 ( 14.338 -6.577 -18.391) 24.230 3.105 ( -8.268 9.971 14.786) 19.658 3.267 ( 0.935 8.631 -13.824) 16.324 3.685 ( 10.108 24.248 0.439) 26.275 3.751 ( 21.425 14.934 -11.206) 28.419 4.102 ( 32.463 9.516 20.406) 39.507 4.554 ( 16.714 15.612 12.027) 25.841 4.683 ( 12.332 12.257 3.722) 17.781 4.809 ( 17.745 8.521 -8.274) 21.353 4.890 ( 21.878 14.955 -12.602) 29.345 5.101 ( 3.162 5.207 -4.981) 7.868 5.220 ( -1.877 -0.243 5.320) 5.646 5.271 ( 11.813 8.751 5.062) 15.548 5.474 ( 11.493 5.345 -0.898) 12.707 5.682 ( 10.171 6.508 -9.778) 15.538 5.824 ( -5.487 -2.764 -10.047) 11.776 6.102 ( 0.759 1.438 -0.343) 1.662 6.254 ( -2.125 2.635 -0.013) 3.385 6.392 ( -3.163 5.336 -5.505) 8.294 6.493 ( 4.000 -4.309 -0.432) 5.895 6.742 ( -3.449 -10.941 6.193) 13.037 6.882 ( -0.939 -11.151 -0.322) 11.196 6.898 ( 0.087 -7.392 0.291) 7.399 7.114 ( 6.155 1.963 -7.383) 9.811 7.122 ( 3.649 -0.582 1.267) 3.906 7.208 ( 2.483 -9.248 -0.488) 9.588 7.416 ( 2.481 5.834 2.701) 6.891 7.502 ( -3.362 3.584 4.376) 6.580 7.681 ( -3.906 4.307 -4.782) 7.528 7.710 ( -3.170 -0.930 -6.889) 7.640 7.795 ( -0.697 1.730 -5.120) 5.449 7.951 ( -2.982 0.387 0.038) 3.007 8.050 ( -1.831 8.002 4.560) 9.391 8.237 ( 2.680 -3.408 -0.657) 4.385 8.452 ( 1.402 6.600 2.259) 7.115 8.587 ( 2.625 -4.949 8.321) 10.031 8.624 ( 3.348 -9.710 3.505) 10.852 8.833 ( 1.026 3.496 11.943) 12.486 9.028 ( 0.589 -8.053 1.913) 8.298 9.053 ( 4.061 -9.058 -3.863) 10.652 9.187 ( 5.183 -13.702 2.957) 14.945 9.331 ( -6.339 0.667 -5.486) 8.410 9.521 ( 5.934 -3.778 3.785) 7.988 9.664 ( -1.340 0.533 3.636) 3.912 9.822 ( 2.815 0.184 -7.381) 7.902 9.914 ( -8.112 -3.741 -0.155) 8.934 10.055 ( 1.252 -2.669 -0.642) 3.017 10.202 ( -0.097 -5.453 6.872) 8.773 10.335 ( 0.770 12.028 -0.369) 12.058 10.486 ( -1.793 6.722 -1.443) 7.105 10.583 ( 2.908 2.663 0.181) 3.947 10.693 ( 7.619 -2.356 2.762) 8.440 10.907 ( -1.034 -1.691 -6.590) 6.881 11.049 ( -7.700 -2.707 -5.859) 10.047 11.123 ( -1.235 6.369 0.053) 6.488 11.208 ( -8.771 6.264 1.253) 10.851 11.455 ( -6.179 3.457 0.606) 7.106 11.481 ( -5.335 1.422 -8.256) 9.932 11.554 ( -2.555 -0.355 6.655) 7.138 11.694 ( 0.766 -0.251 3.421) 3.515 11.974 ( -2.145 3.818 1.574) 4.653 11.989 ( -4.133 -0.498 -1.785) 4.529 12.278 ( 5.596 -2.097 4.328) 7.379 12.464 ( -5.213 4.417 -4.272) 8.058 12.561 ( 3.965 -2.241 -1.082) 4.681 12.607 ( -4.927 0.585 2.363) 5.495 12.745 ( -3.327 -9.368 -1.696) 10.084 12.924 ( 3.309 -11.782 -0.072) 12.238 13.051 ( 1.518 -3.075 -0.271) 3.440 13.058 ( 0.731 -6.135 -4.392) 7.580 13.434 ( -7.508 -0.692 -2.323) 7.890 13.668 ( 0.777 -8.252 -0.663) 8.315 13.788 ( -6.950 -12.499 2.280) 14.482 13.878 ( -0.915 3.060 -1.272) 3.437 13.914 ( -0.602 -10.055 -0.320) 10.078 14.135 ( -1.380 -4.353 1.919) 4.953 14.257 ( -1.931 -0.260 0.496) 2.010 14.424 ( 1.195 -1.618 0.200) 2.021 16.434 ( 0.255 -13.704 0.835) 13.732 16.625 ( -1.587 -8.177 -0.527) 8.347 17.117 ( 9.066 -16.626 -1.278) 18.980 17.331 ( 4.769 -19.047 -0.316) 19.638 18.080 ( -1.025 5.770 -1.652) 6.088 18.129 ( 3.079 7.768 1.922) 8.574 18.423 ( -3.338 13.054 -0.058) 13.474 18.473 ( -3.630 13.781 -1.314) 14.312 20.230 ( -1.970 3.603 -0.195) 4.111 20.336 ( -2.918 8.095 -0.928) 8.654 20.487 ( 2.253 -6.295 6.253) 9.154 20.531 ( 0.682 -5.525 -2.588) 6.139 20.931 ( -3.708 -6.412 1.005) 7.475 21.094 ( -3.871 -4.275 -1.820) 6.048 21.554 ( 9.205 -2.337 -0.003) 9.497 21.617 ( 9.148 -1.967 0.380) 9.364 22.428 ( -0.634 0.402 -1.199) 1.414 22.631 ( 0.754 -2.218 -1.159) 2.614 22.734 ( 0.089 -2.434 3.368) 4.156 22.813 ( 0.013 -2.229 -1.046) 2.462 23.152 ( 0.377 18.695 0.208) 18.700 23.392 ( -11.555 29.888 -1.483) 32.078 24.003 ( -6.024 6.061 -1.482) 8.673 24.059 ( -10.225 6.986 2.223) 12.582 24.397 ( 0.346 3.990 -3.523) 5.334 24.582 ( -9.259 3.810 4.038) 10.796 25.036 ( -6.218 -1.394 -3.375) 7.210 25.156 ( -11.517 -1.258 2.501) 11.853 26.899 ( 4.366 -3.277 -1.416) 5.640 26.951 ( 5.004 -1.323 0.095) 5.177 26.957 ( 1.397 -2.390 -0.640) 2.841 27.204 ( 0.809 -2.153 -1.906) 2.987 27.237 ( -1.109 -3.011 1.183) 3.420 27.446 ( -6.374 -4.009 -1.083) 7.608 27.547 ( -1.321 -11.486 -0.696) 11.582 27.608 ( -2.169 -5.032 -3.482) 6.493 27.792 ( 1.881 0.983 1.674) 2.703 28.056 ( -1.505 6.501 3.280) 7.436 28.085 ( -0.377 8.720 -3.512) 9.408 28.234 ( 1.491 4.262 0.841) 4.593 28.413 ( -6.801 5.877 2.483) 9.325 28.571 ( 0.774 2.562 -0.313) 2.694 28.757 ( 5.387 2.349 -0.849) 5.938 28.895 ( 6.070 6.106 2.085) 8.859 29.135 ( 3.140 -2.746 3.179) 5.244 29.352 ( 4.207 -3.062 -0.753) 5.258 29.446 ( 4.136 3.555 0.200) 5.457 29.676 ( 1.095 9.497 2.186) 9.807 30.574 ( 0.916 -2.441 0.075) 2.608 30.675 ( 0.884 0.343 -0.160) 0.962 30.759 ( 0.509 4.502 -0.281) 4.540 30.781 ( -1.120 6.261 0.570) 6.386 33.855 ( -0.310 0.319 0.066) 0.450 33.894 ( -1.949 -0.223 0.523) 2.030 33.980 ( -0.215 -0.892 1.663) 1.899 34.055 ( -0.710 -1.385 -0.862) 1.779 37.233 ( 0.892 -0.850 -0.018) 1.233 37.254 ( 1.862 -0.684 0.462) 2.037 37.279 ( 1.362 -1.575 -0.196) 2.091 37.360 ( 0.398 0.304 -0.567) 0.757 37.539 ( 0.772 3.191 0.584) 3.335 37.636 ( 0.663 1.653 -1.285) 2.196 37.784 ( 2.325 0.271 -1.859) 2.989 37.916 ( 0.289 -2.228 0.095) 2.249 49.058 ( 8.000 -1.704 -0.643) 8.205 49.089 ( 10.531 -1.103 -1.529) 10.698 49.310 ( 14.366 -3.266 8.889) 17.207 49.529 ( 11.386 -6.279 -10.490) 16.706 50.536 ( 0.841 -0.280 -0.547) 1.042 50.574 ( -2.112 -0.648 -2.647) 3.448 50.988 ( -5.964 -3.944 -7.172) 10.128 51.237 ( -10.394 -13.202 7.289) 18.316 51.779 ( 0.123 3.996 0.163) 4.001 51.815 ( -0.589 5.021 -0.369) 5.068 52.315 ( 0.524 3.395 0.083) 3.436 52.333 ( 0.599 4.147 -0.450) 4.214 52.509 ( -2.984 -2.776 -2.621) 4.845 53.053 ( 0.615 -13.142 -4.215) 13.815 53.226 ( 2.945 -4.234 2.148) 5.587 53.400 ( 5.305 -10.627 -0.357) 11.883 53.839 ( 2.193 -0.006 1.503) 2.659 53.882 ( 1.885 0.115 -0.664) 2.002 54.146 ( -4.005 -1.765 6.414) 7.765 54.336 ( -0.241 -1.478 -1.179) 1.906 55.737 ( 1.297 -0.021 1.534) 2.009 55.815 ( 2.168 0.340 -1.149) 2.477 56.002 ( -7.077 -3.829 9.574) 12.506 56.424 ( -8.323 -8.452 -4.864) 12.821 57.417 ( 0.028 3.684 0.046) 3.684 57.436 ( 0.082 4.566 -0.574) 4.603 57.498 ( -1.347 8.572 1.715) 8.845 57.641 ( -8.041 17.740 -1.574) 19.541 58.168 ( 0.314 -2.728 -1.222) 3.005 58.235 ( 2.133 0.198 -5.133) 5.562 58.452 ( 1.568 -3.936 5.432) 6.889 58.835 ( -0.904 -8.911 2.029) 9.184 60.931 ( 0.063 1.408 0.320) 1.445 60.952 ( 0.064 1.784 -0.255) 1.803 60.997 ( -1.316 4.585 0.104) 4.771 61.011 ( -2.012 6.159 -0.720) 6.519 ======================= Grid point 92 (37/90) ======================= q-point: ( 0.38 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.653 ( 19.612 6.449 5.458) 21.354 2.888 ( -10.733 17.114 9.759) 22.435 2.951 ( 5.066 1.300 -7.060) 8.786 3.091 ( 3.317 11.433 -4.419) 12.698 3.505 ( 23.239 12.906 8.442) 27.891 3.991 ( 14.696 13.771 -9.025) 22.070 4.045 ( 10.254 6.116 -4.891) 12.902 4.479 ( 0.748 2.772 8.189) 8.678 4.661 ( -5.169 13.211 -0.066) 14.186 4.885 ( -8.023 13.709 -2.879) 16.143 5.087 ( 9.462 -0.774 5.015) 10.737 5.213 ( 9.005 7.346 -5.615) 12.907 5.389 ( 21.617 8.662 2.857) 23.462 5.413 ( 9.740 1.504 -8.065) 12.735 5.490 ( 13.365 -0.312 10.670) 17.105 5.586 ( 13.377 0.445 6.612) 14.928 5.840 ( 8.387 -4.513 -6.778) 11.689 5.916 ( -0.931 2.168 -0.440) 2.400 6.029 ( 2.410 6.388 -8.249) 10.708 6.299 ( 2.982 1.525 2.378) 4.108 6.458 ( 6.958 -0.689 -0.125) 6.993 6.574 ( 8.625 2.898 3.972) 9.927 6.631 ( 0.645 -5.558 2.319) 6.057 6.885 ( -0.402 -8.322 5.541) 10.006 6.938 ( -0.894 -0.060 -6.951) 7.009 7.152 ( -2.759 -5.757 6.853) 9.365 7.211 ( 1.949 4.570 -3.209) 5.915 7.279 ( 4.110 1.083 -6.280) 7.583 7.424 ( -1.209 3.457 3.145) 4.828 7.489 ( 0.629 6.979 -2.444) 7.421 7.533 ( -6.650 6.018 -5.029) 10.283 7.630 ( -1.645 -7.967 0.727) 8.168 7.829 ( 4.227 5.152 -8.049) 10.450 7.876 ( -4.891 7.516 4.253) 9.925 8.017 ( -0.908 9.742 5.316) 11.135 8.271 ( 0.696 -7.650 -4.952) 9.140 8.467 ( 0.044 -5.763 0.456) 5.781 8.597 ( -1.956 -4.623 -2.683) 5.692 8.745 ( 3.750 3.025 -0.237) 4.824 8.884 ( 1.216 -6.463 8.286) 10.579 8.974 ( -2.351 -10.086 -2.463) 10.645 9.144 ( -1.752 -10.501 -0.103) 10.647 9.194 ( 0.886 0.446 1.046) 1.442 9.341 ( 4.832 -6.879 3.321) 9.039 9.530 ( -7.597 5.081 0.921) 9.186 9.652 ( -0.855 3.503 3.030) 4.710 9.782 ( -3.202 -2.318 -10.243) 10.980 9.837 ( 0.565 -4.873 3.220) 5.868 10.109 ( 2.752 1.322 0.754) 3.145 10.254 ( 3.256 -0.935 7.045) 7.817 10.324 ( 0.332 2.962 1.480) 3.327 10.567 ( 9.882 2.450 -1.846) 10.347 10.582 ( -5.556 -3.226 -0.605) 6.453 10.727 ( -1.161 1.701 -2.102) 2.943 10.930 ( 0.971 -3.126 0.420) 3.300 11.002 ( 5.926 4.979 -1.917) 7.974 11.043 ( -6.936 8.192 0.587) 10.750 11.086 ( -1.854 4.460 0.294) 4.839 11.248 ( -9.085 6.229 -3.637) 11.600 11.384 ( -1.631 6.404 -5.322) 8.485 11.525 ( -1.250 0.912 6.549) 6.729 11.733 ( -0.021 1.927 -1.250) 2.297 11.896 ( -4.063 -6.822 5.914) 9.900 11.957 ( -0.281 4.036 3.771) 5.530 12.289 ( -12.169 5.109 -1.709) 13.308 12.366 ( 0.380 -2.388 1.688) 2.949 12.469 ( -1.107 3.099 -0.392) 3.314 12.659 ( -0.825 -3.872 0.751) 4.030 12.713 ( 3.899 -2.610 -2.951) 5.543 12.960 ( -0.933 -11.929 -5.838) 13.313 13.044 ( 1.830 -9.048 0.753) 9.262 13.128 ( 3.844 -5.087 1.157) 6.480 13.281 ( -6.103 -1.274 -2.169) 6.601 13.606 ( -8.846 -8.281 -1.940) 12.271 13.712 ( 2.865 -7.425 -0.911) 8.011 13.817 ( -2.592 -3.627 -5.468) 7.055 13.945 ( 1.856 -6.913 3.408) 7.928 14.104 ( -3.585 -6.832 3.494) 8.470 14.227 ( 0.329 1.787 1.650) 2.454 14.435 ( -0.022 -0.546 -0.099) 0.556 16.425 ( -1.720 -12.336 4.191) 13.141 16.598 ( 0.105 -9.825 -3.752) 10.517 17.286 ( 6.636 -16.641 -0.748) 17.931 17.390 ( 0.954 -17.726 -0.340) 17.755 18.071 ( 0.431 9.517 0.144) 9.528 18.212 ( 4.005 9.309 1.734) 10.281 18.326 ( -4.733 10.752 -2.779) 12.072 18.409 ( -2.553 13.041 -0.249) 13.291 20.202 ( -0.782 6.331 0.476) 6.397 20.279 ( -2.044 9.384 -0.798) 9.637 20.560 ( 3.373 -5.893 -2.812) 7.349 20.575 ( 4.407 -4.422 5.008) 8.004 20.820 ( -7.203 -5.849 0.950) 9.327 20.989 ( -4.994 -4.347 -2.589) 7.109 21.754 ( 8.322 -6.593 0.879) 10.653 21.810 ( 8.003 -5.736 -0.454) 9.857 22.433 ( 0.947 0.100 0.719) 1.193 22.625 ( -0.573 -0.972 -3.027) 3.230 22.746 ( 0.063 -2.268 3.386) 4.076 22.812 ( 0.191 -2.260 -0.824) 2.413 23.205 ( 4.674 14.114 0.129) 14.869 23.277 ( -0.058 18.388 -0.065) 18.389 23.792 ( -12.906 6.905 1.416) 14.705 23.843 ( -10.240 7.784 -1.832) 12.992 24.403 ( -6.914 5.018 4.239) 9.537 24.417 ( 1.909 4.885 -4.053) 6.628 24.934 ( -7.935 -0.843 2.886) 8.485 24.953 ( -2.922 -0.087 -2.518) 3.858 26.966 ( 1.654 -3.876 0.475) 4.241 27.001 ( 3.263 -2.663 0.020) 4.212 27.057 ( 4.634 -3.772 -1.771) 6.232 27.168 ( -1.995 -0.423 0.054) 2.040 27.241 ( -1.046 -2.700 -0.244) 2.905 27.309 ( -4.729 -4.185 -3.815) 7.378 27.490 ( -2.892 -6.806 4.043) 8.429 27.609 ( 1.451 -8.145 -6.176) 10.324 27.853 ( 2.968 -1.019 4.354) 5.367 28.020 ( -2.089 1.895 1.714) 3.300 28.062 ( -0.713 12.992 0.119) 13.012 28.292 ( 2.649 3.375 1.518) 4.551 28.333 ( -2.071 3.333 0.899) 4.026 28.577 ( -0.134 2.668 -2.026) 3.352 28.847 ( 3.338 2.890 -0.193) 4.420 28.998 ( 2.900 4.107 -0.110) 5.029 29.202 ( 2.239 -2.978 4.049) 5.502 29.410 ( 1.641 -3.612 -1.776) 4.347 29.525 ( 3.381 5.738 0.064) 6.660 29.659 ( -2.095 6.538 0.145) 6.867 30.602 ( 1.601 -1.968 0.151) 2.541 30.676 ( -0.903 0.520 -0.062) 1.043 30.758 ( 0.297 4.189 -0.943) 4.304 30.776 ( -0.238 3.248 1.122) 3.445 33.857 ( 0.501 -0.080 -0.712) 0.874 33.862 ( -1.195 -0.058 0.556) 1.320 33.976 ( -0.632 -0.651 1.799) 2.015 34.039 ( -0.366 -0.974 -1.344) 1.700 37.253 ( 0.894 -0.971 -0.015) 1.320 37.283 ( 0.736 -0.631 -0.668) 1.177 37.311 ( 1.354 -1.570 1.421) 2.513 37.365 ( 0.288 0.344 -0.480) 0.656 37.562 ( 0.828 2.776 1.440) 3.235 37.647 ( 0.814 1.659 -1.583) 2.433 37.825 ( 1.941 -0.132 -1.131) 2.250 37.908 ( -0.926 -1.374 0.183) 1.667 49.220 ( 6.786 -2.489 -0.397) 7.239 49.273 ( 7.000 -1.189 -2.380) 7.488 49.574 ( 6.746 -5.090 9.532) 12.739 49.687 ( 6.483 -4.433 -5.104) 9.367 50.525 ( -0.749 0.029 -2.606) 2.711 50.564 ( 1.787 -0.398 -2.704) 3.265 50.907 ( -0.754 -2.772 -3.952) 4.886 51.018 ( -11.084 -6.439 5.008) 13.762 51.783 ( 0.202 3.428 0.171) 3.438 51.811 ( 0.034 4.594 -0.324) 4.606 52.325 ( 0.359 3.559 0.280) 3.588 52.344 ( 0.491 4.400 -0.268) 4.435 52.476 ( 0.251 -2.647 0.995) 2.839 53.013 ( -2.420 -9.244 -8.096) 12.524 53.278 ( 1.430 -4.261 2.734) 5.261 53.459 ( 0.992 -7.560 -1.128) 7.708 53.891 ( 1.800 -0.246 0.919) 2.036 53.915 ( 1.322 -0.093 -0.769) 1.532 54.097 ( -2.025 -0.871 6.878) 7.222 54.328 ( -0.161 -1.637 -1.768) 2.415 55.780 ( 2.343 -0.425 2.091) 3.169 55.863 ( 2.542 -0.143 -1.410) 2.911 55.901 ( -4.551 -1.621 5.618) 7.409 56.242 ( -7.119 -5.151 -4.582) 9.910 57.420 ( 0.212 3.793 0.028) 3.799 57.435 ( -0.087 4.399 -0.300) 4.410 57.481 ( -0.701 7.131 1.092) 7.249 57.539 ( -2.343 11.583 -1.046) 11.864 58.164 ( -0.180 -1.718 1.610) 2.361 58.274 ( 2.301 -1.924 -6.274) 6.955 58.496 ( 1.227 -4.560 6.121) 7.731 58.791 ( -2.731 -7.901 -0.717) 8.390 60.936 ( 0.291 1.621 0.136) 1.652 60.955 ( 0.309 2.275 -0.143) 2.300 60.970 ( -1.019 3.071 -0.110) 3.238 60.985 ( -0.861 3.410 0.064) 3.518 ======================= Grid point 93 (38/90) ======================= q-point: (-0.50 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.690 ( -8.537 20.400 9.051) 23.895 2.927 ( 4.225 5.993 -1.366) 7.458 2.971 ( -5.609 0.999 2.278) 6.135 3.189 ( 12.107 9.012 -8.534) 17.338 3.815 ( -13.105 7.871 10.747) 18.686 4.011 ( -10.610 2.224 -2.128) 11.048 4.230 ( 18.821 12.068 -10.166) 24.560 4.369 ( 4.449 9.345 0.686) 10.373 4.617 ( -9.861 15.604 -4.894) 19.097 4.804 ( 4.867 13.015 1.229) 13.950 5.105 ( -12.391 1.926 -1.205) 12.598 5.256 ( -2.294 6.276 -4.974) 8.330 5.407 ( 1.729 9.387 -5.531) 11.032 5.585 ( -10.364 -3.018 3.386) 11.313 5.718 ( 13.325 -7.910 5.864) 16.569 5.796 ( 1.804 -8.512 -4.250) 9.684 5.931 ( 4.411 3.146 20.151) 20.867 6.055 ( 0.686 1.783 -10.060) 10.240 6.180 ( 7.793 -3.701 11.568) 14.430 6.351 ( -7.026 -19.515 -4.955) 21.325 6.438 ( 15.468 0.065 -1.456) 15.537 6.632 ( -18.563 -0.601 -11.040) 21.607 6.765 ( -1.759 7.277 5.014) 9.011 6.867 ( 1.047 1.365 7.887) 8.073 7.014 ( 0.601 1.776 6.985) 7.232 7.110 ( 9.886 1.507 6.885) 12.141 7.245 ( 0.381 9.947 -1.491) 10.066 7.332 ( 1.241 -2.804 -2.384) 3.884 7.399 ( 1.257 6.002 -4.431) 7.566 7.416 ( -2.486 9.021 -6.822) 11.580 7.514 ( 8.162 6.161 -2.509) 10.530 7.698 ( 3.501 -9.952 8.060) 13.276 7.802 ( 0.345 14.501 4.972) 15.333 7.903 ( 2.913 5.947 -1.703) 6.837 8.081 ( 3.620 2.107 6.580) 7.800 8.214 ( -4.177 -2.936 -9.255) 10.570 8.386 ( -11.046 -9.136 -11.798) 18.565 8.509 ( -1.692 -0.895 -3.478) 3.970 8.752 ( -1.644 -1.154 -2.424) 3.148 8.850 ( -3.522 1.262 -9.341) 10.063 8.981 ( 0.869 -10.259 4.383) 11.190 9.110 ( 1.420 -12.790 6.336) 14.344 9.232 ( -0.302 0.213 -1.797) 1.835 9.331 ( -1.265 -0.174 3.228) 3.472 9.494 ( -0.693 1.440 5.287) 5.523 9.545 ( -5.577 -3.669 -1.617) 6.869 9.661 ( -6.617 -1.831 -2.077) 7.173 9.849 ( -0.009 0.913 -3.268) 3.393 10.145 ( -1.795 2.458 0.256) 3.054 10.299 ( 0.202 -1.303 -1.401) 1.924 10.382 ( 2.585 -3.969 2.050) 5.161 10.483 ( 3.047 -5.067 2.439) 6.395 10.732 ( -1.849 3.159 -0.856) 3.759 10.854 ( 8.108 2.393 5.458) 10.062 10.906 ( -2.201 11.199 -4.266) 12.185 10.966 ( 3.454 5.269 4.205) 7.575 11.045 ( 0.241 -2.781 1.239) 3.054 11.055 ( -1.797 3.253 -0.556) 3.758 11.176 ( 1.936 6.637 3.351) 7.683 11.421 ( 5.190 7.571 -4.778) 10.348 11.553 ( 0.873 0.741 3.580) 3.758 11.712 ( 0.614 6.040 -3.133) 6.832 11.817 ( -1.746 -8.322 5.190) 9.962 12.021 ( -5.271 10.129 7.036) 13.412 12.050 ( 1.628 -3.098 -2.332) 4.206 12.332 ( -1.794 1.407 -5.364) 5.828 12.491 ( 1.513 -0.025 4.183) 4.448 12.663 ( 0.510 -3.429 0.765) 3.550 12.766 ( 0.922 -3.312 -2.722) 4.385 12.894 ( -2.622 -9.221 -6.728) 11.712 13.104 ( 3.936 -8.232 0.564) 9.142 13.156 ( -3.887 -8.440 -0.407) 9.301 13.236 ( 3.694 -2.174 2.737) 5.086 13.443 ( -4.761 -3.624 -5.749) 8.297 13.757 ( -1.209 -4.390 -4.492) 6.396 13.768 ( 2.148 -8.173 -3.826) 9.276 14.003 ( 2.841 -7.490 3.927) 8.922 14.012 ( -4.987 -5.724 2.583) 8.019 14.279 ( 2.812 0.026 5.069) 5.796 14.423 ( -1.016 -0.917 -1.143) 1.783 16.396 ( -1.967 -10.977 4.435) 12.001 16.609 ( 1.826 -11.217 -4.079) 12.075 17.373 ( -2.220 -16.648 -0.374) 16.799 17.379 ( 2.298 -16.649 -0.475) 16.813 18.097 ( 1.467 11.562 2.401) 11.900 18.218 ( -3.579 9.218 -2.419) 10.180 18.302 ( 2.429 11.157 0.652) 11.436 18.366 ( -0.530 11.276 -1.722) 11.419 20.199 ( 0.342 7.587 1.018) 7.663 20.251 ( -0.363 9.576 -1.086) 9.644 20.630 ( -6.136 -4.887 -0.091) 7.845 20.637 ( 2.637 -6.682 -0.169) 7.186 20.718 ( 4.060 -3.604 3.936) 6.706 20.903 ( -1.299 -4.432 -3.830) 6.000 21.851 ( -0.048 -8.115 1.192) 8.203 21.899 ( 0.031 -7.523 -0.800) 7.566 22.462 ( 1.239 -0.253 2.128) 2.475 22.595 ( -1.233 -0.845 -4.069) 4.335 22.754 ( -0.252 -1.760 2.752) 3.277 22.815 ( 0.293 -2.317 -0.532) 2.395 23.297 ( 0.581 12.424 0.197) 12.439 23.307 ( -0.722 12.424 -0.196) 12.447 23.604 ( -0.853 7.819 1.719) 8.052 23.697 ( 1.077 9.690 -2.121) 9.978 24.313 ( -2.577 6.042 2.832) 7.153 24.474 ( 4.259 5.010 -4.402) 7.912 24.804 ( -4.086 -0.476 4.399) 6.023 24.951 ( 2.266 0.100 -2.209) 3.166 26.992 ( 0.670 -3.874 1.695) 4.282 27.048 ( -0.617 -3.568 -0.444) 3.648 27.102 ( 1.282 -2.332 0.754) 2.766 27.163 ( -0.434 -4.636 -0.928) 4.748 27.202 ( 0.669 -1.174 -1.327) 1.894 27.247 ( -0.256 -0.851 -5.339) 5.412 27.456 ( -1.773 -8.659 4.213) 9.791 27.618 ( 0.984 -8.618 -4.734) 9.882 27.932 ( 2.740 -0.148 4.792) 5.522 27.983 ( -1.567 1.716 0.052) 2.324 28.085 ( 2.724 11.275 4.398) 12.405 28.272 ( -2.508 4.614 -2.400) 5.774 28.364 ( 2.071 2.562 3.601) 4.880 28.551 ( -1.453 2.728 -4.038) 5.085 28.893 ( 0.896 2.901 1.258) 3.287 29.003 ( -1.962 3.031 -2.608) 4.454 29.244 ( 0.412 -3.291 4.662) 5.722 29.417 ( -0.198 -2.790 -2.724) 3.905 29.579 ( 0.502 8.097 0.750) 8.147 29.617 ( -0.738 3.931 -0.758) 4.071 30.633 ( 0.275 -0.913 0.419) 1.042 30.651 ( -0.287 -0.219 -0.322) 0.484 30.765 ( -0.909 2.908 0.133) 3.050 30.772 ( 0.974 3.463 -0.088) 3.598 33.845 ( -0.417 0.058 0.341) 0.542 33.870 ( 0.845 -0.435 -0.848) 1.274 33.965 ( -0.843 -0.352 1.797) 2.016 34.034 ( 0.238 -0.886 -1.196) 1.507 37.265 ( 0.170 -0.928 0.210) 0.966 37.284 ( -0.428 -1.063 -0.829) 1.415 37.332 ( 0.192 -0.915 1.336) 1.631 37.369 ( 0.133 0.254 -0.468) 0.549 37.574 ( -0.153 2.482 1.672) 2.996 37.660 ( 0.806 1.502 -1.706) 2.412 37.855 ( 0.669 -0.728 0.288) 1.030 37.881 ( -1.323 -0.568 -0.840) 1.667 49.301 ( 0.416 -2.953 -0.225) 2.990 49.347 ( 0.409 -1.229 -2.835) 3.117 49.624 ( -3.733 -4.744 6.187) 8.645 49.790 ( 4.471 -4.752 -0.842) 6.578 50.526 ( 1.001 0.274 -1.133) 1.536 50.595 ( 2.004 -1.254 -5.947) 6.400 50.832 ( -7.519 -3.127 4.463) 9.286 50.925 ( 3.057 -2.731 -0.896) 4.196 51.787 ( 0.050 3.307 0.302) 3.321 51.808 ( -0.233 4.287 -0.571) 4.331 52.331 ( 0.087 3.705 0.400) 3.727 52.350 ( 0.057 4.504 -0.331) 4.517 52.528 ( 3.575 -3.370 5.627) 7.470 52.915 ( -4.167 -7.599 -12.113) 14.894 53.301 ( -0.086 -4.261 3.371) 5.434 53.449 ( -1.418 -5.744 -1.687) 6.152 53.897 ( -1.192 0.056 0.259) 1.221 53.931 ( 0.288 -0.095 -0.637) 0.706 54.115 ( 1.543 -0.997 7.283) 7.511 54.321 ( 0.087 -1.931 -2.391) 3.075 55.817 ( -1.890 -0.434 1.795) 2.642 55.862 ( 2.216 -1.662 4.776) 5.521 55.904 ( 0.540 -0.403 -0.500) 0.839 56.139 ( -0.225 -3.773 -5.195) 6.424 57.423 ( -0.102 3.977 0.137) 3.980 57.434 ( 0.290 4.420 -0.366) 4.444 57.474 ( -0.306 6.437 0.884) 6.504 57.515 ( 0.019 9.577 -0.870) 9.616 58.163 ( -0.667 -1.316 1.565) 2.151 58.290 ( 0.850 -2.639 -5.177) 5.873 58.543 ( 1.694 -5.188 6.875) 8.777 58.739 ( -1.556 -7.078 -2.695) 7.732 60.942 ( -0.043 2.167 0.210) 2.178 60.954 ( 0.024 2.296 -0.324) 2.319 60.966 ( 0.252 2.687 0.182) 2.705 60.971 ( -0.198 2.147 -0.074) 2.157 ======================= Grid point 94 (39/90) ======================= q-point: (-0.38 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.550 ( -11.161 18.347 1.415) 21.522 2.694 ( -21.331 -6.522 8.288) 23.796 2.867 ( -9.359 6.520 -3.807) 12.024 3.295 ( -13.955 11.603 4.236) 18.636 3.522 ( 9.787 16.804 4.419) 19.942 3.823 ( -10.073 4.051 -11.984) 16.171 4.203 ( -16.708 4.378 -2.087) 17.398 4.526 ( 1.043 18.430 5.299) 19.205 4.596 ( -0.671 13.773 1.752) 13.900 4.803 ( -11.757 -0.873 -8.398) 14.475 4.864 ( -2.768 14.181 1.510) 14.527 5.112 ( -8.369 10.820 7.527) 15.613 5.195 ( -20.425 10.601 -1.110) 23.039 5.428 ( -7.360 6.244 3.141) 10.150 5.580 ( -12.170 11.937 1.533) 17.116 5.726 ( -6.568 -4.003 -3.778) 8.570 5.988 ( -9.632 -5.463 -5.854) 12.525 6.043 ( 6.672 -6.375 -5.769) 10.883 6.265 ( -5.945 -10.910 -4.330) 13.158 6.375 ( 1.995 -4.410 0.254) 4.847 6.473 ( 13.294 -8.970 15.814) 22.523 6.638 ( -3.586 -2.066 1.950) 4.575 6.682 ( -3.852 -1.065 1.071) 4.137 6.839 ( -9.037 0.128 5.935) 10.813 6.882 ( 1.359 -6.756 -2.807) 7.441 7.148 ( -2.226 3.254 -1.090) 4.090 7.227 ( -1.168 10.205 -2.766) 10.637 7.382 ( 3.019 8.765 1.889) 9.461 7.424 ( 0.741 3.567 1.883) 4.101 7.468 ( 4.598 3.172 -1.696) 5.838 7.657 ( -8.765 4.871 -14.878) 17.942 7.700 ( -4.280 4.696 -9.487) 11.418 7.879 ( 0.991 -4.448 5.871) 7.432 7.932 ( 1.236 -1.849 -1.504) 2.685 8.034 ( 3.701 2.337 6.977) 8.237 8.137 ( -2.653 -1.169 -7.459) 8.003 8.266 ( 3.932 2.268 9.509) 10.536 8.495 ( 0.472 -1.865 -1.799) 2.634 8.680 ( -4.173 -2.211 -5.384) 7.161 8.795 ( 0.809 2.085 -4.668) 5.176 9.009 ( -0.629 -11.519 8.874) 14.554 9.162 ( 1.192 -2.575 1.040) 3.022 9.253 ( 0.341 -11.929 1.573) 12.038 9.337 ( -2.872 -3.237 9.257) 10.219 9.382 ( -2.907 1.672 0.788) 3.445 9.524 ( -2.522 -0.636 -1.516) 3.010 9.569 ( 3.287 -1.964 -2.867) 4.783 9.832 ( -1.037 5.830 -2.195) 6.315 10.055 ( -2.009 -3.675 2.411) 4.833 10.360 ( 4.224 -8.832 -2.508) 10.107 10.422 ( -0.098 2.026 2.761) 3.426 10.598 ( -8.146 -0.339 -1.415) 8.275 10.642 ( 7.660 0.654 -1.690) 7.871 10.748 ( -4.815 6.681 2.938) 8.743 10.965 ( 0.266 11.253 0.429) 11.265 11.002 ( 0.625 3.795 -0.880) 3.946 11.107 ( 5.527 1.399 -0.660) 5.739 11.150 ( 4.686 0.620 1.918) 5.102 11.224 ( 0.360 6.614 -1.984) 6.915 11.369 ( -7.259 0.288 -6.643) 9.844 11.638 ( 4.761 2.225 1.046) 5.358 11.743 ( 3.044 2.342 -0.028) 3.841 11.938 ( 8.200 -4.340 7.255) 11.778 12.027 ( 8.486 3.269 7.845) 12.010 12.161 ( 3.742 0.007 1.359) 3.982 12.316 ( 3.275 2.547 -6.617) 7.810 12.540 ( 1.397 0.433 3.813) 4.084 12.618 ( -3.794 -5.325 -3.036) 7.208 12.756 ( -1.847 -6.634 -1.248) 6.998 12.855 ( 1.223 -4.546 -2.642) 5.398 13.079 ( -2.495 -9.810 -3.293) 10.644 13.183 ( -0.819 -6.646 2.153) 7.033 13.283 ( 3.895 -5.549 -3.678) 7.713 13.448 ( 5.806 -0.322 -0.232) 5.820 13.732 ( 0.160 -5.616 -2.643) 6.209 13.790 ( 0.836 -5.844 -2.677) 6.482 13.934 ( -2.878 -4.288 0.070) 5.164 14.083 ( 3.289 -7.711 4.932) 9.726 14.341 ( 1.250 -0.549 4.737) 4.930 14.384 ( -2.133 -0.242 -3.093) 3.765 16.375 ( -0.834 -10.608 2.721) 10.983 16.643 ( 2.098 -11.310 -2.248) 11.720 17.286 ( -5.945 -17.276 -0.792) 18.287 17.387 ( -1.551 -17.108 -0.336) 17.182 18.107 ( -2.012 6.778 -0.276) 7.076 18.169 ( -0.144 12.895 1.902) 13.036 18.320 ( 1.255 9.110 -2.427) 9.511 18.408 ( 3.499 14.086 -0.335) 14.518 20.222 ( 1.303 7.379 1.264) 7.599 20.255 ( 1.062 8.326 -1.620) 8.548 20.474 ( -6.164 -2.631 0.766) 6.746 20.656 ( -1.263 -7.952 1.433) 8.179 20.845 ( 5.679 -3.914 2.884) 7.476 20.941 ( 5.057 -4.574 -4.446) 8.141 21.756 ( -8.523 -6.233 0.912) 10.598 21.808 ( -7.918 -6.302 -0.500) 10.133 22.494 ( 1.236 -0.112 3.030) 3.274 22.555 ( -1.290 -0.779 -4.621) 4.860 22.748 ( -0.870 -1.544 2.350) 2.943 22.819 ( 0.201 -2.679 -0.501) 2.732 23.231 ( -3.353 16.599 0.990) 16.963 23.239 ( -2.439 15.195 -0.928) 15.418 23.767 ( 11.380 6.561 0.578) 13.148 23.879 ( 12.762 8.171 -1.016) 15.188 24.303 ( 1.273 5.663 0.435) 5.820 24.550 ( 2.671 4.994 -0.327) 5.673 24.818 ( 5.669 -1.289 0.564) 5.841 25.030 ( 5.551 -0.403 -0.098) 5.566 26.986 ( -2.484 -4.132 0.717) 4.875 27.002 ( -1.869 -3.057 0.146) 3.586 27.118 ( 0.147 -0.769 -1.193) 1.427 27.168 ( -2.077 -0.510 -1.580) 2.659 27.182 ( 2.707 -4.927 -0.700) 5.665 27.330 ( 7.107 -3.125 -3.092) 8.357 27.430 ( -1.777 -11.392 3.186) 11.962 27.625 ( 0.763 -9.130 -2.841) 9.592 27.937 ( -1.851 2.259 -0.850) 3.042 27.992 ( 1.030 1.379 2.950) 3.415 28.206 ( -1.983 6.082 -3.394) 7.242 28.211 ( 6.938 9.956 5.495) 13.321 28.408 ( 1.036 4.413 5.878) 7.423 28.501 ( -1.767 2.278 -5.778) 6.457 28.886 ( -2.743 2.562 1.994) 4.250 28.924 ( -3.787 2.926 -1.979) 5.178 29.247 ( -1.194 -4.291 5.259) 6.892 29.386 ( -2.119 -1.982 -3.173) 4.299 29.527 ( -4.025 4.228 0.188) 5.840 29.641 ( 1.580 8.863 0.068) 9.003 30.606 ( -1.548 -1.872 0.165) 2.435 30.672 ( 0.881 0.395 -0.074) 0.969 30.743 ( -0.946 3.498 -0.277) 3.634 30.797 ( 1.443 4.153 0.461) 4.421 33.847 ( 0.589 0.152 -0.113) 0.618 33.887 ( 0.877 -0.712 -0.339) 1.180 33.953 ( -0.658 -0.076 1.872) 1.985 34.038 ( 0.387 -1.001 -1.115) 1.548 37.257 ( -1.042 -0.828 0.015) 1.331 37.266 ( -0.898 -1.252 -0.217) 1.556 37.329 ( -0.708 -0.650 1.016) 1.399 37.367 ( -0.169 0.094 -0.555) 0.588 37.567 ( -0.783 2.234 1.434) 2.768 37.670 ( 0.517 1.631 -1.448) 2.242 37.821 ( -2.730 -0.624 -2.114) 3.509 37.876 ( -0.257 -0.453 1.025) 1.150 49.237 ( -5.995 -2.601 0.059) 6.536 49.273 ( -6.234 -1.229 -3.313) 7.166 49.479 ( -10.816 -3.414 4.996) 12.394 49.868 ( 2.628 -8.242 0.987) 8.707 50.547 ( 0.941 -0.358 -1.273) 1.622 50.586 ( -1.296 -2.351 -10.752) 11.082 50.736 ( -2.963 -1.594 4.218) 5.396 51.032 ( 6.871 -3.618 2.367) 8.118 51.787 ( -0.210 3.515 0.385) 3.542 51.801 ( -0.207 4.446 -0.531) 4.482 52.331 ( -0.229 3.802 0.382) 3.828 52.346 ( -0.286 4.281 -0.404) 4.310 52.637 ( 4.508 -4.507 8.448) 10.583 52.778 ( -5.103 -6.679 -14.590) 16.838 53.291 ( -1.867 -4.347 3.633) 5.965 53.397 ( -3.024 -4.980 -1.534) 6.025 53.865 ( -1.733 0.367 0.991) 2.030 53.920 ( -1.213 -0.022 -0.529) 1.323 54.176 ( 2.106 -1.316 5.968) 6.464 54.322 ( 0.699 -2.309 -2.426) 3.421 55.774 ( -2.129 -0.223 1.914) 2.872 55.863 ( -2.516 -0.240 -1.341) 2.861 55.966 ( 4.603 -2.692 7.242) 8.993 56.218 ( 8.287 -5.389 -6.146) 11.640 57.418 ( -0.283 3.619 0.012) 3.630 57.444 ( 0.557 5.098 -0.544) 5.157 57.476 ( 0.419 6.944 1.497) 7.116 57.530 ( 1.698 10.686 -1.187) 10.885 58.144 ( -1.232 -0.971 0.754) 1.741 58.287 ( 0.270 -2.558 -4.254) 4.971 58.609 ( 2.653 -6.068 8.566) 10.828 58.710 ( -0.554 -6.614 -4.337) 7.929 60.934 ( -0.408 1.570 0.107) 1.626 60.959 ( -0.426 1.680 -0.101) 1.737 60.970 ( 1.286 3.601 -0.123) 3.826 60.986 ( 1.051 3.685 0.063) 3.833 ======================= Grid point 95 (40/90) ======================= q-point: (-0.25 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.048 ( -34.828 1.698 4.036) 35.102 2.113 ( -33.126 5.402 28.854) 44.261 2.766 ( -3.080 10.236 -9.111) 14.045 3.134 ( -0.142 17.788 5.927) 18.750 3.481 ( -17.019 10.478 -18.828) 27.458 3.804 ( -42.816 32.896 12.342) 55.387 3.818 ( 7.830 11.517 -1.096) 13.970 3.968 ( -15.800 11.210 -6.091) 20.308 4.335 ( -17.483 19.410 10.905) 28.308 4.567 ( -13.397 13.816 -5.697) 20.070 4.734 ( -12.550 11.838 3.199) 17.546 4.846 ( -11.170 0.513 -0.996) 11.226 5.165 ( 2.310 5.187 8.502) 10.224 5.319 ( -7.523 10.334 4.987) 13.721 5.456 ( -4.371 5.257 0.505) 6.856 5.602 ( -6.484 3.971 -3.481) 8.363 5.746 ( -1.237 -10.625 -10.901) 15.273 5.973 ( -9.787 3.282 -1.630) 10.451 6.191 ( -2.825 -1.766 -6.502) 7.306 6.326 ( -9.581 -1.632 -4.128) 10.560 6.385 ( -12.672 8.554 -8.051) 17.279 6.618 ( 3.697 -4.249 0.818) 5.692 6.721 ( 4.364 -12.108 8.131) 15.224 6.853 ( 2.418 -11.071 -3.282) 11.798 6.910 ( 5.971 -8.870 -0.786) 10.721 7.124 ( -3.303 6.792 -4.938) 9.023 7.248 ( 4.738 1.267 1.005) 5.006 7.293 ( -6.567 1.729 -18.756) 19.947 7.401 ( -2.114 -2.977 3.742) 5.229 7.484 ( 3.573 12.751 2.293) 13.439 7.531 ( 1.427 2.816 5.185) 6.070 7.709 ( -2.395 -0.579 -3.307) 4.124 7.828 ( -0.436 -11.917 6.089) 13.389 7.907 ( -0.699 4.460 -5.056) 6.778 8.166 ( 2.575 1.390 3.215) 4.347 8.177 ( 4.059 -4.108 8.809) 10.533 8.326 ( -0.884 3.216 5.797) 6.687 8.468 ( -4.801 -9.935 -2.661) 11.351 8.599 ( -0.453 5.521 0.085) 5.540 8.822 ( 1.722 0.535 -1.770) 2.527 8.951 ( -8.943 -5.432 18.434) 21.196 9.138 ( -3.972 -4.571 -0.522) 6.078 9.175 ( -2.261 -14.508 -0.156) 14.684 9.326 ( -1.619 0.171 -2.321) 2.835 9.422 ( -2.707 -5.804 -0.910) 6.468 9.443 ( 4.549 0.040 0.794) 4.618 9.740 ( 7.705 3.997 -2.222) 8.960 9.824 ( 3.944 5.476 -0.658) 6.780 10.115 ( 3.004 -4.685 4.658) 7.257 10.319 ( -7.320 -2.858 0.060) 7.859 10.399 ( -0.165 -7.572 -3.331) 8.274 10.526 ( 0.811 2.484 0.891) 2.761 10.677 ( 0.453 2.077 0.495) 2.183 10.733 ( -2.553 -4.440 1.004) 5.219 10.964 ( 1.751 11.531 -1.544) 11.765 11.094 ( 0.715 6.153 -7.892) 10.033 11.137 ( 0.878 5.920 -0.464) 6.002 11.181 ( -0.571 4.027 -3.467) 5.345 11.239 ( 5.943 2.652 -1.374) 6.651 11.308 ( 3.628 -0.196 6.339) 7.306 11.721 ( 3.600 1.301 2.984) 4.853 11.844 ( 4.495 0.002 0.469) 4.520 12.010 ( -0.446 -4.566 -0.917) 4.678 12.169 ( -2.439 -2.428 -0.324) 3.457 12.284 ( 7.307 -2.351 6.638) 10.148 12.401 ( 2.621 3.028 -3.649) 5.418 12.499 ( -2.067 -4.081 -3.239) 5.606 12.614 ( 1.833 0.875 -0.342) 2.059 12.735 ( 1.852 -6.428 0.438) 6.703 12.884 ( 0.964 -6.104 -0.131) 6.181 13.029 ( -2.181 -9.477 -6.482) 11.687 13.098 ( -4.652 -6.354 0.078) 7.876 13.419 ( 8.009 -2.560 -4.665) 9.616 13.586 ( 5.306 -4.266 4.356) 8.082 13.759 ( 3.131 -3.667 -0.184) 4.826 13.805 ( 1.020 -4.538 1.369) 4.848 13.885 ( -1.497 -2.083 -2.514) 3.592 14.145 ( 0.656 -8.113 3.705) 8.943 14.314 ( -2.977 0.955 -2.957) 4.304 14.352 ( -1.686 0.766 2.918) 3.456 16.378 ( 0.681 -10.760 0.512) 10.794 16.670 ( -0.047 -10.020 -0.104) 10.021 17.133 ( -7.406 -19.383 -1.435) 20.799 17.311 ( -5.544 -16.719 -0.169) 17.615 18.056 ( -1.795 7.038 -0.838) 7.311 18.179 ( 0.068 5.542 1.503) 5.742 18.367 ( 3.257 14.221 -0.887) 14.616 18.483 ( 3.634 14.314 -0.833) 14.792 20.235 ( -0.336 3.308 -0.349) 3.343 20.293 ( 2.766 6.445 0.105) 7.015 20.411 ( -0.330 0.341 2.236) 2.286 20.624 ( -1.802 -9.008 0.705) 9.214 20.958 ( 4.246 -3.416 2.992) 6.217 21.032 ( 4.152 -4.813 -3.801) 7.406 21.555 ( -9.419 -2.188 -0.002) 9.670 21.614 ( -9.219 -2.245 0.374) 9.496 22.503 ( -1.625 -0.776 -4.126) 4.502 22.543 ( 1.682 -0.545 2.613) 3.155 22.739 ( -0.514 -1.299 2.320) 2.708 22.816 ( -0.400 -2.867 -0.812) 3.006 23.223 ( 1.467 22.687 3.479) 22.999 23.252 ( 5.116 24.148 -4.467) 25.085 23.982 ( 8.490 6.468 -0.624) 10.691 24.093 ( 5.849 6.983 1.457) 9.224 24.396 ( 8.482 4.058 -3.873) 10.169 24.573 ( -0.526 4.007 4.244) 5.861 25.032 ( 13.551 -1.823 -2.966) 13.991 25.171 ( 7.207 -1.203 2.059) 7.592 26.924 ( -3.212 -2.312 0.870) 4.052 26.956 ( -2.382 -3.753 -1.248) 4.617 27.130 ( -1.067 -2.079 1.037) 2.557 27.140 ( 2.605 -0.258 -2.694) 3.756 27.232 ( 1.628 -6.777 -1.481) 7.125 27.403 ( -0.752 -11.679 0.648) 11.721 27.491 ( 8.119 -5.941 -1.568) 10.182 27.637 ( 0.815 -9.399 -0.636) 9.456 27.895 ( -1.154 2.033 -2.367) 3.327 28.001 ( -1.282 3.075 3.191) 4.614 28.160 ( 0.034 8.002 -4.825) 9.344 28.380 ( 4.742 3.857 1.649) 6.331 28.438 ( -0.521 4.664 -1.180) 4.839 28.497 ( 5.676 6.717 2.473) 9.135 28.774 ( -6.442 0.844 -0.979) 6.570 28.872 ( -2.074 7.291 3.097) 8.188 29.236 ( -1.719 -6.284 6.319) 9.076 29.299 ( -5.164 -1.947 -3.633) 6.607 29.434 ( -4.482 3.234 0.309) 5.536 29.686 ( 3.140 12.910 2.507) 13.521 30.580 ( -0.875 -2.331 0.089) 2.491 30.673 ( -0.562 0.425 -0.151) 0.721 30.735 ( 0.254 5.101 -0.010) 5.107 30.842 ( 3.093 6.497 0.312) 7.203 33.872 ( 1.934 0.148 -0.563) 2.019 33.905 ( 0.835 -1.022 0.940) 1.620 33.954 ( 0.274 0.021 2.398) 2.413 34.040 ( -0.081 -1.120 -1.220) 1.658 37.231 ( -1.167 -0.948 0.002) 1.503 37.246 ( -0.966 -1.169 0.191) 1.529 37.309 ( -1.478 -0.848 0.452) 1.763 37.359 ( -0.417 0.009 -0.911) 1.002 37.554 ( -0.655 1.868 0.997) 2.217 37.671 ( -0.025 2.347 -1.704) 2.900 37.745 ( -3.684 0.369 -3.801) 5.306 37.855 ( -2.232 -0.570 1.865) 2.964 49.083 ( -7.951 -2.069 -0.183) 8.218 49.098 ( -8.751 -1.071 -2.894) 9.279 49.229 ( -13.886 -2.277 5.558) 15.129 49.849 ( -7.102 -17.619 -7.994) 20.610 50.476 ( -3.890 -0.816 -8.938) 9.782 50.573 ( 1.219 -0.390 -1.886) 2.279 50.699 ( -2.148 -1.394 4.545) 5.217 51.211 ( 8.620 -5.377 4.697) 11.193 51.780 ( -0.442 3.726 0.215) 3.758 51.802 ( 0.481 5.402 -0.388) 5.438 52.324 ( -0.498 3.600 0.189) 3.639 52.336 ( -0.476 3.986 -0.538) 4.050 52.639 ( -4.097 -5.262 -11.923) 13.661 52.744 ( 3.147 -5.957 8.595) 10.921 53.237 ( -4.363 -4.435 3.100) 6.951 53.319 ( -3.868 -4.572 -1.284) 6.125 53.835 ( -1.367 0.544 1.155) 1.871 53.881 ( -2.139 0.131 -0.658) 2.242 54.227 ( 1.319 -1.861 4.868) 5.376 54.335 ( 0.952 -2.561 -1.605) 3.169 55.741 ( -1.476 0.087 1.586) 2.169 55.810 ( -1.983 0.299 -1.299) 2.389 56.092 ( 4.844 -5.795 10.534) 12.962 56.410 ( 10.907 -9.752 -6.236) 15.904 57.414 ( -0.111 3.397 0.003) 3.399 57.448 ( 0.051 5.227 -0.850) 5.296 57.507 ( 1.869 9.498 3.173) 10.187 57.585 ( 4.396 14.031 -2.699) 14.949 58.137 ( 1.387 -0.531 -0.975) 1.776 58.284 ( 0.623 -2.232 -3.180) 3.934 58.669 ( -1.596 -6.614 -3.551) 7.675 58.710 ( 3.642 -7.588 8.664) 12.079 60.929 ( -0.099 1.395 0.252) 1.421 60.951 ( -0.249 1.337 -0.173) 1.371 60.996 ( 0.965 3.944 -0.048) 4.061 61.029 ( 3.715 7.909 -0.636) 8.761 ======================= Grid point 96 (41/90) ======================= q-point: (-0.12 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.346 ( -26.455 14.319 24.242) 38.634 1.680 ( -17.614 21.852 47.241) 54.950 2.535 ( -25.302 21.129 -2.487) 33.058 2.820 ( -30.459 39.897 13.720) 52.036 2.960 ( -21.861 11.806 -23.516) 34.209 3.299 ( 10.622 13.380 1.915) 17.190 3.887 ( 6.767 16.734 -6.062) 19.041 3.978 ( -10.618 15.099 3.160) 18.727 4.095 ( 1.901 9.162 6.727) 11.524 4.255 ( -10.036 18.927 -2.237) 21.539 4.380 ( -16.943 12.313 3.305) 21.203 4.637 ( -10.835 10.770 -8.034) 17.261 5.055 ( -12.121 -0.781 -0.660) 12.164 5.128 ( -9.101 12.697 -10.416) 18.776 5.286 ( -10.458 7.429 -2.519) 13.073 5.503 ( -0.837 4.709 -1.427) 4.991 5.749 ( -3.504 7.052 -11.051) 13.570 5.878 ( -1.616 2.064 5.107) 5.740 6.043 ( 2.265 -1.357 -2.203) 3.439 6.115 ( -2.962 0.911 5.300) 6.140 6.412 ( 3.474 1.429 -4.283) 5.697 6.636 ( 0.455 -10.716 -6.471) 12.526 6.732 ( -2.802 -8.667 6.087) 10.955 6.912 ( 2.101 -9.153 -0.244) 9.394 6.948 ( -3.527 -0.343 -8.804) 9.490 7.078 ( 0.959 -7.783 -0.356) 7.850 7.263 ( -2.079 1.932 -7.460) 7.981 7.300 ( 8.878 -3.841 -10.170) 14.036 7.417 ( 3.200 -8.377 1.143) 9.039 7.562 ( -3.746 -5.418 5.595) 8.642 7.602 ( 1.140 5.714 1.641) 6.053 7.625 ( -1.292 -4.114 12.705) 13.417 7.819 ( 0.129 -0.805 -1.408) 1.627 7.960 ( 3.785 1.130 -1.648) 4.280 8.155 ( -3.854 -6.113 -0.656) 7.256 8.229 ( 0.783 0.755 2.766) 2.972 8.280 ( -2.388 -0.747 11.932) 12.192 8.405 ( -1.406 1.429 6.062) 6.385 8.613 ( 0.478 3.468 -1.892) 3.979 8.780 ( -7.856 -5.624 18.104) 20.521 8.879 ( 2.311 -6.252 -1.141) 6.762 9.024 ( -5.817 -4.524 2.550) 7.798 9.134 ( -3.817 -2.486 -8.318) 9.484 9.265 ( 0.639 -1.353 0.021) 1.496 9.456 ( 5.346 -1.073 -0.854) 5.520 9.517 ( 0.876 -9.992 1.134) 10.094 9.833 ( 6.080 10.622 -3.311) 12.679 9.958 ( 0.413 3.131 -3.609) 4.796 10.095 ( 0.441 4.156 5.413) 6.839 10.235 ( -2.128 -15.271 1.800) 15.523 10.388 ( -0.409 -6.302 0.471) 6.333 10.498 ( -5.217 5.499 -3.749) 8.457 10.642 ( -3.943 -3.589 -1.220) 5.470 10.742 ( 3.826 -4.574 0.272) 5.969 10.984 ( -0.881 6.041 -8.403) 10.387 11.050 ( 5.305 4.462 0.777) 6.976 11.179 ( 0.540 2.530 3.789) 4.588 11.224 ( 1.699 7.175 5.828) 9.398 11.378 ( 7.513 2.498 1.168) 8.003 11.521 ( 12.592 1.766 4.875) 13.618 11.713 ( -5.814 -6.340 -4.758) 9.830 11.894 ( -0.790 0.122 1.912) 2.072 11.986 ( -0.194 -2.475 0.810) 2.611 12.104 ( -1.446 -0.026 -5.495) 5.682 12.258 ( -7.632 -1.806 -4.153) 8.875 12.386 ( -3.121 -2.526 4.249) 5.846 12.478 ( -2.524 -2.166 -6.227) 7.059 12.642 ( 2.393 -1.305 -0.648) 2.802 12.785 ( -0.093 -4.083 2.673) 4.881 12.884 ( -1.143 -1.694 0.586) 2.125 12.932 ( -3.712 -10.105 -5.070) 11.899 13.028 ( -1.749 -3.272 -1.135) 3.880 13.555 ( 5.118 -3.790 -1.771) 6.610 13.667 ( 2.273 -5.536 1.314) 6.127 13.827 ( 0.817 0.896 1.974) 2.317 13.850 ( 2.540 -6.494 2.544) 7.423 13.890 ( 3.917 0.662 2.164) 4.524 14.112 ( -3.493 -5.287 0.527) 6.359 14.249 ( -3.301 2.115 0.679) 3.979 14.309 ( -2.372 0.179 2.052) 3.141 16.409 ( 2.331 -10.693 -1.008) 10.990 16.594 ( -7.182 -7.949 0.333) 10.718 17.031 ( -1.700 -18.845 0.216) 18.923 17.178 ( -5.929 -16.142 -0.635) 17.208 18.039 ( 0.147 5.875 0.549) 5.902 18.177 ( -0.327 1.812 -1.142) 2.167 18.431 ( 2.406 16.353 1.467) 16.594 18.546 ( 2.532 14.128 -1.653) 14.448 20.238 ( 1.051 -0.684 1.872) 2.253 20.354 ( 2.473 5.188 0.571) 5.776 20.432 ( 0.833 -1.162 1.828) 2.321 20.578 ( -2.850 -10.649 -0.081) 11.025 21.030 ( 1.689 -2.350 2.502) 3.825 21.095 ( 2.857 -3.920 -2.629) 5.517 21.407 ( -4.285 0.556 -1.182) 4.480 21.482 ( -2.692 1.483 0.279) 3.086 22.457 ( -0.940 -0.028 -2.565) 2.732 22.583 ( 0.777 -2.365 1.472) 2.892 22.739 ( -0.213 -0.998 2.297) 2.514 22.803 ( -0.366 -2.252 -0.927) 2.463 23.264 ( 0.151 28.125 6.349) 28.833 23.470 ( 19.256 39.464 -15.998) 46.735 24.117 ( 4.861 6.300 -1.325) 8.067 24.151 ( 0.554 6.710 1.577) 6.915 24.560 ( -1.613 3.053 4.786) 5.902 24.582 ( 8.566 2.987 -5.114) 10.414 25.292 ( 8.918 -2.419 -0.423) 9.250 25.318 ( 6.890 -1.337 1.066) 7.099 26.862 ( -2.838 -1.761 1.577) 3.693 26.910 ( -1.349 -2.732 -1.594) 3.439 27.118 ( -1.536 -6.301 4.004) 7.622 27.185 ( 0.148 -4.403 -1.096) 4.540 27.256 ( 2.229 -6.168 1.009) 6.636 27.422 ( 3.828 -11.010 -4.928) 12.655 27.613 ( 1.016 -9.365 1.672) 9.567 27.650 ( 2.000 -7.261 -2.483) 7.930 27.914 ( 4.214 2.944 -2.756) 5.833 27.965 ( -2.191 3.754 2.193) 4.869 28.192 ( 3.242 6.025 -2.478) 7.277 28.407 ( -1.079 2.158 -5.148) 5.685 28.449 ( 3.034 5.933 3.950) 7.747 28.609 ( 0.735 0.571 -0.524) 1.068 28.662 ( -2.221 0.304 -0.175) 2.249 28.886 ( 2.899 12.478 0.392) 12.816 29.076 ( -11.702 -3.804 0.227) 12.307 29.282 ( 0.994 -2.753 0.915) 3.066 29.363 ( -1.265 3.742 0.060) 3.951 29.788 ( 3.527 10.057 -1.942) 10.833 30.574 ( 0.244 -1.548 0.158) 1.575 30.664 ( -0.090 1.099 -0.779) 1.351 30.751 ( 1.275 6.672 -0.097) 6.793 30.937 ( 6.043 12.057 -6.486) 14.965 33.922 ( 2.278 -1.054 0.798) 2.634 33.934 ( 2.148 -1.038 0.349) 2.411 33.983 ( 1.470 -1.157 4.195) 4.593 34.026 ( -0.753 -1.038 -0.943) 1.592 37.217 ( -0.151 -0.346 0.548) 0.665 37.234 ( 0.084 -1.827 -0.169) 1.837 37.265 ( -2.647 -1.442 -0.997) 3.175 37.344 ( -0.698 0.500 -1.668) 1.876 37.549 ( 0.298 2.496 -0.068) 2.515 37.642 ( -2.602 4.654 -5.923) 7.970 37.675 ( -0.965 1.555 1.667) 2.476 37.794 ( -3.828 0.108 1.545) 4.129 48.927 ( -7.589 -0.970 0.624) 7.676 48.931 ( -6.096 -1.940 -1.517) 6.575 48.969 ( -9.979 -1.012 1.860) 10.201 49.350 ( -34.333 -16.364 -21.230) 43.558 50.485 ( 4.249 -1.039 4.993) 6.638 50.594 ( 1.299 -0.801 -1.615) 2.222 50.711 ( 3.792 -4.142 14.618) 15.659 51.377 ( 4.799 -7.670 4.142) 9.951 51.774 ( -0.150 4.099 0.578) 4.142 51.819 ( 1.467 6.262 -1.283) 6.558 52.310 ( -0.821 2.833 -0.038) 2.950 52.326 ( -0.253 3.917 -0.695) 3.987 52.563 ( -0.622 -2.863 -3.747) 4.757 52.798 ( -0.560 -7.703 5.708) 9.604 53.135 ( -5.176 -3.518 1.721) 6.491 53.238 ( -3.225 -4.079 -1.498) 5.412 53.814 ( -0.957 0.639 0.800) 1.402 53.839 ( -1.391 0.362 -0.653) 1.579 54.257 ( 0.213 -3.084 4.610) 5.550 54.347 ( 0.490 -2.412 -0.805) 2.589 55.720 ( -0.903 0.424 1.327) 1.660 55.776 ( -0.890 0.519 -1.196) 1.578 56.210 ( 2.547 -11.873 14.394) 18.832 56.595 ( 7.235 -14.587 -5.044) 17.046 57.413 ( 0.036 3.394 0.099) 3.396 57.445 ( -0.078 5.211 -1.012) 5.309 57.555 ( 0.916 11.747 5.209) 12.883 57.711 ( 9.096 16.986 -7.024) 20.509 58.234 ( 8.655 -0.516 -1.535) 8.805 58.300 ( 1.526 -2.157 -1.413) 2.996 58.591 ( -4.078 -6.072 -4.807) 8.752 58.806 ( 0.745 -12.563 7.627) 14.716 60.930 ( 0.043 1.516 0.452) 1.583 60.948 ( 0.007 1.156 -0.076) 1.159 61.012 ( 0.601 4.900 0.228) 4.942 61.153 ( 8.943 12.979 -5.943) 16.844 ======================= Grid point 97 (42/90) ======================= q-point: ( 0.00 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.153 ( 12.927 32.737 29.843) 46.146 2.325 ( -2.084 43.392 19.065) 47.442 2.706 ( -0.749 20.831 2.771) 21.027 3.014 ( -8.714 29.044 20.365) 36.527 3.262 ( 5.974 21.668 -16.918) 28.132 3.591 ( -0.152 11.908 -5.264) 13.020 3.985 ( -2.003 -0.807 -5.140) 5.576 4.248 ( -1.616 7.907 -1.918) 8.295 4.358 ( 2.916 9.092 1.419) 9.653 4.550 ( 0.267 21.265 1.149) 21.298 4.648 ( -0.598 13.676 -2.118) 13.852 4.856 ( 0.915 20.483 -4.534) 20.999 5.011 ( -0.681 9.678 -4.282) 10.605 5.255 ( -2.708 18.175 -10.823) 21.326 5.387 ( -1.491 4.684 -0.659) 4.959 5.602 ( 3.578 11.906 -9.325) 15.540 5.774 ( -11.489 0.502 6.762) 13.341 5.943 ( -1.686 7.634 10.456) 13.056 6.080 ( 5.581 -6.096 2.802) 8.726 6.149 ( 4.865 1.319 10.782) 11.902 6.372 ( -2.997 -4.764 -2.407) 6.121 6.555 ( -0.682 9.962 -9.448) 13.746 6.632 ( 2.666 4.992 3.282) 6.542 6.731 ( 0.993 -7.956 -4.670) 9.279 6.849 ( -1.612 -8.863 -6.594) 11.164 7.003 ( -1.029 8.364 -2.719) 8.854 7.068 ( -5.983 -5.353 1.374) 8.145 7.174 ( -4.472 0.960 0.453) 4.596 7.292 ( 3.180 -2.965 2.843) 5.195 7.437 ( 6.981 -3.428 -12.081) 14.368 7.617 ( -0.011 -2.562 5.799) 6.340 7.868 ( 3.884 1.158 -3.794) 5.551 7.921 ( -1.668 -0.391 -0.541) 1.796 7.958 ( -0.899 1.462 -0.678) 1.845 8.026 ( 6.290 -6.389 5.634) 10.589 8.171 ( -6.226 -5.662 1.668) 8.580 8.411 ( -2.725 8.517 0.794) 8.978 8.466 ( 4.936 -2.380 3.588) 6.550 8.511 ( 1.082 -0.332 3.180) 3.376 8.643 ( -0.927 5.254 0.571) 5.366 8.745 ( 2.465 -9.889 7.476) 12.640 9.001 ( -3.270 2.089 3.733) 5.384 9.052 ( -0.606 3.648 -3.218) 4.902 9.258 ( -0.259 -5.950 4.678) 7.573 9.451 ( 0.507 -4.900 6.354) 8.040 9.553 ( 4.215 6.068 -7.700) 10.671 9.808 ( -2.482 -5.759 -2.060) 6.601 9.875 ( -3.690 -6.372 0.794) 7.406 10.019 ( 2.630 -14.817 -1.599) 15.133 10.142 ( 0.004 -5.124 -4.510) 6.826 10.278 ( 2.046 3.394 0.528) 3.998 10.533 ( 1.416 4.413 6.855) 8.275 10.546 ( -4.179 1.115 0.339) 4.338 10.770 ( -0.462 0.853 -1.332) 1.648 10.964 ( 1.725 -12.337 -4.503) 13.246 10.991 ( -1.075 -10.276 -1.979) 10.520 11.218 ( 2.218 -3.443 0.089) 4.096 11.289 ( -7.826 -8.882 -5.481) 13.045 11.428 ( 1.041 7.881 5.596) 9.722 11.564 ( 6.268 -2.258 2.635) 7.165 11.761 ( 3.855 -2.905 3.154) 5.766 11.842 ( -4.147 0.533 0.090) 4.182 12.055 ( -3.263 8.183 -0.134) 8.810 12.111 ( 2.014 -1.307 -2.195) 3.253 12.134 ( -2.536 -1.096 2.260) 3.569 12.285 ( 3.131 4.111 -3.571) 6.282 12.401 ( 4.112 -3.156 5.066) 7.248 12.552 ( -2.403 -9.968 -1.785) 10.408 12.756 ( 1.106 1.044 0.263) 1.544 12.797 ( -0.524 2.280 -2.915) 3.738 12.898 ( 0.181 -0.861 1.521) 1.757 12.982 ( -0.896 1.273 -2.730) 3.142 13.431 ( 2.097 -8.688 1.958) 9.150 13.556 ( -2.633 -6.908 -4.204) 8.505 13.731 ( 0.933 -9.101 2.586) 9.507 13.792 ( -1.286 -10.001 -0.690) 10.107 14.003 ( 3.293 2.042 3.846) 5.459 14.081 ( -1.754 5.340 0.379) 5.634 14.230 ( -0.602 -0.346 1.397) 1.560 14.268 ( 0.724 -0.776 -0.052) 1.063 16.258 ( -1.778 -7.502 1.050) 7.781 16.312 ( 1.999 -9.937 -1.153) 10.201 16.676 ( -3.412 -16.790 0.412) 17.138 16.690 ( 3.046 -20.374 -0.051) 20.601 18.200 ( 0.725 7.666 0.525) 7.718 18.230 ( -1.058 5.281 -0.559) 5.415 18.786 ( 0.584 13.697 0.546) 13.721 18.848 ( 0.106 12.073 -1.833) 12.212 20.237 ( 0.710 -1.069 2.079) 2.443 20.326 ( -0.762 -4.797 -1.659) 5.132 20.502 ( 0.109 6.758 0.592) 6.784 20.524 ( -0.085 6.175 -0.348) 6.185 20.957 ( -1.452 -5.734 1.443) 6.089 21.025 ( 1.451 -6.549 -1.322) 6.837 21.304 ( 1.298 -6.947 0.608) 7.094 21.340 ( -1.511 -9.104 -0.909) 9.273 22.470 ( 2.006 -0.387 0.288) 2.064 22.512 ( -1.904 -1.790 -1.402) 2.966 22.716 ( -0.376 -1.225 1.578) 2.033 22.760 ( 0.425 -2.354 -0.237) 2.404 23.919 ( -4.155 32.084 6.867) 33.073 24.262 ( 0.284 9.763 -1.408) 9.868 24.366 ( 2.478 9.902 -1.800) 10.365 24.466 ( 5.324 16.858 -9.666) 20.148 24.600 ( -2.125 6.204 0.521) 6.579 24.769 ( 3.910 2.936 -5.079) 7.050 25.270 ( -3.009 -4.729 3.497) 6.607 25.386 ( 1.740 -3.611 -1.457) 4.265 26.766 ( -1.535 -2.669 0.925) 3.215 26.872 ( 1.354 -0.428 -1.441) 2.023 26.912 ( -3.010 -4.388 5.260) 7.483 27.066 ( 0.584 -4.927 -0.733) 5.016 27.221 ( -0.479 -3.136 1.016) 3.331 27.324 ( 2.410 -6.652 -3.076) 7.715 27.402 ( -1.897 -7.567 2.192) 8.104 27.531 ( 1.516 -8.351 -3.287) 9.101 27.981 ( -3.250 2.554 1.933) 4.563 28.069 ( 5.150 0.880 -1.601) 5.464 28.247 ( -3.813 3.757 2.931) 6.103 28.415 ( 0.059 2.138 -5.275) 5.692 28.613 ( -0.766 1.162 0.061) 1.393 28.624 ( 2.430 2.828 -0.500) 3.762 28.736 ( -2.272 -0.599 4.613) 5.177 28.856 ( 3.739 1.493 -0.928) 4.132 29.065 ( 1.044 2.172 3.864) 4.554 29.221 ( -3.071 -1.378 -2.044) 3.938 29.530 ( 1.337 5.437 0.870) 5.666 29.724 ( -4.551 -0.112 -7.875) 9.096 30.600 ( 0.210 3.185 2.145) 3.846 30.708 ( -0.191 2.902 -1.255) 3.168 30.936 ( 0.312 8.062 0.137) 8.069 31.141 ( -4.295 6.958 -13.788) 16.030 33.906 ( -0.527 -0.443 2.397) 2.494 33.960 ( -0.264 -0.877 -0.249) 0.949 33.977 ( -1.671 -0.688 -0.188) 1.817 33.987 ( 1.869 -0.898 -0.121) 2.077 37.179 ( -0.185 -2.184 -0.010) 2.192 37.188 ( -0.101 -1.923 -0.247) 1.942 37.232 ( 1.039 -1.708 1.409) 2.446 37.289 ( -0.223 -3.306 -1.142) 3.505 37.647 ( 0.675 3.687 -0.378) 3.767 37.653 ( -1.188 2.961 -0.427) 3.219 37.760 ( -0.887 1.253 -0.015) 1.535 37.773 ( 2.768 1.585 -0.987) 3.339 48.783 ( -1.849 -0.017 0.658) 1.963 48.820 ( 3.946 -0.075 -0.917) 4.052 48.870 ( -1.803 -1.385 0.562) 2.343 48.887 ( 0.507 -1.054 -0.217) 1.190 50.517 ( 0.587 -0.544 1.711) 1.889 50.601 ( 0.568 0.036 -1.376) 1.489 50.740 ( 6.461 -8.821 16.388) 19.700 51.162 ( -3.866 -11.801 -3.927) 13.024 51.891 ( 0.157 6.557 1.278) 6.682 51.959 ( 0.201 5.649 -1.456) 5.837 52.373 ( 0.437 3.585 0.940) 3.732 52.426 ( -0.057 5.519 -1.264) 5.663 52.529 ( 2.680 -3.842 1.009) 4.792 52.574 ( -2.865 -7.155 -0.786) 7.747 53.002 ( 0.042 -5.385 1.882) 5.705 53.098 ( 0.330 -5.998 -2.107) 6.366 53.821 ( -0.339 1.227 0.248) 1.297 53.840 ( 0.232 0.871 -0.317) 0.955 54.201 ( -1.372 -1.501 3.171) 3.767 54.299 ( 0.440 -2.864 -1.213) 3.142 55.729 ( -0.352 1.249 1.195) 1.764 55.786 ( 0.326 1.424 -1.129) 1.846 56.038 ( -2.107 -6.502 7.908) 10.452 56.354 ( 1.126 -13.639 -5.283) 14.670 57.516 ( 0.175 6.186 0.564) 6.214 57.573 ( -0.106 7.429 -2.615) 7.877 57.765 ( -1.706 7.860 6.218) 10.166 58.035 ( 4.230 2.189 -6.127) 7.760 58.266 ( 1.421 -4.737 1.614) 5.202 58.328 ( -4.819 -3.192 -1.369) 5.940 58.399 ( 5.719 -6.130 2.838) 8.851 58.522 ( -5.490 -5.194 -2.768) 8.048 60.971 ( -0.018 2.061 0.599) 2.146 60.982 ( 0.092 1.787 0.277) 1.811 61.150 ( 0.171 6.274 1.918) 6.563 61.382 ( -0.586 2.150 -8.761) 9.040 ======================= Grid point 98 (43/90) ======================= q-point: ( 0.12 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.257 ( 0.063 36.719 24.051) 43.895 2.587 ( 20.034 24.717 37.745) 49.366 2.677 ( -0.660 14.747 -13.352) 19.904 3.315 ( 15.090 18.092 -8.208) 24.948 3.463 ( 13.408 15.089 9.800) 22.439 3.600 ( 5.077 14.502 -11.868) 19.415 3.976 ( 6.608 8.978 -10.156) 15.081 4.181 ( -0.892 12.591 -4.452) 13.385 4.476 ( 8.953 4.732 11.132) 15.049 4.733 ( 13.139 13.554 -3.923) 19.281 4.742 ( 9.103 21.130 6.900) 24.020 4.979 ( 12.245 15.874 0.159) 20.049 5.103 ( 8.258 4.920 -5.389) 11.020 5.225 ( 6.038 20.122 -14.044) 25.271 5.344 ( -5.773 0.482 -2.261) 6.219 5.595 ( -3.409 2.429 9.842) 10.695 5.738 ( 9.289 20.058 -6.591) 23.066 5.947 ( -1.852 5.911 3.481) 7.105 6.170 ( 1.328 -3.981 5.577) 6.979 6.292 ( 5.578 -0.341 0.978) 5.674 6.350 ( 4.004 3.789 3.121) 6.334 6.522 ( -0.178 4.589 -7.135) 8.485 6.609 ( -4.060 -2.869 4.402) 6.641 6.739 ( -3.794 -3.711 -4.868) 7.202 6.795 ( -0.604 -4.535 -6.274) 7.765 6.952 ( -3.984 -4.113 -3.940) 6.950 7.026 ( 4.373 0.435 -1.009) 4.509 7.154 ( 2.660 6.022 2.144) 6.924 7.427 ( 7.476 4.712 1.966) 9.053 7.494 ( -1.228 -4.755 -1.157) 5.045 7.640 ( 3.111 -9.628 -5.980) 11.753 7.828 ( -3.851 -2.158 6.986) 8.264 7.869 ( -5.770 -2.816 -3.492) 7.309 7.981 ( 0.239 0.758 -7.915) 7.955 8.018 ( -1.662 3.112 -2.270) 4.195 8.239 ( 8.628 -10.693 8.064) 15.931 8.345 ( -0.412 5.546 -1.323) 5.717 8.473 ( -2.534 -0.279 5.593) 6.147 8.650 ( 7.360 -2.785 1.355) 7.985 8.719 ( 5.891 9.924 0.135) 11.541 8.813 ( 0.655 -2.373 10.468) 10.754 8.958 ( 0.268 -1.008 2.790) 2.978 9.021 ( -1.807 -1.379 -0.271) 2.290 9.275 ( 1.176 -0.859 0.651) 1.595 9.444 ( -2.871 -6.190 5.017) 8.469 9.645 ( 5.481 -0.200 -5.560) 7.809 9.737 ( -3.097 -6.539 2.296) 7.591 9.838 ( 0.940 -1.742 -0.975) 2.207 10.058 ( -2.184 0.776 -8.545) 8.854 10.097 ( 2.607 -14.923 0.103) 15.150 10.420 ( 5.726 0.355 3.493) 6.717 10.474 ( 0.660 3.735 0.877) 3.893 10.608 ( 2.096 5.044 9.452) 10.917 10.709 ( -3.894 1.941 -3.479) 5.571 10.882 ( -3.079 -8.072 -7.746) 11.603 11.036 ( -1.759 -18.255 -4.387) 18.857 11.149 ( 0.919 -1.117 1.407) 2.018 11.329 ( 4.528 -3.099 1.548) 5.702 11.470 ( 0.386 5.450 4.423) 7.030 11.627 ( -0.788 1.910 -5.143) 5.542 11.687 ( -7.615 3.699 2.529) 8.836 11.905 ( 0.019 0.838 4.399) 4.479 11.971 ( 3.568 -2.084 2.449) 4.804 11.996 ( -7.077 -2.884 -2.594) 8.070 12.179 ( 2.259 4.840 -2.009) 5.706 12.354 ( 3.057 0.761 -2.623) 4.100 12.501 ( -0.939 -7.572 -2.682) 8.087 12.567 ( 4.252 -10.492 2.646) 11.626 12.690 ( -3.785 -3.054 0.617) 4.903 12.812 ( 0.268 3.576 -1.082) 3.745 12.884 ( -1.816 -1.618 -1.506) 2.861 12.971 ( 0.718 -2.452 -0.067) 2.556 13.462 ( -0.430 -7.639 2.691) 8.111 13.475 ( -3.179 -7.820 -4.217) 9.437 13.711 ( -3.576 -6.113 3.082) 7.724 13.748 ( -2.569 -10.858 -1.561) 11.266 14.018 ( -2.275 2.116 -0.839) 3.218 14.028 ( -2.537 0.087 3.206) 4.090 14.229 ( 0.539 -2.517 0.998) 2.761 14.331 ( 3.231 -1.187 0.597) 3.494 16.187 ( -2.226 -9.886 0.100) 10.134 16.417 ( 2.504 -10.358 0.344) 10.662 16.623 ( 2.873 -16.974 -0.444) 17.221 16.819 ( 6.846 -17.772 0.144) 19.045 18.210 ( 0.021 6.226 -0.835) 6.282 18.233 ( 1.859 7.488 0.885) 7.765 18.775 ( -1.909 13.454 0.493) 13.598 18.816 ( -2.568 11.986 -1.700) 12.375 20.264 ( 1.088 -1.773 1.876) 2.802 20.313 ( 0.503 -3.862 -1.485) 4.168 20.499 ( -0.582 5.191 0.743) 5.276 20.532 ( 0.723 7.356 -0.503) 7.408 20.896 ( -4.333 -5.880 0.457) 7.319 21.029 ( -0.907 -6.615 -0.512) 6.697 21.339 ( 2.352 -8.126 -1.071) 8.527 21.379 ( 5.011 -7.455 1.148) 9.055 22.466 ( -1.664 -0.216 -2.046) 2.646 22.531 ( 3.106 -1.762 0.949) 3.695 22.708 ( -0.733 -1.176 1.503) 2.045 22.765 ( 0.069 -2.537 -0.389) 2.567 23.776 ( -9.321 29.286 3.055) 30.885 24.244 ( -2.044 10.884 -2.318) 11.314 24.326 ( -9.057 15.648 -2.043) 18.195 24.420 ( -7.758 15.051 -3.730) 17.339 24.504 ( -3.126 3.614 -0.172) 4.782 24.780 ( -1.900 3.543 -0.655) 4.073 25.141 ( -8.458 -4.708 0.537) 9.695 25.315 ( -7.666 -3.470 0.417) 8.425 26.767 ( 1.703 -2.745 -0.867) 3.345 26.878 ( -0.235 -1.164 5.209) 5.343 26.905 ( 0.659 -1.201 -1.479) 2.016 27.101 ( 2.830 -3.302 -0.555) 4.384 27.196 ( -1.173 -4.676 -0.239) 4.827 27.321 ( -1.237 -7.436 -1.742) 7.737 27.392 ( -0.295 -6.881 0.725) 6.925 27.532 ( -1.297 -8.841 -1.684) 9.093 27.899 ( -4.103 3.320 -1.038) 5.379 28.105 ( -2.133 -1.506 3.093) 4.048 28.222 ( 2.186 6.842 -0.802) 7.228 28.398 ( -1.025 4.458 -4.330) 6.298 28.606 ( -0.492 0.527 0.073) 0.724 28.641 ( -3.656 1.826 -0.241) 4.094 28.704 ( 5.282 4.243 0.185) 6.778 29.008 ( 5.018 -1.553 1.166) 5.381 29.064 ( -5.099 6.761 1.414) 8.586 29.181 ( 4.381 -2.765 0.522) 5.206 29.467 ( -0.598 5.834 -0.423) 5.880 29.775 ( 5.544 2.966 -1.619) 6.493 30.603 ( -0.993 4.098 1.877) 4.615 30.693 ( -0.415 2.701 -1.420) 3.080 30.900 ( -2.927 7.708 -0.464) 8.258 31.001 ( -4.080 8.467 -4.794) 10.551 33.886 ( -1.537 0.519 1.334) 2.100 33.928 ( -2.077 -0.546 -0.246) 2.162 33.960 ( -0.077 -0.473 0.692) 0.842 34.019 ( 0.838 -1.807 -0.159) 1.998 37.188 ( 1.029 -1.754 0.384) 2.070 37.192 ( 0.545 -1.714 -0.233) 1.813 37.241 ( 0.301 -1.381 -0.452) 1.484 37.313 ( 1.813 -3.191 -0.153) 3.673 37.622 ( -0.718 4.432 -0.168) 4.493 37.670 ( 0.821 2.789 -0.359) 2.930 37.763 ( 1.109 1.018 -0.967) 1.789 37.833 ( 2.533 -1.412 -0.192) 2.906 48.854 ( 7.894 -0.507 -0.198) 7.913 48.897 ( 4.229 -1.522 -0.124) 4.496 48.992 ( 8.581 -1.816 1.880) 8.970 49.072 ( 16.646 -6.332 -4.617) 18.399 50.526 ( 0.150 0.112 1.206) 1.221 50.595 ( -0.549 -0.055 -2.053) 2.126 50.921 ( 4.064 -14.916 15.831) 22.127 51.022 ( -6.745 -8.914 -7.350) 13.378 51.893 ( -0.257 6.541 0.973) 6.617 51.947 ( -0.753 5.621 -1.114) 5.780 52.395 ( 1.068 5.192 0.513) 5.325 52.422 ( -0.149 3.377 -1.625) 3.750 52.511 ( -2.377 -2.530 -1.732) 3.880 52.628 ( 5.848 -10.734 2.999) 12.586 53.042 ( 2.759 -6.333 1.753) 7.127 53.134 ( 3.444 -6.542 -1.960) 7.649 53.823 ( 0.513 1.155 0.353) 1.312 53.856 ( 1.287 0.646 -0.260) 1.463 54.171 ( -2.297 -0.968 2.885) 3.813 54.299 ( -0.054 -2.710 -0.975) 2.881 55.728 ( 0.037 0.982 1.098) 1.474 55.799 ( 1.126 1.273 -0.966) 1.955 55.995 ( -3.779 -5.082 6.719) 9.233 56.324 ( -2.556 -12.329 -4.669) 13.429 57.521 ( 0.105 6.367 0.583) 6.394 57.564 ( -0.069 7.106 -2.367) 7.490 57.734 ( -2.594 8.854 4.723) 10.365 58.085 ( 2.016 -2.076 -4.471) 5.326 58.183 ( -10.446 2.166 1.089) 10.724 58.286 ( -4.706 0.383 -4.022) 6.202 58.311 ( 0.278 -3.335 1.216) 3.561 58.574 ( 3.989 -10.475 2.348) 11.452 60.969 ( -0.230 2.044 0.446) 2.104 60.986 ( 0.212 1.822 0.236) 1.849 61.142 ( -1.547 5.924 2.014) 6.445 61.270 ( -6.306 5.046 -5.972) 10.045 ======================= Grid point 99 (44/90) ======================= q-point: ( 0.25 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.510 ( 13.967 23.782 24.347) 36.789 2.725 ( 9.374 2.845 -12.350) 15.763 3.132 ( 16.362 11.016 27.416) 33.774 3.335 ( -0.969 12.229 -16.651) 20.682 3.497 ( 2.354 14.175 -2.872) 14.654 3.962 ( 17.162 8.859 -13.491) 23.559 4.142 ( 10.085 13.100 -8.175) 18.443 4.311 ( 11.399 12.397 7.705) 18.520 4.798 ( 10.935 -4.819 3.433) 12.433 4.947 ( 12.864 19.291 12.736) 26.454 5.051 ( 2.255 5.732 5.497) 8.256 5.095 ( 8.684 7.115 -4.366) 12.046 5.273 ( 10.951 5.702 -1.554) 12.444 5.360 ( 12.403 12.447 -1.990) 17.684 5.470 ( 14.561 11.126 -6.785) 19.541 5.675 ( 3.210 5.915 6.130) 9.103 5.807 ( -4.943 12.147 -8.594) 15.679 5.900 ( 6.163 9.701 -3.984) 12.164 6.152 ( -6.920 3.772 -1.111) 7.959 6.348 ( 1.016 -0.431 -2.287) 2.539 6.455 ( -1.849 -0.538 0.959) 2.151 6.512 ( 0.784 1.212 1.648) 2.191 6.592 ( 1.785 5.916 0.142) 6.181 6.655 ( 3.080 -5.273 7.852) 9.947 6.801 ( 7.777 -5.112 -3.282) 9.868 6.969 ( 3.753 2.204 5.716) 7.184 7.145 ( 6.355 3.376 -4.158) 8.312 7.243 ( 5.117 5.145 -3.901) 8.238 7.472 ( 0.733 -3.399 3.317) 4.805 7.560 ( 2.368 5.886 4.177) 7.596 7.651 ( -2.985 -1.474 -3.406) 4.763 7.709 ( -6.299 -4.807 -5.806) 9.823 7.760 ( -1.496 -11.783 -5.025) 12.896 7.934 ( 1.216 8.279 -2.692) 8.791 8.051 ( 2.131 0.847 -3.445) 4.138 8.325 ( -0.858 -1.067 0.351) 1.414 8.424 ( 0.487 -0.522 1.109) 1.319 8.483 ( 5.087 -2.419 7.369) 9.276 8.782 ( 1.910 -4.577 -5.044) 7.074 8.802 ( 3.308 8.900 3.806) 10.229 8.840 ( 1.052 -2.795 8.208) 8.735 8.997 ( -0.661 4.311 -0.637) 4.408 9.031 ( 6.403 -3.425 -0.999) 7.330 9.263 ( -3.400 -0.718 0.571) 3.521 9.489 ( 8.265 -3.508 10.921) 14.138 9.695 ( -0.213 -11.533 2.120) 11.728 9.724 ( 1.543 5.374 -0.374) 5.603 9.877 ( 1.218 3.167 -5.649) 6.589 10.030 ( 0.085 -0.855 -5.953) 6.014 10.112 ( 0.922 -3.575 -1.781) 4.099 10.494 ( 0.591 -3.633 3.029) 4.767 10.506 ( -0.783 2.924 3.788) 4.848 10.625 ( -3.311 -0.324 0.664) 3.393 10.674 ( 2.803 -1.528 2.418) 4.005 10.833 ( -0.312 -3.130 -4.966) 5.878 10.969 ( 0.068 -10.274 -5.925) 11.861 11.214 ( 1.591 0.145 0.917) 1.842 11.352 ( -4.305 4.854 -1.638) 6.691 11.461 ( -0.739 -2.544 2.489) 3.634 11.545 ( -3.237 7.025 -2.916) 8.266 11.597 ( -2.330 5.316 7.240) 9.280 11.767 ( -7.876 9.422 -0.223) 12.282 11.907 ( -1.248 -9.459 -2.798) 9.943 12.088 ( -2.516 4.971 -1.539) 5.780 12.243 ( 6.474 -1.557 4.340) 7.948 12.399 ( 2.324 -12.771 -2.008) 13.135 12.482 ( -0.435 -3.825 0.257) 3.858 12.573 ( -0.854 -7.117 -1.128) 7.256 12.643 ( -2.759 1.669 1.873) 3.729 12.765 ( -4.113 0.367 -2.157) 4.658 12.858 ( 0.733 -7.711 -1.858) 7.965 12.972 ( -1.020 -4.721 -0.006) 4.829 13.395 ( -4.803 -4.510 -2.834) 7.173 13.433 ( -1.661 -10.084 0.436) 10.229 13.625 ( -4.988 -5.179 3.738) 8.104 13.684 ( -2.695 -11.966 -1.498) 12.357 13.946 ( -3.606 2.903 -1.442) 4.849 13.992 ( -1.950 -7.133 1.547) 7.555 14.228 ( -1.167 -3.336 1.183) 3.727 14.372 ( 0.409 -4.349 0.304) 4.378 16.165 ( -0.490 -11.623 1.372) 11.714 16.391 ( -2.508 -13.247 -0.897) 13.513 16.789 ( 10.004 -13.353 -0.448) 16.691 16.956 ( 5.831 -16.334 -0.172) 17.345 18.222 ( 1.555 7.639 -1.070) 7.869 18.298 ( 3.964 7.828 1.443) 8.892 18.698 ( -5.334 12.538 -1.301) 13.687 18.748 ( -3.529 11.968 0.102) 12.478 20.292 ( 1.933 0.500 -0.434) 2.044 20.354 ( 3.273 -5.063 0.689) 6.068 20.485 ( -0.888 4.377 1.424) 4.688 20.538 ( -0.138 9.197 -1.253) 9.283 20.796 ( -5.054 -6.639 0.561) 8.363 20.979 ( -3.834 -6.422 -0.909) 7.535 21.432 ( 6.221 -8.983 -0.009) 10.927 21.505 ( 6.622 -8.538 0.359) 10.811 22.441 ( -0.287 0.966 -0.977) 1.404 22.586 ( 1.733 -2.142 -0.320) 2.773 22.699 ( -0.354 -1.292 1.917) 2.338 22.762 ( -0.159 -2.606 -0.598) 2.679 23.607 ( -6.267 23.243 0.654) 24.082 23.961 ( -17.746 23.746 -1.602) 29.687 24.173 ( -6.496 9.988 -1.121) 11.968 24.232 ( -9.901 8.688 1.420) 13.249 24.503 ( 1.602 5.951 -3.208) 6.948 24.677 ( -7.949 4.826 4.332) 10.259 24.995 ( -4.093 -2.585 -3.714) 6.102 25.114 ( -10.739 -2.915 2.362) 11.375 26.821 ( 3.218 -3.910 -1.746) 5.357 26.893 ( 0.456 -2.828 0.518) 2.911 26.927 ( 1.932 -1.877 2.055) 3.388 27.162 ( 0.452 -4.426 1.089) 4.580 27.174 ( 1.027 -1.745 -2.302) 3.066 27.273 ( -3.421 -7.340 0.349) 8.105 27.382 ( -0.515 -6.175 -0.710) 6.237 27.483 ( -1.809 -6.868 -1.703) 7.303 27.839 ( -0.933 2.467 -1.698) 3.137 28.056 ( -2.779 -1.736 3.750) 4.980 28.294 ( 3.855 5.225 -0.197) 6.496 28.355 ( -1.797 7.767 -4.136) 8.981 28.501 ( -6.937 3.081 -1.331) 7.707 28.623 ( 0.848 1.951 0.441) 2.172 28.832 ( 6.127 4.926 -1.258) 7.961 29.041 ( 2.234 6.270 2.972) 7.290 29.094 ( 3.066 -1.155 4.350) 5.446 29.275 ( 3.541 -4.206 -1.778) 5.779 29.529 ( 4.876 4.667 0.282) 6.755 29.837 ( 0.201 4.073 0.371) 4.095 30.576 ( -0.992 2.903 0.514) 3.111 30.693 ( 0.223 1.278 -0.258) 1.323 30.864 ( -0.610 5.645 0.234) 5.683 30.921 ( -3.395 6.555 -0.714) 7.417 33.863 ( -0.728 0.479 0.084) 0.876 33.888 ( -1.680 -0.263 0.215) 1.714 33.962 ( -0.062 -0.660 1.235) 1.402 34.022 ( -0.246 -1.691 -0.757) 1.869 37.208 ( 1.113 -1.345 -0.358) 1.782 37.227 ( 2.240 -1.474 1.132) 2.910 37.253 ( 0.813 -1.293 -0.714) 1.686 37.341 ( 0.971 -2.151 -0.275) 2.375 37.621 ( 0.448 4.366 0.209) 4.393 37.684 ( 0.662 2.927 -0.493) 3.041 37.790 ( 1.623 0.235 -1.294) 2.089 37.869 ( 0.887 -2.070 0.420) 2.291 49.018 ( 7.229 -1.898 0.078) 7.474 49.060 ( 10.209 -1.649 -1.665) 10.475 49.229 ( 11.829 -4.152 5.790) 13.809 49.373 ( 12.692 -8.042 -6.208) 16.258 50.534 ( 0.381 0.233 0.280) 0.528 50.569 ( -1.072 0.362 -2.809) 3.029 50.886 ( -3.744 -5.665 -6.276) 9.246 50.959 ( -3.460 -12.306 9.622) 16.000 51.886 ( -0.492 6.054 0.292) 6.081 51.933 ( -0.266 6.527 -0.288) 6.539 52.398 ( -1.222 -1.881 -1.334) 2.610 52.419 ( 0.844 5.740 0.059) 5.802 52.481 ( -0.213 4.765 -0.798) 4.836 52.742 ( 3.623 -14.471 0.619) 14.931 53.107 ( 2.691 -7.078 1.746) 7.771 53.217 ( 4.405 -8.239 -1.208) 9.420 53.847 ( 1.626 0.712 0.981) 2.028 53.886 ( 1.548 0.275 -0.416) 1.626 54.125 ( -2.646 -0.349 2.784) 3.856 54.292 ( -0.342 -2.752 -1.081) 2.977 55.740 ( 0.797 0.392 1.254) 1.537 55.826 ( 1.652 0.756 -0.940) 2.046 55.927 ( -4.007 -3.265 4.840) 7.081 56.231 ( -4.869 -9.549 -3.980) 11.433 57.524 ( 0.114 6.479 0.088) 6.480 57.558 ( 0.009 6.979 -1.282) 7.095 57.691 ( -2.380 9.396 3.429) 10.281 57.946 ( -9.758 10.789 -2.193) 14.712 58.100 ( 0.535 -3.728 -1.212) 3.957 58.231 ( -0.068 -0.564 -4.141) 4.180 58.342 ( 0.872 -6.360 4.103) 7.618 58.613 ( -0.402 -11.755 1.105) 11.813 60.968 ( 0.114 2.055 0.228) 2.071 60.992 ( 0.355 1.968 0.090) 2.002 61.102 ( -2.550 5.049 1.087) 5.759 61.140 ( -4.554 5.440 -2.193) 7.426 ======================= Grid point 100 (45/90) ======================= q-point: ( 0.38 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.820 ( 11.159 6.149 4.236) 13.427 2.966 ( 11.023 2.985 3.714) 12.009 3.148 ( -5.511 5.342 -4.863) 9.086 3.295 ( -2.516 8.974 1.046) 9.379 3.836 ( 18.613 17.845 2.436) 25.900 4.165 ( 6.239 7.319 -8.929) 13.124 4.298 ( 4.923 12.614 -1.469) 13.620 4.634 ( 16.266 10.600 7.092) 20.670 4.887 ( 7.150 -5.334 -2.603) 9.293 4.925 ( -8.103 2.387 -6.905) 10.910 5.272 ( 3.694 17.050 1.097) 17.480 5.384 ( 2.148 -2.455 -1.198) 3.475 5.422 ( 6.917 7.304 1.723) 10.206 5.537 ( 12.352 -0.375 -1.587) 12.460 5.607 ( -3.348 6.945 0.382) 7.719 5.637 ( -0.468 6.370 -2.924) 7.025 5.766 ( -3.167 0.335 -4.795) 5.756 6.046 ( 5.090 12.903 11.245) 17.856 6.120 ( 5.856 -2.969 7.543) 10.001 6.235 ( -3.284 -1.446 -8.670) 9.383 6.436 ( -0.369 8.982 3.274) 9.567 6.666 ( 9.120 -4.746 9.729) 14.155 6.711 ( 10.535 0.556 -2.094) 10.755 6.758 ( 1.145 -1.551 3.921) 4.369 7.023 ( 9.164 10.858 -2.970) 14.515 7.099 ( 4.870 1.238 6.253) 8.022 7.286 ( 7.025 10.382 0.103) 12.536 7.330 ( 7.065 1.680 -5.656) 9.205 7.442 ( -6.841 -13.571 5.993) 16.337 7.518 ( -3.572 6.807 2.022) 7.949 7.576 ( -3.375 0.566 -3.571) 4.946 7.628 ( 2.377 5.669 -7.546) 9.732 7.783 ( 3.792 -1.762 -4.964) 6.490 7.996 ( 4.452 5.969 -0.941) 7.506 8.121 ( 5.458 -0.532 -0.897) 5.557 8.292 ( -1.975 2.403 1.417) 3.418 8.360 ( -5.009 4.825 0.646) 6.985 8.587 ( -3.683 -12.261 -4.800) 13.672 8.627 ( -3.530 -0.008 6.589) 7.475 8.907 ( 1.213 -3.119 2.977) 4.479 8.931 ( 0.650 11.750 2.453) 12.021 8.955 ( -0.672 0.560 -4.576) 4.659 9.185 ( 4.964 -0.858 1.248) 5.190 9.257 ( 8.260 -1.987 -2.907) 8.979 9.650 ( -0.402 2.292 -1.126) 2.585 9.692 ( -7.001 4.368 -0.024) 8.252 9.795 ( -1.411 1.534 -9.928) 10.144 9.822 ( 7.177 3.189 9.945) 12.672 10.048 ( 4.742 -6.657 -0.773) 8.210 10.124 ( 0.237 -2.052 -4.591) 5.035 10.453 ( -5.463 -0.548 -0.947) 5.571 10.460 ( -8.634 -2.975 2.270) 9.410 10.575 ( 6.175 -1.615 3.968) 7.516 10.747 ( 4.059 -1.644 0.477) 4.405 10.833 ( 1.203 -7.360 0.423) 7.469 11.039 ( 4.504 -1.554 0.400) 4.781 11.164 ( -5.800 3.463 -0.852) 6.809 11.252 ( -2.956 6.886 0.397) 7.504 11.420 ( -1.358 6.971 -3.381) 7.866 11.542 ( 1.870 1.335 0.543) 2.361 11.611 ( -2.857 5.345 8.338) 10.307 11.616 ( -2.444 4.484 2.139) 5.536 11.884 ( -2.582 -9.414 -2.118) 9.989 11.992 ( -1.594 7.599 -2.283) 8.093 12.265 ( -6.342 -3.956 0.922) 7.531 12.433 ( -0.565 -5.417 -2.164) 5.860 12.494 ( 0.642 0.359 2.058) 2.185 12.554 ( 0.046 -6.412 -0.181) 6.415 12.634 ( 2.433 -3.592 1.340) 4.540 12.675 ( -2.723 -5.679 -3.781) 7.346 12.854 ( -0.311 -7.794 -1.351) 7.917 12.994 ( 2.430 -6.454 1.278) 7.013 13.263 ( -5.390 -0.296 -1.326) 5.558 13.403 ( -2.292 -10.580 -3.010) 11.236 13.546 ( -2.206 -8.459 2.304) 9.040 13.636 ( -1.567 -10.917 -1.867) 11.186 13.875 ( -2.483 -2.240 -0.523) 3.385 13.948 ( -2.756 -7.390 0.973) 7.947 14.205 ( -0.892 -4.016 2.416) 4.771 14.360 ( -1.117 -7.141 -0.283) 7.233 16.159 ( -0.905 -11.988 3.646) 12.563 16.351 ( -0.556 -12.824 -3.021) 13.186 16.970 ( 6.819 -12.822 -0.548) 14.533 17.047 ( 2.746 -14.476 -0.473) 14.742 18.273 ( 3.409 9.912 -0.349) 10.488 18.396 ( 4.227 8.181 1.797) 9.382 18.572 ( -5.337 11.705 -2.182) 13.048 18.664 ( -4.521 10.746 0.196) 11.660 20.353 ( 3.590 4.211 -0.139) 5.535 20.432 ( 3.103 -3.454 -0.006) 4.643 20.490 ( 1.844 0.793 2.317) 3.066 20.520 ( -0.840 10.568 -1.715) 10.739 20.686 ( -5.821 -6.607 0.951) 8.856 20.873 ( -5.325 -6.266 -1.858) 8.430 21.567 ( 5.628 -11.218 0.939) 12.586 21.639 ( 5.452 -10.685 -0.533) 12.007 22.445 ( 0.583 1.054 0.507) 1.306 22.598 ( -0.137 -1.556 -2.142) 2.651 22.705 ( 0.165 -1.747 2.311) 2.902 22.759 ( 0.058 -2.676 -0.470) 2.718 23.544 ( 0.371 17.365 -0.212) 17.371 23.685 ( -7.966 19.329 0.487) 20.912 23.963 ( -11.643 8.781 1.547) 14.665 24.034 ( -8.830 9.713 -2.359) 13.337 24.527 ( -1.484 6.464 0.351) 6.642 24.549 ( -1.251 7.238 -0.142) 7.347 24.916 ( -7.433 -0.882 3.763) 8.378 24.947 ( -1.148 -0.455 -3.358) 3.578 26.869 ( 1.405 -4.849 0.348) 5.061 26.922 ( 2.447 -4.686 -1.408) 5.470 26.975 ( 1.714 -4.259 1.062) 4.712 27.107 ( -3.878 -6.308 0.732) 7.441 27.203 ( -1.465 -1.231 0.666) 2.026 27.227 ( 1.626 -1.274 -2.544) 3.277 27.357 ( -1.903 -5.525 1.752) 6.100 27.468 ( 0.631 -5.852 -4.585) 7.461 27.847 ( 1.647 0.196 1.591) 2.298 28.014 ( -2.091 -1.914 1.995) 3.466 28.281 ( -2.542 5.730 -0.978) 6.344 28.382 ( 0.685 3.639 -0.332) 3.718 28.402 ( 0.023 6.176 0.410) 6.190 28.638 ( 0.227 2.540 -0.561) 2.611 28.929 ( 3.420 4.893 -1.776) 6.229 29.098 ( 1.440 4.680 0.383) 4.912 29.167 ( 2.393 -0.257 5.520) 6.022 29.320 ( 1.693 -4.739 -2.000) 5.415 29.635 ( 4.853 5.004 0.104) 6.972 29.802 ( -3.038 5.780 -0.168) 6.532 30.582 ( 1.360 0.384 0.324) 1.450 30.683 ( -1.356 0.258 -0.074) 1.382 30.857 ( -0.374 4.643 0.043) 4.658 30.864 ( -1.570 5.216 -0.097) 5.448 33.856 ( 0.005 -0.052 -0.396) 0.399 33.860 ( -1.030 -0.068 0.315) 1.079 33.962 ( -0.293 -0.534 1.326) 1.459 34.014 ( -0.159 -1.346 -1.024) 1.699 37.231 ( 1.066 -0.969 -0.242) 1.461 37.264 ( 0.275 -1.261 -0.628) 1.435 37.276 ( 1.832 -1.626 1.622) 2.938 37.355 ( 0.475 -1.447 -0.559) 1.622 37.635 ( 0.576 4.006 0.702) 4.107 37.694 ( 0.518 2.770 -1.060) 3.011 37.820 ( 1.366 -0.400 -0.565) 1.532 37.876 ( -0.233 -1.641 0.212) 1.670 49.163 ( 5.822 -2.674 0.424) 6.421 49.240 ( 6.949 -1.939 -2.864) 7.763 49.448 ( 6.232 -6.365 6.749) 11.176 49.566 ( 7.368 -6.778 -3.962) 10.767 50.533 ( -0.071 0.765 -1.455) 1.645 50.560 ( 0.923 0.178 -2.264) 2.451 50.831 ( -0.695 -4.456 -2.807) 5.312 50.870 ( -5.976 -7.185 5.090) 10.641 51.879 ( -0.160 5.632 0.349) 5.645 51.930 ( -0.134 6.820 -0.498) 6.839 52.382 ( 0.199 -3.954 1.076) 4.102 52.436 ( 0.706 6.363 0.457) 6.419 52.482 ( 0.268 7.116 -0.663) 7.152 52.770 ( -0.390 -13.144 -3.930) 13.724 53.157 ( 1.473 -7.341 2.281) 7.827 53.287 ( 2.253 -8.962 -1.393) 9.346 53.889 ( 1.639 0.058 1.059) 1.952 53.913 ( 1.061 -0.041 -0.312) 1.107 54.086 ( -1.556 -0.008 3.586) 3.909 54.280 ( -0.440 -2.973 -1.610) 3.410 55.770 ( 1.770 -0.372 1.705) 2.485 55.861 ( -2.592 -1.206 2.192) 3.603 55.862 ( 1.237 -0.713 0.156) 1.437 56.116 ( -4.663 -6.593 -3.548) 8.821 57.529 ( 0.485 6.622 -0.136) 6.641 57.555 ( -0.166 6.985 -0.471) 7.003 57.658 ( -1.592 9.334 2.451) 9.781 57.791 ( -4.491 11.466 -2.359) 12.538 58.112 ( 0.671 -3.326 0.593) 3.444 58.227 ( 0.339 -2.534 -4.018) 4.762 58.370 ( 0.786 -7.280 4.605) 8.650 58.584 ( -1.872 -11.468 -0.610) 11.636 60.978 ( 0.787 2.316 0.110) 2.449 61.004 ( 0.812 2.302 0.010) 2.441 61.047 ( -2.524 3.979 0.041) 4.712 61.068 ( -2.386 4.042 -0.276) 4.702 ======================= Grid point 101 (46/90) ======================= q-point: (-0.50 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.924 ( -8.971 -3.933 1.104) 9.857 3.013 ( 1.491 1.262 -0.937) 2.167 3.087 ( -3.817 14.473 3.927) 15.474 3.359 ( 9.336 6.377 -1.947) 11.473 4.030 ( 1.715 9.669 0.428) 9.829 4.096 ( -14.555 9.885 2.132) 17.723 4.503 ( 14.574 12.341 -9.910) 21.515 4.645 ( -6.346 12.595 -2.814) 14.382 4.902 ( -9.098 7.731 -0.809) 11.967 4.962 ( 7.509 5.716 -13.288) 16.299 5.228 ( -7.945 5.552 1.195) 9.766 5.393 ( 9.525 0.073 0.896) 9.568 5.502 ( -4.344 -7.055 -1.460) 8.413 5.588 ( 1.951 0.774 -6.950) 7.260 5.658 ( -3.667 10.947 1.625) 11.658 5.697 ( 12.114 5.599 3.398) 13.771 5.811 ( 6.450 -12.500 10.571) 17.596 6.049 ( -8.415 -5.038 6.288) 11.651 6.170 ( -1.445 3.554 9.485) 10.232 6.291 ( 6.732 16.639 3.930) 18.374 6.441 ( -3.705 -0.466 -1.570) 4.051 6.705 ( -3.885 2.668 0.811) 4.782 6.766 ( -3.273 -2.923 5.540) 7.068 6.940 ( 5.105 -0.245 -1.287) 5.270 7.058 ( -4.896 7.592 -3.933) 9.853 7.173 ( 7.866 -2.450 1.048) 8.304 7.243 ( -10.878 -7.239 -0.367) 13.072 7.323 ( 0.530 -6.489 -1.451) 6.670 7.492 ( -0.112 9.873 -0.216) 9.876 7.554 ( 1.403 13.236 5.819) 14.527 7.618 ( 9.272 2.716 1.666) 9.804 7.705 ( 7.777 7.428 -4.220) 11.553 7.874 ( 3.539 -4.599 1.459) 5.984 8.080 ( 0.408 3.030 -3.500) 4.647 8.174 ( -5.232 14.983 2.997) 16.151 8.236 ( 1.574 3.049 -1.785) 3.867 8.271 ( -3.444 -0.424 -1.839) 3.927 8.449 ( 0.607 -7.268 1.139) 7.382 8.702 ( 3.265 -2.291 4.763) 6.213 8.831 ( -7.387 5.965 -1.808) 9.665 8.872 ( -0.845 -2.333 -0.664) 2.569 8.993 ( 0.347 2.885 -3.546) 4.585 9.274 ( 2.193 3.786 -7.227) 8.448 9.414 ( -0.277 6.696 -5.711) 8.805 9.448 ( -3.751 -1.199 -0.096) 3.939 9.584 ( -8.381 2.184 5.469) 10.244 9.708 ( -2.788 6.562 -4.401) 8.379 9.901 ( 0.389 3.595 -2.450) 4.368 10.100 ( -5.851 -8.087 -2.393) 10.265 10.124 ( 2.741 -3.846 -6.144) 7.750 10.367 ( 4.606 -6.363 4.445) 9.025 10.417 ( 1.509 -0.746 1.783) 2.452 10.708 ( -7.356 -5.322 3.944) 9.899 10.849 ( 15.378 -0.776 3.484) 15.787 10.942 ( 4.829 -4.105 2.485) 6.808 11.047 ( -0.355 1.326 3.860) 4.097 11.097 ( -2.854 5.173 2.084) 6.264 11.197 ( -0.932 7.105 -2.372) 7.549 11.427 ( 1.224 12.399 -0.474) 12.469 11.491 ( -3.540 -13.599 5.284) 15.013 11.617 ( -0.105 9.669 -4.548) 10.686 11.634 ( -0.678 0.978 7.501) 7.595 11.815 ( 1.388 1.544 -3.759) 4.294 12.044 ( 5.003 -1.038 -3.331) 6.099 12.140 ( -3.272 1.311 4.331) 5.584 12.370 ( -2.434 0.646 -4.951) 5.554 12.500 ( -0.658 -2.573 1.063) 2.860 12.550 ( -2.067 -3.995 -0.027) 4.498 12.627 ( 0.859 -8.103 -1.354) 8.260 12.682 ( 1.022 -8.532 -1.389) 8.705 12.933 ( 6.253 -6.420 0.234) 8.965 12.960 ( -4.586 -7.616 1.336) 8.989 13.213 ( -2.348 -0.519 0.393) 2.436 13.343 ( 1.037 -6.110 -4.568) 7.699 13.539 ( -0.096 -11.899 -0.067) 11.899 13.619 ( 0.975 -9.103 -2.739) 9.556 13.847 ( -1.177 -7.383 1.489) 7.623 13.900 ( -0.606 -4.742 0.307) 4.790 14.221 ( 1.462 -5.870 3.985) 7.244 14.337 ( -0.698 -8.016 -1.147) 8.128 16.148 ( -1.138 -11.426 4.379) 12.289 16.349 ( 1.021 -12.924 -3.652) 13.469 17.059 ( 0.924 -13.024 -0.613) 13.071 17.060 ( -0.672 -13.132 -0.609) 13.163 18.337 ( 0.178 11.549 1.790) 11.688 18.421 ( 0.104 9.900 -1.582) 10.026 18.522 ( -1.720 9.631 1.156) 9.851 18.596 ( 1.151 9.616 -1.771) 9.845 20.405 ( 0.956 10.614 1.485) 10.760 20.473 ( -1.056 -1.196 -0.835) 1.801 20.503 ( 1.828 6.653 -0.463) 6.915 20.523 ( -4.209 -3.637 -1.160) 5.683 20.624 ( 3.623 -4.797 3.628) 7.021 20.785 ( -1.290 -6.438 -3.287) 7.342 21.635 ( 0.055 -12.420 1.491) 12.510 21.698 ( -0.132 -11.816 -1.087) 11.867 22.466 ( 1.089 0.711 1.795) 2.216 22.576 ( -1.084 -0.953 -3.261) 3.566 22.713 ( -0.049 -2.014 2.105) 2.914 22.760 ( 0.111 -2.831 -0.377) 2.858 23.591 ( 0.579 14.788 0.091) 14.800 23.601 ( -0.492 14.890 -0.259) 14.901 23.798 ( -1.487 9.877 2.451) 10.285 23.924 ( 1.433 10.929 -2.787) 11.370 24.470 ( -2.162 8.504 2.175) 9.040 24.599 ( 4.330 6.279 -4.167) 8.691 24.800 ( -4.392 0.466 4.966) 6.646 24.953 ( 2.010 0.048 -2.306) 3.059 26.890 ( 0.311 -5.338 1.455) 5.542 26.955 ( 0.081 -5.164 -1.138) 5.289 27.005 ( 1.406 -6.458 0.456) 6.625 27.046 ( -0.841 -6.289 -0.738) 6.388 27.188 ( -0.472 -0.066 0.118) 0.491 27.244 ( 0.579 0.553 -2.280) 2.416 27.321 ( -2.039 -4.519 2.432) 5.522 27.465 ( 0.341 -6.061 -4.495) 7.553 27.909 ( 3.162 -1.480 4.070) 5.362 27.977 ( -1.861 -1.788 0.198) 2.589 28.263 ( 1.075 4.922 0.672) 5.083 28.341 ( -1.414 1.898 -2.075) 3.147 28.474 ( 3.310 7.612 3.664) 9.073 28.622 ( -1.348 3.481 -2.596) 4.547 28.969 ( 0.779 4.127 -0.098) 4.202 29.077 ( -2.967 3.600 -3.252) 5.687 29.208 ( -0.137 -0.225 5.420) 5.427 29.346 ( 0.996 -3.450 -1.061) 3.744 29.709 ( -1.341 4.780 0.501) 4.990 29.743 ( 1.241 6.888 -0.922) 7.059 30.617 ( 0.368 -0.397 0.734) 0.912 30.648 ( -0.439 -0.069 -0.502) 0.671 30.843 ( -0.736 4.347 0.265) 4.417 30.860 ( 0.922 4.664 -0.384) 4.769 33.847 ( -0.265 0.095 0.185) 0.337 33.860 ( 0.450 -0.484 -0.405) 0.775 33.958 ( -0.449 -0.261 1.269) 1.371 34.011 ( 0.153 -1.273 -0.957) 1.600 37.246 ( 0.298 -0.869 0.070) 0.921 37.258 ( -0.630 -1.170 -0.602) 1.459 37.305 ( 0.462 -1.632 1.601) 2.332 37.358 ( -0.040 -1.319 -0.784) 1.535 37.642 ( -0.162 3.883 0.960) 4.003 37.702 ( 0.635 2.468 -1.501) 2.957 37.836 ( -0.203 -0.987 0.638) 1.193 37.866 ( -0.314 -0.908 -0.634) 1.151 49.233 ( 0.230 -3.208 0.717) 3.295 49.311 ( 0.446 -2.110 -3.506) 4.116 49.506 ( -2.321 -5.987 5.387) 8.382 49.662 ( 2.609 -7.191 -1.797) 7.858 50.537 ( 0.554 0.719 -0.918) 1.291 50.572 ( 0.735 -0.606 -3.682) 3.804 50.757 ( -4.833 -3.832 4.102) 7.407 50.851 ( 2.445 -4.292 -0.949) 5.030 51.881 ( 0.124 5.598 0.660) 5.638 51.922 ( -0.377 6.612 -1.032) 6.703 52.416 ( 1.971 -2.409 3.563) 4.731 52.452 ( 0.702 4.576 1.460) 4.855 52.483 ( 0.066 6.697 -0.611) 6.725 52.714 ( -3.158 -11.115 -7.661) 13.864 53.180 ( 0.035 -7.287 2.819) 7.813 53.300 ( -0.484 -8.499 -1.916) 8.726 53.900 ( -0.740 0.240 0.479) 0.913 53.929 ( 0.320 -0.074 -0.151) 0.361 54.095 ( 1.217 -0.663 4.864) 5.058 54.267 ( -0.226 -3.222 -2.396) 4.022 55.805 ( -1.991 -0.630 1.696) 2.690 55.826 ( 2.225 -1.650 3.200) 4.233 55.891 ( 0.344 -0.667 -0.545) 0.927 56.043 ( -0.330 -5.104 -4.043) 6.520 57.537 ( -0.340 6.855 0.183) 6.866 57.554 ( 0.837 6.951 -0.693) 7.035 57.640 ( -0.721 9.073 2.122) 9.346 57.739 ( -0.043 11.041 -2.149) 11.248 58.124 ( -0.037 -2.442 1.282) 2.758 58.218 ( 0.054 -4.164 -3.713) 5.579 58.406 ( 1.397 -7.659 4.974) 9.238 58.548 ( -1.052 -10.907 -1.960) 11.132 60.997 ( -0.208 2.965 0.245) 2.982 61.009 ( 0.198 2.938 -0.219) 2.952 61.024 ( -0.391 2.647 0.159) 2.680 61.033 ( 0.472 3.258 -0.203) 3.298 ======================= Grid point 102 (47/90) ======================= q-point: (-0.38 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.581 ( -22.676 -2.612 3.816) 23.143 2.927 ( -13.585 11.101 1.147) 17.581 3.018 ( -2.316 11.878 1.077) 12.150 3.474 ( -0.878 4.019 -2.854) 5.007 3.833 ( -2.425 12.973 3.372) 13.622 4.022 ( -3.256 13.623 -4.641) 14.756 4.333 ( -14.039 8.827 -3.467) 16.942 4.799 ( -6.887 1.259 -10.238) 12.403 4.845 ( 3.682 6.924 10.715) 13.278 4.881 ( 1.183 11.510 2.336) 11.804 5.186 ( -0.212 10.578 -8.694) 13.694 5.293 ( -5.855 2.065 -1.821) 6.470 5.469 ( -7.986 10.904 1.078) 13.559 5.514 ( -13.420 10.156 4.416) 17.400 5.605 ( -6.277 -7.016 -5.134) 10.724 5.735 ( -2.479 -2.925 2.002) 4.326 5.896 ( -2.598 -2.777 -4.680) 6.030 6.088 ( 3.153 10.634 0.160) 11.092 6.192 ( -8.186 5.146 -3.217) 10.190 6.247 ( 11.015 -12.865 11.159) 20.282 6.403 ( -0.222 10.827 5.766) 12.268 6.597 ( -5.643 -3.208 9.700) 11.671 6.706 ( -4.410 6.253 -1.440) 7.786 6.800 ( -11.018 4.795 1.078) 12.065 6.969 ( -4.053 -0.616 -3.571) 5.436 7.110 ( -1.898 1.039 2.390) 3.224 7.353 ( 2.622 0.761 -0.666) 2.811 7.390 ( 3.654 -4.737 3.789) 7.081 7.468 ( 1.558 3.881 -3.005) 5.150 7.535 ( -2.092 1.652 7.917) 8.353 7.689 ( -1.048 0.566 -1.144) 1.652 7.829 ( -3.503 0.885 -3.839) 5.272 7.875 ( -0.772 5.879 -0.445) 5.946 7.927 ( -6.627 3.310 -15.303) 17.001 8.098 ( -6.860 4.358 -6.627) 10.487 8.196 ( 2.309 0.884 8.135) 8.503 8.329 ( 3.044 8.582 3.327) 9.694 8.447 ( -3.052 0.265 0.186) 3.069 8.617 ( -5.708 -4.096 -4.860) 8.543 8.857 ( 2.677 -1.879 -2.343) 4.023 8.876 ( -3.342 5.650 2.252) 6.940 8.980 ( 9.702 -6.437 2.584) 11.926 9.224 ( -2.990 1.428 -5.118) 6.097 9.262 ( -15.104 2.415 9.365) 17.935 9.443 ( -4.655 0.428 7.667) 8.980 9.517 ( 7.035 -0.041 -8.134) 10.754 9.695 ( 1.491 13.405 -1.286) 13.549 9.878 ( -3.423 -2.705 -2.274) 4.920 10.012 ( 1.777 0.526 1.903) 2.656 10.173 ( 3.067 -6.899 -6.506) 9.967 10.398 ( -2.411 -2.694 -0.604) 3.665 10.560 ( -3.022 -3.614 -0.423) 4.730 10.573 ( 5.599 -6.377 4.491) 9.601 10.890 ( -8.775 4.150 6.873) 11.894 11.003 ( 2.347 -2.382 -2.792) 4.356 11.101 ( 0.961 -4.551 0.552) 4.684 11.153 ( 7.369 2.446 -4.225) 8.839 11.230 ( 2.967 5.839 1.098) 6.641 11.326 ( -5.947 0.779 -1.855) 6.278 11.493 ( -5.607 8.178 -0.159) 9.917 11.609 ( 6.930 -6.048 10.097) 13.658 11.727 ( 5.653 5.509 0.769) 7.931 11.906 ( 6.626 0.672 -1.175) 6.763 12.094 ( -0.482 -0.921 -9.506) 9.563 12.164 ( 2.929 -1.036 7.798) 8.394 12.364 ( 3.170 -0.695 -2.651) 4.190 12.479 ( -1.013 -4.905 1.075) 5.123 12.526 ( -0.100 -4.336 0.901) 4.430 12.608 ( -1.793 -5.898 -1.233) 6.287 12.732 ( 2.724 -3.790 -1.155) 4.808 12.870 ( -1.392 -6.765 -1.471) 7.062 13.028 ( -1.986 -7.943 1.005) 8.249 13.187 ( 4.678 -3.396 -1.177) 5.899 13.415 ( 4.596 -3.459 -2.473) 6.261 13.544 ( 0.972 -10.034 1.413) 10.180 13.658 ( 3.361 -8.104 -2.181) 9.041 13.824 ( -0.341 -5.585 -0.189) 5.599 13.940 ( 3.018 -5.222 1.478) 6.210 14.266 ( 1.233 -6.695 3.379) 7.600 14.330 ( 0.375 -5.852 -1.550) 6.065 16.140 ( -0.550 -10.799 3.099) 11.248 16.371 ( 1.898 -13.844 -2.466) 14.190 16.971 ( -6.787 -12.447 -0.551) 14.188 17.047 ( -2.649 -14.529 -0.476) 14.776 18.277 ( -3.487 9.104 -0.440) 9.759 18.400 ( -4.526 9.035 2.286) 10.361 18.541 ( 5.592 11.417 -2.370) 12.932 18.674 ( 4.431 10.908 -0.014) 11.773 20.367 ( -5.387 0.361 -0.346) 5.411 20.429 ( -2.994 0.800 0.713) 3.180 20.446 ( 0.603 7.072 0.386) 7.108 20.538 ( 0.652 3.344 -0.396) 3.430 20.746 ( 5.834 -4.824 3.394) 8.296 20.820 ( 4.632 -6.614 -4.192) 9.098 21.576 ( -5.578 -11.053 1.187) 12.437 21.629 ( -5.622 -10.843 -0.784) 12.239 22.496 ( 1.047 0.297 2.362) 2.600 22.541 ( -1.242 -0.557 -3.509) 3.763 22.711 ( -0.523 -1.874 1.726) 2.601 22.762 ( 0.114 -2.851 -0.375) 2.877 23.591 ( 2.860 17.531 -1.277) 17.809 23.620 ( 2.977 19.231 1.533) 19.520 23.938 ( 10.847 9.147 0.598) 14.202 24.074 ( 11.093 9.532 -1.414) 14.694 24.450 ( 0.005 7.979 0.253) 7.983 24.682 ( 2.150 7.245 -0.594) 7.581 24.782 ( 4.018 -2.048 1.399) 4.722 25.017 ( 4.460 -0.957 -0.420) 4.581 26.880 ( -1.385 -5.106 0.573) 5.321 26.928 ( -1.726 -4.234 -1.021) 4.685 27.043 ( 1.789 -7.241 0.650) 7.487 27.059 ( 1.129 -5.841 0.218) 5.953 27.162 ( -1.940 -0.188 -0.061) 1.950 27.259 ( 0.548 -1.636 -2.228) 2.818 27.298 ( 0.921 -3.069 1.260) 3.444 27.463 ( 0.469 -6.542 -2.479) 7.012 27.936 ( -1.779 -1.272 -1.428) 2.612 27.982 ( 2.386 -1.703 4.041) 4.992 28.303 ( 0.518 3.092 -0.651) 3.202 28.342 ( 3.660 3.235 -0.709) 4.936 28.554 ( 3.123 7.343 4.673) 9.247 28.569 ( -2.374 4.031 -5.201) 6.995 28.949 ( -4.713 3.227 -0.324) 5.721 29.000 ( -0.987 3.723 0.120) 3.853 29.193 ( -2.576 -0.886 4.707) 5.439 29.337 ( -1.801 -2.400 -1.885) 3.544 29.622 ( -4.927 5.154 0.089) 7.131 29.810 ( 3.227 6.084 -0.149) 6.888 30.587 ( -1.449 0.349 0.349) 1.530 30.677 ( 1.350 0.153 -0.100) 1.362 30.836 ( 0.261 5.141 -0.040) 5.148 30.895 ( 2.632 4.932 -0.010) 5.590 33.851 ( 0.671 0.222 -0.101) 0.715 33.871 ( 0.666 -0.674 -0.045) 0.949 33.952 ( -0.339 0.022 1.300) 1.343 34.013 ( 0.202 -1.393 -0.929) 1.686 37.233 ( -1.409 -1.428 -0.394) 2.044 37.245 ( -0.626 -0.583 0.315) 0.912 37.306 ( -0.699 -1.673 1.228) 2.189 37.348 ( -0.689 -1.813 -0.947) 2.158 37.634 ( -0.730 3.966 0.606) 4.077 37.713 ( 0.666 2.328 -1.001) 2.620 37.809 ( -1.991 -0.430 -0.724) 2.161 37.862 ( -0.446 -0.920 0.393) 1.095 49.175 ( -5.542 -2.966 0.786) 6.335 49.239 ( -6.051 -2.044 -3.646) 7.354 49.394 ( -9.181 -4.336 4.512) 11.111 49.661 ( -2.826 -10.757 -1.160) 11.182 50.531 ( -1.422 -0.754 -2.957) 3.367 50.565 ( 0.128 0.236 -3.269) 3.280 50.695 ( -2.211 -2.143 3.336) 4.540 50.934 ( 5.305 -5.673 1.294) 7.875 51.885 ( -0.010 5.898 0.626) 5.932 51.915 ( 0.178 6.423 -0.774) 6.472 52.439 ( -0.261 6.068 0.963) 6.149 52.465 ( -0.409 6.311 -0.239) 6.329 52.518 ( 2.918 -5.477 5.434) 8.249 52.610 ( -4.148 -8.946 -8.926) 13.300 53.171 ( -1.768 -7.146 2.847) 7.892 53.262 ( -2.395 -7.877 -1.909) 8.451 53.877 ( -1.382 0.775 0.874) 1.810 53.920 ( -1.102 0.059 -0.360) 1.160 54.145 ( 1.875 -1.428 4.668) 5.229 54.261 ( 0.499 -3.361 -2.788) 4.395 55.769 ( -1.653 -0.121 1.638) 2.330 55.859 ( -1.606 0.020 -1.136) 1.967 55.903 ( 2.839 -3.152 4.841) 6.436 56.090 ( 5.155 -6.450 -4.833) 9.567 57.523 ( -0.658 6.409 -0.109) 6.444 57.578 ( 1.149 7.621 -1.138) 7.791 57.646 ( 0.962 8.812 3.455) 9.514 57.767 ( 3.098 11.078 -2.688) 11.813 58.115 ( -0.768 -1.851 0.574) 2.084 58.215 ( 0.520 -4.236 -2.764) 5.084 58.458 ( 2.151 -7.999 5.849) 10.140 58.529 ( -0.244 -10.398 -3.122) 10.860 60.976 ( -0.854 2.326 0.103) 2.479 61.001 ( -0.907 2.198 0.011) 2.378 61.045 ( 2.118 3.757 -0.019) 4.313 61.078 ( 3.287 4.349 -0.211) 5.455 ======================= Grid point 103 (48/90) ======================= q-point: (-0.25 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.090 ( -22.325 10.812 9.126) 26.431 2.541 ( -20.884 25.473 15.191) 36.274 2.946 ( -4.894 8.542 2.352) 10.122 3.463 ( 1.776 9.850 -1.985) 10.204 3.792 ( -14.428 19.394 -21.355) 32.254 3.914 ( 0.586 2.569 0.455) 2.674 4.056 ( -8.195 5.731 -2.012) 10.200 4.590 ( -17.669 17.938 0.559) 25.185 4.669 ( -22.124 20.222 12.405) 32.439 4.803 ( -5.518 1.602 5.348) 7.849 5.015 ( -9.425 12.136 -4.052) 15.891 5.146 ( -16.734 21.344 4.874) 27.556 5.323 ( 0.052 16.317 1.835) 16.420 5.416 ( 3.760 -12.265 -8.872) 15.597 5.438 ( -5.887 -2.139 2.375) 6.699 5.668 ( -4.388 2.282 -2.917) 5.742 5.761 ( -2.999 8.658 3.003) 9.643 6.051 ( -3.034 4.453 -12.889) 13.970 6.112 ( -4.282 3.994 3.192) 6.669 6.357 ( 0.804 -2.844 3.975) 4.954 6.421 ( -10.770 1.365 0.008) 10.857 6.565 ( 3.432 -13.337 0.645) 13.787 6.627 ( -3.769 3.956 1.358) 5.630 6.729 ( 8.774 5.963 9.672) 14.356 6.864 ( -4.770 3.136 -5.955) 8.249 7.100 ( -4.512 0.737 -2.863) 5.394 7.249 ( -6.535 4.793 -6.474) 10.373 7.368 ( -3.978 0.845 -0.114) 4.068 7.444 ( -5.434 4.966 -0.545) 7.381 7.530 ( -3.642 -3.411 -4.671) 6.835 7.600 ( -5.247 0.299 8.830) 10.275 7.731 ( 2.482 2.374 -2.634) 4.328 7.793 ( 4.023 13.178 -5.558) 14.857 7.923 ( -0.482 -1.733 -7.299) 7.517 8.022 ( -0.155 -6.495 -3.938) 7.597 8.262 ( -0.801 -6.183 8.824) 10.804 8.335 ( -1.385 7.256 -0.687) 7.419 8.400 ( -0.917 2.693 7.127) 7.674 8.574 ( 2.221 -8.809 -1.659) 9.235 8.763 ( -7.571 -6.700 0.389) 10.118 8.906 ( -1.996 1.870 3.757) 4.647 8.991 ( -6.415 1.938 7.584) 10.120 9.127 ( -2.702 -1.876 -3.627) 4.897 9.243 ( 7.856 -0.295 -0.386) 7.871 9.365 ( -3.249 -1.378 11.596) 12.121 9.536 ( -3.045 4.766 -7.012) 9.008 9.764 ( 3.173 1.318 2.349) 4.162 9.870 ( 4.432 -2.566 -0.974) 5.213 10.083 ( 0.784 -1.223 -2.571) 2.953 10.176 ( -1.525 -6.942 -8.989) 11.460 10.314 ( -2.317 2.625 5.256) 6.315 10.538 ( -0.253 -3.400 2.330) 4.129 10.646 ( 0.662 -3.922 0.962) 4.092 10.728 ( -6.766 -0.110 3.536) 7.635 11.041 ( -4.432 -8.507 -6.367) 11.513 11.077 ( 2.787 -6.296 -5.129) 8.586 11.233 ( 2.232 3.527 -4.583) 6.199 11.274 ( 0.433 1.774 2.842) 3.379 11.303 ( 3.286 5.396 4.306) 7.646 11.459 ( 3.918 10.717 3.195) 11.850 11.743 ( 3.073 -3.336 2.796) 5.328 11.788 ( -1.424 -0.711 -1.785) 2.391 11.986 ( 0.535 2.174 -3.071) 3.801 12.044 ( 0.642 -4.022 1.818) 4.460 12.269 ( 2.853 -1.626 3.894) 5.094 12.412 ( -0.163 -7.505 -6.685) 10.052 12.479 ( -0.741 1.807 1.867) 2.702 12.517 ( 1.968 -7.235 0.571) 7.519 12.594 ( -0.231 -6.824 1.115) 6.919 12.778 ( 3.791 1.608 -1.425) 4.357 12.876 ( -0.372 -5.118 -2.804) 5.848 12.972 ( -0.325 -4.259 0.858) 4.356 13.315 ( 5.297 -7.011 -1.074) 8.852 13.504 ( 4.853 -4.195 -2.253) 6.799 13.593 ( 2.849 -9.724 3.538) 10.733 13.738 ( 4.070 -5.545 -0.412) 6.891 13.839 ( 1.824 -1.613 -0.589) 2.505 14.004 ( 2.614 -3.805 1.076) 4.741 14.276 ( -0.710 -4.888 0.946) 5.029 14.335 ( -0.286 -2.724 0.261) 2.751 16.146 ( 0.761 -10.444 1.191) 10.539 16.412 ( 2.279 -14.196 -0.701) 14.395 16.786 ( -9.983 -13.080 -0.458) 16.460 16.954 ( -5.871 -16.156 -0.168) 17.191 18.218 ( -1.878 8.281 -0.941) 8.544 18.315 ( -3.571 6.758 1.428) 7.776 18.659 ( 5.444 13.194 -1.170) 14.321 18.760 ( 3.731 11.651 -0.143) 12.234 20.270 ( -3.321 0.065 -0.131) 3.324 20.375 ( -1.983 -3.995 0.352) 4.474 20.473 ( 1.229 9.127 1.015) 9.266 20.541 ( -0.079 3.669 -0.798) 3.756 20.869 ( 4.605 -4.846 3.219) 7.419 20.908 ( 4.478 -6.769 -3.568) 8.866 21.444 ( -6.410 -8.422 -0.110) 10.585 21.493 ( -6.439 -8.995 0.454) 11.071 22.495 ( -1.485 -0.091 -3.077) 3.418 22.528 ( 0.625 -0.784 2.073) 2.303 22.709 ( -0.096 -1.519 1.701) 2.283 22.760 ( -0.178 -2.679 -0.674) 2.768 23.713 ( 7.646 22.698 4.315) 24.337 23.787 ( 13.628 25.220 -5.251) 29.143 24.157 ( 9.023 10.014 -0.438) 13.487 24.275 ( 6.077 9.816 1.020) 11.590 24.498 ( 5.982 5.353 -3.513) 8.763 24.676 ( -1.830 5.471 4.492) 7.311 24.978 ( 12.812 -3.398 -3.199) 13.636 25.132 ( 6.117 -2.708 1.743) 6.913 26.851 ( -1.329 -3.722 -0.090) 3.953 26.883 ( -2.081 -3.430 -1.346) 4.232 27.036 ( -2.909 -6.424 5.367) 8.862 27.092 ( 0.755 -6.395 -1.015) 6.519 27.143 ( 1.726 0.136 -3.734) 4.116 27.238 ( -0.884 -3.914 0.440) 4.037 27.379 ( 4.840 -5.135 -0.591) 7.081 27.473 ( 0.981 -6.899 -1.131) 7.060 27.908 ( 0.214 0.151 -2.616) 2.629 28.026 ( 0.567 -0.559 4.130) 4.207 28.299 ( -0.217 5.263 -1.224) 5.408 28.440 ( 4.728 1.962 0.740) 5.172 28.505 ( -1.557 3.545 -6.914) 7.925 28.620 ( 1.503 3.696 1.674) 4.327 28.808 ( -7.228 2.503 -0.998) 7.714 29.035 ( 2.683 6.329 4.009) 7.958 29.135 ( -3.940 -3.332 4.323) 6.731 29.260 ( -4.380 -1.756 -2.533) 5.356 29.521 ( -4.426 5.134 0.245) 6.783 29.865 ( 1.727 3.467 0.419) 3.895 30.578 ( 0.395 2.323 0.495) 2.408 30.690 ( 0.299 1.138 -0.204) 1.194 30.857 ( 1.704 6.439 -0.007) 6.661 30.980 ( 5.845 6.083 -0.551) 8.453 33.876 ( 1.701 0.196 -0.320) 1.742 33.887 ( 0.751 -0.598 0.573) 1.118 33.955 ( 0.258 0.093 1.583) 1.607 34.011 ( -0.124 -1.469 -1.012) 1.788 37.202 ( -1.306 -1.574 -0.137) 2.050 37.226 ( -1.223 -0.757 0.481) 1.517 37.282 ( -1.871 -1.892 -0.109) 2.663 37.328 ( -0.916 -2.662 -0.452) 2.852 37.621 ( -0.446 4.112 0.188) 4.140 37.722 ( 0.214 2.336 0.317) 2.367 37.760 ( -2.076 1.009 -2.744) 3.586 37.841 ( -1.793 -0.804 1.054) 2.229 49.032 ( -7.598 -2.511 0.329) 8.009 49.069 ( -8.509 -1.720 -2.571) 9.054 49.174 ( -12.301 -2.718 3.945) 13.200 49.497 ( -13.209 -14.607 -4.275) 20.152 50.476 ( -1.829 0.596 -2.797) 3.395 50.567 ( 0.423 -0.182 -1.371) 1.447 50.666 ( -1.646 -1.426 3.338) 3.986 51.066 ( 6.269 -8.262 2.336) 10.631 51.883 ( -0.174 6.156 0.293) 6.165 51.928 ( 1.014 6.604 -0.293) 6.688 52.421 ( -1.676 4.753 -0.173) 5.043 52.450 ( -0.712 6.643 -0.789) 6.727 52.518 ( -1.945 -5.244 -5.699) 7.986 52.589 ( 1.840 -8.309 5.586) 10.179 53.119 ( -3.804 -6.797 2.223) 8.100 53.197 ( -3.220 -7.210 -1.715) 8.080 53.852 ( -1.170 1.060 0.914) 1.824 53.886 ( -1.844 0.353 -0.574) 1.963 54.189 ( 1.026 -1.717 3.961) 4.438 54.272 ( 1.075 -3.328 -2.381) 4.231 55.746 ( -0.979 0.488 1.371) 1.754 55.820 ( -1.502 0.787 -1.145) 2.046 55.980 ( 2.531 -4.920 6.469) 8.512 56.202 ( 6.422 -9.704 -5.531) 12.884 57.513 ( -0.247 6.104 -0.050) 6.109 57.587 ( 0.209 7.936 -1.860) 8.153 57.702 ( 2.652 8.493 5.966) 10.712 57.845 ( 5.155 10.231 -4.273) 12.227 58.118 ( 1.792 -1.420 -0.554) 2.352 58.223 ( 0.805 -3.506 -1.791) 4.019 58.502 ( -1.179 -9.021 -2.034) 9.322 58.532 ( 2.553 -8.991 4.482) 10.366 60.966 ( -0.195 2.023 0.214) 2.044 60.987 ( -0.454 1.941 0.086) 1.995 61.089 ( 2.000 4.832 0.238) 5.235 61.175 ( 6.252 5.400 -1.352) 8.372 ======================= Grid point 104 (49/90) ======================= q-point: (-0.12 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.883 ( 2.009 32.641 14.778) 35.886 2.279 ( -8.989 34.392 33.503) 48.847 2.846 ( -5.830 13.858 1.054) 15.071 3.290 ( -16.369 18.306 -7.399) 25.647 3.543 ( -14.532 19.366 -5.010) 24.725 3.622 ( -12.251 16.386 -3.761) 20.802 4.021 ( 1.196 -2.753 -7.202) 7.802 4.262 ( -3.444 21.699 2.921) 22.164 4.389 ( -9.873 14.962 9.262) 20.177 4.676 ( -8.001 8.635 -4.238) 12.512 4.792 ( -11.611 17.080 -1.894) 20.740 4.900 ( -4.177 21.329 -2.864) 21.922 5.146 ( -10.352 6.305 -0.699) 12.141 5.365 ( -5.363 7.633 2.172) 9.579 5.453 ( -3.942 0.607 -0.099) 3.990 5.597 ( 1.731 6.807 0.511) 7.042 5.874 ( 0.905 4.833 -8.043) 9.427 5.902 ( 4.043 7.443 -0.284) 8.475 6.095 ( -3.031 -4.500 9.448) 10.896 6.148 ( -13.571 3.594 3.623) 14.499 6.361 ( 2.580 -2.032 2.223) 3.966 6.571 ( 0.015 -5.304 -1.546) 5.525 6.653 ( -4.664 16.596 -9.506) 19.686 6.719 ( 3.108 -5.493 -5.878) 8.624 6.890 ( -1.874 -5.484 -4.826) 7.542 7.003 ( 3.705 -0.518 -4.355) 5.742 7.185 ( -0.521 -2.318 -1.403) 2.759 7.294 ( -9.930 -7.673 -0.205) 12.551 7.318 ( -5.875 3.013 7.837) 10.248 7.378 ( -0.807 5.001 -8.192) 9.632 7.593 ( 0.310 1.663 8.026) 8.202 7.828 ( 2.592 -0.684 0.231) 2.690 7.862 ( 2.511 1.165 -0.788) 2.878 7.926 ( 3.731 3.457 -2.683) 5.751 7.975 ( -0.016 -3.872 -6.582) 7.636 8.266 ( -2.642 -3.716 8.111) 9.305 8.346 ( 3.091 -1.166 -2.454) 4.115 8.413 ( 0.737 6.449 6.153) 8.943 8.586 ( -7.677 -6.674 4.311) 11.048 8.645 ( 3.508 -11.263 -1.117) 11.849 8.772 ( -8.073 5.311 8.220) 12.686 9.016 ( 1.145 5.389 3.835) 6.713 9.073 ( -0.377 -1.637 -7.546) 7.731 9.271 ( -2.959 -8.901 10.797) 14.302 9.421 ( 1.083 0.629 5.249) 5.396 9.497 ( 3.200 9.211 -8.950) 13.236 9.809 ( 2.024 -7.516 1.208) 7.877 9.974 ( -4.741 -3.874 0.681) 6.160 10.016 ( 4.067 -11.753 -1.436) 12.519 10.080 ( -2.763 -0.824 -10.187) 10.587 10.339 ( -1.089 4.774 5.603) 7.441 10.511 ( -2.988 -4.540 2.765) 6.098 10.603 ( -1.732 -3.307 3.858) 5.368 10.727 ( 3.759 1.259 -2.101) 4.487 10.948 ( -1.349 -6.680 -7.145) 9.874 11.057 ( -2.462 -9.560 -3.188) 10.374 11.223 ( -1.854 -3.202 -0.595) 3.747 11.330 ( 3.073 3.649 4.215) 6.366 11.408 ( 4.981 3.760 5.113) 8.068 11.567 ( -7.084 -8.138 -5.575) 12.144 11.654 ( 5.045 8.747 0.761) 10.126 11.819 ( 2.276 -5.107 3.199) 6.442 12.039 ( 2.494 5.483 0.980) 6.103 12.092 ( 2.898 1.937 2.204) 4.124 12.211 ( -6.488 -1.372 -2.570) 7.112 12.324 ( -4.371 -7.441 -4.620) 9.788 12.427 ( -4.260 0.929 0.340) 4.373 12.576 ( 0.587 -10.871 1.115) 10.944 12.657 ( 6.179 1.904 0.487) 6.484 12.830 ( -0.641 -3.124 -1.660) 3.595 12.872 ( 2.221 2.342 -0.773) 3.319 12.992 ( 0.622 0.177 -0.091) 0.653 13.383 ( 2.229 -9.818 -0.314) 10.073 13.580 ( 1.882 -5.185 -3.094) 6.325 13.672 ( 3.440 -9.942 3.417) 11.061 13.797 ( 1.201 -8.046 0.090) 8.136 13.904 ( 4.350 2.786 1.259) 5.317 14.061 ( 2.565 1.780 1.001) 3.278 14.249 ( -1.880 -2.290 1.039) 3.140 14.306 ( -2.400 -0.726 0.550) 2.567 16.187 ( 3.191 -9.906 0.095) 10.408 16.414 ( -4.172 -9.503 0.338) 10.384 16.630 ( -1.913 -17.973 -0.434) 18.080 16.816 ( -6.998 -17.375 0.150) 18.732 18.194 ( -0.314 7.990 -0.344) 8.004 18.262 ( -1.946 5.441 0.428) 5.794 18.748 ( 3.093 13.686 -0.090) 14.031 18.824 ( 2.430 11.982 -1.153) 12.280 20.231 ( -0.713 0.064 0.995) 1.226 20.346 ( -0.942 -5.368 -0.646) 5.488 20.494 ( 0.509 7.864 0.706) 7.912 20.533 ( -0.472 4.771 -0.422) 4.813 20.944 ( 2.063 -5.605 1.673) 6.202 20.982 ( 3.045 -6.503 -1.729) 7.386 21.332 ( -3.719 -7.030 -0.725) 7.986 21.390 ( -3.458 -8.625 0.803) 9.327 22.460 ( -0.718 0.260 -1.836) 1.989 22.538 ( -0.354 -1.949 0.781) 2.129 22.714 ( 0.023 -1.299 1.703) 2.142 22.755 ( 0.059 -2.373 -0.631) 2.456 23.881 ( 5.195 28.447 8.108) 30.032 24.121 ( 17.918 23.846 -11.653) 32.023 24.286 ( 3.277 9.570 -0.092) 10.116 24.351 ( 3.607 12.753 -1.026) 13.293 24.638 ( -0.087 4.193 2.362) 4.814 24.655 ( 5.601 3.606 -2.932) 7.278 25.223 ( 8.182 -4.407 0.272) 9.298 25.268 ( 7.069 -3.672 0.404) 7.976 26.812 ( -2.712 -2.663 1.578) 4.115 26.855 ( 0.379 -2.379 -3.143) 3.960 26.976 ( -4.128 -6.015 6.604) 9.840 27.078 ( -1.009 -5.130 -1.779) 5.523 27.195 ( 2.706 -1.872 -1.271) 3.527 27.256 ( 3.139 -5.305 -1.826) 6.429 27.435 ( -0.484 -7.621 2.172) 7.939 27.501 ( 2.205 -7.380 -3.071) 8.292 27.954 ( 4.999 1.388 -2.358) 5.699 28.024 ( -1.706 1.572 3.647) 4.322 28.292 ( -0.570 4.355 0.210) 4.397 28.454 ( -1.634 2.009 -5.896) 6.439 28.558 ( 5.832 3.379 0.959) 6.808 28.627 ( 0.224 1.333 0.481) 1.435 28.678 ( -4.041 1.731 0.276) 4.404 29.009 ( -9.363 -2.960 0.902) 9.862 29.061 ( -1.036 4.919 1.470) 5.238 29.237 ( 1.859 -1.976 0.314) 2.731 29.467 ( 0.472 5.722 -0.432) 5.758 29.857 ( -3.247 -1.802 -1.559) 4.027 30.591 ( 0.306 3.097 1.271) 3.362 30.702 ( 0.878 2.365 -0.625) 2.599 30.902 ( 2.385 7.683 -0.443) 8.057 31.127 ( 7.502 5.811 -6.269) 11.373 33.899 ( 0.420 -0.494 1.599) 1.725 33.924 ( 2.614 -0.294 -0.502) 2.678 33.971 ( 0.573 -0.367 1.537) 1.681 34.001 ( -0.638 -1.281 -0.852) 1.666 37.184 ( -0.330 -2.185 0.113) 2.213 37.202 ( -1.057 -1.254 0.207) 1.653 37.234 ( -1.919 -1.637 -0.690) 2.615 37.309 ( -0.951 -3.216 -0.132) 3.356 37.623 ( 0.755 4.042 -0.157) 4.115 37.699 ( -2.346 2.195 -0.228) 3.220 37.739 ( 0.945 3.004 -2.130) 3.802 37.797 ( -2.409 0.121 0.920) 2.582 48.885 ( -6.110 -2.091 -0.840) 6.512 48.901 ( -7.285 -1.483 0.772) 7.475 48.945 ( -8.323 -1.045 0.381) 8.397 49.108 ( -19.199 -7.579 -4.110) 21.046 50.477 ( 1.934 0.176 2.493) 3.160 50.577 ( 0.914 -0.978 0.605) 1.469 50.653 ( -0.338 -1.473 5.574) 5.775 51.176 ( 2.938 -11.150 0.571) 11.545 51.884 ( 0.120 6.397 0.734) 6.440 51.948 ( 0.983 6.465 -0.899) 6.601 52.382 ( -1.394 2.621 -0.080) 2.970 52.435 ( -0.487 6.218 -1.002) 6.317 52.498 ( 0.602 -1.909 -1.501) 2.502 52.614 ( -0.794 -9.135 2.798) 9.587 53.039 ( -3.727 -5.725 1.656) 7.029 53.129 ( -2.460 -6.456 -1.823) 7.145 53.833 ( -0.852 1.175 0.568) 1.559 53.851 ( -1.136 0.748 -0.545) 1.465 54.208 ( -0.170 -1.741 3.459) 3.876 54.288 ( 0.939 -3.122 -1.709) 3.681 55.735 ( -0.519 1.028 1.276) 1.719 55.794 ( -0.699 1.266 -1.176) 1.864 56.033 ( 0.487 -6.384 7.721) 10.030 56.307 ( 4.702 -12.707 -5.679) 14.691 57.512 ( 0.076 6.056 0.233) 6.061 57.582 ( -0.048 7.765 -2.292) 8.096 57.761 ( 0.608 7.657 7.275) 10.580 57.947 ( 5.600 6.972 -5.898) 10.712 58.210 ( 6.550 -2.482 0.359) 7.014 58.243 ( 2.112 -2.730 -0.710) 3.524 58.439 ( -3.813 -7.824 -3.047) 9.222 58.586 ( 0.265 -8.838 3.154) 9.388 60.967 ( 0.173 1.963 0.420) 2.015 60.982 ( -0.155 1.877 0.244) 1.899 61.128 ( 1.470 5.860 0.962) 6.118 61.318 ( 7.292 3.862 -5.056) 9.677 ======================= Grid point 105 (50/90) ======================= q-point: ( 0.00 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.767 ( 6.970 26.214 17.666) 32.370 3.068 ( -7.953 18.708 5.860) 21.156 3.215 ( 16.628 30.936 8.226) 36.072 3.434 ( -16.991 17.271 6.417) 25.063 3.589 ( 4.513 13.227 -1.863) 14.099 3.846 ( -3.759 -2.503 -7.898) 9.098 3.941 ( 8.397 13.200 -5.122) 16.462 4.443 ( -4.855 -0.500 -5.544) 7.386 4.561 ( -3.042 13.246 0.392) 13.597 4.657 ( 3.301 -8.768 9.649) 13.449 4.852 ( 0.884 2.259 -5.276) 5.807 4.942 ( 1.762 -4.277 3.735) 5.945 5.218 ( 0.821 2.687 -7.563) 8.068 5.305 ( -0.591 2.493 9.874) 10.201 5.440 ( 0.476 -1.107 -11.132) 11.197 5.693 ( -11.321 -8.121 -0.339) 13.936 5.790 ( -1.467 1.881 6.105) 6.554 6.017 ( -3.267 -3.325 5.443) 7.166 6.194 ( 2.844 5.283 -0.281) 6.007 6.199 ( 3.420 1.527 -2.686) 4.609 6.268 ( 8.917 8.720 6.749) 14.181 6.562 ( 5.216 -4.220 0.908) 6.770 6.619 ( -2.144 -4.028 -4.966) 6.744 6.770 ( -8.453 -7.772 -1.859) 11.633 6.933 ( 1.190 16.589 -1.293) 16.681 7.090 ( 0.748 -0.300 -1.827) 1.997 7.176 ( 1.392 8.957 -2.569) 9.421 7.347 ( 2.752 6.088 -9.328) 11.474 7.401 ( -8.126 19.557 -1.888) 21.262 7.536 ( -2.888 12.559 1.250) 12.948 7.610 ( 1.667 0.671 -8.195) 8.390 7.794 ( 2.864 -1.275 -4.239) 5.272 7.895 ( 1.850 2.933 0.157) 3.471 7.927 ( -4.149 4.191 -3.976) 7.112 8.049 ( -1.101 -2.920 -2.761) 4.167 8.099 ( 0.771 5.280 -2.005) 5.700 8.390 ( 5.669 -4.404 7.347) 10.271 8.524 ( 0.669 8.105 7.059) 10.769 8.645 ( 1.230 7.354 2.559) 7.883 8.693 ( 0.833 8.256 -0.195) 8.300 8.829 ( 0.276 12.663 9.656) 15.927 9.031 ( -1.510 1.380 0.572) 2.124 9.110 ( -2.772 -4.098 13.619) 14.490 9.311 ( 6.824 -4.169 -3.307) 8.653 9.322 ( -4.397 3.896 -1.440) 6.049 9.462 ( -1.696 -8.576 2.848) 9.194 9.558 ( -3.437 -16.242 1.068) 16.636 9.631 ( 3.525 -12.797 -0.158) 13.275 9.958 ( -3.158 -10.522 -7.586) 13.350 10.066 ( 3.147 1.424 -10.465) 11.020 10.280 ( 0.091 -13.798 0.869) 13.826 10.413 ( 2.916 -10.934 3.099) 11.733 10.485 ( -1.873 -10.544 0.904) 10.747 10.584 ( -1.527 1.703 4.127) 4.719 10.774 ( 0.016 -4.959 1.481) 5.175 10.934 ( -0.899 3.025 -6.827) 7.521 11.063 ( 1.964 -9.375 1.623) 9.715 11.185 ( -3.517 -0.652 -2.792) 4.538 11.316 ( 2.727 -13.216 6.824) 15.122 11.542 ( -0.761 -9.216 -3.269) 9.808 11.727 ( 2.010 8.745 6.077) 10.837 11.944 ( -2.876 5.992 -1.971) 6.933 12.071 ( 5.479 -2.233 -0.654) 5.953 12.105 ( -3.599 0.122 -2.486) 4.376 12.307 ( -0.454 6.079 -0.488) 6.115 12.364 ( -0.517 5.580 -1.399) 5.776 12.439 ( 0.860 0.280 1.859) 2.067 12.458 ( 0.405 5.935 0.519) 5.971 12.736 ( 1.039 -1.000 1.503) 2.083 12.859 ( -1.547 1.587 -3.634) 4.257 12.936 ( 0.389 6.419 1.880) 6.700 13.034 ( -0.814 3.040 -2.001) 3.729 13.279 ( 2.698 -5.469 2.335) 6.530 13.400 ( -2.979 -7.706 -3.349) 8.915 13.518 ( 0.641 -11.077 1.542) 11.203 13.546 ( -0.253 -12.905 0.076) 12.908 14.051 ( 0.976 1.798 2.316) 3.090 14.142 ( -0.708 -0.906 -1.516) 1.903 14.246 ( -0.690 2.071 0.801) 2.325 14.260 ( 1.039 1.307 0.369) 1.710 16.135 ( -1.474 -3.922 0.470) 4.216 16.153 ( 1.391 -4.953 -0.214) 5.150 16.340 ( -0.295 -12.546 0.569) 12.563 16.369 ( 0.171 -12.420 -0.573) 12.434 18.332 ( -0.207 4.706 0.221) 4.715 18.337 ( -0.104 4.435 0.230) 4.443 19.007 ( 0.581 7.580 -0.374) 7.611 19.039 ( 0.257 6.175 -1.627) 6.391 20.244 ( -0.121 1.485 0.983) 1.784 20.281 ( -0.210 -0.236 -0.512) 0.602 20.668 ( 1.021 8.856 -0.173) 8.916 20.671 ( -0.712 7.689 -0.241) 7.726 20.833 ( -1.762 -5.314 1.273) 5.741 20.892 ( 1.550 -5.329 -1.195) 5.677 21.124 ( 1.032 -9.884 0.221) 9.940 21.127 ( -1.212 -11.053 0.140) 11.120 22.467 ( 0.975 0.049 -0.190) 0.994 22.485 ( -0.899 -0.929 -0.894) 1.572 22.694 ( -0.227 -0.705 0.929) 1.188 22.716 ( 0.186 -1.790 0.060) 1.800 24.442 ( -4.234 9.765 0.831) 10.676 24.472 ( 3.193 17.438 1.491) 17.790 24.555 ( 0.872 6.800 1.478) 7.013 24.658 ( -4.990 7.704 3.769) 9.922 24.802 ( 3.762 0.179 -4.507) 5.873 24.847 ( 3.762 13.969 -7.034) 16.086 25.140 ( -3.366 -8.040 4.214) 9.682 25.284 ( 2.111 -6.562 -2.289) 7.263 26.728 ( -1.155 -0.789 0.619) 1.530 26.814 ( 0.349 -4.425 0.867) 4.522 26.883 ( 0.163 1.060 0.663) 1.261 26.979 ( 0.636 -3.575 -0.311) 3.645 27.188 ( -0.166 0.155 -0.147) 0.271 27.225 ( 1.476 -3.155 -1.531) 3.805 27.273 ( -1.851 -4.661 1.865) 5.351 27.370 ( 0.389 -7.123 -2.370) 7.517 28.022 ( -2.195 1.537 1.989) 3.337 28.067 ( 2.493 -0.695 0.704) 2.682 28.332 ( -1.631 4.124 0.127) 4.436 28.436 ( 0.404 -0.270 -4.312) 4.339 28.642 ( -0.833 1.739 1.200) 2.271 28.689 ( 1.292 2.265 -0.136) 2.611 28.726 ( 0.322 0.700 3.210) 3.301 28.849 ( 2.658 -1.764 -1.552) 3.548 29.101 ( -0.370 1.668 2.628) 3.134 29.185 ( -2.129 -2.090 -0.962) 3.135 29.592 ( 0.672 1.268 0.310) 1.468 29.675 ( -1.293 -3.351 -3.011) 4.687 30.689 ( 0.334 4.546 2.449) 5.174 30.758 ( -0.009 1.546 0.063) 1.548 31.086 ( 0.107 6.259 -0.371) 6.271 31.211 ( -1.632 0.605 -6.603) 6.828 33.912 ( -0.075 0.734 0.878) 1.147 33.943 ( -0.068 -0.721 -0.461) 0.859 33.966 ( -0.698 -0.422 0.062) 0.818 33.971 ( 0.668 -0.641 -0.110) 0.932 37.146 ( 0.163 -0.789 0.285) 0.854 37.160 ( -0.217 -0.627 -0.338) 0.745 37.189 ( 0.480 -2.155 0.756) 2.334 37.218 ( -0.209 -3.158 -0.505) 3.205 37.711 ( 0.368 2.779 0.109) 2.805 37.722 ( -0.575 2.908 -0.300) 2.979 37.776 ( -0.442 0.186 0.128) 0.497 37.790 ( 0.889 0.060 -0.562) 1.053 48.787 ( -1.037 0.452 0.526) 1.248 48.817 ( 2.532 -0.367 -0.823) 2.688 48.846 ( -1.827 -0.732 0.598) 2.057 48.865 ( 0.415 -1.057 -0.295) 1.173 50.513 ( 0.918 0.348 2.659) 2.835 50.588 ( 2.488 -2.753 6.084) 7.126 50.661 ( -0.156 1.871 0.597) 1.971 50.932 ( -2.326 -10.192 -4.554) 11.403 52.036 ( 0.226 7.500 0.956) 7.564 52.086 ( -0.377 6.629 -1.081) 6.727 52.344 ( 1.532 -5.796 1.141) 6.103 52.386 ( -1.349 -7.236 -0.576) 7.383 52.563 ( -0.127 6.279 0.374) 6.291 52.603 ( 0.384 7.677 -1.328) 7.801 52.874 ( -0.397 -6.956 1.655) 7.162 52.955 ( 0.271 -7.853 -1.716) 8.043 53.847 ( -0.270 1.154 0.125) 1.192 53.857 ( 0.097 0.706 -0.164) 0.731 54.184 ( -0.680 -0.203 1.403) 1.572 54.240 ( 0.434 -2.697 -0.912) 2.879 55.763 ( -0.399 2.056 1.349) 2.491 55.822 ( 0.217 1.660 -0.825) 1.866 55.938 ( -0.874 -2.977 3.373) 4.583 56.115 ( 0.921 -9.598 -3.583) 10.286 57.659 ( 0.374 7.390 0.733) 7.436 57.727 ( -0.521 7.063 -2.966) 7.679 57.875 ( -0.242 2.808 4.259) 5.107 58.032 ( 0.163 -2.748 -3.852) 4.735 58.163 ( 0.124 -4.287 2.659) 5.046 58.211 ( 0.509 -5.943 1.149) 6.074 58.348 ( 2.006 -0.067 0.372) 2.041 58.431 ( -2.465 -3.691 -2.436) 5.063 61.009 ( 0.046 1.482 0.582) 1.593 61.015 ( 0.022 1.233 0.457) 1.315 61.263 ( 0.095 4.650 1.019) 4.762 61.386 ( -0.228 -1.245 -4.035) 4.229 ======================= Grid point 106 (51/90) ======================= q-point: ( 0.12 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.885 ( -3.071 23.649 11.932) 26.666 2.952 ( -1.821 14.486 10.401) 17.926 3.195 ( -3.049 22.355 8.374) 24.066 3.542 ( 8.281 12.276 -8.274) 16.963 3.667 ( -0.538 0.390 -5.167) 5.209 3.865 ( 12.878 15.168 8.556) 21.659 4.202 ( 13.554 15.115 -8.497) 22.008 4.389 ( 3.072 4.441 -6.437) 8.402 4.577 ( 4.638 9.379 -1.722) 10.604 4.845 ( 11.068 -9.758 8.910) 17.237 4.943 ( 7.124 -5.585 2.706) 9.448 5.024 ( 5.607 -4.134 -0.478) 6.983 5.173 ( -6.133 -5.014 -4.257) 8.993 5.359 ( 7.496 14.352 4.740) 16.872 5.486 ( 3.340 0.663 -11.396) 11.894 5.585 ( 5.294 2.501 7.062) 9.173 5.866 ( 4.313 -15.221 5.444) 16.731 5.967 ( -2.287 -6.052 3.046) 7.151 6.223 ( 1.177 7.785 1.593) 8.033 6.310 ( 6.408 5.093 -2.745) 8.634 6.442 ( -1.498 3.661 -0.612) 4.002 6.514 ( 0.515 0.874 1.347) 1.686 6.599 ( -5.061 -5.712 -7.038) 10.381 6.702 ( 6.707 7.036 3.821) 10.445 7.010 ( 4.846 9.393 -0.900) 10.607 7.044 ( -2.915 10.341 -1.842) 10.901 7.201 ( -0.774 -0.733 -3.062) 3.243 7.320 ( 1.664 11.198 -1.881) 11.476 7.419 ( 1.633 11.904 -1.295) 12.085 7.504 ( 4.831 6.080 -3.325) 8.448 7.678 ( 4.203 -2.626 -3.408) 6.015 7.765 ( -8.278 0.511 -4.130) 9.265 7.838 ( -0.925 10.986 3.254) 11.495 7.934 ( 6.921 0.017 -9.363) 11.643 8.027 ( -0.537 -2.332 -2.838) 3.712 8.151 ( 3.484 5.186 0.473) 6.266 8.476 ( -0.728 -1.640 4.331) 4.688 8.524 ( -0.943 10.553 2.106) 10.802 8.642 ( 3.218 5.063 1.370) 6.154 8.792 ( 6.037 -0.386 -1.364) 6.201 8.911 ( -1.139 9.419 0.923) 9.532 9.022 ( 5.032 2.275 13.616) 14.693 9.082 ( -2.991 7.993 8.094) 11.762 9.228 ( -2.785 -8.331 -2.737) 9.201 9.378 ( -1.785 0.391 6.776) 7.018 9.506 ( 6.394 -1.138 -0.719) 6.534 9.587 ( 4.693 -10.071 -0.393) 11.118 9.747 ( 7.035 -17.196 -0.421) 18.584 9.904 ( 0.546 -4.979 -4.816) 6.948 10.108 ( 2.919 0.473 -10.191) 10.611 10.292 ( 1.602 -11.809 -1.056) 11.964 10.458 ( 1.281 -23.354 -3.655) 23.673 10.508 ( 1.826 -0.979 6.596) 6.914 10.565 ( -0.903 -3.014 4.693) 5.650 10.787 ( 0.152 -0.277 3.072) 3.088 10.898 ( -1.759 6.531 -7.519) 10.114 11.128 ( 2.745 -1.302 0.299) 3.053 11.151 ( 2.283 -9.722 1.600) 10.113 11.416 ( 2.841 -12.527 1.113) 12.894 11.536 ( 2.645 -11.308 -1.604) 11.723 11.760 ( -1.009 6.445 7.326) 9.810 11.863 ( -3.411 2.400 0.766) 4.240 11.972 ( -6.808 4.621 -6.371) 10.406 12.177 ( 2.942 -1.392 0.222) 3.263 12.251 ( -4.085 12.281 -1.691) 13.053 12.353 ( 0.036 -1.792 0.850) 1.984 12.422 ( -2.144 -2.852 0.216) 3.575 12.515 ( 3.460 5.696 -0.327) 6.673 12.654 ( -7.714 0.676 -0.943) 7.800 12.818 ( -1.595 -2.436 0.641) 2.982 12.953 ( -0.317 6.998 1.313) 7.128 12.989 ( -2.513 3.684 -1.872) 4.837 13.285 ( -3.419 -7.706 -1.642) 8.589 13.354 ( 0.323 -4.676 0.876) 4.768 13.497 ( -2.148 -12.647 -0.248) 12.831 13.542 ( -1.145 -10.449 0.830) 10.544 14.007 ( -4.853 1.316 1.525) 5.254 14.128 ( -1.691 0.893 -1.198) 2.257 14.167 ( -4.185 -0.087 0.612) 4.230 14.292 ( -0.177 -2.284 0.564) 2.359 16.032 ( -3.573 -4.503 0.367) 5.760 16.190 ( -3.074 -11.166 -0.027) 11.582 16.384 ( 9.293 -5.673 -0.107) 10.889 16.514 ( 8.511 -11.459 -0.032) 14.274 18.331 ( 0.712 5.046 -0.342) 5.107 18.361 ( 1.916 4.315 0.661) 4.768 18.992 ( -2.046 7.399 -0.339) 7.684 19.010 ( -2.584 6.495 -1.264) 7.103 20.249 ( 0.542 0.420 0.924) 1.151 20.275 ( -0.040 -0.269 -0.643) 0.698 20.641 ( -1.412 6.796 -0.808) 6.989 20.697 ( 0.866 8.180 1.308) 8.329 20.778 ( -3.121 -4.346 -0.715) 5.398 20.906 ( -0.085 -3.605 -0.014) 3.606 21.136 ( 2.287 -10.939 -0.183) 11.177 21.190 ( 4.409 -10.434 0.491) 11.338 22.469 ( -0.250 0.459 -1.218) 1.325 22.503 ( 2.119 -1.129 0.200) 2.409 22.688 ( -0.556 -0.584 0.917) 1.221 22.717 ( -0.117 -2.000 -0.002) 2.004 24.271 ( -11.345 17.232 1.415) 20.680 24.486 ( -2.302 12.950 0.933) 13.186 24.535 ( -7.145 3.266 3.132) 8.457 24.585 ( 0.887 7.645 -3.395) 8.411 24.727 ( -11.389 10.585 -4.409) 16.161 24.845 ( -1.007 4.208 0.824) 4.405 25.015 ( -7.242 -7.615 0.378) 10.515 25.215 ( -7.500 -6.516 -0.090) 9.936 26.729 ( 1.154 -0.568 -0.576) 1.410 26.824 ( 0.295 -3.769 2.771) 4.688 26.897 ( 0.289 0.529 -0.579) 0.836 27.014 ( 2.105 -4.856 0.215) 5.297 27.153 ( -1.211 1.095 -0.797) 1.817 27.226 ( -0.827 -2.515 -0.569) 2.709 27.273 ( 0.527 -4.463 0.371) 4.510 27.360 ( -0.724 -7.675 -1.489) 7.851 27.957 ( -3.769 2.621 0.098) 4.592 28.064 ( -2.636 -2.411 2.554) 4.391 28.341 ( 1.919 4.845 -0.658) 5.253 28.449 ( 0.950 0.441 -2.979) 3.158 28.621 ( -0.699 1.175 -0.950) 1.665 28.661 ( -2.171 0.164 -0.040) 2.177 28.805 ( 6.234 5.285 0.682) 8.201 28.974 ( 5.820 -2.125 0.841) 6.253 29.119 ( -1.347 0.097 2.315) 2.680 29.131 ( 1.034 -1.802 -0.343) 2.105 29.571 ( 0.679 4.206 -0.498) 4.290 29.746 ( 5.224 -4.040 -1.012) 6.681 30.697 ( -0.583 4.207 2.394) 4.876 30.746 ( -1.092 1.904 -0.336) 2.221 31.044 ( -3.630 5.839 -0.658) 6.907 31.120 ( -4.366 2.952 -3.849) 6.526 33.899 ( -1.235 0.639 0.536) 1.490 33.918 ( -1.704 -0.391 -0.271) 1.769 33.956 ( -0.132 0.128 0.280) 0.335 33.987 ( 0.500 -1.314 -0.121) 1.412 37.160 ( 0.977 -0.656 0.220) 1.198 37.170 ( 1.222 -0.462 -0.217) 1.324 37.203 ( 0.805 -1.931 -0.101) 2.094 37.241 ( 2.055 -3.371 0.056) 3.949 37.705 ( -0.305 3.378 -0.013) 3.392 37.730 ( 0.789 2.747 -0.043) 2.859 37.776 ( 0.447 0.117 -0.407) 0.616 37.811 ( 1.121 -1.030 -0.075) 1.524 48.849 ( 6.448 0.024 -0.078) 6.449 48.870 ( 4.241 -1.005 0.314) 4.370 48.957 ( 7.989 -1.377 0.765) 8.142 48.979 ( 11.252 -2.958 -1.637) 11.749 50.538 ( 0.659 1.234 2.563) 2.920 50.615 ( -0.486 1.604 -2.340) 2.878 50.708 ( 2.459 -6.343 9.432) 11.629 50.848 ( -3.585 -7.764 -6.120) 10.516 52.035 ( -0.667 7.146 0.577) 7.200 52.076 ( -0.111 6.727 -0.430) 6.742 52.343 ( -1.957 -6.405 -1.262) 6.816 52.401 ( 2.878 -7.009 1.552) 7.734 52.569 ( 0.561 6.267 0.367) 6.303 52.616 ( 1.152 8.311 -1.160) 8.470 52.896 ( 1.838 -7.729 1.519) 8.088 52.980 ( 2.472 -8.289 -1.522) 8.783 53.849 ( 0.406 1.212 0.169) 1.289 53.868 ( 0.896 0.404 -0.086) 0.987 54.164 ( -1.476 0.369 1.111) 1.884 54.240 ( -0.195 -2.917 -0.682) 3.002 55.757 ( -0.415 1.832 1.133) 2.194 55.828 ( 0.360 0.830 -0.358) 0.973 55.918 ( -1.764 -1.799 2.530) 3.571 56.103 ( -1.118 -9.004 -3.059) 9.575 57.668 ( 0.213 7.613 0.792) 7.657 57.710 ( -0.238 6.703 -2.473) 7.149 57.875 ( -0.922 4.504 3.741) 5.927 58.018 ( -0.352 -4.621 -3.140) 5.598 58.153 ( -1.822 -3.252 2.561) 4.522 58.212 ( -0.309 -3.273 0.941) 3.420 58.325 ( -5.205 0.455 -3.960) 6.556 58.394 ( 0.619 -6.145 1.469) 6.349 61.008 ( -0.184 1.577 0.430) 1.645 61.018 ( 0.172 1.147 0.402) 1.227 61.245 ( -2.113 4.029 1.154) 4.694 61.322 ( -4.239 0.556 -3.358) 5.436 ======================= Grid point 107 (52/90) ======================= q-point: ( 0.25 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.878 ( -1.366 10.433 -5.869) 12.048 2.936 ( 3.058 15.383 18.762) 24.454 3.236 ( 0.187 0.914 -4.111) 4.215 3.484 ( -5.596 0.109 -3.080) 6.389 3.869 ( 17.809 22.695 4.982) 29.275 4.231 ( 16.889 16.252 4.072) 23.790 4.305 ( 4.978 8.979 -17.290) 20.108 4.589 ( 10.953 12.168 -0.447) 16.378 4.644 ( -1.189 -6.851 3.187) 7.649 5.000 ( 1.240 -5.127 -0.601) 5.309 5.119 ( 11.685 -11.085 0.079) 16.107 5.171 ( 7.344 -6.947 -3.774) 10.790 5.177 ( 8.190 -2.134 5.230) 9.949 5.574 ( 9.155 11.347 5.256) 15.498 5.620 ( 8.380 -6.955 2.417) 11.155 5.805 ( 10.710 10.703 -1.652) 15.231 5.889 ( -0.810 -8.088 1.876) 8.342 5.963 ( -1.945 -4.101 -3.708) 5.861 6.177 ( -3.974 5.890 -1.353) 7.233 6.287 ( -5.360 -2.123 7.418) 9.395 6.334 ( -1.841 -4.378 -2.101) 5.193 6.595 ( 2.655 5.829 -3.424) 7.263 6.647 ( 6.305 -3.923 -0.629) 7.452 6.871 ( 7.121 16.908 5.601) 19.182 6.979 ( 0.065 4.270 6.180) 7.511 7.146 ( 6.378 17.930 1.270) 19.073 7.198 ( -1.366 -7.722 3.171) 8.459 7.345 ( 1.418 0.060 -8.365) 8.484 7.433 ( 2.872 10.956 -6.114) 12.871 7.554 ( -5.195 -1.354 -2.667) 5.994 7.630 ( -0.692 5.683 2.079) 6.091 7.742 ( 7.348 6.981 -1.090) 10.194 7.923 ( 6.869 18.366 -0.480) 19.614 8.004 ( 0.732 -2.607 0.146) 2.712 8.099 ( 6.772 5.623 -6.240) 10.790 8.235 ( 4.489 -1.984 0.772) 4.968 8.454 ( 0.068 4.276 -0.926) 4.376 8.540 ( 2.595 7.160 0.105) 7.616 8.710 ( -3.971 0.071 -2.610) 4.753 8.780 ( 1.402 1.597 -2.504) 3.284 8.987 ( 7.582 -0.903 0.652) 7.663 9.060 ( -0.230 9.394 3.394) 9.991 9.139 ( -0.105 5.672 -1.760) 5.940 9.273 ( 5.677 -6.642 8.376) 12.104 9.410 ( 6.312 6.392 14.106) 16.723 9.600 ( 3.799 2.342 -6.625) 7.988 9.719 ( 4.974 -5.932 1.199) 7.834 9.883 ( 6.118 -12.092 1.293) 13.613 9.941 ( 3.351 -2.598 -4.884) 6.467 10.142 ( 2.237 1.903 -7.753) 8.291 10.340 ( 3.055 -10.118 -2.232) 10.803 10.461 ( -1.686 -17.759 -1.401) 17.894 10.546 ( -1.285 3.226 5.208) 6.259 10.566 ( 1.071 -7.780 2.441) 8.224 10.764 ( -3.203 -0.928 3.521) 4.850 10.846 ( 0.967 5.354 -2.055) 5.816 11.196 ( 1.633 -14.118 -2.128) 14.371 11.222 ( 3.915 -0.177 -0.861) 4.012 11.404 ( -2.281 -9.902 0.912) 10.202 11.631 ( 3.908 -4.797 -0.002) 6.187 11.727 ( -2.749 6.484 4.909) 8.585 11.761 ( -7.050 0.834 -2.455) 7.512 11.868 ( -1.939 -1.654 -0.496) 2.596 12.149 ( -2.218 9.456 1.388) 9.812 12.225 ( -3.100 -2.443 -0.031) 3.947 12.300 ( -2.949 1.327 -2.163) 3.890 12.405 ( 0.534 -7.410 2.103) 7.721 12.471 ( -4.359 3.827 -2.657) 6.381 12.622 ( 3.603 -1.677 0.846) 4.063 12.733 ( -6.550 -3.963 -1.933) 7.896 12.927 ( -2.581 1.470 1.170) 3.193 12.935 ( -1.913 9.356 -0.171) 9.551 13.219 ( -1.174 -6.588 -2.857) 7.276 13.348 ( -2.107 -3.076 2.113) 4.285 13.438 ( -3.097 -11.268 -1.362) 11.765 13.496 ( -3.286 -8.555 2.004) 9.381 13.895 ( -5.641 -0.698 1.250) 5.819 14.017 ( -6.590 3.832 -2.527) 8.031 14.116 ( -2.395 -7.246 1.164) 7.720 14.250 ( -3.795 -6.863 0.350) 7.850 15.990 ( -1.040 -4.867 1.392) 5.168 16.133 ( -1.711 -10.856 -0.822) 11.021 16.601 ( 10.349 -5.067 -0.283) 11.527 16.689 ( 7.819 -9.411 -0.248) 12.237 18.368 ( 3.035 6.041 -0.776) 6.805 18.425 ( 4.087 4.043 0.894) 5.818 18.907 ( -5.629 7.501 -1.158) 9.449 18.937 ( -4.310 6.162 0.376) 7.530 20.279 ( 2.030 -0.640 0.361) 2.159 20.287 ( 1.841 -1.426 -0.521) 2.386 20.610 ( -1.460 3.747 -0.399) 4.041 20.674 ( -3.786 -2.667 1.301) 4.810 20.747 ( 0.947 9.034 -1.127) 9.153 20.886 ( -1.942 0.539 -0.000) 2.015 21.213 ( 4.633 -11.841 0.401) 12.722 21.292 ( 5.051 -11.748 -0.075) 12.788 22.468 ( 0.330 1.599 -0.711) 1.781 22.544 ( 1.597 -1.975 -0.306) 2.559 22.680 ( -0.393 -0.498 1.096) 1.266 22.712 ( -0.228 -2.057 -0.093) 2.072 24.029 ( -10.817 16.912 0.646) 20.086 24.332 ( -14.305 8.009 3.030) 16.672 24.361 ( -15.026 7.894 -2.853) 17.211 24.388 ( -7.907 8.865 -1.337) 11.954 24.634 ( 1.337 6.635 -2.375) 7.173 24.757 ( -6.180 2.500 4.504) 8.045 24.938 ( -0.295 -2.513 -3.915) 4.662 25.035 ( -8.509 -4.791 2.098) 9.988 26.762 ( 1.875 -1.376 -0.964) 2.517 26.835 ( -0.103 -3.225 0.855) 3.338 26.890 ( -0.403 -0.849 1.102) 1.449 27.022 ( -1.666 -6.835 0.101) 7.036 27.174 ( 2.767 1.179 -0.702) 3.088 27.202 ( -1.019 -1.052 0.529) 1.557 27.278 ( 0.066 -3.746 -0.708) 3.812 27.348 ( 0.339 -5.962 -1.174) 6.086 27.889 ( -2.327 2.537 -0.745) 3.523 28.007 ( -2.984 -2.880 2.526) 4.855 28.373 ( 0.314 3.174 0.574) 3.241 28.444 ( -0.888 0.858 -1.419) 1.881 28.571 ( -2.672 3.681 -3.926) 6.009 28.646 ( 0.860 0.194 -0.973) 1.313 28.947 ( 6.425 5.853 -0.953) 8.744 29.079 ( 3.939 -0.126 4.096) 5.684 29.120 ( 1.986 1.237 3.799) 4.462 29.187 ( 2.720 -4.197 -2.442) 5.566 29.633 ( 4.573 5.299 0.021) 6.999 29.833 ( 2.874 -3.365 -0.192) 4.430 30.662 ( -2.838 4.260 0.898) 5.197 30.720 ( -1.240 1.063 -0.043) 1.634 30.975 ( -2.266 4.736 -0.222) 5.254 31.024 ( -4.069 3.125 -0.987) 5.224 33.873 ( -1.136 0.405 0.075) 1.208 33.884 ( -1.476 -0.194 0.027) 1.489 33.957 ( -0.018 0.145 0.605) 0.622 33.990 ( -0.042 -1.351 -0.395) 1.408 37.187 ( 1.530 -0.523 -0.045) 1.617 37.204 ( 1.782 -0.751 0.471) 1.991 37.226 ( 1.347 -0.979 -0.317) 1.695 37.283 ( 1.824 -3.066 -0.243) 3.576 37.705 ( 0.284 3.587 0.047) 3.599 37.745 ( 0.599 2.826 -0.032) 2.889 37.789 ( 0.845 -0.539 -0.613) 1.175 37.832 ( 0.787 -1.626 0.213) 1.818 48.991 ( 6.859 -0.563 0.557) 6.905 49.026 ( 9.275 -1.602 -1.005) 9.466 49.159 ( 10.080 -2.133 2.561) 10.616 49.230 ( 12.033 -5.534 -2.793) 13.536 50.553 ( 0.239 1.728 1.409) 2.242 50.591 ( -0.692 1.763 -3.101) 3.634 50.753 ( -0.742 -7.015 5.800) 9.133 50.776 ( -1.585 -5.539 -2.978) 6.485 52.017 ( -0.904 6.618 0.118) 6.681 52.080 ( 0.423 7.676 0.350) 7.696 52.297 ( -1.897 -5.837 -1.130) 6.240 52.467 ( 2.630 -9.512 0.722) 9.895 52.585 ( 0.791 6.779 0.318) 6.832 52.641 ( 1.446 9.054 -1.062) 9.230 52.945 ( 2.163 -8.526 1.539) 8.930 53.039 ( 3.183 -9.220 -1.127) 9.819 53.866 ( 1.116 0.990 0.568) 1.597 53.890 ( 1.133 0.015 -0.051) 1.134 54.131 ( -1.841 1.002 0.972) 2.310 54.229 ( -0.618 -3.229 -0.744) 3.371 55.756 ( 0.088 1.229 1.083) 1.640 55.832 ( -0.086 -1.149 0.634) 1.315 55.886 ( -1.500 0.339 0.919) 1.791 56.055 ( -2.533 -7.253 -2.514) 8.084 57.671 ( 0.094 7.435 -0.312) 7.442 57.706 ( 0.168 6.975 -0.621) 7.005 57.859 ( -1.371 6.302 2.936) 7.087 58.006 ( -0.199 -4.221 -2.618) 4.971 58.094 ( -4.146 2.448 1.029) 4.924 58.199 ( -1.209 -3.432 -0.476) 3.670 58.231 ( -1.919 -2.093 -1.058) 3.030 58.388 ( -1.461 -9.407 1.072) 9.580 61.009 ( 0.244 1.711 0.204) 1.740 61.025 ( 0.444 1.075 0.225) 1.185 61.188 ( -3.323 3.235 0.734) 4.696 61.218 ( -4.579 2.114 -1.672) 5.314 ======================= Grid point 108 (53/90) ======================= q-point: ( 0.38 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.887 ( 2.635 2.907 -2.603) 4.708 3.026 ( -1.203 -0.611 3.494) 3.746 3.206 ( 1.679 3.431 -4.397) 5.825 3.401 ( -1.520 0.226 -0.709) 1.692 4.230 ( 7.994 20.027 -1.636) 21.625 4.337 ( 4.583 7.924 -3.105) 9.667 4.513 ( 6.458 6.544 3.582) 9.867 4.704 ( 14.781 2.570 -2.655) 15.236 4.865 ( 11.858 8.225 0.201) 14.433 5.022 ( 0.577 1.049 -2.449) 2.725 5.248 ( 0.560 -8.068 -4.332) 9.175 5.285 ( 2.778 -8.503 -4.642) 10.078 5.392 ( 6.813 -10.844 8.270) 15.245 5.576 ( -4.208 -9.085 -8.801) 13.330 5.693 ( -4.150 8.837 -2.901) 10.185 5.714 ( -7.007 2.838 -2.574) 7.986 5.961 ( 0.829 12.413 0.031) 12.440 6.020 ( 7.627 -1.712 8.588) 11.613 6.274 ( 1.150 -3.605 20.164) 20.516 6.291 ( 11.374 4.433 -5.411) 13.353 6.409 ( 7.442 0.868 8.182) 11.094 6.572 ( -6.895 1.295 5.191) 8.727 6.690 ( 3.397 -7.798 -1.929) 8.722 6.899 ( -6.233 2.361 3.574) 7.563 7.067 ( 1.542 -3.018 3.533) 4.896 7.167 ( -1.165 5.132 1.707) 5.533 7.253 ( -0.472 4.566 -3.711) 5.903 7.343 ( 1.605 -3.044 -1.734) 3.854 7.401 ( 5.955 0.204 -7.034) 9.219 7.627 ( 4.831 8.850 2.574) 10.406 7.706 ( 6.915 -2.100 -2.983) 7.818 7.885 ( 2.483 16.171 -2.396) 16.535 7.973 ( -0.538 16.116 -0.228) 16.127 8.107 ( 7.260 4.940 -2.737) 9.198 8.168 ( 4.349 8.465 10.637) 14.273 8.340 ( 3.824 4.338 -0.227) 5.787 8.475 ( -1.837 8.986 -6.267) 11.108 8.515 ( -1.075 2.820 -6.979) 7.604 8.677 ( 3.191 4.535 0.410) 5.561 8.802 ( -0.683 -0.754 4.647) 4.757 9.016 ( -1.955 0.593 -5.554) 5.918 9.185 ( 9.569 1.760 3.826) 10.455 9.218 ( 5.249 10.879 1.903) 12.228 9.338 ( 3.660 12.244 -2.588) 13.038 9.635 ( 0.201 -1.953 -2.299) 3.023 9.707 ( 13.926 -7.959 5.052) 16.817 9.788 ( 3.723 2.318 2.946) 5.283 9.892 ( -6.874 1.469 -13.211) 14.965 10.026 ( 3.411 1.123 3.723) 5.173 10.117 ( -1.777 -1.501 -7.970) 8.302 10.322 ( -8.835 -8.683 -0.736) 12.409 10.441 ( 1.621 -3.502 -0.094) 3.860 10.486 ( 1.002 -7.594 7.212) 10.521 10.656 ( 3.220 -5.283 0.675) 6.224 10.694 ( -0.079 -2.114 2.058) 2.952 10.923 ( 1.360 -5.702 5.133) 7.791 11.210 ( 1.459 -4.419 -6.077) 7.654 11.276 ( 3.709 -4.453 -1.300) 5.939 11.353 ( -4.156 -5.083 6.346) 9.132 11.604 ( -5.618 -0.834 -6.420) 8.572 11.688 ( 1.584 4.174 1.571) 4.733 11.707 ( -1.010 2.305 6.084) 6.584 11.784 ( -4.888 0.391 -0.658) 4.948 12.088 ( -6.379 -5.299 -2.968) 8.808 12.136 ( -1.680 -4.320 1.131) 4.771 12.303 ( 1.322 3.222 3.638) 5.036 12.363 ( -0.826 -4.778 -0.652) 4.893 12.503 ( 4.093 -0.638 -0.128) 4.144 12.570 ( -6.774 -4.554 -3.942) 9.064 12.681 ( 0.268 -0.916 0.833) 1.267 12.877 ( -1.331 2.610 0.675) 3.007 12.914 ( 0.149 4.328 -0.677) 4.383 13.213 ( 0.328 -3.810 -3.960) 5.505 13.291 ( -2.398 -0.291 1.182) 2.689 13.354 ( -4.424 -7.871 0.580) 9.047 13.450 ( -1.325 -8.381 2.343) 8.803 13.791 ( -4.662 -3.091 1.501) 5.791 13.883 ( -4.446 0.467 -4.072) 6.047 14.069 ( -2.012 -8.924 1.639) 9.293 14.156 ( -4.519 -11.468 0.054) 12.327 15.982 ( -0.466 -4.643 2.825) 5.455 16.114 ( -0.015 -9.722 -1.677) 9.865 16.782 ( 6.592 -5.549 -0.712) 8.646 16.821 ( 4.546 -7.486 -0.634) 8.781 18.455 ( 5.466 7.416 -0.756) 9.244 18.531 ( 5.310 4.429 1.307) 7.037 18.770 ( -6.602 7.280 -1.319) 9.916 18.828 ( -6.185 4.966 0.674) 7.961 20.327 ( 2.938 -1.636 -0.578) 3.412 20.359 ( 4.345 -3.047 0.053) 5.307 20.557 ( -3.929 -2.873 0.441) 4.888 20.606 ( -2.250 -0.329 0.108) 2.276 20.766 ( 0.571 10.911 -0.054) 10.926 20.834 ( -2.331 8.315 -0.781) 8.671 21.310 ( 3.880 -13.485 1.139) 14.078 21.387 ( 3.790 -13.524 -0.777) 14.066 22.476 ( 0.490 1.908 0.171) 1.977 22.562 ( 0.350 -1.942 -1.126) 2.272 22.678 ( -0.137 -0.703 1.181) 1.381 22.709 ( -0.094 -2.072 -0.079) 2.075 23.867 ( -4.147 13.348 -0.020) 13.977 24.020 ( -11.741 12.690 0.780) 17.305 24.101 ( -10.924 3.569 1.357) 11.572 24.192 ( -8.789 4.683 -2.841) 10.356 24.652 ( 0.274 5.383 -0.276) 5.397 24.680 ( -1.672 4.826 1.177) 5.241 24.903 ( -4.638 -0.170 3.033) 5.544 24.934 ( 0.556 -0.800 -3.110) 3.259 26.791 ( 0.828 -2.327 0.091) 2.472 26.833 ( 0.501 -3.578 -0.790) 3.698 26.891 ( -0.187 -3.278 1.086) 3.459 26.966 ( -2.936 -6.284 -0.290) 6.942 27.196 ( 0.029 0.339 0.906) 0.968 27.228 ( 2.061 0.465 0.484) 2.168 27.273 ( -0.248 -2.331 -0.909) 2.514 27.363 ( 1.050 -4.437 -2.121) 5.028 27.862 ( -0.129 1.333 0.594) 1.465 27.961 ( -1.986 -2.971 1.554) 3.897 28.347 ( -2.029 2.074 -0.187) 2.908 28.398 ( -2.635 -0.314 -0.793) 2.770 28.559 ( 2.008 6.188 -1.377) 6.650 28.666 ( 0.973 0.226 -0.466) 1.102 29.035 ( 2.491 5.028 -3.123) 6.422 29.155 ( 1.469 1.458 2.518) 3.260 29.190 ( 2.152 0.974 3.084) 3.884 29.228 ( 2.931 -3.738 -0.357) 4.763 29.734 ( 4.590 4.641 0.274) 6.533 29.860 ( -0.272 -0.080 -0.249) 0.378 30.618 ( -0.976 2.672 0.346) 2.865 30.685 ( -2.095 -0.183 0.002) 2.103 30.943 ( -1.098 3.452 0.261) 3.632 30.956 ( -1.971 3.225 -0.587) 3.825 33.856 ( -0.463 0.042 -0.099) 0.475 33.859 ( -0.867 -0.069 0.131) 0.880 33.958 ( -0.090 0.112 0.656) 0.671 33.987 ( -0.058 -1.189 -0.545) 1.310 37.217 ( 1.187 -0.400 -0.074) 1.255 37.235 ( 0.754 -1.316 0.613) 1.636 37.256 ( 1.424 -0.253 0.118) 1.451 37.312 ( 1.015 -2.426 -0.650) 2.709 37.713 ( 0.430 3.453 0.235) 3.487 37.753 ( 0.203 2.744 -0.600) 2.816 37.806 ( 0.795 -1.014 0.064) 1.290 37.843 ( 0.193 -1.618 0.018) 1.630 49.126 ( 5.188 -0.664 0.841) 5.298 49.193 ( 6.352 -2.666 -1.889) 7.143 49.347 ( 6.222 -2.728 3.314) 7.559 49.433 ( 7.588 -5.771 -2.363) 9.822 50.556 ( -0.024 1.523 0.083) 1.525 50.577 ( 0.157 1.454 -2.553) 2.942 50.730 ( -2.040 -4.744 2.973) 5.958 50.751 ( -0.623 -4.465 -0.650) 4.555 52.005 ( -0.310 6.458 0.523) 6.486 52.087 ( -0.028 8.442 -0.558) 8.461 52.271 ( -0.234 -6.101 0.881) 6.168 52.499 ( 0.424 -11.122 -1.646) 11.251 52.601 ( 0.593 8.025 0.367) 8.055 52.664 ( 0.860 9.343 -1.298) 9.472 52.988 ( 1.425 -8.818 2.089) 9.174 53.093 ( 1.985 -9.935 -1.104) 10.192 53.894 ( 1.205 0.433 0.899) 1.564 53.911 ( 0.807 -0.186 0.275) 0.873 54.100 ( -1.237 1.409 1.155) 2.202 54.212 ( -0.714 -3.503 -1.206) 3.773 55.769 ( 0.889 0.331 1.332) 1.635 55.820 ( -1.442 -1.916 1.948) 3.089 55.873 ( 0.387 1.077 -0.983) 1.509 55.992 ( -2.635 -5.126 -2.256) 6.190 57.676 ( 0.689 7.240 -0.609) 7.298 57.707 ( -0.237 7.322 0.222) 7.329 57.839 ( -1.195 7.667 2.272) 8.085 57.966 ( -2.534 3.911 -3.251) 5.682 58.049 ( 0.196 -0.869 0.827) 1.216 58.164 ( -1.897 -3.984 -1.026) 4.530 58.223 ( 0.581 -5.896 1.411) 6.090 58.351 ( -1.950 -10.655 0.107) 10.833 61.023 ( 1.136 1.896 0.091) 2.212 61.041 ( 1.152 1.193 0.114) 1.663 61.118 ( -3.296 2.673 0.039) 4.244 61.133 ( -3.241 2.114 -0.362) 3.886 ======================= Grid point 109 (54/90) ======================= q-point: (-0.50 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.851 ( -8.529 -1.791 -1.343) 8.818 2.966 ( -1.098 -4.815 -2.284) 5.441 3.287 ( 5.098 5.667 -1.573) 7.783 3.424 ( 3.934 -0.193 -1.737) 4.305 4.214 ( -4.362 11.048 1.046) 11.924 4.379 ( -2.239 12.921 -0.107) 13.114 4.724 ( -0.131 7.712 -8.859) 11.746 4.789 ( 6.805 4.641 -3.660) 9.014 4.961 ( -10.294 1.933 5.040) 11.624 5.085 ( 1.993 2.570 -3.032) 4.447 5.188 ( -1.886 -7.667 -2.363) 8.242 5.234 ( 2.189 -11.069 -7.477) 13.536 5.442 ( 1.172 -1.591 -8.912) 9.129 5.565 ( -4.446 4.062 -10.155) 11.806 5.687 ( 11.492 2.738 12.561) 17.244 5.728 ( 3.155 -10.078 10.589) 14.955 5.957 ( -0.244 10.671 1.130) 10.733 6.056 ( -4.182 5.582 -1.522) 7.138 6.294 ( -8.901 3.621 5.263) 10.956 6.421 ( -0.698 0.208 8.033) 8.066 6.488 ( 0.698 -4.065 18.295) 18.754 6.602 ( 5.068 1.649 9.650) 11.024 6.756 ( -1.291 -12.918 -0.989) 13.020 6.846 ( 6.000 -2.775 1.800) 6.851 7.016 ( -0.185 0.868 -4.641) 4.725 7.172 ( -3.801 2.132 2.542) 5.045 7.294 ( 1.697 5.912 -5.808) 8.460 7.299 ( 3.729 1.708 -5.051) 6.506 7.513 ( 2.287 -4.913 3.896) 6.674 7.730 ( -1.727 2.600 2.722) 4.141 7.767 ( 1.001 -6.063 -5.027) 7.940 7.817 ( -4.590 7.136 -1.916) 8.699 7.990 ( 5.762 21.015 1.503) 21.842 8.144 ( -5.365 6.429 -7.033) 10.935 8.286 ( -3.752 5.345 1.792) 6.771 8.351 ( -0.110 7.270 -4.130) 8.362 8.459 ( 5.439 9.785 6.131) 12.764 8.528 ( 1.757 13.265 -0.957) 13.415 8.766 ( 4.872 3.634 0.344) 6.088 8.807 ( -0.107 3.436 5.668) 6.629 8.988 ( -0.741 3.369 -1.782) 3.883 9.188 ( -4.646 12.425 -3.594) 13.743 9.370 ( 3.208 5.415 2.602) 6.811 9.457 ( 3.764 6.481 -7.294) 10.458 9.553 ( -12.384 5.351 -3.282) 13.884 9.617 ( -7.849 1.000 -0.214) 7.915 9.849 ( 2.425 1.723 -6.543) 7.188 9.936 ( 3.974 -0.512 0.790) 4.084 10.009 ( -2.423 1.313 -4.624) 5.382 10.087 ( -0.973 -1.394 -8.643) 8.808 10.227 ( 6.056 -5.929 6.813) 10.874 10.375 ( -1.959 -2.736 -0.480) 3.400 10.582 ( -5.809 -5.724 8.890) 12.064 10.709 ( 7.237 -16.668 3.867) 18.578 10.854 ( 7.125 -4.375 -0.541) 8.378 10.876 ( 0.133 -14.454 -0.473) 14.462 11.171 ( -10.550 1.626 4.882) 11.738 11.277 ( 2.920 4.019 3.932) 6.336 11.361 ( -0.557 -1.033 -1.938) 2.265 11.538 ( 2.353 0.826 -5.297) 5.854 11.694 ( -1.347 -1.789 1.902) 2.938 11.713 ( -1.112 -2.364 -0.586) 2.677 11.759 ( 4.203 1.444 2.776) 5.240 11.976 ( -2.292 -5.463 -2.678) 6.501 12.122 ( 1.029 -2.725 2.520) 3.852 12.315 ( -0.116 -8.757 6.222) 10.743 12.368 ( -0.696 3.378 -6.266) 7.152 12.470 ( -2.617 -5.188 -1.911) 6.117 12.598 ( 5.144 1.244 0.962) 5.379 12.645 ( -2.032 2.175 -0.482) 3.015 12.881 ( 0.607 -0.727 1.086) 1.440 12.919 ( 0.023 2.984 -1.119) 3.187 13.194 ( -4.224 -0.864 -2.197) 4.839 13.231 ( 2.231 -2.291 -3.506) 4.745 13.355 ( 2.447 -4.876 4.302) 6.948 13.434 ( -0.893 -8.750 0.627) 8.818 13.726 ( -1.262 -2.859 0.953) 3.267 13.831 ( 0.568 -1.609 -3.605) 3.988 14.054 ( 0.125 -9.408 2.003) 9.620 14.099 ( -0.094 -14.226 -0.271) 14.229 15.981 ( -0.516 -4.214 3.397) 5.437 16.114 ( 0.420 -9.437 -1.936) 9.642 16.860 ( 0.747 -6.193 -0.853) 6.296 16.863 ( -0.290 -6.207 -0.941) 6.285 18.552 ( -1.898 8.997 1.173) 9.270 18.603 ( 4.256 7.407 -0.944) 8.595 18.672 ( -4.951 4.569 1.163) 6.837 18.730 ( 2.138 3.184 -1.255) 4.035 20.376 ( 0.783 -2.639 0.091) 2.754 20.409 ( -1.897 -3.404 -1.445) 4.157 20.514 ( 2.122 -3.737 1.963) 4.725 20.574 ( -0.198 -3.117 -0.506) 3.164 20.763 ( -0.500 11.400 0.281) 11.414 20.807 ( -0.062 14.497 -1.326) 14.557 21.358 ( -0.011 -14.408 1.609) 14.498 21.427 ( -0.068 -14.362 -1.238) 14.415 22.490 ( 0.735 1.590 1.052) 2.043 22.555 ( -0.540 -1.134 -1.834) 2.223 22.679 ( -0.102 -1.098 1.172) 1.609 22.707 ( -0.068 -2.215 -0.177) 2.223 23.854 ( 1.715 10.125 0.320) 10.274 23.882 ( -1.853 11.877 -0.763) 12.045 23.963 ( -0.532 5.334 2.533) 5.929 24.087 ( 0.862 3.925 -2.702) 4.843 24.630 ( -1.654 6.339 1.465) 6.713 24.693 ( 1.919 2.579 -1.179) 3.424 24.843 ( -2.090 3.651 2.399) 4.843 24.948 ( 1.496 -0.686 -1.931) 2.537 26.801 ( 0.154 -2.817 0.953) 2.978 26.851 ( 0.880 -4.602 -1.080) 4.808 26.886 ( -0.154 -4.229 0.685) 4.287 26.923 ( -0.637 -5.254 -0.812) 5.354 27.195 ( -0.660 0.679 0.806) 1.243 27.252 ( -0.510 -1.952 2.246) 3.019 27.268 ( 0.476 1.137 -2.059) 2.400 27.367 ( 0.033 -3.676 -2.669) 4.542 27.886 ( 1.828 -0.559 2.368) 3.043 27.930 ( -1.226 -2.343 0.378) 2.672 28.323 ( 0.195 1.763 -0.130) 1.778 28.358 ( -0.605 0.013 -1.502) 1.619 28.611 ( 2.497 4.930 1.337) 5.686 28.673 ( -0.302 1.310 -1.089) 1.730 29.047 ( -0.310 3.264 -1.612) 3.654 29.123 ( -3.310 0.464 -3.808) 5.067 29.228 ( 0.141 1.827 4.636) 4.985 29.293 ( 1.826 -1.621 1.522) 2.877 29.799 ( -0.581 3.677 0.817) 3.811 29.841 ( 0.608 2.481 -0.860) 2.695 30.622 ( 0.241 0.820 0.644) 1.070 30.648 ( -0.372 -0.035 -0.383) 0.534 30.927 ( -0.348 3.380 0.165) 3.402 30.942 ( 0.606 2.903 -0.441) 2.999 33.849 ( -0.114 0.064 0.078) 0.152 33.853 ( 0.168 -0.229 -0.072) 0.292 33.957 ( -0.156 0.186 0.629) 0.674 33.986 ( 0.058 -1.145 -0.548) 1.270 37.230 ( -0.130 -0.564 0.187) 0.609 37.241 ( -0.017 -0.632 0.101) 0.640 37.276 ( 0.267 -0.783 0.692) 1.078 37.320 ( -0.057 -2.099 -0.908) 2.288 37.720 ( 0.010 3.437 0.450) 3.466 37.753 ( 0.152 2.321 -1.062) 2.557 37.816 ( -0.120 -1.012 0.799) 1.295 37.842 ( -0.087 -1.417 -0.432) 1.484 49.187 ( 0.021 -0.955 1.067) 1.432 49.259 ( 0.182 -3.109 -2.263) 3.849 49.414 ( -0.875 -2.154 2.971) 3.772 49.519 ( 1.095 -6.196 -1.691) 6.515 50.553 ( -0.396 0.899 -0.581) 1.142 50.578 ( 0.311 0.817 -2.021) 2.202 50.689 ( -2.173 -2.333 2.965) 4.354 50.760 ( 1.655 -4.288 -0.698) 4.649 52.008 ( 0.321 6.614 1.114) 6.715 52.073 ( -0.772 8.068 -1.662) 8.273 52.296 ( 1.824 -6.622 3.352) 7.643 52.475 ( -1.792 -10.744 -4.133) 11.650 52.610 ( 0.127 8.640 0.733) 8.672 52.666 ( -0.242 9.280 -1.629) 9.425 53.013 ( 0.253 -8.650 2.625) 9.044 53.109 ( -0.123 -9.910 -1.437) 10.015 53.907 ( -0.248 0.471 0.754) 0.923 53.926 ( 0.310 -0.253 0.616) 0.734 54.096 ( 0.537 0.852 1.815) 2.075 54.196 ( -0.301 -3.494 -1.889) 3.983 55.793 ( -1.374 -0.509 1.870) 2.375 55.801 ( 1.585 -0.811 1.709) 2.468 55.882 ( 0.118 -0.100 -0.919) 0.932 55.948 ( -0.290 -3.808 -2.644) 4.645 57.690 ( -0.650 7.600 0.066) 7.628 57.701 ( 1.099 6.798 -0.435) 6.900 57.823 ( -0.848 8.384 1.983) 8.657 57.929 ( 0.129 6.721 -2.684) 7.238 58.070 ( 0.844 -2.133 1.227) 2.601 58.122 ( -1.348 -5.149 -1.367) 5.495 58.253 ( 1.714 -6.604 2.060) 7.127 58.318 ( -0.903 -10.866 -0.904) 10.941 61.052 ( -0.193 2.148 0.252) 2.171 61.063 ( -0.169 1.971 -0.009) 1.978 61.070 ( -0.136 1.837 0.071) 1.843 61.085 ( 0.560 1.651 -0.347) 1.778 ======================= Grid point 110 (55/90) ======================= q-point: (-0.38 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.608 ( -12.366 5.148 -1.569) 13.486 2.929 ( -1.834 -5.682 0.513) 5.992 3.364 ( 0.538 14.605 -0.476) 14.623 3.503 ( 3.286 0.474 -3.000) 4.475 4.020 ( -10.624 9.130 -2.231) 14.184 4.334 ( -3.406 15.526 2.688) 16.121 4.608 ( -8.193 13.880 -3.718) 16.540 4.756 ( -4.142 -8.828 4.097) 10.577 4.887 ( -6.341 1.874 -2.644) 7.121 4.947 ( -2.678 -5.147 -4.893) 7.590 5.179 ( -7.240 -1.050 -2.912) 7.874 5.199 ( -1.269 -7.716 -1.398) 7.944 5.480 ( 2.830 -7.252 -8.006) 11.167 5.551 ( 6.683 0.160 1.006) 6.760 5.638 ( -12.829 -2.427 6.253) 14.477 5.843 ( -11.413 -4.458 -2.564) 12.518 5.948 ( -1.075 11.997 0.330) 12.049 6.013 ( 7.110 0.143 7.130) 10.070 6.191 ( 1.006 3.809 -4.341) 5.862 6.394 ( -3.305 9.940 3.910) 11.181 6.484 ( -2.329 -7.657 16.984) 18.775 6.582 ( -9.957 3.027 8.059) 13.163 6.774 ( -1.140 -4.833 -1.370) 5.151 6.879 ( -2.794 2.879 -3.171) 5.114 7.061 ( 3.413 -2.165 5.197) 6.583 7.122 ( 2.470 6.798 0.077) 7.234 7.372 ( 1.195 3.411 -0.764) 3.695 7.399 ( 7.442 3.280 -2.045) 8.386 7.555 ( 1.043 -1.903 -4.324) 4.838 7.584 ( -6.640 5.387 3.912) 9.403 7.686 ( -4.264 1.921 -6.674) 8.150 7.817 ( 1.109 -2.843 7.977) 8.541 7.975 ( -6.798 3.405 -2.756) 8.087 8.090 ( -1.553 16.108 1.019) 16.215 8.171 ( -2.728 14.431 -1.070) 14.726 8.354 ( 0.583 -3.970 -2.691) 4.832 8.488 ( -4.923 11.214 -6.757) 13.987 8.533 ( -1.728 9.743 -1.108) 9.957 8.678 ( -9.654 11.977 -3.642) 15.808 8.868 ( 0.288 -0.010 -2.170) 2.189 8.992 ( 1.750 5.175 6.198) 8.262 9.086 ( -8.833 13.172 -4.538) 16.496 9.185 ( -3.502 -3.349 3.485) 5.968 9.322 ( -8.103 2.417 2.763) 8.895 9.403 ( -11.848 -1.870 3.858) 12.600 9.620 ( 4.793 6.781 -2.789) 8.759 9.779 ( -5.132 -4.838 -1.065) 7.133 9.892 ( -6.222 1.537 -2.442) 6.859 10.089 ( 8.380 6.403 -1.554) 10.660 10.115 ( 3.778 -0.124 -9.106) 9.859 10.357 ( -0.806 -2.473 -2.106) 3.347 10.419 ( 5.936 -6.604 3.490) 9.541 10.476 ( -4.388 -3.170 5.375) 7.628 10.768 ( 2.025 -19.521 0.696) 19.638 10.834 ( -1.310 -16.859 -0.119) 16.910 10.908 ( -11.191 -5.010 8.326) 14.821 11.118 ( 8.361 -0.633 -4.008) 9.294 11.289 ( -4.099 -2.183 -1.595) 4.911 11.357 ( 3.240 6.989 2.665) 8.151 11.606 ( -4.937 -5.286 -1.532) 7.393 11.615 ( 4.745 5.375 0.028) 7.170 11.753 ( 1.162 -6.288 1.139) 6.495 11.898 ( 7.231 0.783 3.852) 8.230 11.993 ( 4.428 -2.460 -3.677) 6.260 12.151 ( 1.242 1.750 1.339) 2.529 12.332 ( -1.532 -7.131 3.265) 7.992 12.360 ( -0.197 -1.389 -2.898) 3.220 12.437 ( 4.764 -1.306 0.848) 5.012 12.603 ( -1.973 2.110 -4.068) 4.990 12.701 ( 2.567 -0.544 1.233) 2.900 12.885 ( 0.389 -1.309 0.514) 1.460 12.916 ( 0.370 5.712 -0.592) 5.754 13.158 ( 1.818 0.382 -1.829) 2.607 13.290 ( 3.333 -5.694 -1.055) 6.682 13.399 ( 0.315 -5.929 0.963) 6.015 13.462 ( 3.904 -10.008 2.058) 10.938 13.751 ( 3.232 -0.230 0.709) 3.317 13.882 ( 4.905 -0.563 -2.867) 5.709 14.082 ( 2.073 -10.405 1.240) 10.682 14.150 ( 4.138 -10.578 0.073) 11.359 15.980 ( -0.328 -4.159 2.705) 4.972 16.120 ( 0.647 -10.015 -1.556) 10.156 16.788 ( -6.353 -5.500 -0.697) 8.431 16.821 ( -4.319 -7.373 -0.648) 8.570 18.452 ( -4.758 7.344 -0.705) 8.779 18.536 ( -6.260 4.047 1.325) 7.571 18.747 ( 7.121 8.008 -1.108) 10.774 18.834 ( 5.404 4.452 0.395) 7.013 20.332 ( -3.679 -1.479 -0.779) 4.041 20.349 ( -2.582 -2.706 0.271) 3.750 20.588 ( 2.907 -3.265 0.678) 4.424 20.609 ( 2.823 -1.400 -0.071) 3.151 20.763 ( 0.564 9.141 0.051) 9.158 20.815 ( 1.142 11.546 -0.960) 11.642 21.320 ( -3.715 -13.598 1.456) 14.171 21.377 ( -4.019 -13.438 -1.095) 14.069 22.507 ( 0.387 0.777 1.248) 1.520 22.533 ( -1.022 -0.332 -2.112) 2.370 22.679 ( -0.131 -1.057 1.062) 1.504 22.708 ( 0.180 -2.272 -0.051) 2.279 23.912 ( 5.728 13.064 -0.507) 14.274 23.953 ( 8.324 12.135 1.135) 14.759 24.105 ( 11.156 6.363 0.859) 12.871 24.215 ( 10.913 3.148 -2.244) 11.578 24.603 ( -1.054 6.425 0.259) 6.516 24.741 ( 2.476 -1.700 0.946) 3.149 24.826 ( 0.359 6.259 0.278) 6.276 24.988 ( 2.709 -1.935 -0.627) 3.388 26.802 ( -0.221 -2.204 0.400) 2.251 26.845 ( -0.768 -3.366 -1.468) 3.751 26.903 ( 1.016 -5.374 2.013) 5.828 26.937 ( 1.777 -5.322 -0.819) 5.670 27.171 ( -1.540 0.844 0.516) 1.830 27.228 ( -1.771 -1.829 0.308) 2.564 27.278 ( 0.721 0.644 -0.350) 1.028 27.358 ( -0.179 -3.803 -2.022) 4.311 27.911 ( -0.437 -0.844 -0.588) 1.118 27.940 ( 2.325 -2.068 2.668) 4.099 28.349 ( 1.760 1.635 -0.165) 2.408 28.376 ( 2.941 0.490 -0.989) 3.142 28.643 ( -2.015 2.846 -3.334) 4.825 28.658 ( 1.267 2.772 1.223) 3.284 29.006 ( -4.988 2.168 -1.165) 5.562 29.043 ( -1.444 0.435 0.350) 1.548 29.213 ( -2.514 2.361 3.343) 4.803 29.296 ( -1.767 -1.679 -0.018) 2.437 29.730 ( -4.526 5.063 0.243) 6.795 29.867 ( 0.520 -0.269 -0.219) 0.625 30.620 ( 0.613 2.387 0.370) 2.492 30.678 ( 1.953 -0.132 -0.031) 1.958 30.936 ( 1.319 4.145 -0.034) 4.350 30.977 ( 2.906 2.585 -0.281) 3.899 33.855 ( 0.743 0.169 -0.039) 0.763 33.862 ( 0.686 -0.278 0.066) 0.743 33.956 ( -0.097 0.302 0.666) 0.738 33.986 ( 0.069 -1.182 -0.551) 1.306 37.213 ( -1.365 -0.397 0.056) 1.423 37.236 ( -0.662 -0.464 0.255) 0.848 37.269 ( -1.070 -1.431 0.716) 1.925 37.304 ( -1.235 -2.203 -1.019) 2.723 37.715 ( -0.543 3.616 0.255) 3.666 37.756 ( 0.340 1.699 -0.682) 1.862 37.804 ( -1.040 -0.166 0.107) 1.059 37.837 ( -0.456 -1.493 0.035) 1.561 49.132 ( -5.310 -1.009 1.020) 5.501 49.190 ( -5.850 -2.752 -2.071) 6.789 49.330 ( -7.548 -1.259 2.344) 8.004 49.466 ( -5.842 -7.748 -1.389) 9.803 50.530 ( -1.493 0.669 -1.160) 2.005 50.573 ( -0.361 -0.049 -1.449) 1.495 50.667 ( -0.648 0.058 1.990) 2.093 50.814 ( 3.394 -5.707 0.471) 6.657 52.020 ( 0.374 7.106 1.154) 7.209 52.057 ( -0.105 7.292 -1.184) 7.388 52.351 ( 2.015 -7.720 4.058) 8.951 52.414 ( -2.488 -8.971 -4.908) 10.524 52.608 ( -0.627 8.439 0.928) 8.513 52.648 ( -0.936 8.998 -1.673) 9.200 53.009 ( -1.445 -8.324 2.537) 8.821 53.083 ( -1.829 -9.399 -1.617) 9.711 53.895 ( -0.986 0.956 0.872) 1.627 53.920 ( -0.934 -0.100 0.114) 0.947 54.126 ( 1.545 -0.240 2.269) 2.755 54.193 ( 0.606 -3.131 -2.177) 3.861 55.773 ( -0.872 0.583 1.392) 1.743 55.843 ( 1.229 -2.688 2.665) 3.979 55.868 ( -0.269 0.889 -1.041) 1.395 55.973 ( 2.795 -4.689 -2.975) 6.217 57.668 ( -0.975 7.324 -0.348) 7.396 57.734 ( 1.693 6.731 -0.441) 6.955 57.817 ( -0.180 7.763 2.635) 8.201 57.949 ( 2.147 6.045 -2.832) 7.012 58.065 ( -0.850 -3.112 0.485) 3.262 58.128 ( 1.493 -3.467 -0.277) 3.785 58.302 ( 2.012 -7.631 1.628) 8.058 58.314 ( 1.087 -9.008 -0.897) 9.117 61.021 ( -1.221 1.863 0.085) 2.229 61.038 ( -1.240 1.192 0.107) 1.724 61.115 ( 2.974 2.861 -0.056) 4.127 61.144 ( 3.951 1.898 -0.254) 4.391 ======================= Grid point 111 (56/90) ======================= q-point: (-0.25 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.422 ( -2.897 18.974 1.088) 19.225 2.912 ( -1.070 3.503 8.233) 9.011 3.265 ( -7.760 25.781 5.873) 27.556 3.553 ( 2.208 3.656 -4.863) 6.472 3.886 ( -2.263 -2.584 -5.293) 6.310 4.181 ( -11.569 12.115 3.924) 17.205 4.306 ( -16.739 20.582 -14.547) 30.256 4.718 ( -3.586 -22.331 5.999) 23.399 4.742 ( -2.404 -1.829 4.500) 5.420 4.936 ( -4.735 3.680 -0.781) 6.048 4.957 ( -11.081 9.402 -3.705) 14.997 5.178 ( -4.359 -19.321 -0.811) 19.824 5.326 ( -14.173 8.099 3.316) 16.657 5.378 ( -3.928 -2.106 0.835) 4.535 5.639 ( -6.830 -2.351 4.077) 8.294 5.782 ( 9.482 5.041 -1.953) 10.914 5.912 ( -0.918 8.301 5.170) 9.822 6.107 ( 1.214 -5.907 1.865) 6.313 6.145 ( -4.612 0.182 -8.431) 9.612 6.314 ( -8.794 9.956 2.483) 13.514 6.323 ( -9.285 -7.852 1.099) 12.209 6.490 ( -1.886 1.361 -0.931) 2.506 6.699 ( -3.334 -1.847 -2.565) 4.594 6.861 ( 0.524 1.634 10.408) 10.548 7.037 ( -4.098 18.355 0.628) 18.818 7.205 ( -2.662 7.106 -1.778) 7.794 7.343 ( 3.236 -5.060 2.673) 6.575 7.441 ( -4.030 1.124 -3.172) 5.250 7.514 ( -0.550 -0.968 -1.717) 2.047 7.610 ( -2.316 7.322 -7.508) 10.740 7.642 ( 4.337 18.088 2.220) 18.733 7.826 ( -5.099 -5.091 3.867) 8.177 7.896 ( 2.368 -1.616 5.134) 5.881 8.026 ( 0.507 7.950 -8.399) 11.576 8.092 ( -9.464 18.000 2.372) 20.475 8.195 ( -8.749 8.701 -18.842) 22.523 8.384 ( 0.848 -6.205 -0.223) 6.267 8.478 ( -4.246 11.801 3.023) 12.900 8.573 ( -0.943 8.441 -3.235) 9.089 8.728 ( -8.740 8.528 5.433) 13.366 8.992 ( 2.601 0.952 0.883) 2.907 9.081 ( -3.744 -1.215 1.709) 4.292 9.098 ( -4.718 4.374 5.348) 8.366 9.199 ( -5.005 -3.942 2.746) 6.938 9.298 ( 3.576 -5.742 7.916) 10.413 9.636 ( -2.438 0.547 -4.621) 5.253 9.678 ( -4.837 -5.894 1.996) 7.882 9.763 ( -5.256 -4.172 0.251) 6.715 10.128 ( -0.626 0.595 -6.386) 6.444 10.163 ( -1.657 3.521 -8.261) 9.132 10.317 ( -3.267 -9.852 5.760) 11.871 10.410 ( 0.548 -4.645 -0.631) 4.720 10.525 ( 2.430 -9.858 -0.114) 10.154 10.669 ( -9.751 -1.744 7.696) 12.544 10.814 ( 0.278 -15.426 -2.457) 15.623 10.885 ( 4.215 -0.898 -0.831) 4.389 11.166 ( -3.600 -7.432 -0.983) 8.317 11.241 ( 0.239 -1.675 -1.016) 1.973 11.440 ( 1.930 -5.376 1.760) 5.977 11.522 ( -0.508 4.082 -0.094) 4.115 11.680 ( -6.489 -11.526 0.465) 13.235 11.721 ( 5.166 4.697 -0.282) 6.988 12.050 ( 6.026 0.240 3.767) 7.110 12.106 ( 6.590 5.207 0.002) 8.399 12.243 ( -2.466 -6.344 -2.512) 7.255 12.259 ( 4.770 7.977 -1.379) 9.396 12.391 ( 1.547 -1.888 0.824) 2.576 12.536 ( -2.072 1.067 -2.930) 3.744 12.595 ( 5.531 3.444 3.255) 7.284 12.695 ( 0.706 -7.243 -2.405) 7.664 12.941 ( 2.389 3.854 0.719) 4.591 12.949 ( 3.667 5.763 0.111) 6.832 13.196 ( 1.477 -3.705 -2.037) 4.479 13.372 ( 4.416 -7.303 0.763) 8.569 13.425 ( 1.784 -6.986 -0.055) 7.210 13.535 ( 2.033 -12.643 1.189) 12.860 13.850 ( 5.682 2.902 0.840) 6.435 14.006 ( 7.064 2.617 -1.581) 7.698 14.134 ( 2.121 -8.051 0.602) 8.348 14.238 ( 3.549 -6.265 0.389) 7.211 15.988 ( 0.830 -4.349 1.339) 4.625 16.140 ( 1.804 -11.199 -0.768) 11.369 16.606 ( -10.423 -4.900 -0.276) 11.520 16.689 ( -7.784 -9.308 -0.254) 12.136 18.372 ( -2.599 6.213 -0.875) 6.791 18.428 ( -4.249 3.775 1.024) 5.775 18.880 ( 5.653 7.976 -0.897) 9.817 18.937 ( 4.302 5.359 0.085) 6.873 20.270 ( -1.982 0.430 0.025) 2.028 20.304 ( -1.453 -1.754 -0.191) 2.285 20.625 ( 0.916 1.248 -0.720) 1.707 20.662 ( 1.882 4.396 1.365) 4.973 20.784 ( 1.466 0.839 -1.186) 2.064 20.848 ( 1.765 4.072 0.325) 4.450 21.231 ( -4.548 -11.783 0.558) 12.642 21.275 ( -5.102 -11.772 -0.239) 12.833 22.498 ( -1.322 0.298 -1.893) 2.328 22.515 ( -0.346 -0.508 0.939) 1.122 22.684 ( 0.234 -0.792 1.083) 1.362 22.710 ( 0.059 -2.018 -0.144) 2.024 24.098 ( 10.930 14.578 1.646) 18.295 24.207 ( 14.835 13.773 -1.145) 20.275 24.366 ( 12.736 9.812 -0.380) 16.081 24.447 ( 8.969 5.958 -0.370) 10.774 24.601 ( 2.132 4.777 -2.124) 5.645 24.767 ( -0.969 1.961 4.355) 4.874 24.910 ( 8.644 -1.907 -3.426) 9.492 25.058 ( 3.863 -4.484 1.241) 6.048 26.797 ( -0.516 -1.566 0.341) 1.684 26.819 ( -1.128 -2.426 -1.759) 3.202 26.918 ( -0.659 -4.146 3.733) 5.618 26.973 ( 1.476 -5.038 -1.077) 5.359 27.150 ( 0.064 0.568 -1.206) 1.334 27.191 ( -1.596 -1.513 0.654) 2.295 27.301 ( 1.412 -2.258 -0.345) 2.685 27.352 ( 0.158 -4.698 -1.294) 4.876 27.918 ( 1.646 0.945 -1.121) 2.204 27.993 ( 1.970 -2.205 2.879) 4.127 28.385 ( 1.230 3.304 0.375) 3.545 28.456 ( 4.107 -0.185 -0.446) 4.135 28.580 ( -2.034 3.393 -5.362) 6.663 28.657 ( -1.458 0.140 -0.859) 1.698 28.876 ( -6.520 3.883 0.194) 7.591 29.034 ( -1.552 -3.519 3.693) 5.332 29.160 ( -2.318 2.988 2.064) 4.309 29.229 ( -3.761 -1.244 -0.904) 4.063 29.634 ( -4.326 5.584 0.001) 7.064 29.848 ( -2.281 -3.855 -0.162) 4.483 30.652 ( 1.676 3.865 0.763) 4.281 30.713 ( 1.508 0.815 0.027) 1.714 30.982 ( 3.057 5.343 -0.300) 6.163 31.066 ( 5.726 2.029 -0.859) 6.136 33.879 ( 1.246 0.099 0.095) 1.253 33.881 ( 1.359 -0.015 -0.004) 1.359 33.958 ( 0.165 0.252 0.808) 0.862 33.984 ( -0.083 -1.125 -0.581) 1.269 37.181 ( -1.552 -0.291 0.023) 1.579 37.214 ( -1.457 -0.381 0.355) 1.547 37.238 ( -2.001 -2.107 -0.130) 2.908 37.269 ( -1.687 -2.678 -0.384) 3.189 37.704 ( -0.419 3.654 0.040) 3.678 37.760 ( -0.148 1.252 0.400) 1.323 37.781 ( -0.736 0.866 -1.264) 1.700 37.821 ( -1.181 -1.206 0.438) 1.744 48.994 ( -7.412 -1.004 0.556) 7.500 49.029 ( -8.262 -2.022 -1.038) 8.569 49.137 ( -10.693 -0.506 1.461) 10.805 49.270 ( -12.071 -7.822 -1.723) 14.486 50.495 ( -1.317 1.195 -0.461) 1.837 50.556 ( -0.951 -1.202 0.204) 1.546 50.666 ( 0.042 2.042 0.932) 2.245 50.894 ( 3.703 -8.070 0.542) 8.896 52.024 ( 0.011 7.417 0.117) 7.418 52.069 ( 1.042 7.101 0.317) 7.184 52.351 ( -1.638 -7.301 -3.313) 8.183 52.398 ( 0.848 -8.474 2.919) 9.003 52.591 ( -1.094 7.788 0.818) 7.907 52.623 ( -0.868 8.435 -1.474) 8.607 52.967 ( -3.059 -7.816 1.950) 8.617 53.031 ( -2.521 -8.731 -1.584) 9.225 53.876 ( -1.030 1.101 0.692) 1.660 53.893 ( -1.448 0.291 -0.268) 1.501 54.162 ( 1.182 -0.711 2.116) 2.526 54.207 ( 1.198 -2.761 -1.830) 3.522 55.764 ( -0.313 1.382 1.269) 1.902 55.838 ( -0.707 0.291 -0.405) 0.865 55.899 ( 1.674 -2.197 2.733) 3.886 56.031 ( 3.396 -6.786 -3.473) 8.346 57.653 ( -0.364 7.191 -0.233) 7.204 57.753 ( 0.346 7.376 -1.955) 7.639 57.836 ( 0.843 4.696 4.533) 6.581 57.991 ( 2.434 3.642 -3.274) 5.469 58.071 ( 1.593 -2.808 1.036) 3.390 58.155 ( 1.051 -3.158 -0.184) 3.334 58.322 ( 0.884 -7.036 -2.363) 7.475 58.375 ( 3.307 -6.143 2.393) 7.375 61.005 ( -0.356 1.659 0.189) 1.707 61.020 ( -0.532 1.086 0.218) 1.228 61.180 ( 3.053 3.786 0.105) 4.865 61.242 ( 5.431 1.328 -1.023) 5.684 ======================= Grid point 112 (57/90) ======================= q-point: (-0.12 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.534 ( 11.175 28.533 4.428) 30.962 2.939 ( 1.463 21.037 22.413) 30.774 3.179 ( -2.612 22.628 5.017) 23.324 3.555 ( -0.408 8.568 -3.844) 9.400 3.793 ( -10.126 3.347 -8.042) 13.357 3.921 ( -8.299 5.635 2.106) 10.250 3.988 ( -8.761 16.785 -11.639) 22.225 4.602 ( -8.468 -6.203 1.836) 10.657 4.677 ( -6.524 -16.711 8.865) 20.010 4.708 ( -11.004 10.841 2.619) 15.668 4.836 ( 0.717 17.737 -5.712) 18.647 5.013 ( -7.697 -13.885 -2.267) 16.037 5.218 ( 0.967 -0.763 -1.008) 1.592 5.310 ( -4.273 6.042 3.441) 8.161 5.535 ( -4.639 -3.214 -1.297) 5.791 5.880 ( -5.198 11.007 10.285) 15.936 5.922 ( -6.332 -0.041 -2.243) 6.717 6.030 ( 3.534 -14.658 3.569) 15.494 6.088 ( -4.232 2.759 -0.114) 5.053 6.113 ( 1.670 8.763 0.030) 8.920 6.264 ( -3.384 0.556 -3.928) 5.214 6.471 ( 3.583 -4.412 -4.208) 7.072 6.643 ( -1.213 -3.161 -2.045) 3.956 6.886 ( -2.293 -2.953 11.081) 11.695 6.970 ( -2.988 14.858 -3.471) 15.548 7.096 ( -3.057 0.413 -4.304) 5.295 7.265 ( -6.989 16.805 -8.002) 19.882 7.392 ( -4.082 0.913 -5.181) 6.659 7.473 ( 0.086 11.972 1.888) 12.120 7.594 ( 0.169 6.309 -1.633) 6.519 7.687 ( -2.321 14.176 -1.496) 14.443 7.764 ( -2.426 4.501 -4.300) 6.681 7.855 ( -1.471 -2.879 -6.391) 7.162 7.945 ( 1.505 7.560 -2.457) 8.090 8.059 ( 1.947 -2.323 -3.887) 4.929 8.153 ( -0.847 2.897 -1.570) 3.402 8.300 ( -2.864 1.930 2.534) 4.283 8.468 ( 1.298 2.507 8.014) 8.497 8.612 ( 4.105 9.879 2.032) 10.889 8.644 ( -2.099 10.580 6.185) 12.434 8.921 ( -7.012 7.486 1.386) 10.350 9.041 ( -0.245 -0.561 0.321) 0.691 9.127 ( 0.104 -4.493 12.657) 13.431 9.159 ( 3.255 -2.960 -0.237) 4.406 9.396 ( 1.030 -4.652 3.516) 5.921 9.525 ( -5.492 -5.071 -1.989) 7.735 9.606 ( -1.504 -4.282 0.871) 4.621 9.669 ( -5.105 -16.781 1.217) 17.583 10.039 ( -4.062 -3.772 -7.500) 9.326 10.083 ( -1.671 1.293 -8.813) 9.062 10.279 ( -0.268 -19.564 -0.348) 19.569 10.416 ( -3.182 -0.616 3.898) 5.069 10.528 ( -1.799 -11.323 0.108) 11.466 10.577 ( 0.163 2.577 4.753) 5.409 10.789 ( -1.389 -9.612 -1.405) 9.813 10.952 ( 1.513 2.547 -3.996) 4.974 11.079 ( -3.256 -6.210 0.546) 7.033 11.233 ( -0.923 -7.757 2.738) 8.278 11.351 ( -6.591 -10.622 -0.598) 12.515 11.558 ( -0.047 -9.182 -0.918) 9.228 11.649 ( 3.491 8.122 4.349) 9.852 11.858 ( 7.676 5.886 0.945) 9.719 12.093 ( -3.367 -1.793 -5.086) 6.357 12.156 ( -1.502 -0.962 0.989) 2.040 12.255 ( 5.934 7.702 -0.966) 9.771 12.361 ( 2.283 9.526 0.964) 9.843 12.409 ( 0.368 -4.444 0.387) 4.476 12.474 ( -1.907 4.885 -0.494) 5.268 12.674 ( 3.587 -2.523 -0.898) 4.476 12.800 ( 5.953 1.154 0.770) 6.112 12.960 ( -0.658 5.817 -0.428) 5.870 13.022 ( 2.316 2.394 -0.340) 3.348 13.222 ( 1.977 -4.832 -0.674) 5.264 13.443 ( -0.092 -7.856 -2.130) 8.140 13.464 ( 3.442 -9.288 2.162) 10.138 13.554 ( -0.096 -13.801 0.473) 13.809 13.973 ( 5.251 3.480 1.196) 6.412 14.139 ( 4.243 4.075 -0.897) 5.951 14.167 ( 2.121 -4.662 0.609) 5.158 14.281 ( 0.255 -1.632 0.597) 1.757 16.034 ( 3.632 -4.389 0.369) 5.709 16.192 ( 2.735 -11.255 -0.026) 11.582 16.385 ( -9.335 -5.547 -0.109) 10.859 16.514 ( -8.495 -11.391 -0.032) 14.210 18.337 ( -0.759 5.422 -0.413) 5.490 18.364 ( -2.203 3.900 0.754) 4.542 18.970 ( 3.103 7.733 -0.623) 8.355 19.010 ( 2.737 5.866 -0.996) 6.549 20.247 ( -0.540 1.517 0.698) 1.755 20.286 ( -0.309 -0.784 -0.426) 0.944 20.642 ( 1.116 5.528 -0.846) 5.702 20.685 ( -0.084 8.466 1.100) 8.538 20.822 ( 2.254 -4.999 -0.679) 5.525 20.873 ( 0.465 -2.180 0.211) 2.239 21.149 ( -2.975 -10.242 -0.473) 10.676 21.180 ( -3.792 -11.121 0.771) 11.775 22.468 ( -0.790 0.563 -1.186) 1.532 22.505 ( -0.786 -1.330 0.173) 1.555 22.692 ( 0.181 -0.745 1.040) 1.292 22.711 ( 0.163 -1.724 -0.130) 1.736 24.325 ( 9.169 14.340 2.072) 17.146 24.463 ( 6.573 7.846 0.657) 10.257 24.505 ( 0.819 12.451 1.844) 12.613 24.652 ( 13.203 15.023 -5.426) 20.723 24.700 ( 5.859 0.893 -3.992) 7.146 24.742 ( -1.757 6.673 3.446) 7.713 25.108 ( 6.828 -6.869 0.679) 9.709 25.160 ( 7.013 -7.041 -0.475) 9.949 26.766 ( -2.360 -1.525 1.437) 3.156 26.806 ( 0.366 -2.674 -2.272) 3.528 26.899 ( -1.828 -1.111 3.908) 4.455 26.982 ( -0.150 -4.071 -1.238) 4.257 27.169 ( 1.316 -0.651 -0.873) 1.708 27.185 ( 1.597 -1.958 -0.529) 2.581 27.311 ( -1.038 -4.180 1.018) 4.425 27.360 ( 1.000 -5.975 -2.134) 6.423 27.981 ( 4.450 1.310 -0.528) 4.669 28.031 ( 0.564 -0.622 2.955) 3.072 28.379 ( -1.859 4.014 0.325) 4.435 28.476 ( -1.974 -0.094 -4.548) 4.959 28.598 ( 3.954 1.330 -0.520) 4.204 28.637 ( 1.896 -0.330 -0.016) 1.924 28.752 ( -5.203 4.878 1.249) 7.241 28.943 ( -6.942 -3.672 0.817) 7.895 29.124 ( -2.302 2.011 1.523) 3.415 29.197 ( 0.699 -1.881 0.257) 2.023 29.571 ( -0.913 4.402 -0.508) 4.525 29.772 ( -4.751 -5.430 -0.944) 7.276 30.676 ( 0.425 4.319 1.663) 4.647 30.744 ( 1.256 1.330 0.170) 1.837 31.050 ( 3.104 6.353 -0.770) 7.113 31.185 ( 5.107 0.321 -3.612) 6.264 33.901 ( 0.805 0.439 0.561) 1.075 33.919 ( 1.909 -0.295 -0.307) 1.956 33.965 ( 0.179 -0.168 0.611) 0.658 33.978 ( -0.340 -0.860 -0.430) 1.020 37.154 ( -0.920 -0.586 0.101) 1.095 37.181 ( -1.584 -0.517 -0.084) 1.669 37.196 ( -1.378 -1.921 -0.125) 2.368 37.238 ( -1.281 -3.262 0.065) 3.505 37.701 ( 0.228 3.382 -0.024) 3.389 37.743 ( -1.199 1.901 0.136) 2.252 37.777 ( 0.463 0.757 -1.056) 1.380 37.795 ( -1.252 -0.412 0.410) 1.380 48.855 ( -5.170 -0.742 -0.249) 5.229 48.872 ( -6.240 -1.262 0.610) 6.395 48.933 ( -7.749 -0.018 -0.192) 7.751 49.001 ( -11.507 -3.588 -0.850) 12.083 50.487 ( 0.531 0.790 1.984) 2.201 50.547 ( -0.033 -1.863 3.232) 3.730 50.667 ( -0.138 3.037 -0.187) 3.046 50.951 ( 1.385 -10.216 -1.394) 10.404 52.028 ( 0.300 7.496 0.404) 7.513 52.087 ( 0.515 7.121 -0.256) 7.144 52.327 ( 0.024 -6.087 -0.926) 6.157 52.407 ( -0.550 -8.355 1.223) 8.462 52.572 ( -0.820 6.902 0.567) 6.973 52.606 ( -0.332 7.743 -1.342) 7.866 52.905 ( -2.853 -7.075 1.626) 7.800 52.978 ( -1.867 -8.099 -1.653) 8.475 53.858 ( -0.776 1.092 0.355) 1.386 53.867 ( -0.889 0.675 -0.301) 1.156 54.184 ( 0.288 -0.612 1.757) 1.883 54.227 ( 1.027 -2.624 -1.318) 3.111 55.764 ( -0.132 1.906 1.359) 2.345 55.825 ( -0.279 1.427 -0.839) 1.679 55.932 ( 0.518 -3.144 3.507) 4.738 56.086 ( 2.672 -8.741 -3.779) 9.890 57.651 ( 0.162 7.202 0.194) 7.206 57.745 ( -0.374 7.473 -2.681) 7.948 57.863 ( 0.310 2.463 4.619) 5.244 58.025 ( 1.572 0.597 -3.639) 4.009 58.130 ( 2.592 -3.972 2.779) 5.497 58.178 ( 1.510 -4.716 0.270) 4.959 58.327 ( 0.369 -1.691 -1.984) 2.633 58.439 ( 1.822 -5.656 0.373) 5.954 61.005 ( 0.140 1.535 0.394) 1.591 61.015 ( -0.143 1.153 0.410) 1.232 61.237 ( 2.118 4.584 0.506) 5.075 61.347 ( 4.458 -0.458 -2.692) 5.228 ======================= Grid point 113 (58/90) ======================= q-point: ( 0.00 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.148 ( 3.374 -9.818 6.434) 12.213 3.148 ( 3.374 9.818 6.434) 12.213 3.564 ( -3.260 -13.825 -7.853) 16.230 3.564 ( -3.260 13.825 -7.853) 16.230 3.965 ( 0.893 -4.294 7.171) 8.405 3.965 ( 0.893 4.294 7.171) 8.405 4.140 ( 0.768 -9.864 9.690) 13.848 4.140 ( 0.768 9.864 9.690) 13.848 4.491 ( 3.548 -13.519 4.992) 14.841 4.491 ( 3.548 13.519 4.992) 14.841 5.026 ( -4.139 -17.935 -9.946) 20.922 5.026 ( -4.139 17.935 -9.946) 20.922 5.263 ( 1.240 -14.682 -2.765) 14.992 5.263 ( 1.240 14.682 -2.765) 14.992 5.442 ( 0.028 -8.701 -6.303) 10.744 5.442 ( 0.028 8.701 -6.303) 10.744 5.845 ( -7.118 -5.056 12.249) 15.042 5.845 ( -7.118 5.056 12.249) 15.042 6.284 ( 3.038 -0.635 -3.708) 4.836 6.284 ( 3.038 0.635 -3.708) 4.836 6.441 ( 8.444 -6.931 1.887) 11.086 6.441 ( 8.444 6.931 1.887) 11.086 6.635 ( -3.077 -4.445 -0.060) 5.406 6.635 ( -3.077 4.445 -0.060) 5.406 7.131 ( -1.234 -7.041 -0.062) 7.148 7.131 ( -1.234 7.041 -0.062) 7.148 7.283 ( -4.633 -8.926 -6.285) 11.859 7.283 ( -4.633 8.926 -6.285) 11.859 7.531 ( -0.266 -8.850 0.011) 8.854 7.531 ( -0.266 8.850 0.011) 8.854 7.733 ( 3.267 -7.189 -5.564) 9.660 7.733 ( 3.267 7.189 -5.564) 9.660 8.057 ( -2.957 -3.218 -0.765) 4.437 8.057 ( -2.957 3.218 -0.765) 4.437 8.224 ( 2.636 -6.533 -9.592) 11.901 8.224 ( 2.636 6.533 -9.592) 11.901 8.552 ( 0.431 -31.000 6.450) 31.667 8.552 ( 0.431 31.000 6.450) 31.667 8.779 ( -2.246 -4.226 0.868) 4.864 8.779 ( -2.246 4.226 0.868) 4.864 8.917 ( -2.050 -5.373 9.546) 11.145 8.917 ( -2.050 5.373 9.546) 11.145 9.165 ( 7.816 -3.901 0.696) 8.763 9.165 ( 7.816 3.901 0.696) 8.763 9.330 ( 0.568 -14.834 0.868) 14.870 9.330 ( 0.568 14.834 0.868) 14.870 9.479 ( -3.225 -16.714 7.864) 18.751 9.479 ( -3.225 16.714 7.864) 18.751 9.841 ( -2.078 -18.683 -5.557) 19.602 9.841 ( -2.078 18.683 -5.557) 19.602 10.108 ( 1.589 -1.059 -7.534) 7.772 10.108 ( 1.589 1.059 -7.534) 7.772 10.624 ( -2.360 -3.339 0.409) 4.109 10.624 ( -2.360 3.339 0.409) 4.109 10.786 ( 1.869 -10.477 3.399) 11.171 10.786 ( 1.869 10.477 3.399) 11.171 11.084 ( 0.745 -7.150 2.860) 7.736 11.084 ( 0.745 7.150 2.860) 7.736 11.313 ( -0.593 -10.796 -2.750) 11.157 11.313 ( -0.593 10.796 -2.750) 11.157 11.920 ( -0.749 -8.095 0.854) 8.174 11.920 ( -0.749 8.095 0.854) 8.174 12.078 ( 1.297 -2.868 -0.753) 3.237 12.078 ( 1.297 2.868 -0.753) 3.237 12.394 ( -0.898 -2.755 -0.476) 2.937 12.394 ( -0.898 2.755 -0.476) 2.937 12.487 ( 0.228 -4.423 -0.843) 4.509 12.487 ( 0.228 4.423 -0.843) 4.509 12.833 ( 0.449 -6.667 0.728) 6.721 12.833 ( 0.449 6.667 0.728) 6.721 13.058 ( -0.416 -2.468 -0.688) 2.596 13.058 ( -0.416 2.468 -0.688) 2.596 13.269 ( 0.118 -6.332 1.247) 6.455 13.269 ( 0.118 6.332 1.247) 6.455 13.361 ( -0.252 -2.889 -0.785) 3.004 13.361 ( -0.252 2.889 -0.785) 3.004 14.091 ( 0.069 -2.562 0.228) 2.573 14.091 ( 0.069 2.562 0.228) 2.573 14.281 ( 0.163 -0.461 0.198) 0.528 14.281 ( 0.163 0.461 0.198) 0.528 16.105 ( -0.119 -0.586 0.319) 0.677 16.105 ( -0.119 0.586 0.319) 0.677 16.214 ( -0.010 -1.301 -0.196) 1.316 16.214 ( -0.010 1.301 -0.196) 1.316 18.384 ( -0.167 -0.172 0.317) 0.397 18.384 ( -0.167 0.172 0.317) 0.397 19.093 ( 0.494 -0.850 -1.142) 1.507 19.093 ( 0.494 0.850 -1.142) 1.507 20.276 ( -0.292 -1.008 0.359) 1.110 20.276 ( -0.292 1.008 0.359) 1.110 20.752 ( 0.308 -0.620 -0.184) 0.717 20.752 ( 0.308 0.620 -0.184) 0.717 20.874 ( -0.529 -5.065 -0.904) 5.172 20.874 ( -0.529 5.065 -0.904) 5.172 20.944 ( 0.251 -2.773 1.019) 2.965 20.944 ( 0.251 2.773 1.019) 2.965 22.472 ( 0.061 -0.399 -0.498) 0.641 22.472 ( 0.061 0.399 -0.498) 0.641 22.692 ( -0.047 -0.514 0.416) 0.663 22.692 ( -0.047 0.514 0.416) 0.663 24.563 ( -0.873 -3.041 1.218) 3.390 24.563 ( -0.873 3.041 1.218) 3.390 24.720 ( 2.579 -5.867 -2.345) 6.824 24.720 ( 2.579 5.867 -2.345) 6.824 24.925 ( -4.378 -12.059 4.156) 13.485 24.925 ( -4.378 12.059 4.156) 13.485 25.110 ( 2.899 -10.388 -3.538) 11.350 25.110 ( 2.899 10.388 -3.538) 11.350 26.742 ( -0.371 -2.231 0.939) 2.449 26.742 ( -0.371 2.231 0.939) 2.449 26.918 ( 0.413 -2.358 -0.156) 2.399 26.918 ( 0.413 2.358 -0.156) 2.399 27.196 ( 1.520 -0.258 -0.508) 1.623 27.196 ( 1.520 0.258 -0.508) 1.623 27.254 ( -1.633 -3.653 -0.529) 4.036 27.254 ( -1.633 3.653 -0.529) 4.036 28.048 ( -0.151 -1.112 1.718) 2.052 28.048 ( -0.151 1.112 1.718) 2.052 28.404 ( -0.267 -2.698 -2.241) 3.517 28.404 ( -0.267 2.698 -2.241) 3.517 28.679 ( -0.477 -1.658 2.225) 2.816 28.679 ( -0.477 1.658 2.225) 2.816 28.791 ( 2.401 -3.696 -0.983) 4.516 28.791 ( 2.401 3.696 -0.983) 4.516 29.140 ( -1.439 -2.153 0.739) 2.693 29.140 ( -1.439 2.153 0.739) 2.693 29.618 ( -0.106 -1.874 -1.055) 2.153 29.618 ( -0.106 1.874 -1.055) 2.153 30.757 ( 0.190 -1.780 1.426) 2.289 30.757 ( 0.190 1.780 1.426) 2.289 31.183 ( -0.453 -3.134 -2.470) 4.016 31.183 ( -0.453 3.134 -2.470) 4.016 33.928 ( 0.011 -0.788 0.061) 0.791 33.928 ( 0.011 0.788 0.061) 0.791 33.962 ( -0.064 -0.141 -0.054) 0.164 33.962 ( -0.064 0.141 -0.054) 0.164 37.150 ( 0.128 -0.982 0.266) 1.026 37.150 ( 0.128 0.982 0.266) 1.026 37.171 ( -0.069 -1.233 -0.185) 1.248 37.171 ( -0.069 1.233 -0.185) 1.248 37.752 ( -0.009 -0.790 0.105) 0.797 37.752 ( -0.009 0.790 0.105) 0.797 37.778 ( 0.054 -0.856 -0.250) 0.893 37.778 ( 0.054 0.856 -0.250) 0.893 48.802 ( 0.060 -0.896 0.155) 0.911 48.802 ( 0.060 0.896 0.155) 0.911 48.847 ( -0.073 -0.614 -0.157) 0.638 48.847 ( -0.073 0.614 -0.157) 0.638 50.535 ( 1.409 -1.868 4.710) 5.259 50.535 ( 1.409 1.868 4.710) 5.259 50.756 ( -1.205 -6.803 -3.340) 7.673 50.756 ( -1.205 6.803 -3.340) 7.673 52.182 ( -0.435 -4.396 -0.397) 4.436 52.182 ( -0.435 4.396 -0.397) 4.436 52.248 ( 0.481 -3.977 0.640) 4.057 52.248 ( 0.481 3.977 0.640) 4.057 52.705 ( 0.297 -5.697 -0.048) 5.705 52.705 ( 0.297 5.697 -0.048) 5.705 52.791 ( -0.315 -6.646 -0.433) 6.667 52.791 ( -0.315 6.646 -0.433) 6.667 53.863 ( -0.111 -0.276 0.004) 0.297 53.863 ( -0.111 0.276 0.004) 0.297 54.196 ( -0.007 -1.428 0.048) 1.428 54.196 ( -0.007 1.428 0.048) 1.428 55.811 ( -0.432 -2.375 1.454) 2.818 55.811 ( -0.432 2.375 1.454) 2.818 55.962 ( 0.436 -5.104 -1.455) 5.325 55.962 ( 0.436 5.104 -1.455) 5.325 57.789 ( 0.202 -3.534 0.285) 3.552 57.789 ( 0.202 3.534 0.285) 3.552 57.930 ( -0.550 -5.206 -1.759) 5.523 57.930 ( -0.550 5.206 -1.759) 5.523 58.135 ( 0.662 -1.431 2.820) 3.231 58.135 ( 0.662 1.431 2.820) 3.231 58.371 ( -0.324 -2.137 -1.279) 2.512 58.371 ( -0.324 2.137 -1.279) 2.512 61.027 ( 0.035 -0.138 0.560) 0.578 61.027 ( 0.035 0.138 0.560) 0.578 61.341 ( -0.045 -2.997 -1.089) 3.189 61.341 ( -0.045 2.997 -1.089) 3.189 ======================= Grid point 115 (59/90) ======================= q-point: ( 0.12 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.150 ( -4.584 -3.921 10.582) 12.181 3.150 ( -4.584 3.921 10.582) 12.181 3.431 ( -4.885 -14.417 -13.063) 20.059 3.431 ( -4.885 14.417 -13.063) 20.059 4.084 ( 8.828 -20.120 5.833) 22.732 4.084 ( 8.828 20.120 5.833) 22.732 4.303 ( 10.017 -9.451 12.814) 18.811 4.303 ( 10.017 9.451 12.814) 18.811 4.682 ( 9.918 -9.582 7.743) 15.816 4.682 ( 9.918 9.582 7.743) 15.816 4.904 ( -3.204 -16.882 -16.507) 23.828 4.904 ( -3.204 16.882 -16.507) 23.828 5.239 ( 1.675 -15.293 -8.400) 17.528 5.239 ( 1.675 15.293 -8.400) 17.528 5.617 ( 13.758 -4.487 2.782) 14.736 5.617 ( 13.758 4.487 2.782) 14.736 5.753 ( -3.592 -6.077 9.900) 12.159 5.753 ( -3.592 6.077 9.900) 12.159 6.353 ( 2.031 -2.874 0.275) 3.530 6.353 ( 2.031 2.874 0.275) 3.530 6.462 ( -5.296 -3.906 -8.720) 10.925 6.462 ( -5.296 3.906 -8.720) 10.925 6.685 ( 7.148 -7.639 6.321) 12.223 6.685 ( 7.148 7.639 6.321) 12.223 7.123 ( -0.884 -5.046 0.168) 5.125 7.123 ( -0.884 5.046 0.168) 5.125 7.280 ( 5.107 -10.999 -3.246) 12.553 7.280 ( 5.107 10.999 -3.246) 12.553 7.529 ( 2.010 -5.459 -1.809) 6.092 7.529 ( 2.010 5.459 -1.809) 6.092 7.740 ( -2.268 -7.274 -2.641) 8.064 7.740 ( -2.268 7.274 -2.641) 8.064 7.997 ( -1.160 -6.627 -3.163) 7.434 7.997 ( -1.160 6.627 -3.163) 7.434 8.263 ( 3.541 -11.045 -8.400) 14.321 8.263 ( 3.541 11.045 -8.400) 14.321 8.583 ( 0.218 -18.479 7.945) 20.116 8.583 ( 0.218 18.479 7.945) 20.116 8.769 ( 0.612 -9.150 -2.599) 9.531 8.769 ( 0.612 9.150 -2.599) 9.531 8.898 ( -0.035 -12.214 6.650) 13.907 8.898 ( -0.035 12.214 6.650) 13.907 9.264 ( 0.676 -5.388 7.121) 8.955 9.264 ( 0.676 5.388 7.121) 8.955 9.423 ( 8.756 -7.578 -3.357) 12.056 9.423 ( 8.756 7.578 -3.357) 12.056 9.518 ( 3.918 -15.592 5.221) 16.904 9.518 ( 3.918 15.592 5.221) 16.904 9.828 ( 2.183 -21.225 -3.219) 21.578 9.828 ( 2.183 21.225 -3.219) 21.578 10.159 ( 4.753 -3.372 -6.508) 8.736 10.159 ( 4.753 3.372 -6.508) 8.736 10.586 ( -1.267 -4.398 1.728) 4.892 10.586 ( -1.267 4.398 1.728) 4.892 10.832 ( 1.320 -10.052 2.223) 10.379 10.832 ( 1.320 10.052 2.223) 10.379 11.153 ( 2.232 -11.153 1.300) 11.448 11.153 ( 2.232 11.153 1.300) 11.448 11.279 ( 0.554 -11.550 -2.080) 11.749 11.279 ( 0.554 11.550 -2.080) 11.749 11.872 ( -3.389 -2.847 1.879) 4.808 11.872 ( -3.389 2.847 1.879) 4.808 12.087 ( -1.138 -5.878 -1.873) 6.274 12.087 ( -1.138 5.879 -1.873) 6.274 12.351 ( -2.687 -1.683 0.432) 3.200 12.351 ( -2.687 1.683 0.432) 3.200 12.490 ( -0.049 -6.284 -0.921) 6.352 12.490 ( -0.049 6.284 -0.921) 6.352 12.764 ( -6.062 -5.936 -0.121) 8.485 12.764 ( -6.062 5.936 -0.121) 8.485 13.045 ( -0.946 -2.943 -0.025) 3.092 13.045 ( -0.946 2.943 -0.025) 3.092 13.260 ( -1.261 -7.760 0.584) 7.884 13.260 ( -1.261 7.760 0.584) 7.884 13.351 ( -0.476 -5.545 -0.266) 5.572 13.351 ( -0.476 5.545 -0.266) 5.572 14.058 ( -3.234 -3.543 0.291) 4.806 14.058 ( -3.234 3.543 0.291) 4.806 14.238 ( -4.207 -3.281 0.026) 5.335 14.238 ( -4.207 3.281 0.026) 5.335 16.025 ( -3.712 -4.071 0.160) 5.512 16.025 ( -3.712 4.071 0.160) 5.512 16.362 ( 9.915 -3.235 -0.064) 10.429 16.362 ( 9.915 3.235 -0.064) 10.429 18.396 ( 1.407 -0.900 0.196) 1.681 18.396 ( 1.407 0.900 0.196) 1.681 19.072 ( -2.267 -0.444 -0.862) 2.466 19.072 ( -2.267 0.444 -0.862) 2.466 20.269 ( -0.310 -0.915 0.211) 0.989 20.269 ( -0.310 0.915 0.211) 0.989 20.705 ( -3.561 -1.730 -0.321) 3.972 20.705 ( -3.561 1.730 -0.321) 3.972 20.903 ( 2.530 -9.871 -0.145) 10.191 20.903 ( 2.530 9.871 -0.145) 10.191 20.983 ( 2.863 -8.089 0.428) 8.591 20.983 ( 2.863 8.089 0.428) 8.591 22.483 ( 1.005 -0.838 -0.492) 1.398 22.483 ( 1.005 0.838 -0.492) 1.398 22.689 ( -0.333 -0.694 0.423) 0.878 22.689 ( -0.333 0.694 0.423) 0.878 24.490 ( -6.904 -5.692 0.690) 8.974 24.490 ( -6.904 5.692 0.690) 8.974 24.712 ( -4.605 -1.171 -0.202) 4.756 24.712 ( -4.605 1.171 -0.202) 4.756 24.814 ( -4.925 -8.292 -0.101) 9.645 24.814 ( -4.925 8.292 -0.101) 9.645 25.045 ( -6.661 -9.936 -0.681) 11.982 25.045 ( -6.661 9.936 -0.681) 11.982 26.751 ( 0.841 -2.660 0.757) 2.891 26.751 ( 0.841 2.660 0.757) 2.891 26.932 ( 0.380 -2.913 -0.154) 2.941 26.932 ( 0.380 2.913 -0.154) 2.941 27.204 ( -1.007 -1.147 1.398) 2.070 27.204 ( -1.007 1.147 1.398) 2.070 27.233 ( 0.674 -3.355 -2.316) 4.132 27.233 ( 0.674 3.355 -2.316) 4.132 28.011 ( -3.264 -2.660 1.417) 4.443 28.011 ( -3.264 2.660 1.417) 4.443 28.421 ( 1.488 -2.871 -1.422) 3.532 28.421 ( 1.488 2.871 -1.422) 3.532 28.649 ( -1.213 -1.232 -0.731) 1.877 28.649 ( -1.213 1.232 -0.731) 1.877 28.908 ( 6.797 -4.405 0.682) 8.128 28.908 ( 6.797 4.405 0.682) 8.128 29.113 ( -0.727 -0.229 1.011) 1.266 29.113 ( -0.727 0.229 1.011) 1.266 29.655 ( 3.532 -4.348 -0.686) 5.644 29.655 ( 3.532 4.348 -0.686) 5.644 30.755 ( -0.935 -1.216 1.185) 1.938 30.755 ( -0.935 1.216 1.185) 1.938 31.127 ( -3.803 -2.038 -1.837) 4.690 31.127 ( -3.803 2.038 -1.837) 4.690 33.910 ( -1.442 -0.459 0.007) 1.513 33.910 ( -1.442 0.459 0.007) 1.513 33.966 ( 0.187 -0.767 0.045) 0.791 33.966 ( 0.187 0.767 0.045) 0.791 37.162 ( 0.959 -0.747 0.056) 1.217 37.162 ( 0.959 0.747 0.056) 1.217 37.190 ( 1.765 -1.324 -0.046) 2.206 37.190 ( 1.765 1.324 -0.046) 2.206 37.755 ( 0.263 -1.311 0.067) 1.338 37.755 ( 0.263 1.311 0.067) 1.338 37.784 ( 0.514 -1.532 -0.192) 1.627 37.784 ( 0.514 1.532 -0.192) 1.627 48.855 ( 5.137 -0.547 0.201) 5.170 48.855 ( 5.137 0.547 0.201) 5.170 48.945 ( 8.474 -0.424 -0.312) 8.490 48.945 ( 8.474 0.424 -0.312) 8.490 50.582 ( 1.359 -3.158 4.597) 5.741 50.582 ( 1.359 3.158 4.597) 5.741 50.714 ( -1.506 -5.013 -3.520) 6.308 50.714 ( -1.506 5.013 -3.520) 6.308 52.167 ( -0.882 -3.354 -0.062) 3.468 52.167 ( -0.882 3.354 -0.062) 3.468 52.260 ( 0.575 -3.869 0.275) 3.921 52.260 ( 0.575 3.869 0.275) 3.921 52.723 ( 1.355 -7.213 -0.104) 7.340 52.723 ( 1.355 7.213 -0.104) 7.340 52.804 ( 1.563 -8.028 -0.279) 8.183 52.804 ( 1.563 8.028 -0.279) 8.183 53.868 ( 0.532 -0.529 0.059) 0.752 53.868 ( 0.532 0.529 0.059) 0.752 54.188 ( -0.719 -1.953 0.021) 2.081 54.188 ( -0.719 1.953 0.021) 2.081 55.802 ( -0.745 -2.406 1.317) 2.842 55.802 ( -0.745 2.406 1.317) 2.842 55.958 ( -0.448 -5.055 -1.324) 5.244 55.958 ( -0.448 5.055 -1.324) 5.244 57.791 ( -0.072 -1.586 0.108) 1.591 57.791 ( -0.072 1.586 0.108) 1.591 57.920 ( 0.035 -2.665 -1.042) 2.861 57.920 ( 0.035 2.665 -1.042) 2.861 58.144 ( -0.514 -2.701 2.165) 3.500 58.144 ( -0.514 2.701 2.165) 3.500 58.331 ( -2.924 -0.823 -1.188) 3.262 58.331 ( -2.924 0.823 -1.188) 3.262 61.028 ( -0.010 -0.271 0.452) 0.527 61.028 ( -0.010 0.271 0.452) 0.527 61.306 ( -2.853 -1.967 -0.853) 3.569 61.306 ( -2.853 1.967 -0.853) 3.569 ======================= Grid point 117 (60/90) ======================= q-point: ( 0.25 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.054 ( -5.740 -4.665 5.097) 8.983 3.054 ( -5.740 4.665 5.097) 8.983 3.337 ( -1.225 -10.931 -8.655) 13.996 3.337 ( -1.225 10.931 -8.655) 13.996 4.330 ( 11.799 -14.558 3.277) 19.023 4.330 ( 11.799 14.558 3.277) 19.023 4.544 ( 6.124 -8.774 9.203) 14.113 4.544 ( 6.124 8.774 9.203) 14.113 4.774 ( 5.580 -9.650 -4.906) 12.179 4.774 ( 5.580 9.650 -4.906) 12.179 4.969 ( 9.463 -4.593 -1.612) 10.642 4.969 ( 9.463 4.594 -1.612) 10.642 5.304 ( 3.987 -14.005 -7.401) 16.335 5.304 ( 3.987 14.005 -7.401) 16.335 5.750 ( 2.751 -3.813 10.618) 11.612 5.750 ( 2.751 3.813 10.618) 11.612 5.939 ( 9.711 -3.579 -2.115) 10.564 5.939 ( 9.711 3.579 -2.115) 10.564 6.258 ( -1.212 -4.107 -2.784) 5.108 6.258 ( -1.212 4.107 -2.784) 5.108 6.423 ( -2.054 -13.181 2.338) 13.544 6.423 ( -2.054 13.181 2.338) 13.544 6.791 ( -0.809 -11.503 1.077) 11.582 6.791 ( -0.809 11.503 1.077) 11.582 7.118 ( 2.627 -1.238 3.828) 4.805 7.118 ( 2.627 1.238 3.828) 4.805 7.371 ( 2.187 -2.521 -2.385) 4.102 7.371 ( 2.187 2.521 -2.385) 4.102 7.557 ( -4.852 -6.230 -3.308) 8.562 7.557 ( -4.852 6.230 -3.308) 8.562 7.739 ( 7.780 -3.711 3.846) 9.439 7.739 ( 7.780 3.711 3.846) 9.439 8.014 ( 4.592 -7.407 -4.646) 9.876 8.014 ( 4.592 7.407 -4.646) 9.876 8.330 ( 4.865 -8.958 -7.370) 12.579 8.330 ( 4.865 8.958 -7.370) 12.579 8.595 ( -1.312 -14.006 5.869) 15.243 8.595 ( -1.312 14.006 5.869) 15.243 8.765 ( 0.794 -5.092 -3.998) 6.523 8.765 ( 0.794 5.092 -3.998) 6.523 8.987 ( 5.988 -7.488 3.514) 10.212 8.987 ( 5.988 7.489 3.514) 10.212 9.317 ( 3.381 -8.466 6.645) 11.281 9.317 ( 3.381 8.466 6.645) 11.281 9.565 ( 5.793 -8.767 -0.976) 10.553 9.565 ( 5.793 8.767 -0.976) 10.553 9.666 ( 8.559 -10.439 -5.872) 14.721 9.666 ( 8.559 10.439 -5.872) 14.721 9.904 ( 4.731 -18.569 3.459) 19.472 9.904 ( 4.731 18.569 3.459) 19.472 10.241 ( 3.569 -1.248 -3.766) 5.337 10.241 ( 3.569 1.248 -3.766) 5.337 10.572 ( -1.653 -4.983 3.148) 6.122 10.572 ( -1.653 4.983 3.148) 6.122 10.843 ( -0.232 -13.960 -0.266) 13.965 10.843 ( -0.232 13.960 -0.266) 13.965 11.104 ( -3.680 -14.032 0.528) 14.516 11.104 ( -3.680 14.032 0.528) 14.516 11.386 ( 6.514 -11.622 -1.223) 13.379 11.386 ( 6.514 11.622 -1.223) 13.379 11.800 ( -3.703 -0.128 0.929) 3.820 11.800 ( -3.703 0.128 0.929) 3.820 12.017 ( -4.705 -12.063 -0.457) 12.956 12.017 ( -4.705 12.063 -0.457) 12.956 12.301 ( -3.405 -2.354 2.408) 4.789 12.301 ( -3.405 2.354 2.408) 4.789 12.449 ( -2.924 -8.699 -0.925) 9.224 12.449 ( -2.924 8.699 -0.925) 9.224 12.649 ( -3.425 -4.482 -2.482) 6.163 12.649 ( -3.425 4.482 -2.482) 6.163 13.011 ( -2.464 -4.201 0.620) 4.910 13.011 ( -2.464 4.201 0.620) 4.910 13.232 ( -0.947 -8.511 0.152) 8.565 13.232 ( -0.947 8.511 0.152) 8.565 13.336 ( -1.036 -3.853 0.251) 3.998 13.336 ( -1.036 3.853 0.251) 3.998 13.963 ( -5.661 -6.451 0.517) 8.598 13.963 ( -5.661 6.451 0.517) 8.598 14.116 ( -7.005 -5.846 -0.531) 9.139 14.116 ( -7.005 5.846 -0.531) 9.139 15.978 ( -0.980 -3.768 0.335) 3.908 15.978 ( -0.980 3.768 0.335) 3.908 16.572 ( 9.547 -2.104 -0.307) 9.781 16.572 ( 9.547 2.104 -0.307) 9.781 18.450 ( 3.852 -1.611 -0.057) 4.175 18.450 ( 3.852 1.611 -0.057) 4.175 18.993 ( -5.138 -0.741 -0.224) 5.196 18.993 ( -5.138 0.741 -0.224) 5.196 20.276 ( 1.205 -0.314 -0.176) 1.258 20.276 ( 1.205 0.314 -0.176) 1.258 20.626 ( -3.851 -1.814 -0.219) 4.262 20.626 ( -3.851 1.814 -0.219) 4.262 20.964 ( 3.077 -11.638 0.495) 12.049 20.964 ( 3.077 11.638 0.495) 12.049 21.047 ( 3.003 -11.307 -0.210) 11.701 21.047 ( 3.003 11.307 -0.210) 11.701 22.504 ( 1.026 -1.895 -0.492) 2.210 22.504 ( 1.026 1.895 -0.492) 2.210 22.683 ( -0.303 -0.787 0.473) 0.967 22.683 ( -0.303 0.787 0.473) 0.967 24.284 ( -11.714 -7.908 0.915) 14.163 24.284 ( -11.714 7.908 0.915) 14.163 24.495 ( -14.356 -0.775 -1.245) 14.431 24.495 ( -14.356 0.775 -1.245) 14.431 24.749 ( -1.884 -3.763 0.005) 4.208 24.749 ( -1.884 3.763 0.005) 4.208 24.938 ( -2.603 -3.428 0.296) 4.314 24.938 ( -2.603 3.428 0.296) 4.314 26.772 ( 0.749 -2.226 0.322) 2.370 26.772 ( 0.749 2.226 0.322) 2.370 26.915 ( -1.775 -3.371 -0.168) 3.813 26.915 ( -1.775 3.371 -0.168) 3.813 27.199 ( 0.149 -0.129 2.151) 2.160 27.199 ( 0.149 0.129 2.151) 2.160 27.253 ( 1.861 -2.481 -2.638) 4.071 27.253 ( 1.861 2.481 -2.638) 4.071 27.945 ( -2.910 -2.980 0.935) 4.269 27.945 ( -2.910 2.980 0.935) 4.269 28.427 ( -1.179 -1.976 -0.035) 2.301 28.427 ( -1.179 1.976 -0.035) 2.301 28.629 ( 0.156 -1.830 -2.828) 3.372 28.629 ( 0.156 1.830 -2.828) 3.372 29.053 ( 6.432 -3.705 1.042) 7.496 29.053 ( 6.432 3.705 1.042) 7.496 29.127 ( 1.471 -0.743 1.264) 2.077 29.127 ( 1.471 0.743 1.264) 2.077 29.741 ( 4.303 -5.118 -0.193) 6.690 29.741 ( 4.303 5.118 -0.193) 6.690 30.721 ( -2.463 -1.288 0.552) 2.833 30.721 ( -2.463 1.288 0.552) 2.833 31.041 ( -3.535 -1.413 -0.697) 3.870 31.041 ( -3.535 1.413 -0.697) 3.870 33.879 ( -1.357 -0.244 0.026) 1.379 33.879 ( -1.357 0.244 0.026) 1.379 33.967 ( -0.006 -0.842 0.052) 0.844 33.967 ( -0.006 0.842 0.052) 0.844 37.189 ( 1.419 -0.608 0.197) 1.556 37.189 ( 1.419 0.608 0.197) 1.556 37.232 ( 2.110 -1.622 -0.247) 2.673 37.232 ( 2.110 1.622 -0.247) 2.673 37.763 ( 0.438 -2.008 -0.012) 2.056 37.763 ( 0.438 2.008 -0.012) 2.056 37.796 ( 0.583 -2.028 -0.078) 2.111 37.796 ( 0.583 2.028 -0.078) 2.111 48.997 ( 7.615 -1.052 0.244) 7.691 48.997 ( 7.615 1.052 0.244) 7.691 49.154 ( 10.615 -1.735 -0.404) 10.764 49.154 ( 10.615 1.735 -0.404) 10.764 50.601 ( -0.269 -2.307 0.930) 2.502 50.601 ( -0.269 2.307 0.930) 2.502 50.689 ( -0.396 -2.113 -0.474) 2.201 50.689 ( -0.396 2.113 -0.474) 2.201 52.149 ( -0.788 -5.502 0.338) 5.569 52.149 ( -0.788 5.502 0.338) 5.569 52.272 ( 0.516 -8.037 -0.278) 8.059 52.272 ( 0.516 8.037 -0.278) 8.059 52.754 ( 1.499 -7.781 -0.456) 7.937 52.754 ( 1.499 7.781 -0.456) 7.937 52.846 ( 2.276 -8.602 0.309) 8.904 52.846 ( 2.276 8.602 0.309) 8.904 53.884 ( 0.916 -0.673 0.278) 1.170 53.884 ( 0.916 0.673 0.278) 1.170 54.168 ( -1.122 -2.524 -0.105) 2.764 54.168 ( -1.122 2.524 -0.105) 2.764 55.791 ( -0.606 -2.115 1.212) 2.512 55.791 ( -0.606 2.115 1.212) 2.512 55.938 ( -1.071 -4.219 -1.229) 4.523 55.938 ( -1.071 4.219 -1.229) 4.523 57.788 ( -0.054 -1.774 -0.134) 1.780 57.788 ( -0.054 1.774 -0.134) 1.780 57.926 ( 0.602 -2.693 -0.179) 2.765 57.926 ( 0.602 2.693 -0.179) 2.765 58.127 ( -1.353 -3.547 0.932) 3.909 58.127 ( -1.353 3.547 0.932) 3.909 58.254 ( -3.828 -3.687 -0.617) 5.350 58.254 ( -3.828 3.687 -0.617) 5.350 61.032 ( 0.376 -0.445 0.236) 0.629 61.032 ( 0.376 0.445 0.236) 0.629 61.230 ( -3.918 -0.800 -0.418) 4.021 61.230 ( -3.918 0.800 -0.418) 4.021 ======================= Grid point 119 (61/90) ======================= q-point: ( 0.38 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.962 ( -3.650 -4.114 -1.734) 5.767 2.962 ( -3.650 4.114 -1.734) 5.767 3.318 ( 0.971 -6.488 -3.264) 7.327 3.318 ( 0.971 6.488 -3.264) 7.327 4.429 ( -0.213 -2.901 -3.041) 4.208 4.429 ( -0.213 2.901 -3.041) 4.208 4.755 ( 13.622 -16.509 6.971) 22.510 4.755 ( 13.622 16.509 6.971) 22.510 4.975 ( 7.972 -6.904 -2.625) 10.868 4.975 ( 7.972 6.904 -2.625) 10.868 5.142 ( 1.475 -5.679 -6.771) 8.960 5.142 ( 1.475 5.679 -6.771) 8.960 5.301 ( 3.508 -11.620 0.606) 12.153 5.301 ( 3.508 11.620 0.606) 12.153 5.815 ( -1.826 -3.169 -2.404) 4.377 5.815 ( -1.826 3.169 -2.404) 4.377 5.988 ( 4.141 -1.485 3.332) 5.519 5.988 ( 4.141 1.485 3.332) 5.519 6.329 ( -5.160 -7.980 10.750) 14.348 6.329 ( -5.160 7.980 10.750) 14.348 6.465 ( 9.426 -4.814 0.935) 10.626 6.465 ( 9.426 4.815 0.935) 10.626 6.702 ( -3.114 -9.712 3.381) 10.745 6.702 ( -3.114 9.712 3.381) 10.745 7.197 ( -1.662 -2.667 1.539) 3.499 7.197 ( -1.662 2.667 1.539) 3.499 7.338 ( -1.805 -3.984 -5.019) 6.657 7.338 ( -1.805 3.984 -5.019) 6.657 7.479 ( 1.405 -13.369 0.898) 13.473 7.479 ( 1.405 13.369 0.898) 13.473 7.869 ( 1.423 -10.608 2.157) 10.918 7.869 ( 1.423 10.608 2.157) 10.918 8.174 ( 8.221 -6.581 -2.663) 10.863 8.174 ( 8.221 6.581 -2.663) 10.863 8.406 ( 3.837 -2.466 -5.954) 7.500 8.406 ( 3.837 2.466 -5.954) 7.500 8.582 ( 0.803 -12.057 3.017) 12.454 8.582 ( 0.803 12.057 3.017) 12.454 8.782 ( 0.849 -11.214 -2.048) 11.431 8.782 ( 0.849 11.214 -2.048) 11.431 9.123 ( 5.483 -9.191 1.909) 10.871 9.123 ( 5.483 9.191 1.909) 10.871 9.450 ( 7.010 -8.233 4.721) 11.799 9.450 ( 7.010 8.233 4.721) 11.799 9.697 ( 7.450 -5.843 -6.139) 11.284 9.697 ( 7.450 5.843 -6.139) 11.284 9.765 ( 2.424 -12.079 -7.095) 14.217 9.765 ( 2.424 12.079 -7.095) 14.217 10.009 ( 2.614 -4.987 5.660) 7.984 10.009 ( 2.614 4.987 5.660) 7.984 10.264 ( -0.532 -6.227 -1.556) 6.441 10.264 ( -0.532 6.227 -1.556) 6.441 10.495 ( -5.461 -6.302 1.915) 8.556 10.495 ( -5.461 6.302 1.915) 8.556 10.821 ( -2.651 -9.671 0.670) 10.050 10.821 ( -2.651 9.671 0.670) 10.050 11.126 ( 6.950 -8.103 1.629) 10.799 11.126 ( 6.950 8.103 1.629) 10.799 11.447 ( -1.240 -12.118 -1.498) 12.273 11.447 ( -1.240 12.118 -1.498) 12.273 11.742 ( -1.426 -2.360 -1.031) 2.944 11.742 ( -1.426 2.360 -1.031) 2.944 11.906 ( -6.081 -11.381 1.552) 12.997 11.906 ( -6.081 11.381 1.552) 12.997 12.183 ( -5.919 -6.870 2.528) 9.413 12.183 ( -5.919 6.870 2.528) 9.413 12.457 ( 2.149 -5.337 0.863) 5.818 12.457 ( 2.149 5.337 0.863) 5.818 12.598 ( -0.415 -5.815 -4.063) 7.105 12.598 ( -0.415 5.815 -4.063) 7.105 12.948 ( -3.373 -4.064 0.798) 5.342 12.948 ( -3.373 4.064 0.798) 5.342 13.238 ( 1.302 -6.167 0.351) 6.312 13.238 ( 1.302 6.167 0.351) 6.312 13.310 ( -1.435 -2.095 -0.051) 2.540 13.310 ( -1.435 2.095 -0.051) 2.540 13.849 ( -4.818 -8.069 0.739) 9.427 13.849 ( -4.818 8.069 0.739) 9.427 13.968 ( -6.114 -5.775 -1.100) 8.482 13.968 ( -6.114 5.775 -1.100) 8.482 15.974 ( 0.094 -3.560 0.702) 3.629 15.974 ( 0.094 3.560 0.702) 3.630 16.736 ( 5.866 -0.917 -0.780) 5.988 16.736 ( 5.866 0.917 -0.780) 5.988 18.557 ( 6.217 -2.059 -0.126) 6.551 18.557 ( 6.217 2.059 -0.126) 6.551 18.862 ( -7.176 -1.555 0.195) 7.345 18.862 ( -7.176 1.555 0.195) 7.345 20.321 ( 2.966 -0.739 -0.519) 3.100 20.321 ( 2.966 0.739 -0.519) 3.100 20.544 ( -3.894 -2.367 -0.009) 4.557 20.544 ( -3.894 2.367 -0.009) 4.557 21.025 ( 2.257 -13.345 0.980) 13.570 21.025 ( 2.257 13.345 0.980) 13.570 21.100 ( 2.085 -13.702 -0.781) 13.881 21.100 ( 2.085 13.702 -0.781) 13.881 22.519 ( 0.513 -2.210 -0.330) 2.293 22.519 ( 0.513 2.210 -0.330) 2.293 22.679 ( -0.205 -0.777 0.388) 0.893 22.679 ( -0.205 0.777 0.388) 0.893 24.069 ( -7.948 -5.939 1.097) 9.982 24.069 ( -7.948 5.939 1.097) 9.982 24.201 ( -11.446 -4.027 -1.520) 12.229 24.201 ( -11.446 4.027 -1.520) 12.229 24.723 ( -0.965 -0.904 1.006) 1.661 24.723 ( -0.965 0.904 1.006) 1.661 24.913 ( -0.264 -1.062 -0.530) 1.216 24.913 ( -0.264 1.062 -0.530) 1.216 26.781 ( 0.149 -1.276 0.120) 1.290 26.781 ( 0.149 1.276 0.120) 1.290 26.875 ( -1.642 -2.121 -0.216) 2.691 26.875 ( -1.642 2.122 -0.216) 2.691 27.212 ( 0.422 -1.265 1.454) 1.973 27.212 ( 0.422 1.265 1.454) 1.973 27.288 ( 1.712 -2.807 -1.759) 3.728 27.288 ( 1.712 2.807 -1.759) 3.728 27.902 ( -1.394 -2.544 0.892) 3.035 27.902 ( -1.394 2.544 0.892) 3.035 28.381 ( -2.419 -1.269 -0.455) 2.769 28.381 ( -2.419 1.269 -0.455) 2.769 28.645 ( 1.553 -2.420 -1.152) 3.098 28.645 ( 1.553 2.420 -1.152) 3.098 29.127 ( 0.750 -3.951 -3.836) 5.558 29.127 ( 0.750 3.951 -3.836) 5.558 29.197 ( 3.985 -1.197 4.924) 6.447 29.197 ( 3.985 1.197 4.924) 6.447 29.819 ( 2.883 -3.393 0.015) 4.453 29.819 ( 2.883 3.393 0.015) 4.453 30.667 ( -2.324 -1.725 0.191) 2.901 30.667 ( -2.324 1.725 0.191) 2.901 30.985 ( -1.706 -0.435 -0.223) 1.775 30.985 ( -1.706 0.435 -0.223) 1.775 33.857 ( -0.723 -0.091 0.042) 0.730 33.857 ( -0.723 0.091 0.042) 0.730 33.967 ( -0.041 -0.754 0.013) 0.755 33.967 ( -0.041 0.754 0.013) 0.755 37.216 ( 1.001 -0.417 0.464) 1.179 37.216 ( 1.001 0.417 0.464) 1.179 37.269 ( 1.369 -1.537 -0.492) 2.116 37.269 ( 1.369 1.537 -0.492) 2.116 37.771 ( 0.316 -2.049 -0.078) 2.074 37.771 ( 0.316 2.049 -0.078) 2.074 37.806 ( 0.359 -1.992 0.010) 2.024 37.806 ( 0.359 1.992 0.010) 2.024 49.140 ( 5.342 -1.976 0.258) 5.702 49.140 ( 5.342 1.976 0.258) 5.702 49.346 ( 7.062 -2.368 -0.329) 7.455 49.346 ( 7.062 2.368 -0.329) 7.455 50.591 ( -0.551 -1.130 -0.636) 1.409 50.591 ( -0.551 1.130 -0.636) 1.409 50.684 ( -0.200 -1.249 0.689) 1.441 50.684 ( -0.200 1.249 0.689) 1.441 52.139 ( -0.213 -6.564 0.857) 6.623 52.139 ( -0.213 6.564 0.857) 6.623 52.277 ( 0.007 -10.056 -1.116) 10.118 52.277 ( 0.007 10.056 -1.116) 10.118 52.777 ( 0.805 -7.096 -0.787) 7.185 52.777 ( 0.805 7.096 -0.787) 7.185 52.892 ( 1.687 -8.081 0.888) 8.303 52.892 ( 1.687 8.081 0.888) 8.303 53.904 ( 0.843 -0.479 0.673) 1.180 53.904 ( 0.843 0.479 0.673) 1.180 54.145 ( -0.953 -2.877 -0.372) 3.054 54.145 ( -0.953 2.877 -0.372) 3.054 55.786 ( -0.160 -1.299 1.289) 1.837 55.786 ( -0.160 1.299 1.289) 1.837 55.911 ( -1.019 -2.796 -1.311) 3.252 55.911 ( -1.019 2.796 -1.311) 3.252 57.789 ( 0.143 -1.899 -0.081) 1.906 57.789 ( 0.143 1.899 -0.081) 1.906 57.940 ( 0.702 -3.602 -0.088) 3.670 57.940 ( 0.702 3.602 -0.088) 3.670 58.098 ( -1.465 -3.434 0.310) 3.746 58.098 ( -1.465 3.434 0.310) 3.746 58.184 ( -2.465 -4.188 -0.165) 4.862 58.184 ( -2.465 4.188 -0.165) 4.862 61.049 ( 1.257 -0.508 0.116) 1.361 61.049 ( 1.257 0.508 0.116) 1.361 61.151 ( -3.468 -0.420 -0.169) 3.497 61.151 ( -3.468 0.420 -0.169) 3.497 ======================= Grid point 121 (62/90) ======================= q-point: (-0.50 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.870 ( -4.915 -3.464 -2.690) 6.587 2.870 ( -4.915 3.464 -2.690) 6.587 3.374 ( 5.410 -3.666 -3.153) 7.256 3.374 ( 5.410 3.666 -3.153) 7.256 4.445 ( 1.645 -7.997 0.868) 8.210 4.445 ( 1.645 7.997 0.868) 8.210 4.845 ( -12.856 -5.406 -6.650) 15.451 4.845 ( -12.856 5.406 -6.650) 15.451 4.995 ( 2.438 -3.102 -2.319) 4.576 4.995 ( 2.438 3.102 -2.319) 4.576 5.124 ( 2.933 -1.783 -0.480) 3.466 5.124 ( 2.933 1.783 -0.480) 3.466 5.460 ( 4.545 -7.937 2.650) 9.523 5.460 ( 4.545 7.937 2.650) 9.523 5.768 ( -2.592 -4.992 -4.560) 7.241 5.768 ( -2.592 4.992 -4.560) 7.241 6.026 ( 0.351 -4.011 -1.016) 4.153 6.026 ( 0.351 4.011 -1.016) 4.153 6.336 ( -1.663 -4.561 19.643) 20.234 6.336 ( -1.663 4.561 19.643) 20.234 6.506 ( 4.056 -2.254 2.265) 5.164 6.506 ( 4.056 2.254 2.265) 5.164 6.793 ( 1.404 -5.331 6.332) 8.396 6.793 ( 1.404 5.331 6.332) 8.396 7.069 ( -3.403 -6.154 -6.464) 9.551 7.069 ( -3.403 6.154 -6.464) 9.551 7.354 ( 2.050 -4.605 3.683) 6.243 7.354 ( 2.050 4.605 3.683) 6.243 7.563 ( 4.935 -10.527 -2.837) 11.967 7.563 ( 4.935 10.527 -2.837) 11.967 7.821 ( -5.680 -4.596 -0.362) 7.315 7.821 ( -5.680 4.596 -0.362) 7.315 8.228 ( -0.833 -8.123 -3.634) 8.938 8.228 ( -0.833 8.123 -3.634) 8.938 8.437 ( 0.396 -6.538 -5.317) 8.437 8.437 ( 0.396 6.538 -5.317) 8.437 8.680 ( 4.780 -8.533 4.869) 10.926 8.680 ( 4.780 8.533 4.869) 10.926 8.769 ( -1.159 -12.835 -0.979) 12.924 8.769 ( -1.159 12.835 -0.979) 12.924 9.190 ( -0.147 -10.904 1.905) 11.070 9.190 ( -0.147 10.904 1.905) 11.070 9.510 ( -6.563 -4.579 0.538) 8.021 9.510 ( -6.563 4.579 0.538) 8.021 9.733 ( -2.447 -6.788 -5.727) 9.212 9.733 ( -2.447 6.788 -5.727) 9.212 9.831 ( 6.153 -10.627 -3.797) 12.853 9.831 ( 6.153 10.627 -3.797) 12.853 10.028 ( -0.711 -2.713 -0.769) 2.908 10.028 ( -0.710 2.713 -0.769) 2.908 10.254 ( 2.151 -11.294 2.112) 11.689 10.254 ( 2.151 11.294 2.112) 11.689 10.439 ( -0.345 -3.290 1.239) 3.532 10.439 ( -0.345 3.290 1.239) 3.532 10.761 ( -2.363 -7.219 1.774) 7.801 10.761 ( -2.363 7.219 1.774) 7.801 11.292 ( -0.399 -3.998 1.230) 4.202 11.292 ( -0.399 3.998 1.230) 4.202 11.378 ( 2.033 -11.014 -1.541) 11.306 11.378 ( 2.033 11.014 -1.541) 11.306 11.727 ( -0.012 -3.878 -1.341) 4.103 11.727 ( -0.012 3.878 -1.341) 4.103 11.812 ( -1.096 -8.870 2.234) 9.213 11.812 ( -1.096 8.870 2.234) 9.213 12.153 ( 1.808 -5.397 5.257) 7.748 12.153 ( 1.808 5.397 5.257) 7.748 12.425 ( -3.483 -1.308 -5.823) 6.910 12.425 ( -3.483 1.308 -5.823) 6.910 12.648 ( 3.235 -1.557 1.090) 3.752 12.648 ( 3.235 1.557 1.090) 3.752 12.903 ( -0.189 -3.044 0.369) 3.072 12.903 ( -0.189 3.044 0.369) 3.072 13.261 ( -0.658 -5.819 0.338) 5.866 13.261 ( -0.658 5.819 0.338) 5.866 13.283 ( 0.022 -3.153 -0.622) 3.213 13.283 ( 0.022 3.153 -0.622) 3.213 13.790 ( -0.505 -7.861 0.735) 7.911 13.790 ( -0.505 7.861 0.735) 7.911 13.898 ( 0.421 -2.942 -1.128) 3.179 13.898 ( 0.421 2.942 -1.128) 3.179 15.978 ( -0.040 -3.594 0.898) 3.705 15.978 ( -0.040 3.594 0.898) 3.705 16.799 ( 0.268 -0.144 -1.046) 1.089 16.799 ( 0.268 0.144 -1.046) 1.089 18.677 ( -0.474 -2.247 0.259) 2.311 18.677 ( -0.474 2.247 0.259) 2.311 18.729 ( 0.193 -2.662 -0.056) 2.670 18.729 ( 0.193 2.662 -0.056) 2.670 20.365 ( -0.031 -1.020 -0.686) 1.229 20.365 ( -0.032 1.020 -0.686) 1.229 20.492 ( 0.316 -2.123 0.145) 2.151 20.492 ( 0.316 2.123 0.145) 2.151 21.052 ( -0.077 -14.327 1.238) 14.380 21.052 ( -0.077 14.327 1.238) 14.380 21.121 ( -0.045 -14.647 -1.081) 14.687 21.121 ( -0.045 14.647 -1.081) 14.687 22.526 ( 0.196 -1.710 -0.135) 1.726 22.526 ( 0.196 1.710 -0.135) 1.726 22.675 ( -0.192 -0.727 0.228) 0.786 22.675 ( -0.192 0.727 0.228) 0.786 23.988 ( 0.050 -2.622 1.315) 2.933 23.988 ( 0.050 2.622 1.315) 2.933 24.069 ( 0.072 -5.411 -1.619) 5.648 24.069 ( 0.072 5.411 -1.619) 5.648 24.709 ( -0.697 -1.299 1.060) 1.816 24.709 ( -0.697 1.299 1.060) 1.816 24.915 ( 0.524 -2.709 -0.690) 2.845 24.915 ( 0.524 2.709 -0.690) 2.845 26.786 ( 0.398 -1.372 0.320) 1.464 26.786 ( 0.398 1.372 0.320) 1.464 26.853 ( -0.370 -1.146 -0.491) 1.300 26.853 ( -0.370 1.146 -0.491) 1.300 27.216 ( -0.579 -1.391 0.975) 1.795 27.216 ( -0.579 1.391 0.975) 1.795 27.307 ( 0.478 -2.367 -1.289) 2.737 27.307 ( 0.478 2.367 -1.289) 2.737 27.892 ( 0.107 -1.192 1.047) 1.590 27.892 ( 0.107 1.192 1.047) 1.590 28.349 ( -0.171 -0.842 -0.783) 1.162 28.349 ( -0.171 0.842 -0.783) 1.162 28.673 ( 1.056 -1.360 -0.077) 1.723 28.673 ( 1.056 1.360 -0.077) 1.723 29.101 ( -1.988 -2.088 -3.088) 4.225 29.101 ( -1.988 2.088 -3.088) 4.225 29.266 ( 1.111 -1.528 3.400) 3.890 29.266 ( 1.111 1.528 3.400) 3.890 29.851 ( 0.044 -1.231 0.056) 1.233 29.851 ( 0.044 1.231 0.056) 1.233 30.641 ( -0.087 -0.732 0.118) 0.747 30.641 ( -0.087 0.732 0.118) 0.747 30.968 ( 0.140 -0.455 -0.172) 0.506 30.968 ( 0.140 0.455 -0.172) 0.506 33.850 ( 0.014 -0.064 0.044) 0.079 33.850 ( 0.014 0.064 0.044) 0.079 33.966 ( -0.022 -0.724 -0.003) 0.724 33.966 ( -0.022 0.724 -0.003) 0.724 37.229 ( -0.036 -0.418 0.569) 0.707 37.229 ( -0.036 0.418 0.569) 0.707 37.283 ( 0.064 -1.313 -0.580) 1.437 37.283 ( 0.064 1.313 -0.580) 1.437 37.774 ( -0.046 -1.402 -0.095) 1.406 37.774 ( -0.046 1.402 -0.095) 1.406 37.810 ( 0.021 -1.350 0.034) 1.350 37.810 ( 0.021 1.350 0.034) 1.350 49.199 ( -0.060 -2.080 0.270) 2.099 49.199 ( -0.060 2.080 0.269) 2.099 49.424 ( 0.184 -2.826 -0.300) 2.847 49.424 ( 0.184 2.826 -0.300) 2.847 50.576 ( -0.752 -1.121 -0.478) 1.432 50.576 ( -0.752 1.121 -0.478) 1.432 50.688 ( 0.547 -2.341 0.444) 2.445 50.688 ( 0.547 2.341 0.444) 2.445 52.145 ( 0.363 -6.295 1.415) 6.463 52.145 ( 0.363 6.295 1.415) 6.463 52.266 ( -0.536 -9.012 -1.858) 9.217 52.266 ( -0.536 9.012 -1.858) 9.217 52.782 ( -0.183 -5.439 -0.802) 5.501 52.782 ( -0.183 5.439 -0.802) 5.501 52.916 ( 0.267 -6.434 1.013) 6.518 52.916 ( 0.267 6.434 1.013) 6.518 53.918 ( 0.127 -0.509 0.935) 1.073 53.918 ( 0.127 0.509 0.935) 1.073 54.132 ( -0.038 -2.587 -0.572) 2.650 54.132 ( -0.038 2.587 -0.572) 2.650 55.790 ( 0.096 -0.241 1.508) 1.531 55.790 ( 0.096 0.241 1.508) 1.531 55.894 ( -0.102 -1.484 -1.532) 2.136 55.894 ( -0.102 1.484 -1.532) 2.136 57.791 ( -0.000 -0.126 0.003) 0.126 57.791 ( -0.000 0.126 0.003) 0.126 57.951 ( 0.318 -4.002 -0.415) 4.036 57.951 ( 0.318 4.002 -0.415) 4.036 58.073 ( -0.963 -1.778 0.610) 2.112 58.073 ( -0.963 1.778 0.610) 2.112 58.163 ( 0.657 -0.541 -0.229) 0.881 58.163 ( 0.657 0.541 -0.229) 0.881 61.079 ( -0.360 -0.346 0.318) 0.592 61.079 ( -0.360 0.346 0.318) 0.592 61.097 ( 0.387 -0.486 -0.337) 0.707 61.097 ( 0.387 0.486 -0.337) 0.707 ======================= Grid point 123 (63/90) ======================= q-point: (-0.38 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.764 ( -3.279 -9.073 -2.216) 9.898 2.764 ( -3.279 9.073 -2.216) 9.898 3.509 ( 7.455 -1.078 -2.911) 8.075 3.509 ( 7.455 1.078 -2.911) 8.075 4.345 ( -12.802 -20.813 -3.368) 24.666 4.345 ( -12.802 20.813 -3.368) 24.666 4.656 ( -4.594 -14.706 5.011) 16.201 4.656 ( -4.594 14.706 5.011) 16.201 4.951 ( -2.818 -4.856 0.404) 5.630 4.951 ( -2.818 4.856 0.404) 5.630 5.099 ( -4.698 -3.881 -3.893) 7.231 5.099 ( -4.698 3.881 -3.893) 7.231 5.517 ( -3.052 -7.067 -3.901) 8.630 5.517 ( -3.052 7.067 -3.901) 8.630 5.611 ( -4.972 -4.799 0.940) 6.974 5.611 ( -4.972 4.799 0.940) 6.974 6.088 ( 2.693 -2.216 0.732) 3.563 6.088 ( 2.693 2.216 0.732) 3.563 6.313 ( -2.190 -7.691 4.304) 9.081 6.313 ( -2.190 7.691 4.304) 9.081 6.562 ( -8.302 -5.263 7.914) 12.619 6.562 ( -8.302 5.263 7.914) 12.619 6.792 ( 3.663 -5.314 3.790) 7.485 6.792 ( 3.663 5.314 3.790) 7.485 7.084 ( 4.506 -6.052 -0.641) 7.572 7.084 ( 4.506 6.052 -0.641) 7.572 7.437 ( 3.585 -6.054 2.105) 7.344 7.437 ( 3.585 6.054 2.105) 7.344 7.600 ( -2.586 -8.847 -9.169) 13.001 7.600 ( -2.586 8.847 -9.169) 13.001 7.716 ( -1.024 -6.389 7.896) 10.208 7.716 ( -1.024 6.389 7.896) 10.208 8.170 ( -3.200 -9.730 -2.951) 10.659 8.170 ( -3.200 9.730 -2.951) 10.659 8.387 ( -4.038 -3.037 -7.803) 9.296 8.387 ( -4.038 3.037 -7.803) 9.296 8.672 ( -3.145 -9.202 -2.927) 10.156 8.672 ( -3.145 9.202 -2.927) 10.156 8.812 ( 2.532 -0.406 6.020) 6.543 8.812 ( 2.532 0.406 6.020) 6.543 9.118 ( -7.717 -2.802 1.217) 8.300 9.118 ( -7.717 2.802 1.217) 8.300 9.269 ( -11.572 -7.338 2.140) 13.868 9.269 ( -11.572 7.338 2.139) 13.868 9.579 ( -9.500 -13.103 -4.206) 16.722 9.579 ( -9.500 13.103 -4.206) 16.722 9.867 ( -2.349 -8.128 -4.460) 9.564 9.867 ( -2.349 8.128 -4.460) 9.564 10.061 ( 2.677 -6.050 1.018) 6.694 10.061 ( 2.677 6.050 1.018) 6.694 10.307 ( -1.549 -3.476 1.114) 3.965 10.307 ( -1.549 3.476 1.114) 3.965 10.471 ( 3.741 -12.477 1.225) 13.083 10.471 ( 3.741 12.477 1.225) 13.083 10.763 ( 2.218 -9.871 0.636) 10.138 10.763 ( 2.218 9.871 0.636) 10.138 11.178 ( -4.182 -6.251 1.999) 7.782 11.178 ( -4.182 6.251 1.999) 7.782 11.458 ( 0.663 -8.505 -1.933) 8.747 11.458 ( 0.663 8.505 -1.933) 8.747 11.713 ( -0.336 -2.879 -0.823) 3.013 11.713 ( -0.336 2.879 -0.823) 3.013 11.903 ( 6.992 -2.783 1.657) 7.706 11.903 ( 6.992 2.783 1.657) 7.706 12.235 ( 2.918 -5.426 3.730) 7.203 12.235 ( 2.918 5.426 3.730) 7.203 12.387 ( 3.542 -5.168 -1.878) 6.541 12.387 ( 3.542 5.168 -1.878) 6.541 12.648 ( -2.615 -3.177 -2.721) 4.933 12.648 ( -2.615 3.177 -2.721) 4.933 12.956 ( 3.928 -5.427 0.855) 6.753 12.956 ( 3.928 5.427 0.855) 6.753 13.229 ( -1.123 -7.921 0.270) 8.005 13.229 ( -1.123 7.921 0.270) 8.005 13.305 ( 1.530 -5.055 0.001) 5.281 13.305 ( 1.530 5.055 0.001) 5.281 13.838 ( 4.545 -7.300 0.665) 8.625 13.838 ( 4.545 7.300 0.665) 8.625 13.970 ( 5.987 -4.731 -1.021) 7.698 13.970 ( 5.987 4.731 -1.021) 7.698 15.977 ( -0.172 -3.663 0.702) 3.733 15.977 ( -0.172 3.663 0.702) 3.733 16.740 ( -5.573 -0.729 -0.780) 5.674 16.740 ( -5.573 0.729 -0.780) 5.674 18.555 ( -5.940 -2.273 -0.130) 6.361 18.555 ( -5.940 2.273 -0.130) 6.361 18.854 ( 6.539 -2.301 0.198) 6.935 18.854 ( 6.539 2.301 0.198) 6.935 20.323 ( -2.404 -0.431 -0.507) 2.495 20.323 ( -2.404 0.431 -0.507) 2.495 20.549 ( 3.784 -0.900 -0.027) 3.890 20.549 ( 3.784 0.900 -0.027) 3.890 21.030 ( -2.196 -13.590 1.188) 13.817 21.030 ( -2.196 13.590 1.188) 13.817 21.092 ( -2.234 -13.517 -0.982) 13.735 21.092 ( -2.234 13.517 -0.982) 13.735 22.523 ( -0.459 -0.663 -0.348) 0.879 22.523 ( -0.459 0.663 -0.348) 0.879 22.675 ( 0.150 -0.741 0.406) 0.858 22.675 ( 0.150 0.741 0.406) 0.858 24.078 ( 7.993 -1.250 1.257) 8.187 24.078 ( 7.993 1.250 1.257) 8.187 24.197 ( 11.862 -3.617 -1.699) 12.517 24.197 ( 11.862 3.617 -1.699) 12.517 24.699 ( -0.436 -2.998 0.910) 3.163 24.699 ( -0.436 2.998 0.910) 3.163 24.930 ( 1.078 -3.896 -0.416) 4.064 24.930 ( 1.078 3.896 -0.416) 4.064 26.794 ( 0.094 -1.377 0.161) 1.390 26.794 ( 0.094 1.377 0.161) 1.390 26.861 ( 1.334 -1.423 -0.249) 1.966 26.861 ( 1.334 1.423 -0.249) 1.966 27.194 ( -1.570 -1.435 0.938) 2.325 27.194 ( -1.570 1.435 0.938) 2.325 27.303 ( -0.409 -1.774 -1.246) 2.206 27.303 ( -0.409 1.774 -1.246) 2.206 27.909 ( 1.199 -0.749 0.921) 1.688 27.909 ( 1.199 0.749 0.921) 1.688 28.373 ( 2.528 -0.704 -0.547) 2.680 28.373 ( 2.528 0.704 -0.547) 2.680 28.679 ( -0.648 -0.540 -1.227) 1.489 28.679 ( -0.648 0.540 -1.227) 1.489 29.036 ( -3.513 -0.851 -0.670) 3.676 29.036 ( -3.513 0.851 -0.670) 3.676 29.261 ( -2.138 -1.986 1.891) 3.477 29.261 ( -2.138 1.986 1.891) 3.477 29.821 ( -2.728 -3.675 0.017) 4.577 29.821 ( -2.728 3.675 0.017) 4.577 30.663 ( 1.968 -1.474 0.183) 2.466 30.663 ( 1.968 1.474 0.183) 2.466 30.992 ( 2.285 -1.120 -0.216) 2.554 30.992 ( 2.285 1.120 -0.216) 2.554 33.858 ( 0.754 -0.122 0.043) 0.765 33.858 ( 0.754 0.122 0.043) 0.765 33.966 ( 0.007 -0.730 0.012) 0.730 33.966 ( 0.007 0.730 0.012) 0.730 37.218 ( -1.013 -0.885 0.498) 1.434 37.218 ( -1.013 0.885 0.498) 1.434 37.268 ( -1.347 -1.135 -0.526) 1.838 37.268 ( -1.347 1.135 -0.526) 1.838 37.769 ( -0.341 -1.087 -0.076) 1.142 37.769 ( -0.341 1.087 -0.076) 1.142 37.807 ( -0.358 -0.962 0.007) 1.026 37.807 ( -0.358 0.962 0.007) 1.026 49.139 ( -5.470 -1.700 0.251) 5.733 49.139 ( -5.470 1.700 0.251) 5.733 49.352 ( -6.750 -3.343 -0.323) 7.540 49.352 ( -6.750 3.343 -0.323) 7.540 50.554 ( -1.305 -1.416 -0.363) 1.959 50.554 ( -1.305 1.416 -0.363) 1.959 50.712 ( 1.581 -3.986 0.417) 4.308 50.712 ( 1.581 3.986 0.417) 4.308 52.158 ( 0.462 -3.855 1.323) 4.102 52.158 ( 0.462 3.855 1.323) 4.102 52.250 ( -0.395 -4.464 -1.582) 4.753 52.250 ( -0.395 4.464 -1.582) 4.753 52.766 ( -1.061 -3.795 -0.601) 3.986 52.766 ( -1.061 3.795 -0.601) 3.986 52.907 ( -1.328 -4.631 0.702) 4.868 52.907 ( -1.328 4.631 0.702) 4.868 53.913 ( -0.809 -0.673 0.694) 1.261 53.913 ( -0.809 0.673 0.694) 1.261 54.141 ( 1.016 -1.727 -0.393) 2.042 54.141 ( 1.016 1.727 -0.393) 2.042 55.796 ( 0.115 -1.739 1.555) 2.336 55.796 ( 0.115 1.739 1.555) 2.336 55.901 ( 1.061 -2.442 -1.578) 3.095 55.901 ( 1.061 2.442 -1.578) 3.095 57.788 ( -0.247 -2.747 -0.079) 2.759 57.788 ( -0.247 2.747 -0.079) 2.759 57.953 ( 0.111 -4.619 -0.137) 4.622 57.953 ( 0.111 4.619 -0.137) 4.622 58.064 ( 0.016 -4.059 0.283) 4.069 58.064 ( 0.016 4.059 0.283) 4.069 58.206 ( 3.221 -2.145 -0.091) 3.871 58.206 ( 3.221 2.145 -0.091) 3.871 61.046 ( -1.351 -0.462 0.107) 1.432 61.046 ( -1.351 0.462 0.107) 1.432 61.154 ( 3.638 -0.796 -0.160) 3.728 61.154 ( 3.638 0.796 -0.160) 3.728 ======================= Grid point 125 (64/90) ======================= q-point: (-0.25 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.776 ( 5.434 -13.851 0.440) 14.885 2.776 ( 5.434 13.851 0.440) 14.885 3.625 ( 3.533 -5.393 -4.702) 7.980 3.625 ( 3.533 5.393 -4.702) 7.980 4.065 ( -11.330 -26.369 4.795) 29.098 4.065 ( -11.330 26.369 4.795) 29.098 4.502 ( -11.038 -10.585 5.229) 16.162 4.502 ( -11.038 10.585 5.229) 16.162 4.778 ( -12.437 -17.140 -3.884) 21.530 4.778 ( -12.437 17.140 -3.884) 21.530 5.128 ( 5.861 -10.823 0.380) 12.314 5.128 ( 5.861 10.823 0.380) 12.314 5.309 ( -8.843 -13.295 -8.055) 17.884 5.309 ( -8.843 13.295 -8.055) 17.884 5.628 ( -0.447 -11.065 7.914) 13.611 5.628 ( -0.447 11.065 7.914) 13.611 6.064 ( -5.034 -4.800 3.629) 7.846 6.064 ( -5.034 4.800 3.629) 7.846 6.225 ( -5.542 -0.518 -4.494) 7.153 6.225 ( -5.542 0.518 -4.494) 7.153 6.438 ( -3.058 -3.758 2.068) 5.268 6.438 ( -3.058 3.758 2.068) 5.268 6.784 ( -4.126 -5.264 -0.310) 6.695 6.784 ( -4.126 5.264 -0.310) 6.695 7.235 ( 4.336 -3.935 5.751) 8.208 7.235 ( 4.336 3.935 5.751) 8.208 7.405 ( -2.431 -7.338 -3.406) 8.448 7.405 ( -2.431 7.338 -3.406) 8.448 7.567 ( 1.364 -13.025 -0.199) 13.097 7.567 ( 1.364 13.025 -0.199) 13.097 7.735 ( -2.547 -6.943 1.237) 7.498 7.735 ( -2.547 6.943 1.237) 7.498 8.103 ( -2.181 -14.982 0.298) 15.142 8.103 ( -2.181 14.982 0.298) 15.142 8.259 ( -3.161 -3.749 -12.616) 13.535 8.259 ( -3.161 3.749 -12.616) 13.535 8.604 ( -2.723 -15.049 -1.494) 15.367 8.604 ( -2.723 15.049 -1.494) 15.367 8.855 ( -0.836 -7.162 5.030) 8.792 8.855 ( -0.836 7.162 5.030) 8.792 8.937 ( -5.480 -5.886 1.182) 8.128 8.937 ( -5.480 5.886 1.182) 8.128 9.113 ( -6.065 -8.203 5.889) 11.780 9.113 ( -6.065 8.203 5.889) 11.780 9.394 ( -6.298 -13.436 -1.222) 14.888 9.394 ( -6.298 13.436 -1.222) 14.888 9.766 ( -6.036 -5.906 -2.740) 8.878 9.766 ( -6.036 5.906 -2.740) 8.878 10.041 ( -4.624 -6.808 1.482) 8.363 10.041 ( -4.624 6.808 1.482) 8.363 10.223 ( -4.427 -3.554 -2.688) 6.281 10.223 ( -4.427 3.554 -2.688) 6.281 10.566 ( 4.202 -9.006 2.354) 10.213 10.566 ( 4.202 9.006 2.354) 10.213 10.798 ( -0.257 -9.268 -0.081) 9.272 10.798 ( -0.257 9.268 -0.081) 9.272 11.183 ( 3.172 -9.412 1.245) 10.010 11.183 ( 3.172 9.412 1.245) 10.010 11.359 ( -8.309 -9.847 -1.951) 13.031 11.359 ( -8.309 9.847 -1.951) 13.031 11.748 ( 3.995 -5.939 0.781) 7.200 11.748 ( 3.995 5.939 0.781) 7.200 12.044 ( 5.144 -3.614 -0.077) 6.287 12.044 ( 5.144 3.614 -0.077) 6.287 12.301 ( 3.660 -6.522 1.659) 7.661 12.301 ( 3.660 6.522 1.659) 7.661 12.509 ( 2.164 -9.723 1.412) 10.060 12.509 ( 2.164 9.723 1.412) 10.060 12.600 ( 3.482 -2.989 -4.195) 6.218 12.600 ( 3.482 2.989 -4.195) 6.218 13.027 ( 2.353 -4.332 0.644) 4.972 13.027 ( 2.353 4.332 0.644) 4.972 13.230 ( 0.954 -9.251 0.055) 9.301 13.230 ( 0.954 9.251 0.055) 9.301 13.340 ( 1.477 -3.929 0.289) 4.207 13.340 ( 1.477 3.929 0.289) 4.207 13.955 ( 5.753 -6.928 0.527) 9.021 13.955 ( 5.753 6.928 0.527) 9.021 14.109 ( 6.849 -5.528 -0.538) 8.818 14.109 ( 6.849 5.528 -0.538) 8.818 15.982 ( 0.881 -3.844 0.336) 3.958 15.982 ( 0.881 3.844 0.336) 3.958 16.576 ( -9.549 -1.924 -0.307) 9.746 16.576 ( -9.549 1.924 -0.307) 9.746 18.454 ( -3.652 -1.436 -0.056) 3.924 18.454 ( -3.652 1.436 -0.056) 3.924 18.977 ( 5.048 -1.414 -0.225) 5.247 18.977 ( 5.048 1.414 -0.225) 5.247 20.286 ( -0.951 -0.763 -0.174) 1.232 20.286 ( -0.951 0.763 -0.174) 1.232 20.627 ( 3.606 -1.490 -0.226) 3.908 20.627 ( 3.606 1.490 -0.226) 3.908 20.977 ( -2.903 -11.294 0.661) 11.680 20.977 ( -2.903 11.294 0.661) 11.680 21.033 ( -3.045 -10.417 -0.372) 10.859 21.033 ( -3.045 10.417 -0.372) 10.859 22.505 ( -1.027 -0.422 -0.498) 1.217 22.505 ( -1.027 0.422 -0.498) 1.217 22.682 ( 0.286 -0.673 0.479) 0.874 22.682 ( 0.286 0.673 0.479) 0.874 24.297 ( 11.560 -4.068 1.031) 12.298 24.297 ( 11.560 4.068 1.031) 12.298 24.500 ( 15.284 -1.582 -1.490) 15.438 24.500 ( 15.284 1.582 -1.490) 15.438 24.708 ( 2.282 -5.742 0.191) 6.182 24.708 ( 2.282 5.742 0.191) 6.182 24.956 ( 1.340 -4.942 0.238) 5.126 24.956 ( 1.340 4.942 0.238) 5.126 26.787 ( -0.919 -0.711 0.378) 1.221 26.787 ( -0.919 0.711 0.378) 1.221 26.896 ( 1.657 -1.969 -0.205) 2.581 26.896 ( 1.657 1.969 -0.205) 2.581 27.166 ( -1.050 -0.983 0.757) 1.626 27.166 ( -1.050 0.983 0.757) 1.626 27.290 ( -0.357 -1.254 -1.265) 1.817 27.290 ( -0.357 1.254 -1.265) 1.817 27.948 ( 2.329 -1.983 0.954) 3.204 27.948 ( 2.329 1.983 0.954) 3.204 28.436 ( 2.972 -1.725 0.035) 3.436 28.436 ( 2.972 1.725 0.035) 3.436 28.636 ( -2.368 -1.996 -3.296) 4.523 28.636 ( -2.368 1.996 -3.296) 4.523 28.957 ( -4.328 -3.930 1.761) 6.105 28.957 ( -4.328 3.930 1.761) 6.105 29.203 ( -3.089 -1.464 0.921) 3.540 29.203 ( -3.089 1.464 0.921) 3.540 29.747 ( -4.075 -5.466 -0.188) 6.821 29.747 ( -4.075 5.466 -0.188) 6.821 30.709 ( 1.975 -1.457 0.496) 2.504 30.709 ( 1.975 1.457 0.496) 2.504 31.063 ( 4.405 -2.261 -0.643) 4.993 31.063 ( 4.405 2.261 -0.643) 4.993 33.881 ( 1.360 -0.085 0.025) 1.363 33.881 ( 1.360 0.085 0.025) 1.363 33.966 ( 0.030 -0.613 0.053) 0.616 33.966 ( 0.030 0.613 0.053) 0.616 37.192 ( -1.514 -1.342 0.244) 2.037 37.192 ( -1.514 1.342 0.244) 2.037 37.229 ( -2.091 -1.123 -0.293) 2.392 37.229 ( -2.091 1.123 -0.293) 2.392 37.761 ( -0.383 -1.564 -0.015) 1.610 37.761 ( -0.383 1.564 -0.015) 1.610 37.796 ( -0.607 -0.897 -0.075) 1.086 37.796 ( -0.607 0.897 -0.075) 1.086 48.995 ( -7.691 -1.054 0.231) 7.766 48.995 ( -7.691 1.054 0.231) 7.766 49.162 ( -10.595 -3.069 -0.396) 11.038 49.162 ( -10.595 3.069 -0.396) 11.038 50.524 ( -1.352 -1.634 0.529) 2.186 50.524 ( -1.352 1.634 0.529) 2.186 50.749 ( 1.706 -5.796 -0.066) 6.042 50.749 ( 1.706 5.796 -0.066) 6.042 52.171 ( 0.588 -4.551 0.580) 4.626 52.171 ( 0.588 4.551 0.580) 4.626 52.242 ( -0.168 -4.412 -0.527) 4.446 52.242 ( -0.168 4.412 -0.527) 4.446 52.738 ( -1.399 -3.286 -0.332) 3.587 52.738 ( -1.399 3.286 -0.332) 3.587 52.868 ( -2.368 -4.072 0.191) 4.714 52.868 ( -2.368 4.072 0.191) 4.714 53.892 ( -1.122 -0.450 0.282) 1.241 53.892 ( -1.122 0.450 0.282) 1.241 54.166 ( 1.255 -1.132 -0.110) 1.694 54.166 ( 1.255 1.132 -0.110) 1.694 55.804 ( 0.197 -2.396 1.489) 2.827 55.804 ( 0.197 2.396 1.489) 2.827 55.924 ( 1.489 -3.646 -1.505) 4.216 55.924 ( 1.489 3.646 -1.505) 4.216 57.783 ( -0.141 -4.411 -0.122) 4.414 57.783 ( -0.141 4.411 -0.122) 4.414 57.954 ( -0.027 -6.000 -0.381) 6.012 57.954 ( -0.027 6.000 -0.381) 6.012 58.076 ( 0.935 -3.037 0.884) 3.298 58.076 ( 0.935 3.037 0.884) 3.298 58.283 ( 3.858 -2.480 -0.379) 4.602 58.283 ( 3.858 2.480 -0.379) 4.602 61.028 ( -0.483 -0.413 0.221) 0.673 61.028 ( -0.483 0.413 0.221) 0.673 61.237 ( 4.128 -1.661 -0.403) 4.468 61.237 ( 4.128 1.661 -0.403) 4.468 ======================= Grid point 127 (65/90) ======================= q-point: (-0.12 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.971 ( 10.766 -12.536 3.529) 16.897 2.971 ( 10.766 12.536 3.529) 16.897 3.618 ( -1.178 -12.922 -7.174) 14.826 3.618 ( -1.178 12.922 -7.174) 14.826 3.949 ( -2.796 -24.596 13.013) 27.966 3.949 ( -2.796 24.596 13.013) 27.966 4.265 ( -11.660 -9.150 3.386) 15.204 4.265 ( -11.660 9.150 3.386) 15.204 4.543 ( -8.048 -16.660 -0.545) 18.510 4.543 ( -8.048 16.660 -0.545) 18.510 5.124 ( -3.912 -15.709 -3.340) 16.530 5.124 ( -3.912 15.709 -3.340) 16.530 5.233 ( 1.580 -10.590 -7.582) 13.120 5.233 ( 1.580 10.590 -7.582) 13.120 5.564 ( -7.076 -17.872 3.364) 19.514 5.564 ( -7.076 17.872 3.364) 19.514 5.959 ( -6.596 -2.810 10.463) 12.684 5.959 ( -6.596 2.810 10.463) 12.684 6.204 ( 5.513 -4.919 -4.266) 8.532 6.204 ( 5.513 4.919 -4.266) 8.532 6.362 ( -2.667 -6.490 -4.475) 8.322 6.362 ( -2.667 6.490 -4.475) 8.322 6.701 ( -3.621 -7.139 2.154) 8.289 6.701 ( -3.621 7.139 2.154) 8.289 7.188 ( -4.117 -6.664 -1.002) 7.897 7.188 ( -4.117 6.664 -1.002) 7.897 7.448 ( -3.572 -13.918 4.347) 15.013 7.448 ( -3.572 13.918 4.347) 15.013 7.520 ( -2.546 -8.823 -2.960) 9.649 7.520 ( -2.546 8.823 -2.960) 9.649 7.678 ( 2.508 -5.144 -8.230) 10.024 7.678 ( 2.508 5.144 -8.230) 10.024 8.091 ( -0.458 -5.843 1.935) 6.172 8.091 ( -0.458 5.843 1.935) 6.172 8.212 ( 1.164 -2.687 -11.853) 12.209 8.212 ( 1.164 2.687 -11.853) 12.209 8.553 ( -1.873 -27.013 2.321) 27.177 8.553 ( -1.873 27.013 2.321) 27.177 8.828 ( -2.605 -16.010 9.855) 18.979 8.828 ( -2.605 16.010 9.855) 18.979 8.913 ( 0.380 -11.796 -0.877) 11.835 8.913 ( 0.380 11.796 -0.877) 11.835 9.052 ( 0.534 -0.868 3.517) 3.662 9.052 ( 0.534 0.868 3.517) 3.662 9.323 ( -1.239 -12.773 3.740) 13.366 9.323 ( -1.239 12.773 3.740) 13.366 9.608 ( -8.357 -9.427 1.060) 12.643 9.608 ( -8.357 9.427 1.060) 12.643 9.929 ( -5.012 -11.230 -2.179) 12.489 9.929 ( -5.012 11.230 -2.179) 12.489 10.137 ( -2.265 -4.666 -6.353) 8.202 10.137 ( -2.265 4.666 -6.353) 8.202 10.641 ( 1.565 -5.828 2.183) 6.417 10.641 ( 1.565 5.828 2.183) 6.417 10.768 ( -1.492 -13.727 1.638) 13.904 10.768 ( -1.492 13.727 1.638) 13.904 11.146 ( -6.700 -2.460 0.509) 7.155 11.146 ( -6.700 2.460 0.509) 7.155 11.292 ( 2.768 -10.527 -1.227) 10.954 11.292 ( 2.768 10.527 -1.227) 10.954 11.860 ( 5.279 -7.557 1.863) 9.405 11.860 ( 5.279 7.557 1.863) 9.405 12.084 ( -0.515 -3.441 -1.924) 3.976 12.084 ( -0.515 3.441 -1.924) 3.976 12.380 ( 2.512 -2.033 0.806) 3.331 12.380 ( 2.512 2.033 0.806) 3.331 12.488 ( -0.577 -7.097 -1.281) 7.234 12.488 ( -0.577 7.097 -1.281) 7.234 12.745 ( 7.004 -8.293 -0.076) 10.856 12.745 ( 7.004 8.293 -0.076) 10.856 13.059 ( 0.693 -1.691 0.005) 1.828 13.059 ( 0.693 1.691 0.005) 1.828 13.254 ( 1.028 -9.219 0.434) 9.286 13.254 ( 1.028 9.219 0.434) 9.286 13.361 ( 0.477 -1.468 -0.154) 1.551 13.361 ( 0.477 1.468 -0.154) 1.551 14.055 ( 3.317 -4.784 0.299) 5.829 14.055 ( 3.317 4.784 0.299) 5.829 14.231 ( 4.452 -3.511 0.020) 5.670 14.231 ( 4.452 3.511 0.020) 5.670 16.027 ( 3.559 -3.975 0.161) 5.338 16.027 ( 3.559 3.975 0.161) 5.338 16.364 ( -9.984 -3.153 -0.064) 10.470 16.364 ( -9.984 3.153 -0.064) 10.470 18.401 ( -1.585 -0.640 0.205) 1.722 18.401 ( -1.585 0.640 0.205) 1.722 19.060 ( 2.966 -1.009 -0.867) 3.250 19.060 ( 2.966 1.009 -0.867) 3.250 20.278 ( -0.054 -0.937 0.211) 0.962 20.278 ( -0.054 0.937 0.211) 0.962 20.701 ( 3.537 -2.240 -0.317) 4.199 20.701 ( 3.537 2.240 -0.317) 4.199 20.919 ( -2.617 -7.475 -0.334) 7.927 20.919 ( -2.617 7.475 -0.334) 7.927 20.970 ( -2.709 -5.859 0.609) 6.483 20.970 ( -2.709 5.859 0.609) 6.483 22.483 ( -0.876 -0.877 -0.494) 1.334 22.483 ( -0.876 0.877 -0.494) 1.334 22.688 ( 0.211 -0.471 0.424) 0.668 22.688 ( 0.211 0.471 0.424) 0.668 24.507 ( 6.803 -3.798 0.839) 7.836 24.507 ( 6.803 3.798 0.839) 7.836 24.661 ( 2.755 -4.270 -0.401) 5.097 24.661 ( 2.755 4.270 -0.401) 5.097 24.898 ( 10.615 -3.854 0.368) 11.299 24.898 ( 10.615 3.854 0.368) 11.299 24.989 ( 3.097 -5.191 -1.098) 6.144 24.989 ( 3.097 5.191 -1.098) 6.144 26.761 ( -1.457 -1.154 0.836) 2.038 26.761 ( -1.457 1.154 0.836) 2.038 26.916 ( 0.261 -2.257 -0.244) 2.286 26.916 ( 0.261 2.257 -0.244) 2.286 27.166 ( 0.997 -0.246 0.026) 1.027 27.166 ( 0.997 0.246 0.026) 1.027 27.279 ( -0.568 -1.355 -0.944) 1.747 27.279 ( -0.568 1.355 -0.944) 1.747 28.009 ( 2.841 -1.343 1.407) 3.443 28.009 ( 2.841 1.343 1.407) 3.443 28.448 ( -2.153 -2.526 -1.471) 3.630 28.448 ( -2.153 2.526 -1.471) 3.630 28.622 ( 2.728 -1.020 -0.841) 3.032 28.622 ( 2.728 1.020 -0.841) 3.032 28.855 ( -5.609 -4.869 1.047) 7.501 28.855 ( -5.609 4.869 1.047) 7.501 29.161 ( -1.175 -1.710 0.819) 2.231 29.161 ( -1.175 1.710 0.819) 2.231 29.663 ( -3.492 -4.891 -0.677) 6.048 29.663 ( -3.492 4.891 -0.677) 6.048 30.742 ( 0.979 -1.767 1.065) 2.284 30.742 ( 0.979 1.767 1.065) 2.284 31.152 ( 3.734 -3.444 -1.722) 5.364 31.152 ( 3.734 3.444 -1.722) 5.364 33.911 ( 1.358 -0.473 0.006) 1.438 33.911 ( 1.358 0.473 0.006) 1.438 33.966 ( -0.121 -0.315 0.045) 0.340 33.966 ( -0.121 0.315 0.045) 0.340 37.162 ( -1.252 -1.225 0.057) 1.752 37.162 ( -1.252 1.225 0.057) 1.752 37.189 ( -1.483 -1.345 -0.046) 2.003 37.189 ( -1.483 1.345 -0.046) 2.003 37.754 ( -0.233 -1.476 0.066) 1.495 37.754 ( -0.233 1.476 0.066) 1.495 37.784 ( -0.468 -0.599 -0.190) 0.784 37.784 ( -0.468 0.599 -0.190) 0.784 48.853 ( -5.160 -0.474 0.190) 5.185 48.853 ( -5.160 0.474 0.190) 5.185 48.949 ( -8.594 -1.589 -0.304) 8.745 48.949 ( -8.594 1.589 -0.304) 8.745 50.511 ( -0.139 -1.495 2.632) 3.029 50.511 ( -0.139 1.495 2.632) 3.029 50.772 ( 0.469 -7.061 -1.548) 7.244 50.772 ( 0.469 7.061 -1.548) 7.244 52.184 ( 0.386 -7.527 -0.162) 7.538 52.184 ( 0.386 7.527 -0.162) 7.538 52.240 ( 0.063 -7.789 0.371) 7.798 52.240 ( 0.063 7.789 0.371) 7.798 52.712 ( -0.878 -4.073 -0.132) 4.169 52.712 ( -0.878 4.073 -0.132) 4.169 52.818 ( -2.069 -4.988 -0.247) 5.405 52.818 ( -2.069 4.988 -0.247) 5.405 53.872 ( -0.774 -0.220 0.058) 0.807 53.872 ( -0.774 0.220 0.058) 0.807 54.188 ( 0.763 -1.095 0.021) 1.335 54.188 ( 0.763 1.095 0.021) 1.335 55.811 ( 0.022 -2.401 1.493) 2.828 55.811 ( 0.022 2.401 1.493) 2.828 55.949 ( 1.182 -4.521 -1.499) 4.907 55.949 ( 1.182 4.521 -1.499) 4.907 57.784 ( 0.162 -4.582 0.074) 4.586 57.784 ( 0.162 4.582 0.074) 4.586 57.947 ( -0.470 -6.640 -1.401) 6.802 57.947 ( -0.470 6.640 -1.401) 6.802 58.105 ( 1.307 -1.355 2.286) 2.961 58.105 ( 1.307 1.355 2.286) 2.961 58.350 ( 2.455 -3.029 -0.915) 4.005 58.350 ( 2.455 3.029 -0.915) 4.005 61.024 ( -0.001 -0.282 0.432) 0.516 61.024 ( -0.001 0.282 0.432) 0.516 61.312 ( 2.910 -2.767 -0.834) 4.101 61.312 ( 2.910 2.767 -0.834) 4.101 ======================= Grid point 153 (66/90) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 50 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( -3.287 0.000 -6.258) 7.069 1.661 ( 3.287 0.000 6.258) 7.069 1.808 ( 11.110 0.000 -5.260) 12.292 1.808 ( -11.110 0.000 5.260) 12.292 3.298 ( -5.938 0.000 -63.050) 63.329 3.298 ( 5.938 0.000 63.050) 63.329 3.649 ( -10.321 0.000 -20.066) 22.565 3.649 ( 10.321 0.000 20.066) 22.565 3.736 ( 6.458 0.000 -11.536) 13.220 3.736 ( -6.458 0.000 11.536) 13.220 4.194 ( 15.365 0.000 -5.173) 16.212 4.194 ( -15.365 0.000 5.173) 16.212 4.558 ( -10.600 0.000 -18.779) 21.564 4.558 ( 10.600 0.000 18.779) 21.564 5.115 ( 1.156 0.000 -9.052) 9.125 5.115 ( -1.156 0.000 9.052) 9.125 6.016 ( 3.293 0.000 -11.038) 11.519 6.016 ( -3.293 0.000 11.038) 11.519 6.217 ( 0.388 0.000 -2.259) 2.292 6.217 ( -0.388 0.000 2.259) 2.292 6.325 ( -6.656 0.000 -10.993) 12.851 6.325 ( 6.656 0.000 10.993) 12.851 6.874 ( 1.162 0.000 -6.661) 6.761 6.874 ( -1.162 0.000 6.661) 6.761 7.013 ( -0.065 0.000 -2.739) 2.740 7.013 ( 0.065 0.000 2.739) 2.740 7.412 ( 3.484 0.000 -4.152) 5.420 7.412 ( -3.484 0.000 4.152) 5.420 7.469 ( -5.246 0.000 -2.900) 5.994 7.469 ( 5.246 0.000 2.900) 5.994 7.570 ( 10.941 0.000 -6.233) 12.592 7.570 ( -10.941 0.000 6.233) 12.592 7.957 ( 0.388 0.000 -7.582) 7.592 7.957 ( -0.388 0.000 7.582) 7.592 8.255 ( -5.180 0.000 -9.868) 11.145 8.255 ( 5.180 0.000 9.868) 11.145 8.354 ( -1.214 0.000 -2.049) 2.382 8.354 ( 1.214 0.000 2.049) 2.382 8.994 ( -5.943 0.000 1.484) 6.126 8.994 ( 5.943 0.000 -1.484) 6.126 9.046 ( -2.034 0.000 -2.058) 2.894 9.046 ( 2.034 0.000 2.058) 2.894 9.336 ( 0.608 0.000 -8.760) 8.781 9.336 ( -0.608 0.000 8.760) 8.781 9.489 ( 14.679 0.000 -9.560) 17.517 9.489 ( -14.679 0.000 9.560) 17.517 9.634 ( -1.979 0.000 -0.655) 2.085 9.634 ( 1.979 0.000 0.655) 2.085 10.199 ( 3.813 0.000 -3.691) 5.307 10.199 ( -3.813 0.000 3.691) 5.307 10.476 ( -0.700 0.000 -4.959) 5.008 10.476 ( 0.700 0.000 4.959) 5.008 10.548 ( -1.503 0.000 0.119) 1.508 10.548 ( 1.503 0.000 -0.119) 1.508 11.084 ( 3.011 0.000 -2.173) 3.714 11.084 ( -3.011 0.000 2.173) 3.714 11.398 ( -6.585 0.000 -4.300) 7.865 11.398 ( 6.585 0.000 4.300) 7.865 11.536 ( -5.674 0.000 -9.388) 10.969 11.536 ( 5.674 0.000 9.388) 10.969 11.728 ( -6.633 0.000 -0.003) 6.633 11.728 ( 6.633 0.000 0.003) 6.633 11.984 ( -8.646 0.000 -1.990) 8.873 11.984 ( 8.646 0.000 1.990) 8.873 12.341 ( -10.150 0.000 -2.049) 10.355 12.341 ( 10.150 0.000 2.049) 10.355 12.601 ( -8.740 0.000 -0.628) 8.762 12.601 ( 8.740 0.000 0.628) 8.762 12.875 ( -1.670 0.000 -7.311) 7.499 12.875 ( 1.670 0.000 7.311) 7.499 12.970 ( 0.481 0.000 -1.789) 1.852 12.970 ( -0.481 0.000 1.789) 1.852 13.747 ( -4.006 0.000 0.932) 4.113 13.747 ( 4.006 0.000 -0.932) 4.113 13.940 ( 5.885 0.000 -3.298) 6.746 13.940 ( -5.885 0.000 3.298) 6.746 14.102 ( 10.507 0.000 -5.039) 11.653 14.102 ( -10.507 0.000 5.039) 11.653 14.244 ( -3.934 0.000 -4.225) 5.772 14.244 ( 3.934 0.000 4.225) 5.772 16.547 ( 6.115 0.000 -3.835) 7.219 16.547 ( -6.115 0.000 3.835) 7.219 17.259 ( 4.898 0.000 -6.462) 8.108 17.259 ( -4.898 0.000 6.462) 8.108 18.087 ( -1.113 0.000 -3.176) 3.365 18.087 ( 1.113 0.000 3.176) 3.365 18.325 ( 0.264 0.000 -3.751) 3.760 18.325 ( -0.264 0.000 3.751) 3.760 20.329 ( 0.087 0.000 -0.326) 0.338 20.329 ( -0.087 0.000 0.326) 0.338 20.741 ( -4.768 0.000 0.369) 4.782 20.741 ( 4.768 0.000 -0.369) 4.782 21.067 ( 2.042 0.000 -2.827) 3.487 21.067 ( -2.042 0.000 2.827) 3.487 21.291 ( -0.031 0.000 -2.211) 2.211 21.291 ( 0.031 0.000 2.211) 2.211 22.595 ( -9.293 0.000 -0.195) 9.295 22.595 ( 9.293 0.000 0.195) 9.295 22.802 ( -1.033 0.000 -1.796) 2.072 22.802 ( 1.033 0.000 1.796) 2.072 22.872 ( -0.089 0.000 -0.003) 0.089 22.872 ( 0.089 0.000 0.003) 0.089 24.097 ( 2.515 0.000 -1.545) 2.951 24.097 ( -2.515 0.000 1.545) 2.951 24.578 ( 4.961 0.000 -5.395) 7.329 24.578 ( -4.961 0.000 5.395) 7.329 25.416 ( 3.312 0.000 -3.005) 4.472 25.416 ( -3.312 0.000 3.005) 4.472 26.884 ( 0.724 0.000 -2.189) 2.305 26.884 ( -0.724 0.000 2.189) 2.305 27.233 ( 1.297 0.000 -1.923) 2.320 27.233 ( -1.297 0.000 1.923) 2.320 27.518 ( -2.583 0.000 -3.782) 4.580 27.518 ( 2.583 0.000 3.782) 4.580 27.760 ( 6.412 0.000 -4.465) 7.814 27.760 ( -6.412 0.000 4.465) 7.814 27.928 ( 6.301 0.000 -2.329) 6.718 27.928 ( -6.301 0.000 2.329) 6.718 28.185 ( -16.649 0.000 3.108) 16.937 28.185 ( 16.649 0.000 -3.108) 16.937 28.471 ( -1.655 0.000 -4.324) 4.630 28.471 ( 1.655 0.000 4.324) 4.630 28.695 ( -2.577 0.000 0.062) 2.578 28.695 ( 2.577 0.000 -0.062) 2.578 28.990 ( -8.118 0.000 -2.216) 8.415 28.990 ( 8.118 0.000 2.216) 8.415 29.314 ( 1.313 0.000 -1.894) 2.304 29.314 ( -1.313 0.000 1.894) 2.304 30.620 ( -0.804 0.000 -0.308) 0.861 30.620 ( 0.804 0.000 0.308) 0.861 30.671 ( -0.191 0.000 0.020) 0.192 30.671 ( 0.191 0.000 -0.020) 0.192 33.982 ( -1.093 0.000 -0.597) 1.245 33.982 ( 1.093 0.000 0.597) 1.245 34.026 ( -5.302 0.000 -0.424) 5.319 34.026 ( 5.302 0.000 0.424) 5.319 37.225 ( 0.278 0.000 -0.526) 0.595 37.225 ( -0.278 0.000 0.526) 0.595 37.292 ( -2.397 0.000 0.192) 2.405 37.292 ( 2.397 0.000 -0.192) 2.405 37.571 ( 3.743 0.000 -1.627) 4.081 37.571 ( -3.743 0.000 1.627) 4.081 37.703 ( -4.392 0.000 -0.926) 4.488 37.703 ( 4.392 0.000 0.926) 4.488 48.807 ( -6.271 0.000 1.155) 6.376 48.807 ( 6.271 0.000 -1.155) 6.376 48.910 ( -2.961 0.000 0.078) 2.962 48.910 ( 2.961 0.000 -0.078) 2.962 50.580 ( 1.139 0.000 -2.419) 2.674 50.580 ( -1.139 0.000 2.419) 2.674 51.545 ( -13.673 0.000 3.570) 14.131 51.545 ( 13.673 0.000 -3.570) 14.131 51.731 ( 0.873 0.000 -0.301) 0.923 51.731 ( -0.873 0.000 0.301) 0.923 52.273 ( 0.110 0.000 -0.239) 0.263 52.273 ( -0.110 0.000 0.239) 0.263 52.795 ( -15.580 0.000 -0.732) 15.597 52.795 ( 15.580 0.000 0.732) 15.597 53.178 ( -1.287 0.000 -3.181) 3.432 53.178 ( 1.287 0.000 3.181) 3.432 53.809 ( 0.390 0.000 -0.718) 0.818 53.809 ( -0.390 0.000 0.718) 0.818 54.373 ( -1.086 0.000 0.184) 1.102 54.373 ( 1.086 0.000 -0.184) 1.102 55.734 ( 0.367 0.000 -1.593) 1.635 55.734 ( -0.367 0.000 1.593) 1.635 56.866 ( -4.342 0.000 -0.545) 4.376 56.866 ( 4.342 0.000 0.545) 4.376 57.379 ( -0.064 0.000 0.014) 0.066 57.379 ( 0.064 0.000 -0.014) 0.066 57.389 ( -0.075 0.000 -0.034) 0.083 57.389 ( 0.075 0.000 0.034) 0.083 58.371 ( -1.562 0.000 -0.681) 1.704 58.371 ( 1.562 0.000 0.681) 1.704 58.669 ( -22.590 0.000 -0.237) 22.591 58.669 ( 22.590 0.000 0.237) 22.591 60.914 ( 0.055 0.000 -0.156) 0.165 60.914 ( -0.055 0.000 0.156) 0.165 60.949 ( -0.123 0.000 0.017) 0.124 60.949 ( 0.123 0.000 -0.017) 0.124 ======================= Grid point 155 (67/90) ======================= q-point: ( 0.12 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.859 ( 11.367 0.000 9.615) 14.888 2.014 ( 31.822 0.000 -14.218) 34.854 2.091 ( 33.763 0.000 -24.340) 41.622 2.271 ( 25.822 0.000 24.830) 35.823 3.100 ( 1.819 0.000 -33.963) 34.012 3.444 ( 6.740 0.000 -44.838) 45.342 3.498 ( 0.524 0.000 13.266) 13.276 3.735 ( -5.255 0.000 36.432) 36.809 3.949 ( 7.252 0.000 23.379) 24.478 4.007 ( 17.626 0.000 -12.651) 21.696 4.155 ( 22.197 0.000 13.283) 25.868 4.506 ( 14.094 0.000 1.589) 14.183 4.552 ( 15.061 0.000 -8.784) 17.435 4.986 ( 22.968 0.000 15.657) 27.797 5.202 ( 8.949 0.000 -8.859) 12.592 5.213 ( 7.839 0.000 9.451) 12.279 5.854 ( -14.503 0.000 12.437) 19.105 5.862 ( -14.292 0.000 -16.934) 22.159 6.193 ( 0.350 0.000 -11.691) 11.696 6.222 ( -0.311 0.000 1.840) 1.866 6.243 ( -0.639 0.000 -0.387) 0.747 6.532 ( 8.892 0.000 10.307) 13.613 6.857 ( -1.204 0.000 9.253) 9.331 6.879 ( 2.082 0.000 -4.352) 4.824 7.044 ( 2.464 0.000 -0.612) 2.539 7.052 ( 1.576 0.000 5.217) 5.449 7.298 ( -3.171 0.000 -0.598) 3.227 7.329 ( -6.622 0.000 0.136) 6.624 7.348 ( -6.545 0.000 -3.585) 7.463 7.482 ( -2.319 0.000 4.818) 5.347 7.514 ( -0.418 0.000 1.743) 1.792 7.817 ( 3.818 0.000 0.432) 3.842 7.894 ( -4.724 0.000 -7.184) 8.598 7.945 ( 0.662 0.000 9.176) 9.200 8.082 ( -7.388 0.000 -1.487) 7.537 8.239 ( -1.195 0.000 2.999) 3.228 8.403 ( 2.056 0.000 -2.840) 3.506 8.465 ( 6.226 0.000 2.344) 6.653 8.928 ( -1.528 0.000 -6.152) 6.338 9.003 ( -0.421 0.000 2.454) 2.490 9.043 ( -2.061 0.000 -14.147) 14.296 9.168 ( 7.673 0.000 -2.983) 8.232 9.228 ( -5.626 0.000 15.957) 16.920 9.374 ( 0.923 0.000 2.688) 2.842 9.378 ( 6.416 0.000 -12.284) 13.859 9.589 ( 1.527 0.000 -8.615) 8.749 9.648 ( 1.716 0.000 -2.017) 2.648 9.820 ( 9.843 0.000 0.423) 9.852 10.106 ( -5.223 0.000 3.085) 6.066 10.260 ( 2.825 0.000 -1.125) 3.041 10.458 ( -3.312 0.000 2.462) 4.127 10.489 ( -3.802 0.000 12.084) 12.667 10.570 ( 5.788 0.000 5.770) 8.173 10.582 ( 2.399 0.000 0.443) 2.440 10.975 ( -6.891 0.000 -0.249) 6.895 11.060 ( -5.049 0.000 -3.364) 6.067 11.209 ( -8.350 0.000 -4.851) 9.657 11.371 ( -6.155 0.000 -12.953) 14.341 11.386 ( -7.197 0.000 -0.815) 7.243 11.565 ( -6.795 0.000 -1.287) 6.916 11.699 ( 2.559 0.000 8.894) 9.255 11.820 ( -0.876 0.000 7.121) 7.175 11.905 ( 5.754 0.000 3.249) 6.608 12.047 ( -3.306 0.000 -2.202) 3.972 12.231 ( 4.991 0.000 0.742) 5.046 12.448 ( -5.195 0.000 -4.078) 6.604 12.476 ( 3.912 0.000 -0.056) 3.913 12.678 ( -1.431 0.000 -2.269) 2.683 12.893 ( 4.096 0.000 -4.858) 6.354 12.931 ( -0.508 0.000 -1.713) 1.787 13.016 ( 4.279 0.000 2.304) 4.859 13.027 ( 4.329 0.000 0.784) 4.399 13.582 ( -11.100 0.000 -2.428) 11.363 13.802 ( -2.827 0.000 0.886) 2.963 13.805 ( 2.006 0.000 0.122) 2.010 13.952 ( -0.841 0.000 -5.330) 5.396 14.082 ( 2.737 0.000 3.355) 4.330 14.126 ( -5.465 0.000 -8.889) 10.434 14.310 ( 1.168 0.000 2.222) 2.510 14.341 ( 7.458 0.000 -10.612) 12.971 16.514 ( 1.641 0.000 -0.626) 1.757 16.698 ( 6.339 0.000 -0.614) 6.369 17.225 ( 0.942 0.000 6.180) 6.251 17.379 ( 8.005 0.000 -5.140) 9.513 18.040 ( -2.553 0.000 -1.963) 3.221 18.105 ( -0.156 0.000 3.806) 3.809 18.291 ( -2.380 0.000 -4.800) 5.357 18.308 ( -1.961 0.000 2.043) 2.831 20.285 ( -3.573 0.000 0.112) 3.575 20.287 ( -3.287 0.000 -1.008) 3.438 20.601 ( -6.222 0.000 -4.237) 7.528 20.755 ( -2.617 0.000 2.039) 3.318 21.065 ( 0.534 0.000 1.959) 2.031 21.110 ( 1.292 0.000 -3.990) 4.194 21.361 ( 6.602 0.000 2.360) 7.011 21.368 ( 8.056 0.000 -2.126) 8.332 22.440 ( -3.071 0.000 -0.986) 3.226 22.661 ( -1.366 0.000 -2.160) 2.556 22.802 ( 0.623 0.000 -2.341) 2.423 22.884 ( 3.227 0.000 -0.159) 3.230 22.889 ( 1.730 0.000 -0.977) 1.986 22.891 ( 1.729 0.000 -0.262) 1.749 24.030 ( -4.240 0.000 0.495) 4.269 24.118 ( -0.625 0.000 -1.678) 1.791 24.450 ( -8.145 0.000 4.385) 9.250 24.622 ( 0.649 0.000 -4.357) 4.405 25.262 ( -11.352 0.000 2.776) 11.687 25.376 ( -5.966 0.000 -1.534) 6.159 26.903 ( 1.916 0.000 2.217) 2.930 26.914 ( 2.477 0.000 -1.829) 3.079 27.118 ( -13.655 0.000 9.512) 16.642 27.236 ( -0.381 0.000 -2.762) 2.788 27.293 ( -5.136 0.000 6.162) 8.022 27.506 ( -2.869 0.000 4.717) 5.521 27.681 ( 1.113 0.000 1.327) 1.731 27.808 ( 0.376 0.000 -2.731) 2.756 27.847 ( -1.085 0.000 2.582) 2.801 27.964 ( -6.975 0.000 6.176) 9.316 27.975 ( 1.031 0.000 -5.233) 5.333 28.272 ( -2.550 0.000 6.506) 6.988 28.481 ( 0.671 0.000 -4.407) 4.458 28.559 ( -9.441 0.000 3.073) 9.928 28.648 ( 2.585 0.000 1.170) 2.838 28.662 ( 9.620 0.000 1.787) 9.785 29.104 ( 8.593 0.000 1.513) 8.725 29.321 ( 1.803 0.000 1.474) 2.329 29.336 ( 3.188 0.000 -0.419) 3.215 29.475 ( 14.707 0.000 7.932) 16.709 30.627 ( 1.168 0.000 -0.469) 1.258 30.649 ( 0.296 0.000 0.482) 0.566 30.667 ( -0.114 0.000 -0.070) 0.134 30.699 ( 3.062 0.000 2.094) 3.710 33.911 ( -4.097 0.000 1.243) 4.281 33.947 ( -1.863 0.000 0.169) 1.870 34.013 ( 0.733 0.000 1.238) 1.439 34.081 ( -1.047 0.000 -0.674) 1.245 37.226 ( 0.344 0.000 0.320) 0.470 37.229 ( 1.036 0.000 -0.062) 1.038 37.268 ( 1.110 0.000 -0.528) 1.230 37.324 ( 0.998 0.000 -0.720) 1.231 37.505 ( -0.388 0.000 0.505) 0.637 37.587 ( -0.110 0.000 -1.854) 1.858 37.696 ( 1.948 0.000 -1.930) 2.742 37.843 ( 5.995 0.000 -3.420) 6.902 48.900 ( 9.368 0.000 2.914) 9.811 48.929 ( 4.469 0.000 0.111) 4.470 49.088 ( 17.313 0.000 -8.002) 19.073 49.133 ( 20.153 0.000 8.806) 21.993 50.560 ( -1.202 0.000 2.157) 2.470 50.579 ( -1.121 0.000 -2.941) 3.147 51.126 ( -18.559 0.000 -11.097) 21.623 51.590 ( -5.257 0.000 -6.653) 8.479 51.730 ( 0.443 0.000 0.002) 0.443 51.741 ( -0.175 0.000 -1.291) 1.303 52.275 ( 0.230 0.000 0.260) 0.347 52.277 ( 0.359 0.000 0.141) 0.385 52.582 ( -4.941 0.000 -2.136) 5.383 53.044 ( 3.472 0.000 -9.061) 9.703 53.242 ( 3.574 0.000 2.749) 4.509 53.244 ( 10.409 0.000 -5.879) 11.955 53.820 ( 1.313 0.000 0.855) 1.566 53.827 ( 1.446 0.000 -0.975) 1.744 54.345 ( -1.230 0.000 -1.074) 1.633 54.373 ( -1.392 0.000 0.539) 1.493 55.742 ( 0.720 0.000 1.654) 1.804 55.747 ( 1.336 0.000 -1.705) 2.166 56.656 ( -11.990 0.000 -6.835) 13.801 56.726 ( -17.829 0.000 7.259) 19.250 57.378 ( 0.017 0.000 0.042) 0.046 57.380 ( 0.087 0.000 -0.062) 0.107 57.390 ( 0.219 0.000 0.015) 0.219 57.392 ( 0.235 0.000 0.017) 0.235 58.176 ( -9.249 0.000 4.306) 10.202 58.297 ( -3.566 0.000 0.988) 3.700 58.538 ( 2.892 0.000 6.081) 6.734 58.989 ( 3.714 0.000 4.860) 6.117 60.915 ( 0.048 0.000 0.146) 0.154 60.916 ( 0.143 0.000 -0.161) 0.215 60.946 ( -0.180 0.000 0.047) 0.186 60.951 ( 0.021 0.000 -0.039) 0.045 ======================= Grid point 156 (68/90) ======================= q-point: ( 0.25 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.214 ( 19.759 0.000 -3.180) 20.013 2.433 ( 9.006 0.000 -11.106) 14.299 2.689 ( 20.991 0.000 -13.858) 25.153 2.879 ( 28.055 0.000 20.682) 34.854 3.228 ( 14.252 0.000 -15.033) 20.715 3.474 ( -16.745 0.000 17.310) 24.084 3.650 ( 11.616 0.000 14.227) 18.367 3.892 ( 47.780 0.000 -44.143) 65.050 4.329 ( 14.927 0.000 -10.473) 18.234 4.397 ( 23.794 0.000 2.293) 23.904 4.727 ( 17.564 0.000 -5.426) 18.383 4.777 ( 9.214 0.000 7.796) 12.070 5.153 ( 39.802 0.000 33.919) 52.294 5.368 ( -0.245 0.000 7.096) 7.101 5.401 ( 8.830 0.000 -6.044) 10.700 5.458 ( -10.262 0.000 -16.868) 19.744 5.468 ( 11.906 0.000 8.025) 14.359 5.607 ( -2.972 0.000 16.786) 17.047 6.172 ( -3.638 0.000 -1.496) 3.934 6.183 ( 0.027 0.000 -6.821) 6.821 6.291 ( 6.903 0.000 8.279) 10.779 6.684 ( 1.722 0.000 8.462) 8.636 6.902 ( 3.014 0.000 0.834) 3.127 6.940 ( 3.095 0.000 -4.061) 5.106 7.065 ( -3.005 0.000 5.045) 5.872 7.093 ( 2.238 0.000 1.317) 2.597 7.155 ( -7.659 0.000 -4.936) 9.112 7.212 ( -1.920 0.000 -6.536) 6.812 7.308 ( 0.058 0.000 -1.362) 1.363 7.476 ( -0.335 0.000 3.612) 3.627 7.524 ( 1.589 0.000 -0.985) 1.869 7.673 ( -11.201 0.000 1.955) 11.370 7.774 ( -2.297 0.000 -0.508) 2.353 7.949 ( -5.807 0.000 2.317) 6.253 8.058 ( 2.528 0.000 11.510) 11.784 8.276 ( 2.914 0.000 -2.026) 3.549 8.422 ( 0.855 0.000 -6.753) 6.807 8.568 ( 3.858 0.000 -1.460) 4.125 8.846 ( -3.574 0.000 -4.971) 6.123 8.889 ( -7.477 0.000 -13.921) 15.802 9.083 ( 5.856 0.000 2.037) 6.200 9.196 ( -1.397 0.000 11.358) 11.443 9.361 ( 5.664 0.000 -6.710) 8.782 9.404 ( 3.735 0.000 3.484) 5.108 9.502 ( 6.962 0.000 -10.092) 12.260 9.570 ( -2.013 0.000 -2.734) 3.395 9.672 ( 2.039 0.000 -6.599) 6.907 9.867 ( -3.612 0.000 -10.577) 11.176 10.121 ( 4.713 0.000 11.771) 12.679 10.318 ( 3.412 0.000 1.665) 3.797 10.402 ( -1.579 0.000 5.331) 5.560 10.420 ( -5.810 0.000 6.002) 8.354 10.575 ( -3.579 0.000 3.491) 4.999 10.752 ( 6.367 0.000 6.861) 9.361 10.880 ( 0.269 0.000 -2.152) 2.169 10.912 ( -3.841 0.000 -5.170) 6.441 11.025 ( -8.516 0.000 -1.912) 8.728 11.214 ( -7.774 0.000 -1.825) 7.985 11.239 ( -3.985 0.000 -5.702) 6.956 11.383 ( -7.514 0.000 -3.508) 8.292 11.752 ( -1.784 0.000 5.289) 5.582 11.768 ( -5.793 0.000 5.688) 8.119 12.011 ( 0.270 0.000 6.388) 6.393 12.083 ( 7.049 0.000 7.054) 9.973 12.252 ( -6.061 0.000 -5.568) 8.231 12.440 ( 5.790 0.000 5.958) 8.308 12.490 ( -5.434 0.000 -4.724) 7.200 12.617 ( -0.175 0.000 -1.131) 1.144 12.836 ( -6.374 0.000 -1.820) 6.629 12.960 ( 2.159 0.000 -3.186) 3.848 13.111 ( 3.387 0.000 -0.515) 3.426 13.135 ( 5.204 0.000 3.024) 6.019 13.359 ( -8.568 0.000 -1.467) 8.692 13.776 ( -0.592 0.000 -0.390) 0.709 13.830 ( -1.148 0.000 0.666) 1.327 13.850 ( -8.101 0.000 -8.645) 11.847 14.000 ( -1.410 0.000 -6.495) 6.647 14.177 ( 4.711 0.000 5.587) 7.308 14.299 ( -2.444 0.000 0.624) 2.522 14.389 ( 1.466 0.000 -4.060) 4.317 16.554 ( 2.293 0.000 -4.648) 5.183 16.744 ( -1.755 0.000 3.652) 4.052 17.350 ( 8.422 0.000 3.680) 9.191 17.531 ( 6.702 0.000 -3.977) 7.793 17.981 ( -2.420 0.000 0.005) 2.420 18.111 ( -0.095 0.000 3.454) 3.455 18.210 ( -3.691 0.000 -4.749) 6.015 18.264 ( -2.319 0.000 0.478) 2.368 20.206 ( -3.564 0.000 0.292) 3.576 20.212 ( -3.263 0.000 -0.979) 3.406 20.513 ( -0.427 0.000 -5.400) 5.417 20.715 ( -1.269 0.000 4.848) 5.012 21.043 ( -3.782 0.000 1.083) 3.934 21.065 ( -3.700 0.000 -4.484) 5.813 21.587 ( 13.106 0.000 1.910) 13.244 21.593 ( 12.953 0.000 -1.620) 13.053 22.436 ( 1.233 0.000 2.550) 2.832 22.610 ( -2.117 0.000 -3.039) 3.703 22.807 ( 0.452 0.000 -2.298) 2.342 22.881 ( -2.179 0.000 0.781) 2.315 22.943 ( 3.471 0.000 -0.404) 3.494 22.944 ( 3.679 0.000 0.506) 3.713 23.915 ( -7.078 0.000 -0.739) 7.116 24.023 ( -9.458 0.000 1.134) 9.526 24.312 ( -4.062 0.000 -0.247) 4.070 24.578 ( -4.484 0.000 -0.370) 4.499 25.016 ( -10.716 0.000 0.115) 10.717 25.200 ( -9.724 0.000 0.473) 9.736 26.967 ( 2.802 0.000 -1.049) 2.992 26.969 ( 3.664 0.000 1.921) 4.137 27.003 ( -0.002 0.000 7.091) 7.091 27.203 ( -1.951 0.000 -2.428) 3.114 27.275 ( -0.411 0.000 0.268) 0.490 27.432 ( -5.321 0.000 3.489) 6.363 27.718 ( 0.151 0.000 2.573) 2.578 27.770 ( -2.642 0.000 -2.809) 3.856 27.808 ( -2.143 0.000 1.637) 2.697 27.926 ( 1.900 0.000 5.644) 5.956 27.976 ( 0.253 0.000 -4.666) 4.672 28.261 ( -0.053 0.000 5.437) 5.437 28.399 ( -5.880 0.000 2.409) 6.354 28.481 ( 0.553 0.000 -4.672) 4.705 28.744 ( 5.080 0.000 1.192) 5.218 28.835 ( 6.535 0.000 -1.050) 6.619 29.243 ( 3.901 0.000 4.108) 5.665 29.386 ( 2.085 0.000 -0.291) 2.105 29.405 ( 5.230 0.000 1.002) 5.326 29.576 ( -1.531 0.000 -2.958) 3.331 30.647 ( 0.458 0.000 -0.413) 0.617 30.647 ( -0.145 0.000 0.178) 0.230 30.675 ( 1.148 0.000 -0.258) 1.177 30.751 ( 0.813 0.000 1.681) 1.867 33.859 ( -1.377 0.000 0.553) 1.484 33.909 ( -1.768 0.000 0.707) 1.904 34.024 ( -0.079 0.000 1.619) 1.621 34.032 ( -1.713 0.000 -3.369) 3.779 37.242 ( 1.075 0.000 0.154) 1.086 37.262 ( 1.396 0.000 -0.206) 1.411 37.312 ( 2.131 0.000 1.280) 2.486 37.339 ( 0.659 0.000 -0.532) 0.847 37.544 ( 2.418 0.000 3.846) 4.543 37.583 ( 0.352 0.000 -2.080) 2.110 37.742 ( 2.916 0.000 -1.795) 3.425 37.909 ( 1.558 0.000 -2.479) 2.928 49.072 ( 8.417 0.000 0.728) 8.449 49.096 ( 9.035 0.000 0.507) 9.049 49.397 ( 13.988 0.000 -8.714) 16.480 49.639 ( 17.747 0.000 21.409) 27.808 50.502 ( -3.775 0.000 -5.713) 6.848 50.545 ( -0.646 0.000 1.255) 1.411 50.872 ( -3.464 0.000 -9.096) 9.734 51.373 ( -12.170 0.000 -4.415) 12.946 51.741 ( 0.381 0.000 -0.369) 0.530 51.742 ( 0.646 0.000 -0.065) 0.649 52.283 ( 0.465 0.000 0.079) 0.472 52.288 ( 0.486 0.000 0.394) 0.626 52.534 ( -0.070 0.000 3.042) 3.043 53.005 ( -2.791 0.000 -10.228) 10.602 53.326 ( 3.403 0.000 3.059) 4.575 53.402 ( 5.456 0.000 -8.228) 9.873 53.859 ( 1.789 0.000 -1.457) 2.307 53.864 ( 2.319 0.000 0.901) 2.488 54.318 ( -0.940 0.000 -2.408) 2.585 54.323 ( -3.500 0.000 4.012) 5.324 55.773 ( 1.845 0.000 1.932) 2.672 55.778 ( 2.097 0.000 -2.038) 2.924 56.353 ( -17.436 0.000 13.324) 21.944 56.390 ( -10.809 0.000 -9.185) 14.185 57.380 ( 0.107 0.000 0.086) 0.137 57.382 ( 0.112 0.000 -0.117) 0.162 57.396 ( 0.303 0.000 0.036) 0.305 57.398 ( 0.267 0.000 -0.020) 0.267 58.139 ( 2.279 0.000 -1.353) 2.651 58.247 ( -1.674 0.000 2.684) 3.163 58.615 ( 2.289 0.000 6.575) 6.962 58.945 ( -5.245 0.000 -2.593) 5.851 60.917 ( 0.106 0.000 0.130) 0.168 60.919 ( 0.169 0.000 -0.181) 0.248 60.943 ( -0.140 0.000 0.140) 0.198 60.950 ( -0.080 0.000 -0.097) 0.126 ======================= Grid point 157 (69/90) ======================= q-point: ( 0.38 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.535 ( 7.957 0.000 -14.558) 16.590 2.620 ( 17.841 0.000 1.116) 17.876 2.858 ( -1.373 0.000 2.918) 3.224 3.132 ( -12.814 0.000 12.708) 18.047 3.532 ( 19.316 0.000 -18.713) 26.894 3.565 ( 25.613 0.000 9.915) 27.465 4.063 ( 21.219 0.000 8.857) 22.993 4.485 ( -1.005 0.000 -7.972) 8.036 4.549 ( -21.787 0.000 4.324) 22.212 4.693 ( 4.718 0.000 -23.067) 23.544 4.887 ( 19.038 0.000 -6.657) 20.169 4.911 ( 24.942 0.000 9.048) 26.533 5.295 ( -0.353 0.000 7.091) 7.100 5.377 ( 5.850 0.000 -26.419) 27.059 5.620 ( 11.668 0.000 -10.614) 15.773 5.672 ( 11.483 0.000 5.003) 12.526 5.809 ( 11.456 0.000 16.790) 20.326 6.097 ( -7.319 0.000 6.561) 9.829 6.143 ( 12.316 0.000 19.603) 23.151 6.267 ( 33.727 0.000 20.632) 39.537 6.590 ( 14.644 0.000 7.547) 16.474 6.668 ( -0.234 0.000 1.854) 1.869 6.837 ( -13.015 0.000 -6.415) 14.510 6.936 ( -0.544 0.000 -4.173) 4.208 6.965 ( -5.707 0.000 -4.326) 7.162 6.999 ( -2.970 0.000 -5.169) 5.962 7.097 ( -4.317 0.000 -0.911) 4.412 7.264 ( 5.104 0.000 -2.882) 5.861 7.321 ( 4.186 0.000 5.649) 7.031 7.435 ( -10.305 0.000 2.301) 10.559 7.438 ( -2.748 0.000 0.426) 2.781 7.550 ( -0.030 0.000 -5.131) 5.131 7.793 ( -4.207 0.000 8.587) 9.563 7.930 ( 7.891 0.000 5.974) 9.897 8.092 ( -2.615 0.000 8.652) 9.038 8.284 ( -2.863 0.000 -4.742) 5.539 8.394 ( -0.861 0.000 -11.943) 11.974 8.594 ( -14.249 0.000 -11.505) 18.314 8.650 ( 2.431 0.000 -7.450) 7.836 8.779 ( -1.992 0.000 -1.422) 2.448 9.200 ( 0.207 0.000 6.018) 6.021 9.211 ( 4.953 0.000 2.467) 5.533 9.350 ( -1.949 0.000 -3.112) 3.672 9.419 ( -8.217 0.000 -5.376) 9.819 9.564 ( 7.257 0.000 3.278) 7.963 9.628 ( 3.812 0.000 1.780) 4.207 9.704 ( 2.191 0.000 -4.678) 5.166 9.780 ( -0.295 0.000 -15.392) 15.394 10.218 ( 0.397 0.000 13.816) 13.822 10.277 ( -4.803 0.000 -6.473) 8.060 10.387 ( 1.272 0.000 1.924) 2.307 10.436 ( 1.372 0.000 3.263) 3.540 10.623 ( 7.553 0.000 6.068) 9.689 10.699 ( -2.623 0.000 -7.631) 8.069 10.891 ( -2.812 0.000 -3.693) 4.641 10.900 ( -0.901 0.000 2.874) 3.012 11.056 ( -6.606 0.000 3.781) 7.611 11.059 ( 8.563 0.000 10.070) 13.219 11.210 ( 2.647 0.000 -2.801) 3.854 11.245 ( -4.744 0.000 0.052) 4.744 11.641 ( -6.381 0.000 3.592) 7.323 11.666 ( -5.069 0.000 -0.569) 5.101 12.050 ( -5.206 0.000 8.357) 9.846 12.094 ( -0.793 0.000 -4.099) 4.175 12.166 ( -3.381 0.000 5.323) 6.306 12.237 ( -11.413 0.000 -10.123) 15.256 12.577 ( 4.384 0.000 7.066) 8.316 12.643 ( 1.484 0.000 -6.194) 6.369 12.766 ( 0.842 0.000 4.559) 4.636 12.937 ( -2.908 0.000 -5.974) 6.644 13.167 ( 2.190 0.000 -0.104) 2.193 13.200 ( -0.041 0.000 3.252) 3.253 13.272 ( 0.976 0.000 0.340) 1.033 13.577 ( -11.832 0.000 -8.571) 14.610 13.772 ( 0.534 0.000 -1.444) 1.540 13.818 ( -1.544 0.000 1.490) 2.146 14.025 ( 3.759 0.000 -2.809) 4.693 14.217 ( -4.589 0.000 0.663) 4.636 14.295 ( 3.956 0.000 5.725) 6.958 14.402 ( 0.285 0.000 -2.588) 2.604 16.588 ( 2.583 0.000 -5.952) 6.488 16.692 ( -3.747 0.000 5.676) 6.801 17.524 ( 6.348 0.000 1.465) 6.515 17.613 ( 1.911 0.000 -1.908) 2.701 17.957 ( 0.126 0.000 2.852) 2.855 18.085 ( -3.295 0.000 -3.806) 5.034 18.160 ( 0.382 0.000 1.731) 1.773 18.220 ( -1.728 0.000 -1.124) 2.061 20.149 ( -1.887 0.000 0.412) 1.932 20.155 ( -1.913 0.000 -0.639) 2.016 20.557 ( 5.565 0.000 -3.563) 6.608 20.735 ( 1.600 0.000 3.841) 4.160 20.919 ( -7.753 0.000 2.332) 8.096 20.958 ( -4.919 0.000 -4.466) 6.644 21.846 ( 10.305 0.000 -1.305) 10.387 21.852 ( 10.183 0.000 1.493) 10.292 22.478 ( 1.794 0.000 3.583) 4.007 22.565 ( -1.356 0.000 -3.688) 3.929 22.811 ( 0.590 0.000 -1.888) 1.978 22.840 ( -1.686 0.000 1.829) 2.488 23.043 ( 6.397 0.000 -0.428) 6.411 23.053 ( 6.645 0.000 0.444) 6.660 23.721 ( -10.850 0.000 -1.662) 10.976 23.754 ( -14.767 0.000 2.134) 14.920 24.282 ( 1.031 0.000 -3.496) 3.645 24.443 ( -7.740 0.000 4.476) 8.942 24.877 ( -2.017 0.000 -3.669) 4.187 25.011 ( -8.141 0.000 2.449) 8.501 27.021 ( 2.407 0.000 0.756) 2.523 27.053 ( 3.524 0.000 1.017) 3.668 27.076 ( 4.554 0.000 1.223) 4.715 27.152 ( -1.984 0.000 -0.842) 2.156 27.243 ( -2.448 0.000 -1.979) 3.148 27.313 ( -6.377 0.000 1.644) 6.585 27.690 ( -1.939 0.000 5.225) 5.573 27.714 ( -1.611 0.000 -2.958) 3.368 27.836 ( 2.983 0.000 -0.174) 2.988 27.951 ( -1.717 0.000 -2.143) 2.746 28.015 ( 4.423 0.000 6.275) 7.677 28.235 ( -3.640 0.000 -2.771) 4.575 28.367 ( 1.548 0.000 5.119) 5.348 28.468 ( -0.605 0.000 -4.983) 5.019 28.845 ( 3.919 0.000 2.144) 4.467 28.920 ( 2.096 0.000 -2.963) 3.629 29.316 ( 2.505 0.000 3.531) 4.329 29.407 ( -0.404 0.000 -1.186) 1.253 29.500 ( 2.885 0.000 1.603) 3.300 29.530 ( -0.343 0.000 -4.248) 4.262 30.647 ( 0.048 0.000 0.292) 0.296 30.649 ( 0.042 0.000 -0.249) 0.253 30.706 ( 1.578 0.000 -0.157) 1.585 30.753 ( -0.547 0.000 0.289) 0.619 33.847 ( 0.104 0.000 -0.307) 0.324 33.878 ( -1.396 0.000 0.924) 1.674 34.007 ( 0.050 0.000 -2.769) 2.769 34.020 ( -0.644 0.000 1.789) 1.902 37.267 ( 1.129 0.000 0.244) 1.155 37.283 ( 0.634 0.000 -0.498) 0.806 37.345 ( 0.785 0.000 0.698) 1.051 37.349 ( 0.430 0.000 -0.357) 0.559 37.590 ( 0.793 0.000 -2.339) 2.470 37.591 ( 0.709 0.000 3.888) 3.952 37.807 ( 3.351 0.000 -0.395) 3.374 37.909 ( -0.861 0.000 -1.344) 1.596 49.246 ( 6.959 0.000 0.882) 7.015 49.263 ( 6.286 0.000 -0.280) 6.292 49.627 ( 10.211 0.000 -5.780) 11.733 49.866 ( 0.054 0.000 11.614) 11.614 50.474 ( 1.946 0.000 -0.344) 1.976 50.538 ( -0.332 0.000 -0.236) 0.407 50.850 ( 2.074 0.000 -4.844) 5.269 51.114 ( -11.080 0.000 -1.135) 11.138 51.750 ( 0.421 0.000 -0.101) 0.433 51.753 ( 0.363 0.000 -0.165) 0.399 52.292 ( 0.391 0.000 -0.068) 0.397 52.296 ( 0.190 0.000 0.316) 0.368 52.595 ( 4.171 0.000 8.741) 9.685 52.889 ( -5.176 0.000 -11.587) 12.690 53.395 ( 2.168 0.000 3.968) 4.522 53.447 ( 1.407 0.000 -6.706) 6.852 53.891 ( 1.609 0.000 -1.596) 2.267 53.907 ( 1.216 0.000 0.739) 1.423 54.272 ( -2.295 0.000 6.167) 6.580 54.290 ( -0.808 0.000 -3.962) 4.044 55.823 ( 2.765 0.000 -2.537) 3.752 55.829 ( 2.745 0.000 2.238) 3.542 56.107 ( -9.454 0.000 10.688) 14.269 56.167 ( -7.856 0.000 -8.425) 11.519 57.382 ( 0.101 0.000 0.123) 0.159 57.384 ( 0.076 0.000 -0.141) 0.160 57.402 ( 0.198 0.000 0.049) 0.204 57.403 ( 0.173 0.000 -0.045) 0.179 58.193 ( 2.877 0.000 -3.458) 4.498 58.235 ( -0.596 0.000 3.410) 3.462 58.671 ( 1.608 0.000 6.296) 6.498 58.823 ( -4.704 0.000 -5.193) 7.007 60.919 ( 0.107 0.000 0.129) 0.167 60.921 ( 0.096 0.000 -0.189) 0.212 60.942 ( -0.011 0.000 0.224) 0.224 60.947 ( -0.146 0.000 -0.167) 0.222 ======================= Grid point 158 (70/90) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 50 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.709 ( 11.860 0.000 -13.547) 18.005 2.709 ( -11.860 0.000 13.547) 18.005 2.925 ( -10.646 0.000 -0.425) 10.655 2.925 ( 10.646 0.000 0.425) 10.655 3.905 ( -11.960 0.000 -1.866) 12.105 3.905 ( 11.960 0.000 1.866) 12.105 4.199 ( -10.388 0.000 -19.430) 22.032 4.199 ( 10.388 0.000 19.430) 22.032 4.521 ( -11.701 0.000 -14.471) 18.610 4.521 ( 11.701 0.000 14.471) 18.610 5.179 ( 8.785 0.000 -5.013) 10.114 5.179 ( -8.785 0.000 5.013) 10.114 5.325 ( -3.284 0.000 -23.266) 23.496 5.325 ( 3.284 0.000 23.266) 23.496 5.814 ( 10.364 0.000 -9.939) 14.359 5.814 ( -10.364 0.000 9.939) 14.359 6.142 ( -16.893 0.000 3.637) 17.280 6.142 ( 16.893 0.000 -3.637) 17.280 6.305 ( -26.673 0.000 -14.891) 30.548 6.305 ( 26.673 0.000 14.891) 30.548 6.621 ( -11.510 0.000 -4.675) 12.423 6.621 ( 11.510 0.000 4.675) 12.423 6.947 ( -3.090 0.000 -1.975) 3.667 6.947 ( 3.090 0.000 1.975) 3.667 6.965 ( 5.212 0.000 -5.897) 7.870 6.965 ( -5.212 0.000 5.897) 7.870 7.190 ( -18.665 0.000 -2.418) 18.821 7.190 ( 18.665 0.000 2.418) 18.821 7.336 ( -1.949 0.000 -3.157) 3.710 7.336 ( 1.949 0.000 3.157) 3.710 7.514 ( -2.289 0.000 -15.374) 15.543 7.514 ( 2.289 0.000 15.374) 15.543 7.844 ( -14.407 0.000 -15.397) 21.086 7.844 ( 14.407 0.000 15.397) 21.086 8.137 ( -7.635 0.000 -5.284) 9.286 8.137 ( 7.635 0.000 5.284) 9.286 8.363 ( 3.165 0.000 -9.817) 10.315 8.363 ( -3.165 0.000 9.817) 10.315 8.728 ( 3.720 0.000 -2.738) 4.619 8.728 ( -3.720 0.000 2.738) 4.619 9.251 ( -3.434 0.000 -0.217) 3.441 9.251 ( 3.434 0.000 0.217) 3.441 9.304 ( 1.515 0.000 -2.011) 2.518 9.304 ( -1.515 0.000 2.011) 2.518 9.670 ( -0.972 0.000 0.286) 1.014 9.670 ( 0.972 0.000 -0.286) 1.014 9.735 ( -1.150 0.000 -7.849) 7.933 9.735 ( 1.150 0.000 7.849) 7.933 10.232 ( 1.560 0.000 -10.772) 10.885 10.232 ( -1.560 0.000 10.772) 10.885 10.411 ( -1.393 0.000 -3.715) 3.967 10.411 ( 1.393 0.000 3.715) 3.967 10.727 ( -1.889 0.000 -2.477) 3.115 10.727 ( 1.889 0.000 2.477) 3.115 10.873 ( 1.139 0.000 -3.020) 3.228 10.873 ( -1.139 0.000 3.020) 3.228 11.042 ( -4.982 0.000 -6.242) 7.987 11.042 ( 4.982 0.000 6.242) 7.987 11.269 ( 0.637 0.000 -5.609) 5.645 11.269 ( -0.637 0.000 5.609) 5.645 11.587 ( -1.485 0.000 -1.438) 2.067 11.587 ( 1.485 0.000 1.438) 2.067 11.970 ( -3.377 0.000 -1.887) 3.868 11.970 ( 3.377 0.000 1.887) 3.868 12.149 ( -2.405 0.000 -4.680) 5.262 12.149 ( 2.405 0.000 4.680) 5.262 12.643 ( -0.169 0.000 -6.840) 6.842 12.643 ( 0.169 0.000 6.840) 6.842 12.842 ( -3.801 0.000 -6.385) 7.431 12.842 ( 3.801 0.000 6.385) 7.431 13.201 ( -0.783 0.000 -0.039) 0.784 13.201 ( 0.783 0.000 0.039) 0.784 13.355 ( -6.772 0.000 -4.827) 8.316 13.355 ( 6.772 0.000 4.827) 8.316 13.789 ( 1.447 0.000 -1.495) 2.081 13.789 ( -1.447 0.000 1.495) 2.081 14.114 ( -5.018 0.000 1.177) 5.154 14.114 ( 5.018 0.000 -1.177) 5.154 14.375 ( -2.062 0.000 -4.287) 4.757 14.375 ( 2.062 0.000 4.287) 4.757 16.633 ( 3.394 0.000 -6.343) 7.194 16.633 ( -3.394 0.000 6.343) 7.194 17.609 ( -1.851 0.000 -0.550) 1.931 17.609 ( 1.851 0.000 0.550) 1.931 18.002 ( -2.808 0.000 -4.894) 5.642 18.002 ( 2.808 0.000 4.894) 5.642 18.187 ( -1.118 0.000 -2.343) 2.596 18.187 ( 1.118 0.000 2.343) 2.596 20.132 ( -0.081 0.000 -0.481) 0.488 20.132 ( 0.081 0.000 0.481) 0.488 20.700 ( -7.483 0.000 0.969) 7.545 20.700 ( 7.483 0.000 -0.969) 7.545 20.854 ( -2.839 0.000 -5.538) 6.224 20.854 ( 2.839 0.000 5.538) 6.224 21.964 ( 0.460 0.000 -1.210) 1.295 21.964 ( -0.460 0.000 1.210) 1.295 22.525 ( -1.629 0.000 -3.725) 4.065 22.525 ( 1.629 0.000 3.725) 4.065 22.821 ( 0.815 0.000 -1.690) 1.877 22.821 ( -0.815 0.000 1.690) 1.877 23.159 ( -0.748 0.000 0.234) 0.784 23.159 ( 0.748 0.000 -0.234) 0.784 23.551 ( 0.292 0.000 -1.959) 1.981 23.551 ( -0.292 0.000 1.959) 1.981 24.326 ( 4.400 0.000 -4.793) 6.506 24.326 ( -4.400 0.000 4.793) 6.506 24.891 ( 3.957 0.000 -3.863) 5.530 24.891 ( -3.957 0.000 3.863) 5.530 27.070 ( -1.692 0.000 -1.929) 2.565 27.070 ( 1.692 0.000 1.929) 2.565 27.158 ( -0.296 0.000 -3.399) 3.412 27.158 ( 0.296 0.000 3.399) 3.412 27.198 ( -2.906 0.000 -0.049) 2.906 27.198 ( 2.906 0.000 0.049) 2.906 27.686 ( -0.148 0.000 -4.007) 4.010 27.686 ( 0.148 0.000 4.007) 4.010 27.899 ( -2.775 0.000 -0.603) 2.840 27.899 ( 2.775 0.000 0.603) 2.840 28.131 ( -4.729 0.000 -6.081) 7.704 28.131 ( 4.729 0.000 6.081) 7.704 28.426 ( -2.010 0.000 -5.166) 5.543 28.426 ( 2.010 0.000 5.166) 5.543 28.913 ( -1.670 0.000 -3.174) 3.587 28.913 ( 1.670 0.000 3.174) 3.587 29.372 ( -1.941 0.000 -2.775) 3.387 29.372 ( 1.941 0.000 2.775) 3.387 29.530 ( 0.159 0.000 -1.944) 1.950 29.530 ( -0.159 0.000 1.944) 1.950 30.649 ( -0.003 0.000 -0.273) 0.273 30.649 ( 0.003 0.000 0.273) 0.273 30.735 ( -1.181 0.000 -0.027) 1.181 30.735 ( 1.181 0.000 0.027) 1.181 33.857 ( 0.887 0.000 -0.803) 1.196 33.857 ( -0.887 0.000 0.803) 1.196 34.010 ( 0.718 0.000 -2.085) 2.205 34.010 ( -0.718 0.000 2.085) 2.205 37.284 ( -0.363 0.000 -0.425) 0.559 37.284 ( 0.363 0.000 0.425) 0.559 37.353 ( 0.004 0.000 -0.346) 0.346 37.353 ( -0.004 0.000 0.346) 0.346 37.599 ( 0.602 0.000 -2.817) 2.881 37.599 ( -0.602 0.000 2.817) 2.881 37.870 ( -2.488 0.000 -0.663) 2.575 37.870 ( 2.488 0.000 0.663) 2.575 49.329 ( -0.304 0.000 -0.496) 0.581 49.329 ( 0.304 0.000 0.496) 0.581 49.796 ( 7.214 0.000 -4.829) 8.681 49.796 ( -7.214 0.000 4.829) 8.681 50.521 ( -1.347 0.000 -1.827) 2.270 50.521 ( 1.347 0.000 1.827) 2.270 50.928 ( -6.572 0.000 2.110) 6.903 50.928 ( 6.572 0.000 -2.110) 6.903 51.755 ( -0.089 0.000 -0.096) 0.131 51.755 ( 0.089 0.000 0.096) 0.131 52.298 ( 0.130 0.000 -0.195) 0.235 52.298 ( -0.130 0.000 0.195) 0.235 52.736 ( -6.015 0.000 -11.663) 13.123 52.736 ( 6.015 0.000 11.663) 13.123 53.437 ( -0.635 0.000 -5.208) 5.247 53.437 ( 0.635 0.000 5.208) 5.247 53.913 ( 0.731 0.000 -1.123) 1.340 53.913 ( -0.731 0.000 1.123) 1.340 54.266 ( 0.035 0.000 -5.653) 5.653 54.266 ( -0.035 0.000 5.653) 5.653 55.867 ( 1.056 0.000 -2.441) 2.659 55.867 ( -1.056 0.000 2.441) 2.659 56.037 ( -1.146 0.000 -8.609) 8.685 56.037 ( 1.146 0.000 8.609) 8.685 57.384 ( -0.015 0.000 -0.143) 0.143 57.384 ( 0.015 0.000 0.143) 0.143 57.404 ( -0.008 0.000 -0.054) 0.055 57.404 ( 0.008 0.000 0.054) 0.055 58.228 ( 1.322 0.000 -3.644) 3.876 58.228 ( -1.322 0.000 3.644) 3.876 58.730 ( -2.727 0.000 -5.761) 6.374 58.730 ( 2.727 0.000 5.761) 6.374 60.921 ( -0.036 0.000 -0.157) 0.161 60.921 ( 0.036 0.000 0.157) 0.161 60.944 ( -0.122 0.000 -0.225) 0.256 60.944 ( 0.122 0.000 0.225) 0.256 ======================= Grid point 163 (71/90) ======================= q-point: ( 0.00 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.938 ( -11.870 23.725 -26.650) 37.603 1.938 ( 11.870 23.725 26.650) 37.603 2.219 ( 14.798 32.697 -27.433) 45.173 2.219 ( -14.798 32.697 27.433) 45.173 3.364 ( -3.804 7.639 -46.442) 47.219 3.364 ( 3.804 7.639 46.442) 47.219 3.757 ( 5.447 7.897 -10.071) 13.909 3.757 ( -5.447 7.897 10.071) 13.909 4.071 ( -1.363 27.679 -5.289) 28.213 4.071 ( 1.363 27.679 5.289) 28.213 4.342 ( -7.565 11.997 -2.632) 14.425 4.342 ( 7.565 11.997 2.632) 14.425 4.645 ( -6.247 10.527 -13.948) 18.558 4.645 ( 6.247 10.527 13.948) 18.558 5.220 ( 0.954 9.971 -7.026) 12.235 5.220 ( -0.954 9.971 7.026) 12.235 5.987 ( 7.805 -2.324 -3.573) 8.893 5.987 ( -7.805 -2.324 3.573) 8.893 6.214 ( -4.107 0.576 -3.176) 5.224 6.214 ( 4.107 0.576 3.176) 5.224 6.331 ( -3.411 0.019 -8.481) 9.141 6.331 ( 3.411 0.019 8.481) 9.141 6.855 ( 0.686 -2.989 -1.520) 3.423 6.855 ( -0.686 -2.989 1.520) 3.423 6.935 ( -1.702 -7.410 -7.651) 10.786 6.935 ( 1.702 -7.410 7.651) 10.786 7.250 ( -4.070 -8.390 -6.324) 11.267 7.250 ( 4.070 -8.390 6.324) 11.267 7.403 ( 12.767 -6.310 -9.509) 17.125 7.403 ( -12.767 -6.310 9.509) 17.125 7.728 ( -1.161 12.115 -2.747) 12.476 7.728 ( 1.161 12.115 2.747) 12.476 7.924 ( 0.540 -5.335 -5.756) 7.867 7.924 ( -0.540 -5.335 5.756) 7.867 8.247 ( -4.128 -2.980 -2.587) 5.711 8.247 ( 4.128 -2.980 2.587) 5.711 8.417 ( -7.145 4.168 0.622) 8.295 8.417 ( 7.145 4.168 -0.622) 8.295 8.764 ( -0.532 -16.431 -10.293) 19.396 8.764 ( 0.532 -16.431 10.293) 19.396 8.976 ( -5.357 -0.608 0.797) 5.450 8.976 ( 5.357 -0.608 -0.797) 5.450 9.110 ( 4.002 -5.922 -15.098) 16.705 9.110 ( -4.002 -5.922 15.098) 16.705 9.590 ( -0.699 -2.936 -4.143) 5.126 9.590 ( 0.699 -2.936 4.143) 5.126 9.866 ( 7.570 11.197 -5.731) 14.681 9.866 ( -7.570 11.197 5.731) 14.681 10.178 ( -4.596 -2.713 -1.544) 5.556 10.178 ( 4.596 -2.713 1.544) 5.556 10.390 ( -3.394 -7.770 -3.540) 9.189 10.390 ( 3.394 -7.770 3.540) 9.189 10.564 ( -3.358 5.561 -6.859) 9.447 10.564 ( 3.358 5.561 6.859) 9.447 11.076 ( -5.552 0.017 -1.326) 5.708 11.076 ( 5.552 0.017 1.326) 5.708 11.365 ( -9.313 -6.219 -6.216) 12.809 11.365 ( 9.313 -6.219 6.216) 12.809 11.484 ( 0.162 -0.136 -7.119) 7.122 11.484 ( -0.162 -0.136 7.119) 7.122 11.822 ( -5.837 4.635 -1.399) 7.584 11.822 ( 5.837 4.635 1.399) 7.584 11.979 ( -0.947 1.306 -2.851) 3.276 11.979 ( 0.947 1.306 2.851) 3.276 12.276 ( -9.553 -5.174 -2.042) 11.054 12.276 ( 9.553 -5.174 2.042) 11.054 12.616 ( -7.297 -0.197 -2.845) 7.834 12.616 ( 7.297 -0.197 2.845) 7.834 12.797 ( -0.075 -7.055 -4.771) 8.517 12.797 ( 0.075 -7.055 4.771) 8.517 12.940 ( -1.809 -1.057 -1.506) 2.580 12.940 ( 1.809 -1.057 1.506) 2.580 13.641 ( -1.769 -7.811 -1.584) 8.163 13.641 ( 1.769 -7.811 1.584) 8.163 13.910 ( -0.232 -3.509 -1.333) 3.760 13.910 ( 0.232 -3.509 1.333) 3.760 14.059 ( -5.237 -2.240 0.224) 5.701 14.059 ( 5.237 -2.240 -0.224) 5.701 14.257 ( -2.489 0.787 -1.770) 3.154 14.257 ( 2.489 0.787 1.770) 3.154 16.461 ( 0.564 -7.551 -2.277) 7.907 16.461 ( -0.564 -7.551 2.277) 7.907 17.066 ( 1.038 -16.537 -3.241) 16.883 17.066 ( -1.038 -16.537 3.241) 16.883 18.099 ( -1.249 3.501 -2.946) 4.743 18.099 ( 1.249 3.501 2.946) 4.743 18.522 ( 0.015 14.348 -3.116) 14.682 18.522 ( -0.015 14.348 3.116) 14.682 20.351 ( -2.648 0.373 -1.505) 3.069 20.351 ( 2.648 0.373 1.505) 3.069 20.492 ( -1.100 -9.022 -2.309) 9.377 20.492 ( 1.100 -9.022 2.309) 9.377 21.087 ( 1.794 -2.587 -2.732) 4.168 21.087 ( -1.794 -2.587 2.732) 4.168 21.395 ( -2.230 2.000 -1.935) 3.566 21.395 ( 2.230 2.000 1.935) 3.566 22.522 ( -4.561 -2.741 -2.002) 5.686 22.522 ( 4.561 -2.741 2.002) 5.686 22.782 ( 0.580 -1.421 -1.857) 2.410 22.782 ( -0.580 -1.421 1.857) 2.410 23.415 ( 8.745 38.161 -14.383) 41.709 23.415 ( -8.745 38.161 14.383) 41.709 24.162 ( 2.465 6.187 -1.503) 6.827 24.162 ( -2.465 6.187 1.503) 6.827 24.607 ( 4.921 2.625 -5.314) 7.703 24.607 ( -4.921 2.625 5.314) 7.703 25.398 ( 2.979 -1.814 -2.964) 4.578 25.398 ( -2.979 -1.814 2.964) 4.578 26.863 ( 1.106 -2.013 -2.209) 3.187 26.863 ( -1.106 -2.013 2.209) 3.187 27.153 ( 1.392 -6.991 -2.271) 7.482 27.153 ( -1.392 -6.991 2.271) 7.482 27.377 ( 3.181 -7.786 -6.794) 10.812 27.377 ( -3.181 -7.786 6.794) 10.812 27.627 ( 4.226 -8.402 -3.900) 10.182 27.627 ( -4.226 -8.402 3.900) 10.182 27.964 ( 3.024 3.523 -2.246) 5.157 27.964 ( -3.024 3.523 2.246) 5.157 28.268 ( -2.672 2.939 -2.950) 4.948 28.268 ( 2.672 2.939 2.950) 4.948 28.569 ( -1.973 3.511 -1.374) 4.255 28.569 ( 1.973 3.511 1.374) 4.255 28.779 ( -12.920 4.431 1.070) 13.701 28.779 ( 12.920 4.431 -1.070) 13.701 29.091 ( -11.868 7.019 -6.506) 15.246 29.091 ( 11.868 7.019 6.506) 15.246 29.395 ( -6.643 9.262 -0.891) 11.432 29.395 ( 6.643 9.262 0.891) 11.432 30.605 ( -0.867 0.733 -1.882) 2.198 30.605 ( 0.867 0.733 1.882) 2.198 30.779 ( -1.629 8.253 -1.023) 8.474 30.779 ( 1.629 8.253 1.023) 8.474 33.973 ( -1.425 -1.021 -0.687) 1.883 33.973 ( 1.425 -1.021 0.687) 1.883 34.002 ( -3.800 -1.592 -0.034) 4.120 34.002 ( 3.800 -1.592 0.034) 4.120 37.220 ( 0.623 -1.184 -0.478) 1.421 37.220 ( -0.623 -1.184 0.478) 1.421 37.289 ( -1.459 -0.349 -1.266) 1.963 37.289 ( 1.459 -0.349 1.266) 1.963 37.587 ( 0.076 1.784 -0.948) 2.022 37.587 ( -0.076 1.784 0.948) 2.022 37.725 ( -3.605 1.800 -0.374) 4.047 37.725 ( 3.605 1.800 0.374) 4.047 48.804 ( -5.231 -0.243 1.081) 5.347 48.804 ( 5.231 -0.243 -1.081) 5.347 48.902 ( -2.821 -0.776 0.055) 2.926 48.902 ( 2.821 -0.776 -0.055) 2.926 50.571 ( 0.761 -0.746 -2.341) 2.572 50.571 ( -0.761 -0.746 2.341) 2.572 51.335 ( -11.499 -15.648 -6.051) 20.340 51.335 ( 11.499 -15.648 6.051) 20.340 51.808 ( 0.670 5.082 -2.223) 5.587 51.808 ( -0.670 5.082 2.223) 5.587 52.307 ( 0.163 3.297 -0.710) 3.377 52.307 ( -0.163 3.297 0.710) 3.377 52.700 ( -10.164 -7.378 -2.196) 12.750 52.700 ( 10.164 -7.378 2.196) 12.750 53.142 ( -0.610 -3.289 -3.017) 4.504 53.142 ( 0.610 -3.289 3.017) 4.504 53.814 ( 0.425 0.512 -0.737) 0.993 53.814 ( -0.425 0.512 0.737) 0.993 54.327 ( 0.318 -3.420 -2.035) 3.993 54.327 ( -0.318 -3.420 2.035) 3.993 55.739 ( 0.379 0.566 -1.594) 1.734 55.739 ( -0.379 0.566 1.594) 1.734 56.521 ( 1.491 -19.243 -10.452) 21.950 56.521 ( -1.491 -19.243 10.452) 21.950 57.423 ( -0.150 4.002 -0.610) 4.051 57.423 ( 0.150 4.002 0.610) 4.051 57.685 ( 4.861 15.357 -8.744) 18.328 57.685 ( -4.861 15.357 8.744) 18.328 58.354 ( -2.522 -1.684 -0.819) 3.142 58.354 ( 2.522 -1.684 0.819) 3.142 58.593 ( -16.247 -6.281 -0.948) 17.444 58.593 ( 16.247 -6.281 0.948) 17.444 60.945 ( 0.085 1.549 -0.611) 1.667 60.945 ( -0.085 1.549 0.611) 1.667 61.064 ( -0.450 9.313 -4.606) 10.400 61.064 ( 0.450 9.313 4.606) 10.400 ======================= Grid point 165 (72/90) ======================= q-point: ( 0.12 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.920 ( 17.052 8.836 -32.761) 37.975 2.202 ( 8.255 24.591 29.881) 39.570 2.474 ( 26.208 20.679 19.765) 38.796 2.544 ( 18.339 23.804 -36.256) 47.090 3.348 ( 9.840 18.861 -19.057) 28.561 3.470 ( -0.460 4.477 -6.768) 8.128 3.715 ( 4.139 12.523 19.641) 23.658 3.833 ( 8.558 10.354 -3.150) 13.797 4.172 ( 0.061 23.701 5.801) 24.401 4.280 ( 11.729 22.976 -3.575) 26.044 4.326 ( 19.166 15.074 8.328) 25.766 4.521 ( 12.883 4.246 -5.300) 14.564 4.774 ( 16.140 18.846 7.094) 25.807 5.003 ( 20.514 2.056 11.287) 23.504 5.287 ( 7.879 10.520 1.320) 13.210 5.349 ( 9.623 9.605 2.010) 13.744 5.768 ( -14.271 -4.000 4.398) 15.460 5.918 ( -17.568 0.891 -9.836) 20.153 6.113 ( 4.068 -2.842 0.725) 5.015 6.240 ( 2.089 4.842 -10.283) 11.556 6.324 ( 0.143 3.197 4.560) 5.571 6.471 ( 3.407 -5.844 7.478) 10.084 6.819 ( -1.687 -5.749 0.385) 6.004 6.864 ( 0.716 -4.720 2.839) 5.554 6.904 ( 1.312 -6.406 -4.932) 8.190 7.024 ( 1.696 -9.652 2.971) 10.240 7.138 ( -7.809 -3.334 4.864) 9.785 7.182 ( 0.631 -3.663 1.162) 3.894 7.379 ( 2.818 -4.561 4.276) 6.857 7.622 ( 3.696 0.478 -0.645) 3.782 7.650 ( -5.872 10.987 -3.799) 13.024 7.727 ( -1.015 1.673 -0.540) 2.030 7.885 ( -3.230 -0.740 2.102) 3.924 7.901 ( 0.228 -2.998 -4.304) 5.250 8.137 ( -2.462 -11.395 1.086) 11.709 8.269 ( -3.967 6.796 2.710) 8.323 8.400 ( 5.006 3.297 -3.649) 7.017 8.558 ( 5.286 5.608 -0.501) 7.723 8.661 ( -4.254 -14.311 -5.630) 15.957 8.866 ( 4.244 -14.983 -3.157) 15.890 8.945 ( 4.111 -2.329 0.810) 4.793 9.070 ( -2.313 -7.705 9.411) 12.381 9.127 ( 7.865 -3.623 -6.269) 10.691 9.194 ( 4.848 -6.571 -3.783) 9.000 9.478 ( -2.894 -0.275 -2.495) 3.831 9.608 ( -3.375 1.677 -4.254) 5.683 9.764 ( -1.071 8.208 3.221) 8.883 9.965 ( 0.763 -0.902 -6.295) 6.405 10.125 ( 1.298 -1.007 4.338) 4.638 10.210 ( -3.392 -6.466 0.102) 7.302 10.385 ( 2.392 -3.712 5.122) 6.763 10.463 ( 0.604 9.202 -4.329) 10.187 10.551 ( 3.956 -3.852 4.788) 7.308 10.679 ( 5.522 5.221 8.666) 11.526 10.917 ( -7.935 -3.076 -1.913) 8.722 11.109 ( -4.838 2.250 -3.941) 6.634 11.194 ( -3.538 -1.691 0.328) 3.935 11.386 ( -6.786 2.417 -3.729) 8.111 11.416 ( -5.200 3.472 -7.484) 9.752 11.552 ( 2.845 -2.566 5.508) 6.710 11.649 ( -4.545 -3.582 -1.333) 5.938 11.873 ( -4.178 4.094 5.977) 8.363 11.978 ( 3.830 6.080 3.276) 7.897 12.021 ( -2.754 -2.006 -2.624) 4.300 12.193 ( 6.233 -3.444 1.914) 7.373 12.436 ( 5.633 -3.269 -0.722) 6.552 12.488 ( -3.649 1.231 -3.933) 5.505 12.661 ( -1.643 -1.230 -2.390) 3.150 12.827 ( -0.919 -2.806 0.829) 3.067 12.850 ( 2.619 -11.968 0.322) 12.256 12.930 ( 2.830 -4.959 -3.660) 6.782 13.009 ( 3.382 -1.127 0.664) 3.626 13.555 ( -6.220 -3.439 -1.159) 7.201 13.666 ( -0.027 -9.012 0.250) 9.016 13.863 ( -2.532 -2.390 -1.075) 3.645 13.890 ( -2.178 -0.441 -2.142) 3.087 13.943 ( -2.300 -7.984 0.055) 8.309 14.140 ( -0.253 -3.008 -3.298) 4.470 14.277 ( 2.333 -1.300 -0.847) 2.801 14.335 ( 4.744 0.276 -1.093) 4.876 16.396 ( -0.528 -9.614 0.052) 9.629 16.610 ( 6.395 -7.833 -0.952) 10.157 17.004 ( -0.179 -17.756 2.207) 17.893 17.189 ( 6.822 -16.502 -1.312) 17.904 18.066 ( -1.017 4.477 -2.181) 5.083 18.132 ( 1.150 4.227 3.020) 5.320 18.480 ( -2.990 13.806 -2.618) 14.366 18.512 ( -1.593 14.884 1.179) 15.015 20.273 ( -3.031 -0.040 -1.287) 3.293 20.370 ( -1.752 5.922 -1.002) 6.257 20.470 ( 0.012 -7.972 -1.692) 8.149 20.550 ( 2.406 -9.930 2.890) 10.619 21.026 ( -3.280 -3.306 2.364) 5.222 21.103 ( -0.913 -3.334 -2.857) 4.485 21.398 ( 4.036 1.213 -0.358) 4.230 21.479 ( 4.938 1.299 0.494) 5.130 22.439 ( -2.019 -0.006 -0.671) 2.128 22.597 ( 1.719 -3.323 -0.025) 3.741 22.776 ( -0.079 -2.030 1.789) 2.707 22.785 ( 0.191 -1.548 -1.989) 2.528 23.254 ( -7.390 30.698 6.876) 32.315 23.448 ( -2.340 34.754 -13.163) 37.236 24.096 ( -4.212 6.376 0.637) 7.668 24.186 ( -0.296 6.468 -1.783) 6.716 24.482 ( -7.812 2.913 4.380) 9.418 24.656 ( 1.051 3.012 -4.290) 5.346 25.244 ( -11.425 -1.921 2.739) 11.904 25.359 ( -5.844 -1.705 -1.521) 6.275 26.869 ( 1.034 -3.285 2.473) 4.240 26.897 ( 2.419 -1.522 -1.819) 3.388 27.060 ( -7.188 -3.972 9.456) 12.525 27.168 ( -0.008 -3.906 0.488) 3.936 27.266 ( -2.437 -3.306 -1.033) 4.235 27.423 ( 1.472 -9.044 -4.328) 10.134 27.568 ( -3.070 -6.541 2.851) 7.768 27.681 ( -0.037 -10.498 -2.431) 10.776 27.860 ( -5.054 1.870 3.431) 6.388 27.990 ( 1.695 8.119 -1.183) 8.378 28.157 ( -4.185 7.430 0.656) 8.553 28.301 ( -0.765 2.109 5.461) 5.904 28.529 ( -2.779 4.117 -4.016) 6.387 28.598 ( -1.508 1.229 0.548) 2.021 28.651 ( 2.291 0.863 0.801) 2.576 28.857 ( -1.279 14.537 3.185) 14.936 29.069 ( 8.889 -2.429 0.905) 9.259 29.271 ( 2.580 -2.841 1.624) 4.167 29.367 ( 2.575 3.062 -0.200) 4.006 29.659 ( 8.987 11.656 7.727) 16.623 30.574 ( -0.675 -0.739 0.219) 1.025 30.646 ( 1.530 0.441 0.538) 1.680 30.752 ( -0.619 5.996 -0.181) 6.031 30.821 ( 0.756 8.796 3.515) 9.503 33.910 ( -3.650 -0.032 1.168) 3.833 33.938 ( -1.742 -0.777 -0.082) 1.910 34.000 ( 0.783 -1.095 1.240) 1.830 34.049 ( -0.237 -2.405 -1.410) 2.798 37.225 ( 1.035 -0.909 0.484) 1.460 37.231 ( -1.215 -0.587 -0.437) 1.418 37.245 ( 1.876 -1.267 0.231) 2.275 37.335 ( 1.250 0.417 -0.442) 1.390 37.542 ( -0.577 3.179 0.413) 3.257 37.610 ( 0.467 2.329 -0.602) 2.450 37.709 ( 1.407 1.279 -1.810) 2.625 37.832 ( 4.973 -0.842 -2.420) 5.594 48.886 ( 8.844 -1.123 2.259) 9.197 48.921 ( 4.344 -0.806 0.221) 4.423 49.055 ( 16.158 -2.918 -6.285) 17.581 49.102 ( 17.308 -2.735 6.102) 18.555 50.554 ( -1.023 -0.562 1.073) 1.585 50.565 ( -1.288 -0.982 -2.228) 2.755 51.013 ( -12.618 -8.733 -12.864) 20.024 51.431 ( -2.676 -13.188 -0.553) 13.468 51.787 ( -0.691 5.007 -0.006) 5.055 51.812 ( -0.360 4.919 -1.210) 5.079 52.311 ( 0.331 3.504 0.694) 3.588 52.313 ( 0.569 3.375 -0.416) 3.448 52.550 ( -4.010 -2.879 -1.481) 5.153 52.903 ( 6.071 -12.116 -4.886) 14.406 53.187 ( 6.075 -4.345 -2.915) 8.017 53.198 ( 3.759 -4.052 1.864) 5.833 53.823 ( 1.147 0.350 0.944) 1.526 53.832 ( 1.380 0.458 -0.930) 1.726 54.309 ( -1.524 -3.648 1.787) 4.338 54.322 ( -0.679 -2.858 -0.726) 3.025 55.741 ( 0.514 0.148 0.742) 0.915 55.756 ( 1.331 0.761 -0.760) 1.711 56.430 ( -9.572 -16.934 11.012) 22.353 56.450 ( -5.094 -14.016 -8.602) 17.216 57.417 ( -0.165 3.687 -0.280) 3.701 57.430 ( 0.270 4.297 0.414) 4.325 57.600 ( -4.452 13.810 4.609) 15.224 57.699 ( -2.431 17.315 -10.144) 20.214 58.185 ( -10.127 0.882 3.713) 10.822 58.280 ( -3.312 -1.577 0.650) 3.725 58.491 ( 2.894 -4.440 5.287) 7.487 58.845 ( 4.341 -11.459 1.810) 12.387 60.939 ( -0.297 1.341 -0.079) 1.376 60.946 ( 0.037 1.798 -0.137) 1.803 61.028 ( -1.554 6.987 -1.804) 7.382 61.054 ( -2.258 8.791 3.466) 9.716 ======================= Grid point 166 (73/90) ======================= q-point: ( 0.25 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.288 ( 21.680 4.077 -15.877) 27.179 2.563 ( 12.054 13.855 9.501) 20.676 2.750 ( 15.635 7.427 -25.961) 31.203 3.047 ( 23.766 14.586 11.881) 30.311 3.317 ( 0.752 8.006 -3.568) 8.797 3.678 ( -2.267 11.381 9.609) 15.066 3.796 ( 8.447 13.645 7.661) 17.783 4.266 ( 40.443 32.020 -30.174) 59.761 4.423 ( 17.832 6.459 6.455) 20.034 4.545 ( 12.477 17.693 -5.936) 22.449 4.752 ( 15.793 2.017 2.736) 16.155 4.879 ( 16.579 11.264 -5.380) 20.753 5.259 ( 19.013 9.591 24.508) 32.467 5.380 ( 9.865 0.159 -0.467) 9.877 5.457 ( -2.874 2.565 -1.181) 4.029 5.495 ( -11.529 1.710 1.660) 11.773 5.546 ( 7.802 0.555 3.278) 8.481 5.612 ( 11.256 11.404 8.586) 18.179 6.195 ( -0.908 2.616 1.333) 3.073 6.282 ( 5.866 3.270 1.690) 6.925 6.310 ( 2.128 6.327 -1.711) 6.891 6.515 ( 1.183 -7.998 5.683) 9.882 6.791 ( -3.619 -11.479 1.736) 12.161 6.837 ( -4.365 -11.886 -4.129) 13.319 6.943 ( 1.409 -5.548 -1.857) 6.018 7.024 ( 5.996 -1.976 4.802) 7.932 7.146 ( 2.130 3.723 0.270) 4.298 7.261 ( 3.573 -0.993 1.666) 4.065 7.448 ( 2.714 -0.301 -0.175) 2.736 7.496 ( -5.897 8.651 -3.240) 10.960 7.603 ( -2.712 3.790 -1.227) 4.819 7.666 ( -3.070 -2.242 0.026) 3.801 7.779 ( -5.354 3.981 4.234) 7.902 7.964 ( 3.024 -1.517 -0.978) 3.522 8.118 ( -0.447 -10.544 3.946) 11.267 8.221 ( -2.295 7.773 -0.667) 8.132 8.453 ( 0.853 4.000 -4.464) 6.055 8.566 ( -1.922 -10.101 -5.716) 11.764 8.645 ( 3.074 4.175 -2.480) 5.747 8.885 ( -0.947 -8.157 -8.252) 11.642 9.050 ( 0.008 -6.412 7.168) 9.617 9.129 ( 8.083 -3.326 4.532) 9.845 9.204 ( 0.658 -11.113 -5.019) 12.211 9.270 ( 3.257 -10.450 2.733) 11.282 9.507 ( 5.938 0.379 -7.445) 9.530 9.548 ( 0.577 1.658 -9.076) 9.244 9.712 ( -7.328 5.607 -0.057) 9.227 9.887 ( -3.134 -1.381 -5.112) 6.153 10.167 ( -1.559 -7.372 1.300) 7.646 10.232 ( 6.966 -2.452 6.124) 9.594 10.386 ( -2.629 -4.201 0.271) 4.963 10.475 ( 1.089 10.602 3.111) 11.102 10.635 ( 0.632 4.360 3.764) 5.794 10.776 ( -2.973 -3.106 -3.861) 5.779 10.857 ( 8.237 2.505 10.750) 13.773 10.963 ( -4.573 3.129 -1.261) 5.683 11.138 ( -3.806 5.783 0.502) 6.941 11.210 ( -8.426 5.119 -1.324) 9.947 11.285 ( -4.824 5.577 -7.486) 10.508 11.420 ( -6.487 0.605 -4.620) 7.987 11.723 ( 1.488 -1.934 5.961) 6.441 11.781 ( -6.025 0.935 4.878) 7.809 11.967 ( -0.692 -3.191 0.672) 3.334 12.073 ( 2.511 -1.027 7.774) 8.234 12.308 ( -0.445 3.133 -1.906) 3.695 12.440 ( 2.793 0.888 2.486) 3.843 12.491 ( -2.860 -0.421 -5.602) 6.304 12.621 ( -0.259 -0.745 -1.259) 1.485 12.744 ( -5.572 -5.040 0.968) 7.576 12.890 ( 1.106 -12.457 -1.615) 12.610 12.983 ( 2.484 -6.560 -2.030) 7.302 13.079 ( 3.603 -4.856 1.852) 6.324 13.390 ( -8.083 0.736 -1.250) 8.213 13.655 ( -1.384 -10.484 -1.443) 10.673 13.782 ( -6.497 -4.168 -1.541) 7.871 13.813 ( -3.349 -3.921 -2.837) 5.885 13.921 ( 1.103 -4.416 -2.131) 5.026 14.157 ( 1.609 -5.447 1.433) 5.857 14.275 ( -1.221 0.564 0.998) 1.674 14.403 ( 1.958 -0.082 -2.041) 2.830 16.411 ( 1.716 -11.420 -2.395) 11.794 16.648 ( -2.415 -9.474 1.967) 9.973 17.108 ( 8.348 -17.398 0.605) 19.307 17.319 ( 5.167 -17.611 -0.757) 18.369 18.055 ( 0.485 6.648 -0.737) 6.706 18.171 ( 2.161 6.388 1.971) 7.026 18.388 ( -4.954 12.923 -2.603) 14.083 18.468 ( -2.726 14.918 0.555) 15.175 20.230 ( -1.018 3.127 0.153) 3.292 20.312 ( -2.884 7.564 -1.387) 8.213 20.464 ( 0.593 -3.608 -3.075) 4.778 20.600 ( 1.731 -8.576 3.564) 9.447 20.964 ( -3.962 -5.627 2.512) 7.326 21.034 ( -4.404 -3.431 -3.936) 6.831 21.555 ( 10.086 -2.824 0.068) 10.474 21.620 ( 8.577 -1.592 -0.129) 8.725 22.436 ( 0.987 0.196 2.133) 2.358 22.596 ( -0.966 -1.238 -2.353) 2.828 22.782 ( 0.190 -2.025 -1.746) 2.680 22.790 ( 0.547 -2.841 1.833) 3.425 23.177 ( -1.196 20.549 2.491) 20.734 23.317 ( -5.293 26.293 -5.176) 27.315 23.981 ( -7.124 6.300 -0.571) 9.527 24.098 ( -9.140 6.823 1.137) 11.463 24.357 ( -3.232 4.142 -0.208) 5.257 24.622 ( -3.951 4.062 -0.295) 5.675 24.999 ( -10.374 -1.738 -0.044) 10.519 25.187 ( -9.448 -1.315 0.472) 9.551 26.916 ( 2.902 -4.250 2.350) 5.658 26.943 ( 2.311 -2.208 -0.809) 3.297 27.016 ( 0.643 0.448 6.092) 6.142 27.169 ( -0.019 -2.470 -1.515) 2.898 27.236 ( -1.028 -3.125 -1.150) 3.485 27.426 ( -3.161 -2.057 -0.738) 3.843 27.487 ( -2.179 -13.600 -2.155) 13.941 27.618 ( -3.510 -8.369 1.440) 9.189 27.852 ( 2.161 -0.289 2.826) 3.569 28.040 ( 2.173 7.600 -1.071) 7.976 28.095 ( -2.119 7.488 1.242) 7.880 28.311 ( 0.680 2.770 6.228) 6.850 28.432 ( -5.540 1.955 -0.703) 5.917 28.548 ( -1.481 5.582 -1.747) 6.033 28.754 ( 5.620 1.253 0.680) 5.798 28.913 ( 3.930 7.253 -0.546) 8.267 29.217 ( 4.247 -1.822 4.627) 6.539 29.322 ( 2.912 -4.700 -2.638) 6.126 29.442 ( 4.126 3.433 -0.445) 5.386 29.711 ( -2.396 9.557 0.590) 9.871 30.578 ( 0.893 -2.177 0.258) 2.367 30.672 ( 0.894 0.273 -0.093) 0.940 30.742 ( -0.313 5.244 -0.721) 5.303 30.819 ( -1.327 5.594 2.252) 6.174 33.861 ( -1.400 0.268 0.503) 1.512 33.903 ( -1.620 -0.544 0.461) 1.769 34.012 ( 0.008 -1.052 1.413) 1.761 34.018 ( -1.138 -1.116 -2.835) 3.252 37.232 ( 0.854 -1.032 -0.072) 1.341 37.252 ( 1.261 -0.812 -0.377) 1.547 37.297 ( 2.369 -1.429 1.547) 3.170 37.350 ( 0.495 0.421 -0.279) 0.708 37.560 ( 1.489 1.946 1.019) 2.654 37.620 ( 0.532 3.096 0.543) 3.188 37.748 ( 2.661 0.567 -1.729) 3.224 37.893 ( 1.625 -1.386 -1.906) 2.862 49.059 ( 8.111 -1.167 0.929) 8.247 49.078 ( 8.955 -1.585 0.182) 9.096 49.356 ( 13.820 -3.744 -7.648) 16.233 49.545 ( 16.817 -8.144 16.050) 24.632 50.496 ( -2.711 -0.284 -5.031) 5.722 50.544 ( -0.556 -0.098 1.157) 1.287 50.835 ( -2.043 -3.163 -8.288) 9.103 51.278 ( -9.991 -8.414 -1.674) 13.169 51.782 ( 0.145 4.100 0.056) 4.103 51.803 ( -0.116 4.894 -0.544) 4.925 52.323 ( 0.533 3.768 0.567) 3.847 52.327 ( 0.752 3.731 -0.082) 3.807 52.506 ( -0.296 -2.534 2.704) 3.717 52.916 ( -1.522 -8.514 -8.725) 12.285 53.277 ( 3.369 -4.599 2.772) 6.339 53.322 ( 5.650 -6.601 -5.328) 10.192 53.861 ( 1.706 0.283 -1.270) 2.145 53.864 ( 2.205 0.086 0.946) 2.401 54.273 ( -2.651 -3.669 4.753) 6.563 54.301 ( -0.846 -1.713 -2.408) 3.074 55.765 ( 1.600 -0.372 0.473) 1.709 55.789 ( 1.987 0.713 -0.543) 2.180 56.229 ( -11.330 -9.047 11.335) 18.403 56.290 ( -7.305 -7.916 -8.415) 13.669 57.415 ( 0.057 3.504 -0.161) 3.508 57.436 ( 0.118 4.498 0.399) 4.517 57.537 ( -2.488 11.058 2.261) 11.557 57.580 ( -4.669 14.073 -4.057) 15.372 58.129 ( 1.531 -0.968 -0.648) 1.924 58.234 ( -1.486 -1.207 1.982) 2.756 58.562 ( 2.055 -4.982 5.900) 7.991 58.833 ( -3.442 -9.671 -2.793) 10.639 60.935 ( -0.087 1.356 -0.146) 1.366 60.948 ( 0.212 1.857 0.021) 1.869 60.996 ( -1.376 4.758 -0.115) 4.955 61.012 ( -1.827 5.886 0.745) 6.208 ======================= Grid point 167 (74/90) ======================= q-point: ( 0.38 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.682 ( 18.224 7.008 -8.886) 21.452 2.729 ( 7.845 13.566 -1.309) 15.726 2.944 ( 3.586 4.923 -4.954) 7.851 3.256 ( -10.556 8.794 11.880) 18.163 3.586 ( 22.758 5.721 -0.693) 23.476 3.739 ( 14.586 16.159 -8.568) 23.394 4.123 ( 18.904 5.833 6.424) 20.801 4.537 ( -14.684 1.689 6.227) 16.039 4.642 ( -3.854 14.272 -6.102) 15.993 4.774 ( -7.256 7.796 -12.311) 16.279 5.003 ( 15.506 12.336 -6.940) 20.994 5.103 ( 22.525 12.230 2.526) 25.755 5.376 ( 4.447 5.339 11.491) 13.429 5.476 ( 11.130 1.295 -19.153) 22.189 5.560 ( 4.365 2.313 -4.423) 6.631 5.657 ( 14.045 1.174 7.873) 16.144 5.874 ( 13.690 6.473 1.636) 15.232 5.899 ( 3.067 -9.230 9.479) 13.581 6.091 ( 1.798 -4.541 10.895) 11.940 6.390 ( -3.615 -4.188 2.916) 6.254 6.558 ( 6.445 -5.216 9.048) 12.272 6.667 ( 8.728 1.669 2.266) 9.170 6.716 ( 9.176 -1.435 2.858) 9.717 6.797 ( 1.857 0.184 0.172) 1.874 6.897 ( -0.966 -1.557 -4.751) 5.092 7.128 ( 2.818 5.101 -4.041) 7.092 7.219 ( 0.182 8.361 1.189) 8.447 7.277 ( 1.472 -1.057 4.049) 4.436 7.399 ( -0.963 4.260 2.618) 5.092 7.445 ( -4.737 2.634 -0.089) 5.421 7.498 ( -5.866 4.359 -1.716) 7.507 7.694 ( 4.421 7.819 -4.350) 9.980 7.788 ( 4.940 -8.104 11.023) 14.546 7.968 ( -2.583 7.447 1.239) 7.980 8.123 ( -2.373 -11.520 -4.726) 12.676 8.148 ( -2.259 7.160 2.529) 7.922 8.422 ( -2.405 -3.759 -4.801) 6.554 8.484 ( -6.772 -0.259 -7.365) 10.009 8.692 ( 2.848 2.554 -5.372) 6.595 8.798 ( -3.961 -0.610 -4.756) 6.219 9.079 ( 0.860 -6.037 4.965) 7.863 9.175 ( -1.494 -15.326 -1.095) 15.438 9.231 ( 1.249 -7.259 2.426) 7.755 9.376 ( -0.593 -3.170 0.230) 3.233 9.479 ( -1.520 -0.912 -1.284) 2.189 9.561 ( -0.003 1.255 -6.121) 6.248 9.639 ( 5.060 -3.535 -9.135) 11.025 9.841 ( -1.620 2.793 -1.467) 3.546 10.123 ( -0.408 -6.449 -2.655) 6.986 10.312 ( -4.357 -5.614 -0.587) 7.131 10.391 ( 3.441 3.998 6.585) 8.437 10.544 ( 2.477 1.018 0.189) 2.684 10.624 ( 2.191 1.772 3.333) 4.364 10.751 ( 1.736 4.884 2.425) 5.723 10.947 ( 2.873 6.252 1.754) 7.101 11.023 ( -3.629 6.504 -0.706) 7.481 11.066 ( -0.812 4.485 1.135) 4.697 11.121 ( 2.038 1.878 6.579) 7.139 11.183 ( -1.206 5.303 -1.093) 5.547 11.315 ( -2.560 3.062 -2.156) 4.536 11.657 ( -5.364 2.549 3.747) 7.022 11.703 ( -2.474 3.675 -0.296) 4.441 11.995 ( -0.538 -6.593 2.482) 7.065 12.052 ( -5.523 -4.278 4.907) 8.537 12.229 ( -6.083 7.190 -1.565) 9.547 12.298 ( -7.677 3.627 -7.911) 11.605 12.531 ( 2.938 -3.976 4.583) 6.741 12.629 ( 0.511 -1.248 -3.832) 4.062 12.709 ( 2.099 -4.696 2.633) 5.778 12.865 ( -2.651 -7.786 -3.168) 8.814 13.033 ( 2.964 -9.916 0.285) 10.354 13.181 ( 5.417 -5.410 2.929) 8.197 13.240 ( -5.901 -1.300 -1.202) 6.161 13.520 ( -9.239 -5.118 -5.543) 11.928 13.708 ( -0.233 -5.577 0.189) 5.585 13.752 ( -2.173 -6.027 -0.488) 6.425 13.961 ( 3.069 -5.172 -1.220) 6.136 14.136 ( -3.851 -7.590 -0.459) 8.523 14.302 ( 2.853 0.682 4.964) 5.766 14.413 ( -0.386 -0.642 -2.358) 2.474 16.448 ( 2.697 -11.432 -3.459) 12.244 16.578 ( -4.196 -10.608 3.306) 11.878 17.276 ( 6.642 -16.719 -0.018) 17.990 17.384 ( 1.209 -17.462 -0.108) 17.504 18.085 ( 2.352 8.541 1.240) 8.946 18.228 ( 1.782 11.101 -2.110) 11.440 18.279 ( -3.389 9.681 0.409) 10.265 18.404 ( -3.369 13.800 -0.098) 14.206 20.220 ( -0.305 6.895 1.249) 7.014 20.255 ( -2.003 8.642 -1.426) 8.985 20.508 ( 4.774 -4.149 -2.430) 6.776 20.653 ( 2.402 -7.076 2.204) 7.791 20.858 ( -6.497 -5.108 3.362) 8.922 20.918 ( -5.223 -3.840 -4.268) 7.761 21.767 ( 8.898 -6.617 0.156) 11.090 21.802 ( 7.461 -5.804 -0.119) 9.454 22.473 ( 1.623 -0.223 3.268) 3.655 22.561 ( -1.404 -0.413 -3.378) 3.682 22.786 ( 0.598 -2.213 -1.241) 2.607 22.799 ( -0.093 -2.462 1.434) 2.851 23.215 ( 4.087 14.183 0.878) 14.786 23.262 ( 1.308 18.005 -1.376) 18.105 23.789 ( -10.482 6.511 -1.444) 12.423 23.846 ( -13.460 8.014 1.941) 15.785 24.340 ( 1.302 5.283 -3.179) 6.301 24.496 ( -7.351 4.855 4.427) 9.859 24.871 ( -1.441 -0.543 -4.012) 4.298 25.004 ( -7.807 -0.605 2.526) 8.228 26.989 ( 2.158 -3.370 1.155) 4.165 26.997 ( 3.830 -4.544 0.009) 5.943 27.065 ( 1.933 -1.278 2.392) 3.330 27.159 ( -0.113 -0.050 -0.551) 0.565 27.206 ( -1.596 -2.467 -2.713) 3.999 27.286 ( -7.217 -3.000 1.414) 7.942 27.502 ( 2.159 -11.198 -4.066) 12.108 27.568 ( -2.125 -8.066 3.028) 8.874 27.918 ( 2.991 0.233 1.673) 3.435 28.026 ( -2.090 2.811 -0.861) 3.607 28.111 ( 2.218 9.336 4.605) 10.644 28.303 ( -4.532 4.632 -2.584) 6.977 28.382 ( 2.375 1.686 5.627) 6.336 28.513 ( -1.497 4.486 -4.434) 6.483 28.864 ( 4.333 1.851 1.881) 5.074 28.964 ( 1.030 4.076 -3.185) 5.274 29.293 ( 2.349 -1.620 4.156) 5.041 29.356 ( 0.837 -3.969 -3.373) 5.276 29.527 ( 3.867 4.136 0.103) 5.663 29.652 ( -2.493 8.032 -0.751) 8.443 30.606 ( 1.606 -1.803 0.184) 2.421 30.673 ( -0.912 0.449 -0.172) 1.031 30.745 ( 0.883 3.793 -0.408) 3.915 30.795 ( -1.278 3.633 0.658) 3.907 33.848 ( -0.023 0.097 -0.245) 0.264 33.875 ( -1.262 -0.334 0.727) 1.494 34.000 ( 0.097 -0.632 -2.500) 2.581 34.011 ( -0.521 -0.870 1.709) 1.988 37.254 ( 1.084 -1.105 0.172) 1.558 37.271 ( 0.566 -0.905 -0.536) 1.195 37.338 ( 1.211 -0.778 0.725) 1.612 37.357 ( 0.189 0.121 -0.091) 0.242 37.592 ( 1.384 1.402 0.027) 1.970 37.628 ( -0.225 2.506 1.138) 2.761 37.807 ( 3.080 0.066 -0.462) 3.115 37.898 ( -0.633 -1.011 -1.044) 1.585 49.227 ( 6.644 -1.728 1.285) 6.984 49.243 ( 6.214 -1.844 -0.740) 6.524 49.584 ( 9.851 -3.960 -5.447) 11.933 49.775 ( 1.851 -8.060 9.707) 12.752 50.480 ( 1.790 0.627 -0.469) 1.954 50.537 ( -0.293 0.013 -0.110) 0.314 50.825 ( 2.040 -2.307 -4.544) 5.489 51.060 ( -9.756 -4.878 -0.127) 10.909 51.788 ( 0.349 3.671 0.304) 3.700 51.801 ( -0.070 4.267 -0.602) 4.309 52.334 ( 0.398 3.966 0.480) 4.015 52.339 ( 0.340 4.104 -0.225) 4.125 52.558 ( 3.710 -3.473 7.803) 9.312 52.823 ( -4.447 -6.295 -10.438) 12.975 53.344 ( 2.105 -4.775 3.575) 6.326 53.383 ( 1.873 -5.787 -5.317) 8.079 53.891 ( 1.518 0.126 -1.492) 2.132 53.906 ( 1.203 -0.017 0.771) 1.429 54.240 ( -1.583 -2.672 6.170) 6.908 54.274 ( -0.909 -1.593 -3.903) 4.313 55.810 ( 2.592 -0.835 -0.507) 2.770 55.836 ( 2.369 0.309 0.245) 2.401 56.057 ( -7.319 -4.228 8.770) 12.180 56.121 ( -6.388 -4.058 -7.119) 10.390 57.419 ( 0.315 3.631 -0.084) 3.646 57.435 ( -0.261 4.528 0.285) 4.545 57.505 ( -1.141 8.833 1.298) 9.001 57.510 ( -1.507 9.447 -1.797) 9.734 58.174 ( 2.471 -1.854 -2.100) 3.735 58.221 ( -0.590 -1.298 2.099) 2.537 58.611 ( 1.342 -5.615 5.703) 8.115 58.740 ( -3.795 -7.563 -4.723) 9.691 60.936 ( 0.316 1.618 -0.087) 1.651 60.955 ( 0.399 2.083 0.159) 2.126 60.968 ( -1.093 3.253 -0.010) 3.432 60.986 ( -0.946 3.455 0.033) 3.582 ======================= Grid point 168 (75/90) ======================= q-point: ( 0.50 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.888 ( 7.773 11.675 -7.014) 15.682 2.888 ( -7.773 11.675 7.014) 15.682 3.008 ( -1.788 8.293 -2.248) 8.776 3.008 ( 1.788 8.293 2.248) 8.776 3.950 ( -7.736 3.228 -2.803) 8.839 3.950 ( 7.736 3.228 2.803) 8.839 4.326 ( -6.307 11.087 -16.474) 20.835 4.326 ( 6.307 11.087 16.474) 20.835 4.552 ( -5.135 6.209 -9.518) 12.470 4.552 ( 5.135 6.209 9.518) 12.470 5.270 ( 7.745 8.626 -5.789) 12.958 5.270 ( -7.745 8.626 5.789) 12.958 5.467 ( -4.225 9.173 -20.924) 23.234 5.467 ( 4.225 9.173 20.924) 23.234 5.695 ( 7.688 -7.126 -4.619) 11.455 5.695 ( -7.688 -7.126 4.619) 11.455 6.098 ( -10.800 -8.118 -10.535) 17.133 6.098 ( 10.800 -8.118 10.535) 17.133 6.327 ( -15.694 6.672 -0.382) 17.057 6.327 ( 15.694 6.672 0.382) 17.057 6.432 ( -15.040 -12.175 -7.068) 20.600 6.432 ( 15.040 -12.175 7.068) 20.600 6.893 ( -1.164 1.092 -5.820) 6.034 6.893 ( 1.164 1.092 5.820) 6.034 7.152 ( 4.361 3.194 -7.715) 9.420 7.152 ( -4.361 3.194 7.715) 9.420 7.243 ( -8.115 5.857 -5.093) 11.229 7.243 ( 8.115 5.857 5.093) 11.229 7.345 ( -1.058 5.465 -0.082) 5.567 7.345 ( 1.058 5.465 0.082) 5.567 7.653 ( -11.416 5.493 -13.663) 18.633 7.653 ( 11.416 5.493 13.663) 18.633 7.950 ( -6.427 5.132 -3.765) 9.046 7.950 ( 6.427 5.132 3.765) 9.046 8.023 ( -2.725 -1.461 -5.775) 6.551 8.023 ( 2.725 -1.461 5.775) 6.551 8.363 ( -0.750 -1.012 -11.192) 11.263 8.363 ( 0.750 -1.012 11.192) 11.263 8.736 ( 1.571 1.050 -1.902) 2.681 8.736 ( -1.571 1.050 1.902) 2.681 9.122 ( -1.891 -10.873 -7.933) 13.592 9.122 ( 1.891 -10.873 7.933) 13.592 9.269 ( -0.296 -6.636 -7.702) 10.171 9.269 ( 0.296 -6.636 7.702) 10.171 9.542 ( -0.870 -1.459 -4.151) 4.486 9.542 ( 0.870 -1.459 4.151) 4.486 9.750 ( 2.489 0.700 -8.517) 8.901 9.750 ( -2.489 0.700 8.517) 8.901 10.195 ( -1.163 -5.750 -5.187) 7.831 10.195 ( 1.163 -5.750 5.187) 7.831 10.462 ( -2.421 1.389 -3.798) 4.713 10.462 ( 2.421 1.389 3.798) 4.713 10.784 ( 2.678 5.299 -5.755) 8.268 10.784 ( -2.678 5.299 5.755) 8.268 10.992 ( -0.796 7.399 -5.356) 9.169 10.992 ( 0.796 7.399 5.356) 9.169 11.038 ( -2.273 0.658 -2.205) 3.234 11.038 ( 2.273 0.658 2.205) 3.234 11.287 ( 0.633 4.783 -7.518) 8.933 11.287 ( -0.633 4.783 7.518) 8.933 11.643 ( -0.895 4.622 -4.244) 6.338 11.643 ( 0.895 4.622 4.244) 6.338 11.943 ( -1.598 -4.493 -6.595) 8.138 11.943 ( 1.598 -4.493 6.595) 8.138 12.194 ( -2.267 4.940 -8.370) 9.980 12.194 ( 2.267 4.940 8.370) 9.980 12.598 ( -1.946 -4.159 -6.126) 7.656 12.598 ( 1.946 -4.159 6.126) 7.656 12.787 ( -3.108 -5.182 -4.224) 7.372 12.787 ( 3.108 -5.182 4.224) 7.372 13.120 ( -4.965 -7.339 -1.833) 9.048 13.120 ( 4.965 -7.339 1.833) 9.048 13.326 ( -6.327 -2.646 -5.553) 8.824 13.326 ( 6.327 -2.646 5.553) 8.824 13.719 ( 1.101 -6.458 -0.668) 6.585 13.719 ( -1.101 -6.458 0.668) 6.585 14.041 ( -4.559 -6.432 -0.026) 7.883 14.041 ( 4.559 -6.432 0.026) 7.883 14.375 ( -2.379 -0.988 -4.005) 4.762 14.375 ( 2.379 -0.988 4.005) 4.762 16.505 ( 2.289 -11.070 -6.155) 12.871 16.505 ( -2.289 -11.070 6.155) 12.871 17.371 ( -2.516 -16.704 0.188) 16.893 17.371 ( 2.516 -16.704 -0.188) 16.893 18.157 ( -3.366 10.494 -3.480) 11.557 18.157 ( 3.366 10.494 3.480) 11.557 18.328 ( -2.816 11.308 -1.764) 11.786 18.328 ( 2.816 11.308 1.764) 11.786 20.225 ( -0.526 8.579 -1.486) 8.723 20.225 ( 0.526 8.579 1.486) 8.723 20.632 ( -5.998 -5.936 0.230) 8.442 20.632 ( 5.998 -5.936 -0.230) 8.442 20.811 ( -2.678 -4.001 -5.272) 7.140 20.811 ( 2.678 -4.001 5.272) 7.140 21.878 ( -0.132 -7.814 -1.333) 7.928 21.878 ( 0.132 -7.814 1.333) 7.928 22.519 ( -1.694 -0.451 -3.613) 4.016 22.519 ( 1.694 -0.451 3.613) 4.016 22.796 ( 0.428 -2.140 -1.536) 2.669 22.796 ( -0.428 -2.140 1.536) 2.669 23.302 ( -1.132 12.428 -0.247) 12.482 23.302 ( 1.132 12.428 0.247) 12.482 23.648 ( 0.963 8.726 -2.585) 9.151 23.648 ( -0.963 8.726 2.585) 9.151 24.386 ( 4.203 5.446 -4.435) 8.185 24.386 ( -4.203 5.446 4.435) 8.185 24.889 ( 3.887 -0.099 -4.020) 5.593 24.889 ( -3.887 -0.099 4.020) 5.593 27.029 ( -0.899 -3.918 -1.676) 4.355 27.029 ( 0.899 -3.918 1.676) 4.355 27.130 ( -4.018 -3.644 -2.320) 5.900 27.130 ( 4.018 -3.644 2.320) 5.900 27.187 ( -2.357 0.114 -0.744) 2.474 27.187 ( 2.357 0.114 0.744) 2.474 27.535 ( 1.870 -9.240 -4.051) 10.261 27.535 ( -1.870 -9.240 4.051) 10.261 27.976 ( -2.169 2.022 -0.798) 3.070 27.976 ( 2.169 2.022 0.798) 3.070 28.196 ( -4.205 5.783 -5.508) 9.026 28.196 ( 4.205 5.783 5.508) 9.026 28.456 ( -2.618 3.204 -5.395) 6.799 28.456 ( 2.618 3.204 5.395) 6.799 28.941 ( -2.129 2.557 -3.339) 4.714 28.941 ( 2.129 2.557 3.339) 4.714 29.341 ( -0.531 -2.209 -4.861) 5.366 29.341 ( 0.531 -2.209 4.861) 5.366 29.598 ( -2.169 5.621 -0.937) 6.098 29.598 ( 2.169 5.621 0.937) 6.098 30.643 ( -1.396 -0.521 -0.404) 1.544 30.643 ( 1.396 -0.521 0.404) 1.544 30.769 ( -1.273 3.141 0.185) 3.395 30.769 ( 1.273 3.141 -0.185) 3.395 33.855 ( 0.750 -0.129 -0.662) 1.009 33.855 ( -0.750 -0.129 0.662) 1.009 34.003 ( 0.617 -0.678 -1.944) 2.149 34.003 ( -0.617 -0.678 1.944) 2.149 37.271 ( -0.349 -1.039 -0.471) 1.193 37.271 ( 0.349 -1.039 0.471) 1.193 37.355 ( 0.014 -0.210 -0.969) 0.991 37.355 ( -0.014 -0.210 0.969) 0.991 37.617 ( 0.493 1.786 -2.505) 3.116 37.617 ( -0.493 1.786 2.505) 3.116 37.865 ( -2.001 -0.498 -0.648) 2.162 37.865 ( 2.001 -0.498 0.648) 2.162 49.307 ( -0.207 -1.992 -1.108) 2.289 49.307 ( 0.207 -1.992 1.108) 2.289 49.737 ( 5.726 -5.343 -4.737) 9.153 49.737 ( -5.726 -5.343 4.737) 9.153 50.522 ( -1.235 0.167 -1.395) 1.871 50.522 ( 1.235 0.167 1.395) 1.871 50.896 ( 3.875 -2.923 -1.751) 5.160 50.896 ( -3.875 -2.923 1.751) 5.160 51.796 ( -0.200 3.763 -0.606) 3.816 51.796 ( 0.200 3.763 0.606) 3.816 52.341 ( -0.035 4.113 -0.537) 4.149 52.341 ( 0.035 4.113 0.537) 4.149 52.686 ( -5.464 -4.748 -10.575) 12.815 52.686 ( 5.464 -4.748 10.575) 12.815 53.382 ( -0.429 -5.091 -4.528) 6.826 53.382 ( 0.429 -5.091 4.528) 6.826 53.913 ( 0.696 0.012 -1.070) 1.276 53.913 ( -0.696 0.012 1.070) 1.276 54.245 ( -0.321 -1.917 -5.538) 5.869 54.245 ( 0.321 -1.917 5.538) 5.869 55.858 ( 0.788 -0.733 -2.183) 2.434 55.858 ( -0.788 -0.733 2.183) 2.434 56.008 ( -1.131 -2.583 -7.731) 8.229 56.008 ( 1.131 -2.583 7.731) 8.229 57.427 ( -0.055 4.117 -0.244) 4.125 57.427 ( 0.055 4.117 0.244) 4.125 57.494 ( 0.177 7.996 -1.156) 8.081 57.494 ( -0.177 7.996 1.156) 8.081 58.209 ( 0.991 -1.778 -3.245) 3.831 58.209 ( -0.991 -1.778 3.245) 3.831 58.662 ( -2.280 -6.353 -5.233) 8.541 58.662 ( 2.280 -6.353 5.233) 8.541 60.947 ( -0.385 2.281 -0.265) 2.329 60.947 ( 0.385 2.281 0.265) 2.329 60.969 ( -0.621 2.365 -0.104) 2.448 60.969 ( 0.621 2.365 0.104) 2.448 ======================= Grid point 173 (76/90) ======================= q-point: ( 0.00 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 74 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.528 ( -17.096 31.030 -13.124) 37.780 2.528 ( 17.096 31.030 13.124) 37.780 2.872 ( 8.328 29.099 -22.311) 37.602 2.872 ( -8.328 29.099 22.311) 37.602 3.527 ( -4.647 6.025 -15.452) 17.224 3.527 ( 4.647 6.025 15.452) 17.224 3.921 ( 2.848 8.205 -14.070) 16.535 3.921 ( -2.848 8.205 14.070) 16.535 4.479 ( -4.999 9.913 -8.376) 13.907 4.479 ( 4.999 9.913 8.376) 13.907 4.777 ( 0.665 27.755 -10.917) 29.832 4.777 ( -0.665 27.755 10.917) 29.832 4.978 ( -1.479 15.418 -8.388) 17.614 4.978 ( 1.479 15.418 8.388) 17.614 5.454 ( 3.027 10.121 -5.969) 12.134 5.454 ( -3.027 10.121 5.969) 12.134 5.964 ( 2.395 0.659 -8.655) 9.005 5.964 ( -2.395 0.659 8.655) 9.005 6.210 ( -5.406 -2.590 -10.954) 12.486 6.210 ( 5.406 -2.590 10.954) 12.486 6.398 ( -0.806 9.559 -6.820) 11.770 6.398 ( 0.806 9.559 6.820) 11.770 6.683 ( -5.137 -11.525 -7.108) 14.483 6.683 ( 5.137 -11.525 7.108) 14.483 6.823 ( -3.958 0.782 -8.930) 9.799 6.823 ( 3.958 0.782 8.930) 9.799 7.206 ( 7.298 -1.752 -10.240) 12.696 7.206 ( -7.298 -1.752 10.240) 12.696 7.274 ( -0.179 -0.278 -4.257) 4.270 7.274 ( 0.179 -0.278 4.257) 4.270 7.729 ( 4.686 -8.552 -7.226) 12.137 7.729 ( -4.686 -8.552 7.226) 12.137 7.952 ( -1.182 3.473 -1.195) 3.859 7.952 ( 1.182 3.473 1.195) 3.859 8.148 ( -8.857 -5.883 -4.107) 11.398 8.148 ( 8.857 -5.883 4.107) 11.398 8.449 ( -6.454 0.250 -1.473) 6.625 8.449 ( 6.454 0.250 1.473) 6.625 8.581 ( -1.084 0.254 -4.352) 4.492 8.581 ( 1.084 0.254 4.352) 4.492 8.931 ( -0.024 -1.471 -7.914) 8.050 8.931 ( 0.024 -1.471 7.914) 8.050 9.173 ( 1.376 5.882 -10.855) 12.423 9.173 ( -1.376 5.882 10.855) 12.423 9.533 ( -2.239 -0.398 -0.491) 2.326 9.533 ( 2.239 -0.398 0.491) 2.326 9.816 ( -0.689 -9.326 -4.370) 10.322 9.816 ( 0.689 -9.326 4.370) 10.322 10.040 ( -5.492 -12.474 -4.239) 14.274 10.040 ( 5.492 -12.474 4.239) 14.274 10.394 ( -5.149 7.633 -9.411) 13.166 10.394 ( 5.149 7.633 9.411) 13.166 10.715 ( -3.548 5.231 -7.191) 9.574 10.715 ( 3.548 5.231 7.191) 9.574 10.938 ( -3.559 -16.413 -2.413) 16.966 10.938 ( 3.559 -16.413 2.413) 16.966 11.222 ( -6.255 -5.248 -1.149) 8.245 11.222 ( 6.255 -5.248 1.149) 8.245 11.543 ( -0.156 3.367 -4.476) 5.604 11.543 ( 0.156 3.367 4.476) 5.604 11.825 ( -6.748 -2.543 -2.345) 7.583 11.825 ( 6.748 -2.543 2.345) 7.583 12.063 ( -2.937 2.271 -0.764) 3.790 12.063 ( 2.937 2.271 0.764) 3.790 12.203 ( 0.388 2.289 -3.624) 4.304 12.203 ( -0.388 2.289 3.624) 4.304 12.496 ( -5.032 -7.237 -4.108) 9.725 12.496 ( 5.032 -7.237 4.108) 9.725 12.763 ( -2.781 2.075 -0.568) 3.516 12.763 ( 2.781 2.075 0.568) 3.516 12.931 ( -1.782 0.271 -2.087) 2.757 12.931 ( 1.782 0.271 2.087) 2.757 13.482 ( -3.102 -7.575 -3.318) 8.833 13.482 ( 3.102 -7.575 3.318) 8.833 13.770 ( -1.243 -9.666 -1.534) 9.866 13.770 ( 1.243 -9.666 1.534) 9.866 14.068 ( -3.515 2.416 -2.119) 4.763 14.068 ( 3.515 2.416 2.119) 4.763 14.257 ( -1.128 -0.626 -0.790) 1.513 14.257 ( 1.128 -0.626 0.790) 1.513 16.284 ( -4.962 -8.588 -0.499) 9.931 16.284 ( 4.962 -8.588 0.499) 9.931 16.685 ( -5.609 -18.722 0.255) 19.546 16.685 ( 5.609 -18.722 -0.255) 19.546 18.215 ( -1.303 6.672 -0.922) 6.860 18.215 ( 1.303 6.672 0.922) 6.860 18.809 ( -0.395 12.593 -1.799) 12.727 18.809 ( 0.395 12.593 1.799) 12.727 20.284 ( -1.083 -3.048 -2.511) 4.095 20.284 ( 1.083 -3.048 2.511) 4.095 20.514 ( -0.167 6.185 -0.639) 6.220 20.514 ( 0.167 6.185 0.639) 6.220 20.992 ( 1.656 -6.153 -1.899) 6.649 20.992 ( -1.656 -6.153 1.899) 6.649 21.320 ( -2.048 -7.688 -1.015) 8.020 21.320 ( 2.048 -7.688 1.015) 8.020 22.485 ( -2.693 -1.148 -1.209) 3.168 22.485 ( 2.693 -1.148 1.209) 3.168 22.746 ( 0.476 -1.899 -1.279) 2.339 22.746 ( -0.476 -1.899 1.279) 2.339 24.114 ( 6.920 27.137 -12.453) 30.649 24.114 ( -6.920 27.137 12.453) 30.649 24.345 ( -1.850 11.963 -0.517) 12.116 24.345 ( 1.850 11.963 0.517) 12.116 24.671 ( 4.818 3.183 -4.881) 7.561 24.671 ( -4.818 3.183 4.881) 7.561 25.339 ( 2.775 -4.134 -3.222) 5.931 25.339 ( -2.775 -4.134 3.222) 5.931 26.811 ( 2.432 -2.589 -3.272) 4.830 26.811 ( -2.432 -2.589 3.272) 4.830 27.022 ( 2.562 -4.971 -4.236) 7.015 27.022 ( -2.562 -4.971 4.236) 7.015 27.259 ( 1.170 -4.371 -2.867) 5.357 27.259 ( -1.170 -4.371 2.867) 5.357 27.460 ( 2.322 -7.781 -3.650) 8.903 27.460 ( -2.322 -7.781 3.650) 8.903 28.027 ( 4.861 2.395 -2.550) 5.989 28.027 ( -4.861 2.395 2.550) 5.989 28.318 ( 1.129 2.350 -4.348) 5.069 28.318 ( -1.129 2.350 4.348) 5.069 28.617 ( -2.263 2.133 0.183) 3.115 28.617 ( 2.263 2.133 -0.183) 3.115 28.815 ( -6.310 0.024 -1.712) 6.538 28.815 ( 6.310 0.024 1.712) 6.538 29.155 ( -3.922 0.559 -4.695) 6.143 29.155 ( 3.922 0.559 4.695) 6.143 29.582 ( -7.686 5.359 -4.665) 10.467 29.582 ( 7.686 5.359 4.665) 10.467 30.659 ( -0.630 3.992 -3.493) 5.342 30.659 ( 0.630 3.992 3.493) 5.342 30.965 ( -2.091 8.768 -4.006) 9.864 30.965 ( 2.091 8.768 4.006) 9.864 33.944 ( -0.118 -1.267 -1.421) 1.908 33.944 ( 0.118 -1.267 1.421) 1.908 33.981 ( -1.603 -0.687 0.207) 1.756 33.981 ( 1.603 -0.687 -0.207) 1.756 37.182 ( 0.015 -1.965 -0.266) 1.983 37.182 ( -0.015 -1.965 0.266) 1.983 37.261 ( -1.610 -2.400 -1.438) 3.227 37.261 ( 1.610 -2.400 1.438) 3.227 37.645 ( -1.390 3.546 -0.154) 3.811 37.645 ( 1.390 3.546 0.154) 3.811 37.762 ( -2.034 1.533 0.224) 2.557 37.762 ( 2.034 1.533 -0.224) 2.557 48.800 ( -3.443 -0.105 1.019) 3.592 48.800 ( 3.443 -0.105 -1.019) 3.592 48.881 ( -2.276 -1.193 -0.028) 2.570 48.881 ( 2.276 -1.193 0.028) 2.570 50.560 ( 0.019 -0.066 -2.463) 2.464 50.560 ( -0.019 -0.066 2.463) 2.464 51.023 ( -7.165 -13.434 -11.099) 18.841 51.023 ( 7.165 -13.434 11.099) 18.841 51.924 ( -0.108 6.236 -1.965) 6.540 51.924 ( 0.108 6.236 1.965) 6.540 52.397 ( -0.253 4.666 -1.498) 4.907 52.397 ( 0.253 4.666 1.498) 4.907 52.553 ( -4.029 -5.915 -1.301) 7.275 52.553 ( 4.029 -5.915 1.301) 7.275 53.049 ( 0.124 -5.693 -2.756) 6.326 53.049 ( -0.124 -5.693 2.756) 6.326 53.830 ( 0.388 1.034 -0.592) 1.253 53.830 ( -0.388 1.034 0.592) 1.253 54.261 ( 1.062 -2.787 -2.664) 3.999 54.261 ( -1.062 -2.787 2.664) 3.999 55.758 ( 0.382 1.338 -1.633) 2.146 55.758 ( -0.382 1.338 1.633) 2.146 56.212 ( 2.148 -11.497 -8.979) 14.745 56.212 ( -2.148 -11.497 8.979) 14.745 57.535 ( -0.303 6.616 -1.410) 6.771 57.535 ( 0.303 6.616 1.410) 6.771 57.899 ( 3.516 6.152 -7.375) 10.227 57.899 ( -3.516 6.152 7.375) 10.227 58.298 ( -3.220 -3.876 -1.702) 5.319 58.298 ( 3.220 -3.876 1.702) 5.319 58.460 ( -9.471 -5.749 -2.984) 11.474 58.460 ( 9.471 -5.749 2.984) 11.474 60.982 ( -0.058 1.973 -0.329) 2.001 60.982 ( 0.058 1.973 0.329) 2.001 61.226 ( -0.474 5.848 -6.264) 8.583 61.226 ( 0.474 5.848 6.264) 8.583 ======================= Grid point 175 (77/90) ======================= q-point: ( 0.12 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.272 ( -0.842 22.968 -22.402) 32.095 2.764 ( 0.660 26.242 17.840) 31.739 2.967 ( 18.377 26.557 5.120) 32.699 3.063 ( 8.210 28.338 -33.760) 44.835 3.467 ( 3.278 -2.250 16.958) 17.418 3.605 ( 0.004 4.638 -4.850) 6.711 3.941 ( 2.474 6.063 2.197) 6.908 4.142 ( 18.729 16.423 9.071) 26.510 4.505 ( 9.785 8.838 -5.658) 14.348 4.708 ( 13.720 12.226 -0.740) 18.392 4.817 ( 6.015 29.753 -9.392) 31.775 4.912 ( 11.613 25.005 -1.447) 27.608 5.078 ( 10.484 6.544 3.779) 12.923 5.171 ( 11.791 13.579 18.404) 25.732 5.429 ( -1.903 -4.519 4.314) 6.531 5.593 ( 8.878 14.229 -3.945) 17.229 5.788 ( -6.554 8.325 4.887) 11.668 5.910 ( -10.588 4.663 -4.519) 12.421 6.204 ( 5.491 7.675 -3.109) 9.936 6.306 ( -4.240 -8.155 -0.678) 9.216 6.414 ( 7.318 6.393 -1.420) 9.821 6.469 ( 7.472 13.797 2.129) 15.834 6.576 ( -1.936 -7.466 -3.216) 8.357 6.677 ( -6.331 -11.747 -2.882) 13.652 6.746 ( -1.170 -10.632 5.554) 12.052 6.917 ( 2.327 5.040 3.694) 6.668 7.137 ( -0.277 -1.702 5.732) 5.986 7.218 ( 0.577 8.278 5.109) 9.745 7.372 ( 8.743 2.621 -5.313) 10.561 7.437 ( 6.532 -5.650 -3.295) 9.244 7.682 ( -0.455 -12.852 7.492) 14.883 7.774 ( -0.120 -5.714 -8.498) 10.241 7.862 ( -7.259 -0.002 -0.122) 7.260 7.943 ( -1.357 5.578 0.572) 5.769 7.957 ( -5.234 -0.372 -2.550) 5.834 8.312 ( -3.300 -0.416 -0.191) 3.332 8.347 ( 8.788 -8.047 1.080) 11.964 8.506 ( -3.188 -1.285 -2.139) 4.048 8.646 ( 5.196 -4.458 -1.625) 7.036 8.656 ( 7.083 4.299 -3.613) 9.039 8.938 ( 2.564 -5.142 -6.374) 8.582 8.952 ( 0.030 -0.114 3.996) 3.998 9.075 ( -3.999 3.930 3.929) 6.846 9.273 ( 2.748 8.080 0.623) 8.558 9.478 ( -1.187 1.401 -1.987) 2.706 9.567 ( 2.103 -1.584 -5.974) 6.529 9.794 ( -1.180 -9.515 1.103) 9.651 9.875 ( 2.548 -6.500 9.056) 11.435 9.964 ( 0.275 -1.695 -0.491) 1.786 10.068 ( -3.317 -12.402 -3.703) 13.361 10.415 ( 8.112 3.607 -3.071) 9.394 10.520 ( 2.034 3.667 4.211) 5.943 10.632 ( -1.087 1.960 -4.235) 4.792 10.772 ( -6.259 -9.888 -1.771) 11.835 10.798 ( 1.079 2.186 6.084) 6.554 10.989 ( -0.851 -12.982 1.571) 13.105 11.195 ( 2.161 -3.159 2.361) 4.498 11.370 ( 3.337 -6.116 2.061) 7.265 11.482 ( -1.984 4.973 -3.905) 6.627 11.536 ( -0.213 2.638 -2.005) 3.320 11.691 ( -5.879 5.832 -2.066) 8.535 11.889 ( -2.778 -6.178 -3.924) 7.828 12.014 ( -5.254 6.737 3.262) 9.145 12.062 ( 2.040 -4.139 4.678) 6.571 12.176 ( 4.609 6.926 1.405) 8.437 12.300 ( 3.321 -8.731 -2.244) 9.607 12.449 ( 1.382 -2.839 -2.171) 3.832 12.589 ( 0.549 -9.505 -0.018) 9.521 12.679 ( -3.481 0.129 -1.392) 3.751 12.807 ( 1.492 0.681 0.458) 1.703 12.863 ( -3.999 0.730 -0.165) 4.068 12.981 ( 1.183 -1.189 0.827) 1.870 13.402 ( -3.250 -9.553 -2.445) 10.383 13.522 ( -0.844 -5.709 2.886) 6.452 13.719 ( -3.013 -10.382 -1.607) 10.930 13.768 ( -2.148 -7.782 2.581) 8.475 13.965 ( -4.186 3.146 -3.771) 6.453 14.070 ( -2.821 -0.969 0.474) 3.020 14.252 ( 0.980 -2.567 0.818) 2.867 14.327 ( 3.170 -1.124 -1.026) 3.516 16.188 ( -2.511 -9.609 0.024) 9.932 16.420 ( 3.516 -10.164 -0.122) 10.755 16.621 ( 1.995 -17.319 0.275) 17.435 16.819 ( 6.803 -17.678 -0.119) 18.942 18.195 ( -0.194 7.155 -0.490) 7.175 18.255 ( 2.314 6.679 0.989) 7.138 18.764 ( -3.366 12.723 -1.530) 13.250 18.803 ( -1.471 12.463 0.722) 12.571 20.260 ( -0.207 -0.750 -1.766) 1.930 20.321 ( 1.769 -5.111 1.729) 5.678 20.509 ( -0.085 5.480 -0.333) 5.490 20.523 ( 0.157 6.872 0.210) 6.877 20.923 ( -4.396 -6.385 2.104) 8.033 21.002 ( -0.934 -5.964 -2.052) 6.376 21.326 ( 3.071 -7.260 -0.167) 7.884 21.395 ( 4.454 -8.113 0.333) 9.262 22.442 ( -0.876 0.386 -0.202) 0.978 22.542 ( 2.152 -2.181 0.255) 3.075 22.737 ( -0.519 -1.845 1.293) 2.312 22.747 ( 0.009 -1.991 -1.455) 2.466 23.893 ( -14.062 27.796 8.803) 32.371 24.096 ( -5.840 26.124 -11.339) 29.072 24.284 ( -4.357 11.762 -0.402) 12.550 24.367 ( -0.246 10.839 -1.958) 11.017 24.552 ( -7.103 3.424 4.397) 9.028 24.731 ( 2.100 3.932 -3.986) 5.980 25.180 ( -11.531 -4.352 2.899) 12.661 25.304 ( -5.520 -3.867 -1.652) 6.939 26.792 ( -0.061 -3.373 2.846) 4.414 26.859 ( 2.432 -2.072 -2.865) 4.291 26.992 ( -1.059 -3.077 5.448) 6.346 27.083 ( 3.304 -4.521 -1.895) 5.912 27.177 ( -3.447 -4.014 -1.019) 5.388 27.269 ( -0.262 -5.004 -2.453) 5.579 27.428 ( -2.110 -6.864 2.821) 7.715 27.490 ( 0.302 -8.357 -2.254) 8.661 27.912 ( -5.531 2.712 1.926) 6.455 28.090 ( 1.888 1.551 -2.957) 3.836 28.278 ( -1.297 4.935 3.076) 5.959 28.356 ( 0.383 3.022 1.607) 3.444 28.584 ( -3.018 0.878 -1.745) 3.595 28.639 ( -3.799 1.847 -0.213) 4.229 28.691 ( 4.859 3.715 -1.090) 6.212 29.021 ( 8.723 -2.310 -0.098) 9.024 29.079 ( -1.416 5.863 -0.050) 6.032 29.217 ( 0.450 -2.338 2.137) 3.199 29.462 ( 0.103 5.639 -0.014) 5.640 29.797 ( 6.786 1.088 3.362) 7.651 30.622 ( -1.921 4.730 -1.162) 5.236 30.679 ( 0.415 2.604 1.179) 2.889 30.895 ( -2.541 7.547 0.104) 7.964 30.999 ( -1.426 7.533 4.394) 8.837 33.910 ( -2.588 -0.012 0.964) 2.762 33.920 ( -1.360 -0.784 -0.600) 1.680 33.977 ( 0.536 -0.929 0.979) 1.452 34.006 ( 0.234 -1.623 -1.196) 2.030 37.187 ( 0.386 -2.110 -0.220) 2.156 37.198 ( 1.574 -1.585 0.567) 2.304 37.231 ( 0.145 -1.142 -0.416) 1.224 37.309 ( 1.694 -2.837 -0.176) 3.309 37.621 ( -0.564 4.241 0.047) 4.279 37.674 ( 1.076 3.441 0.938) 3.726 37.743 ( 0.299 1.736 -1.067) 2.059 37.817 ( 2.897 -0.549 -1.104) 3.149 48.863 ( 7.365 -1.012 1.026) 7.505 48.900 ( 4.188 -1.142 0.396) 4.359 48.989 ( 13.162 -3.042 -3.478) 13.949 49.038 ( 12.540 -3.154 2.745) 13.218 50.540 ( -1.051 -0.373 -2.716) 2.936 50.559 ( -0.810 0.442 1.198) 1.512 50.840 ( -5.542 -7.472 -11.111) 14.492 51.131 ( 0.077 -14.497 5.954) 15.672 51.903 ( -0.905 6.187 -0.681) 6.290 51.932 ( -0.050 6.634 0.325) 6.643 52.392 ( 0.066 2.080 -1.169) 2.387 52.411 ( 0.681 5.873 1.190) 6.031 52.490 ( -1.832 -0.737 -0.431) 2.021 52.650 ( 4.275 -11.067 -0.641) 11.881 53.078 ( 3.021 -6.311 -0.442) 7.011 53.091 ( 3.377 -6.207 0.153) 7.068 53.836 ( 0.850 0.906 0.827) 1.492 53.846 ( 1.186 0.906 -0.674) 1.638 54.238 ( -1.922 -2.852 3.299) 4.766 54.268 ( 0.164 -2.628 -2.308) 3.501 55.751 ( -0.012 0.905 0.589) 1.080 55.778 ( 1.256 1.364 -0.576) 1.941 56.156 ( -5.123 -10.277 7.976) 13.981 56.198 ( -1.337 -10.273 -7.111) 12.566 57.522 ( -0.369 6.294 -0.733) 6.347 57.548 ( 0.487 6.989 1.007) 7.078 57.834 ( -4.211 8.603 5.586) 11.088 57.926 ( 0.503 5.192 -9.468) 10.810 58.211 ( -10.413 1.263 0.756) 10.516 58.237 ( -2.452 -2.501 -0.601) 3.553 58.372 ( 2.640 -6.482 3.646) 7.892 58.607 ( 2.932 -10.746 0.740) 11.163 60.974 ( -0.364 1.930 -0.104) 1.967 60.987 ( 0.171 2.020 -0.165) 2.034 61.170 ( -2.903 6.009 -3.728) 7.644 61.210 ( -3.354 5.671 5.059) 8.307 ======================= Grid point 176 (78/90) ======================= q-point: ( 0.25 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 132 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.380 ( 15.411 7.203 -19.068) 25.553 2.914 ( 6.600 16.263 9.950) 20.175 3.030 ( 3.661 17.919 -24.311) 30.423 3.420 ( 12.867 18.416 3.276) 22.703 3.438 ( 2.860 5.368 5.981) 8.530 3.796 ( 11.183 3.980 8.071) 14.354 4.070 ( 9.614 10.527 -3.335) 14.642 4.532 ( 12.565 6.302 9.729) 17.096 4.780 ( 13.716 6.856 -2.287) 15.504 4.992 ( 10.948 11.909 -2.477) 16.365 5.048 ( 18.996 27.020 -14.929) 36.246 5.188 ( -2.050 -7.157 6.776) 10.067 5.220 ( 12.035 12.759 1.400) 17.596 5.367 ( 5.000 5.905 2.549) 8.146 5.510 ( 8.194 1.812 13.653) 16.026 5.578 ( -6.799 7.470 -11.149) 15.044 5.772 ( 1.142 12.443 -1.730) 12.614 5.855 ( 8.392 9.500 5.302) 13.740 6.208 ( -0.357 -1.258 -4.538) 4.723 6.303 ( 1.495 8.711 6.741) 11.115 6.476 ( -4.379 -9.045 -2.461) 10.346 6.567 ( 2.693 -3.711 0.183) 4.589 6.596 ( 6.180 10.043 9.386) 15.072 6.723 ( 8.978 7.251 -4.359) 12.336 6.838 ( 5.986 0.821 5.785) 8.365 6.977 ( 9.302 0.150 -1.636) 9.446 7.185 ( 2.651 -0.073 2.557) 3.684 7.269 ( 1.154 5.058 8.888) 10.291 7.485 ( 0.474 1.926 -2.102) 2.890 7.521 ( 6.184 4.681 -6.003) 9.808 7.669 ( -5.514 -1.563 2.900) 6.423 7.691 ( -5.679 -5.216 -1.406) 7.837 7.715 ( -3.912 -10.999 8.328) 14.340 7.893 ( 2.173 7.291 -4.864) 9.030 8.002 ( 4.225 0.399 -0.981) 4.355 8.307 ( 1.843 -0.799 -1.397) 2.447 8.426 ( -3.597 -0.253 -2.608) 4.450 8.505 ( 6.121 -6.187 -2.705) 9.114 8.642 ( -3.045 -3.957 -8.559) 9.909 8.808 ( 5.279 -2.750 -3.316) 6.814 8.928 ( 0.160 -3.284 0.405) 3.312 9.022 ( 1.551 1.563 5.074) 5.531 9.078 ( 6.559 0.482 2.793) 7.145 9.241 ( -4.800 4.654 -0.109) 6.687 9.514 ( 4.098 0.725 -5.776) 7.119 9.597 ( 2.597 1.548 -9.314) 9.792 9.768 ( -3.508 -1.336 -0.519) 3.789 9.918 ( -0.490 5.415 4.025) 6.765 9.975 ( 1.475 -11.506 3.372) 12.080 10.058 ( 2.609 -5.741 -0.547) 6.330 10.448 ( -1.993 3.247 -6.347) 7.403 10.564 ( -0.515 -1.345 0.104) 1.444 10.644 ( -0.231 -6.480 -0.458) 6.500 10.742 ( 2.378 2.052 6.075) 6.839 10.826 ( 5.230 -4.947 4.686) 8.590 10.984 ( -1.002 -4.066 6.458) 7.696 11.212 ( -2.080 -1.456 -0.956) 2.713 11.328 ( -3.569 2.489 -1.734) 4.684 11.406 ( -3.782 7.230 -5.366) 9.766 11.523 ( -3.220 7.059 -2.694) 8.213 11.670 ( 4.248 1.265 4.623) 6.405 11.839 ( -1.949 -4.715 -1.870) 5.434 11.889 ( -4.994 1.834 6.250) 8.208 12.065 ( -4.251 4.594 -0.616) 6.290 12.302 ( 3.937 -4.057 1.011) 5.743 12.357 ( 2.989 -14.402 -1.308) 14.767 12.486 ( 1.227 -3.195 0.003) 3.423 12.549 ( -1.649 -3.619 -1.311) 4.187 12.636 ( -0.900 -2.783 -2.621) 3.927 12.746 ( -6.351 3.614 1.074) 7.386 12.840 ( 1.481 -6.084 0.374) 6.273 12.978 ( -0.647 -3.931 0.342) 3.998 13.326 ( -4.329 -7.739 -2.371) 9.179 13.464 ( -4.157 -5.650 1.734) 7.226 13.646 ( -3.287 -10.590 -1.708) 11.219 13.699 ( -4.936 -5.000 2.702) 7.528 13.887 ( -2.374 0.147 -3.896) 4.564 14.011 ( -2.495 -6.543 0.360) 7.011 14.261 ( -0.306 -3.236 1.734) 3.684 14.361 ( 0.301 -4.082 -1.413) 4.330 16.172 ( 0.737 -10.645 -0.857) 10.705 16.391 ( -3.748 -14.179 0.977) 14.699 16.782 ( 10.013 -12.849 -0.117) 16.291 16.953 ( 5.651 -16.323 -0.052) 17.274 18.210 ( 1.747 7.986 -0.111) 8.176 18.323 ( 4.046 7.206 0.719) 8.295 18.662 ( -5.790 12.783 -1.522) 14.116 18.755 ( -3.270 12.056 0.362) 12.497 20.277 ( 2.384 0.409 -0.765) 2.537 20.371 ( 2.712 -4.998 0.707) 5.731 20.503 ( -0.534 8.734 -1.628) 8.900 20.519 ( -0.442 4.194 1.319) 4.418 20.834 ( -4.814 -6.871 3.133) 8.956 20.938 ( -4.429 -5.335 -3.072) 7.584 21.437 ( 6.901 -8.497 0.431) 10.955 21.505 ( 6.011 -8.989 -0.446) 10.823 22.446 ( 0.819 0.804 1.548) 1.927 22.565 ( 0.241 -1.633 -1.597) 2.297 22.734 ( -0.178 -2.180 0.712) 2.300 22.745 ( 0.245 -2.075 -0.526) 2.155 23.656 ( -9.199 23.378 4.332) 25.494 23.865 ( -11.386 24.633 -7.072) 28.043 24.157 ( -7.857 10.254 -0.391) 12.924 24.270 ( -9.613 8.832 1.625) 13.155 24.465 ( -0.878 5.983 -0.370) 6.058 24.727 ( -2.673 5.663 0.075) 6.262 24.945 ( -8.959 -3.557 -0.577) 9.657 25.144 ( -8.496 -2.967 0.522) 9.015 26.823 ( 2.246 -4.106 1.697) 4.978 26.886 ( 0.938 -3.063 -0.891) 3.325 27.002 ( 0.238 -2.423 5.017) 5.576 27.126 ( 0.248 -1.678 -1.974) 2.603 27.150 ( 1.630 -5.546 -2.873) 6.455 27.259 ( -0.407 -6.137 -1.543) 6.341 27.367 ( -3.469 -4.118 0.094) 5.385 27.461 ( -2.016 -6.952 -0.126) 7.239 27.857 ( -0.094 1.059 2.522) 2.737 28.082 ( -1.819 -1.185 -1.271) 2.516 28.291 ( 0.541 8.540 -0.823) 8.596 28.365 ( 1.341 2.803 5.920) 6.685 28.470 ( -5.250 1.877 -1.797) 5.858 28.631 ( 0.167 2.026 0.223) 2.045 28.806 ( 5.957 3.926 -0.878) 7.188 29.077 ( 0.637 6.978 0.133) 7.008 29.183 ( 5.509 -1.596 3.597) 6.770 29.224 ( 1.493 -4.400 -2.837) 5.444 29.528 ( 4.727 4.835 -0.320) 6.770 29.856 ( -0.961 3.077 1.140) 3.420 30.584 ( -1.040 2.922 0.062) 3.102 30.688 ( 0.249 1.213 -0.102) 1.243 30.860 ( -1.121 6.018 -0.350) 6.131 30.944 ( -3.797 5.861 2.474) 7.408 33.869 ( -1.441 0.394 0.374) 1.540 33.891 ( -1.322 -0.543 0.037) 1.430 33.988 ( 0.125 -1.127 1.147) 1.612 33.995 ( -0.482 -1.059 -1.815) 2.155 37.202 ( 1.140 -1.462 -0.193) 1.864 37.236 ( 1.371 -0.880 -0.465) 1.694 37.260 ( 2.274 -1.955 1.585) 3.392 37.332 ( 0.735 -2.208 -0.610) 2.405 37.624 ( 0.729 3.958 -0.003) 4.024 37.691 ( 0.108 3.457 1.465) 3.756 37.764 ( 1.940 0.840 -1.380) 2.524 37.861 ( 1.457 -1.555 -0.925) 2.323 49.031 ( 7.492 -1.425 1.286) 7.734 49.039 ( 8.711 -1.959 -0.530) 8.944 49.262 ( 13.029 -4.889 -5.193) 14.853 49.362 ( 14.124 -8.591 7.903) 18.323 50.501 ( -1.065 0.803 -3.713) 3.945 50.547 ( -0.467 0.552 0.936) 1.183 50.761 ( -0.325 -3.793 -6.176) 7.255 51.071 ( -5.954 -10.803 2.250) 12.538 51.888 ( -0.302 6.021 -0.110) 6.030 51.927 ( -0.402 6.877 -0.240) 6.893 52.398 ( 0.773 -1.363 1.374) 2.084 52.430 ( 0.815 6.520 1.001) 6.646 52.470 ( -0.181 3.439 0.022) 3.444 52.695 ( 0.473 -11.720 -4.746) 12.653 53.150 ( 3.154 -7.442 2.011) 8.329 53.175 ( 4.341 -7.520 -2.349) 8.995 53.869 ( 1.842 0.459 0.950) 2.123 53.872 ( 1.459 0.704 -0.875) 1.841 54.204 ( -2.142 -2.744 4.342) 5.565 54.256 ( -0.590 -2.540 -2.664) 3.728 55.762 ( 0.957 0.198 0.425) 1.066 55.807 ( 1.620 1.004 -0.431) 1.954 56.056 ( -5.993 -7.381 6.744) 11.657 56.125 ( -3.691 -7.549 -5.768) 10.192 57.517 ( 0.074 6.165 -0.454) 6.183 57.559 ( 0.211 7.285 0.964) 7.352 57.763 ( -3.659 9.942 3.978) 11.316 57.836 ( -5.589 9.474 -7.369) 13.240 58.102 ( -0.679 -1.466 0.937) 1.868 58.202 ( -1.048 -1.750 0.216) 2.052 58.426 ( 1.334 -7.872 4.372) 9.103 58.607 ( -1.896 -11.308 -1.964) 11.632 60.970 ( 0.064 1.990 -0.104) 1.993 60.991 ( 0.347 2.091 -0.190) 2.128 61.102 ( -2.837 5.092 -1.183) 5.948 61.137 ( -3.977 5.290 2.072) 6.935 ======================= Grid point 177 (79/90) ======================= q-point: ( 0.38 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.715 ( 17.787 -1.968 -8.790) 19.938 3.018 ( 1.733 2.146 -2.566) 3.767 3.069 ( 4.731 16.008 -4.728) 17.349 3.392 ( -4.085 3.518 6.203) 8.218 3.809 ( 15.628 13.947 0.458) 20.951 4.037 ( 10.898 13.045 -4.544) 17.595 4.279 ( 9.761 8.700 0.934) 13.109 4.672 ( 0.323 8.993 1.613) 9.142 4.883 ( -13.289 6.322 -1.261) 14.771 4.968 ( 2.045 2.857 8.194) 8.915 5.201 ( 2.855 1.608 -14.791) 15.149 5.281 ( 6.057 5.694 0.017) 8.313 5.456 ( 6.803 6.781 3.715) 10.299 5.537 ( 9.644 5.313 -0.199) 11.013 5.579 ( 2.542 5.042 -1.480) 5.837 5.713 ( 5.408 -7.030 9.277) 12.835 5.758 ( 1.866 -1.032 0.119) 2.135 6.088 ( 15.278 12.291 -0.285) 19.610 6.137 ( -3.321 7.717 0.404) 8.411 6.443 ( -2.944 2.310 -1.814) 4.158 6.462 ( 6.139 7.757 14.456) 17.517 6.573 ( -1.203 -2.597 -10.678) 11.055 6.748 ( 7.203 5.951 0.858) 9.383 6.870 ( 7.195 -1.801 5.677) 9.340 6.932 ( 8.621 0.981 -8.967) 12.478 7.158 ( -3.927 -1.164 -2.169) 4.635 7.287 ( -2.390 -4.755 5.840) 7.902 7.380 ( 12.439 6.191 2.403) 14.101 7.470 ( -1.221 5.286 1.105) 5.536 7.547 ( -1.265 10.220 6.357) 12.102 7.609 ( 2.112 6.077 4.619) 7.920 7.665 ( -0.617 -3.772 5.699) 6.862 7.711 ( 8.021 -0.352 1.281) 8.130 7.945 ( 2.230 1.979 -5.010) 5.830 8.097 ( 5.367 5.163 -1.720) 7.643 8.316 ( -1.752 3.171 -1.947) 4.112 8.367 ( -1.507 1.708 2.407) 3.314 8.481 ( -8.054 -8.210 -5.997) 12.971 8.603 ( 4.632 -3.238 -5.745) 8.059 8.848 ( 0.765 -0.883 -3.841) 4.015 8.972 ( 1.976 0.941 -0.911) 2.371 9.001 ( -6.359 3.479 4.220) 8.387 9.172 ( 0.769 1.173 -2.726) 3.065 9.277 ( 6.672 -2.947 5.384) 9.065 9.543 ( -2.594 2.671 -8.752) 9.511 9.613 ( 3.524 1.425 -6.751) 7.748 9.642 ( -3.363 6.312 -0.769) 7.193 9.919 ( -0.072 5.492 -1.958) 5.831 10.032 ( -2.093 -2.813 -1.914) 3.994 10.081 ( 2.345 -12.465 2.417) 12.912 10.408 ( -0.438 -2.814 -1.691) 3.312 10.520 ( -4.310 -3.611 2.666) 6.223 10.626 ( 2.011 -0.415 0.251) 2.069 10.842 ( 7.926 -0.760 7.695) 11.074 10.960 ( -3.679 -1.998 8.623) 9.586 11.041 ( 7.721 -1.728 0.076) 7.912 11.134 ( -1.908 -1.036 -1.650) 2.726 11.251 ( -4.645 5.220 -0.495) 7.005 11.343 ( 0.935 8.517 -3.392) 9.215 11.499 ( 1.409 11.998 -2.196) 12.278 11.691 ( -3.808 1.312 4.464) 6.013 11.815 ( -0.972 -11.067 -7.424) 13.362 11.828 ( -3.481 2.066 9.082) 9.943 11.947 ( -5.192 2.748 1.576) 6.082 12.264 ( -3.100 -6.316 -1.756) 7.252 12.367 ( -3.516 -0.956 -3.327) 4.934 12.513 ( -0.542 2.509 -1.545) 2.996 12.544 ( 2.879 -7.037 -0.090) 7.604 12.598 ( -1.732 -7.341 -1.739) 7.740 12.689 ( -0.354 -2.445 2.938) 3.839 12.845 ( 0.869 -5.615 0.574) 5.711 13.025 ( 3.155 -8.310 1.263) 8.978 13.205 ( -4.483 -2.811 -2.955) 6.060 13.382 ( -4.826 -7.047 0.590) 8.562 13.583 ( -2.039 -9.260 -1.831) 9.657 13.601 ( -4.012 -4.999 2.110) 6.748 13.851 ( 0.069 -4.675 -1.885) 5.041 13.957 ( -3.156 -9.033 -0.072) 9.569 14.265 ( 0.334 -5.105 3.009) 5.936 14.339 ( -1.592 -6.734 -1.883) 7.171 16.202 ( 2.260 -11.206 -1.446) 11.523 16.316 ( -3.561 -13.273 1.444) 13.818 16.964 ( 6.721 -12.637 0.036) 14.313 17.041 ( 2.560 -14.598 0.010) 14.821 18.270 ( 4.110 9.265 0.149) 10.137 18.428 ( 5.578 8.051 0.606) 9.813 18.524 ( -6.697 12.388 -1.555) 14.168 18.670 ( -4.904 11.095 0.317) 12.134 20.357 ( 4.962 1.546 0.512) 5.223 20.432 ( 2.768 -1.810 0.078) 3.308 20.477 ( -1.082 11.850 -2.288) 12.118 20.526 ( 0.773 -0.634 1.050) 1.450 20.735 ( -5.231 -6.277 3.961) 9.080 20.817 ( -5.764 -5.258 -3.636) 8.607 21.586 ( 6.334 -10.868 0.609) 12.594 21.624 ( 4.819 -11.052 -0.638) 12.074 22.475 ( 1.297 0.491 2.560) 2.912 22.550 ( -1.015 -0.646 -2.645) 2.906 22.735 ( 0.333 -2.455 -0.054) 2.478 22.750 ( 0.073 -2.375 0.287) 2.393 23.556 ( -1.098 17.464 1.400) 17.554 23.667 ( -5.350 19.446 -2.132) 20.281 23.961 ( -9.418 9.417 -1.647) 13.420 24.033 ( -11.991 8.922 2.216) 15.110 24.477 ( 1.842 7.443 -2.372) 8.026 24.619 ( -6.361 6.428 4.205) 9.973 24.859 ( 0.292 -0.357 -4.789) 4.811 24.986 ( -6.591 -1.158 2.670) 7.205 26.884 ( 2.847 -5.313 0.687) 6.067 26.908 ( 1.295 -4.566 0.232) 4.752 27.009 ( -0.609 -4.320 2.286) 4.925 27.095 ( -2.734 -6.621 -1.936) 7.420 27.183 ( 1.564 -0.197 -1.755) 2.359 27.221 ( -2.011 -1.217 1.391) 2.731 27.347 ( 1.669 -4.295 -3.340) 5.691 27.421 ( -1.969 -5.971 1.344) 6.430 27.899 ( 2.731 -1.132 2.640) 3.963 28.029 ( -2.682 -1.840 -0.738) 3.335 28.277 ( -0.656 5.359 0.885) 5.471 28.363 ( -3.943 1.410 -1.828) 4.569 28.458 ( 4.229 5.698 5.273) 8.840 28.616 ( -1.600 4.244 -1.855) 4.901 28.919 ( 4.678 3.427 0.983) 5.882 29.064 ( -1.423 4.636 -3.742) 6.125 29.263 ( 2.605 -1.463 0.491) 3.027 29.281 ( 2.495 -2.553 1.013) 3.711 29.629 ( 4.862 5.352 -0.509) 7.248 29.804 ( -3.521 5.701 0.336) 6.709 30.589 ( 1.415 0.446 0.230) 1.501 30.679 ( -1.364 0.207 -0.282) 1.408 30.842 ( -0.275 5.192 -0.632) 5.238 30.884 ( -2.252 4.608 1.080) 5.241 33.851 ( -0.318 0.176 -0.107) 0.379 33.867 ( -0.995 -0.355 0.335) 1.108 33.985 ( 0.093 -0.745 -1.799) 1.949 33.990 ( -0.274 -1.041 1.395) 1.762 37.229 ( 1.271 -1.126 0.019) 1.698 37.253 ( 0.408 -0.827 -0.469) 1.035 37.309 ( 1.700 -1.856 1.404) 2.881 37.340 ( 0.257 -1.715 -0.715) 1.876 37.645 ( 1.186 3.436 -0.144) 3.638 37.687 ( -0.720 3.099 0.830) 3.288 37.809 ( 2.356 0.026 -0.468) 2.402 37.872 ( -0.222 -1.413 -0.492) 1.513 49.185 ( 5.952 -2.095 1.935) 6.600 49.197 ( 6.032 -2.322 -1.583) 6.655 49.481 ( 8.966 -5.529 -4.371) 11.404 49.584 ( 4.591 -9.521 6.183) 12.245 50.500 ( 1.420 1.307 -0.870) 2.117 50.542 ( -0.251 0.538 0.210) 0.629 50.765 ( 1.798 -3.269 -3.641) 5.212 50.935 ( -6.805 -6.798 1.456) 9.729 51.889 ( 0.237 5.871 0.463) 5.894 51.914 ( -0.606 6.555 -0.837) 6.636 52.437 ( 1.631 0.849 3.093) 3.599 52.451 ( 0.999 6.310 0.586) 6.415 52.478 ( 1.120 1.146 2.260) 2.770 52.651 ( -2.703 -9.736 -7.360) 12.501 53.212 ( 1.993 -7.791 2.872) 8.540 53.236 ( 2.071 -8.065 -3.257) 8.941 53.898 ( 1.283 0.515 -1.101) 1.767 53.907 ( 1.179 0.166 0.808) 1.439 54.182 ( -0.942 -2.648 5.180) 5.893 54.229 ( -1.075 -2.598 -3.610) 4.576 55.794 ( 1.997 -0.591 -0.060) 2.083 55.842 ( 1.625 0.353 -0.111) 1.667 55.960 ( -4.319 -4.820 4.977) 8.165 56.026 ( -4.108 -4.726 -4.295) 7.593 57.524 ( 0.687 6.355 -0.222) 6.396 57.559 ( -0.482 7.309 0.706) 7.359 57.709 ( -2.284 10.025 2.375) 10.552 57.724 ( -3.005 10.272 -3.599) 11.291 58.122 ( 1.719 -3.016 0.111) 3.473 58.185 ( -0.859 -2.119 -0.106) 2.289 58.457 ( 0.788 -8.946 4.255) 9.938 58.547 ( -2.614 -10.410 -3.296) 11.228 60.978 ( 0.799 2.297 -0.072) 2.433 61.003 ( 0.866 2.338 -0.101) 2.495 61.046 ( -2.366 3.887 -0.108) 4.552 61.070 ( -2.651 4.095 0.442) 4.898 ======================= Grid point 178 (80/90) ======================= q-point: ( 0.50 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 74 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.968 ( 6.855 -2.202 -3.003) 7.802 2.968 ( -6.855 -2.202 3.003) 7.802 3.234 ( 3.636 9.313 -8.340) 13.020 3.234 ( -3.636 9.313 8.340) 13.020 4.067 ( -7.771 9.109 -3.984) 12.619 4.067 ( 7.771 9.109 3.984) 12.619 4.526 ( -14.755 8.498 -10.230) 19.864 4.526 ( 14.755 8.498 10.230) 19.864 4.835 ( -10.354 17.029 -2.321) 20.064 4.835 ( 10.354 17.029 2.321) 20.064 5.335 ( 1.946 -10.095 -6.772) 12.311 5.335 ( -1.946 -10.095 6.772) 12.311 5.489 ( -8.041 -1.440 0.912) 8.219 5.489 ( 8.041 -1.440 -0.912) 8.219 5.694 ( -5.402 7.819 1.299) 9.592 5.694 ( 5.402 7.819 -1.299) 9.592 6.021 ( -6.779 -4.093 -7.818) 11.128 6.021 ( 6.779 -4.093 7.818) 11.128 6.334 ( -3.299 7.828 -7.239) 11.161 6.334 ( 3.299 7.828 7.239) 11.161 6.525 ( 2.833 10.894 -11.989) 16.445 6.525 ( -2.833 10.894 11.989) 16.445 6.931 ( -3.662 0.805 -1.970) 4.236 6.931 ( 3.662 0.805 1.970) 4.236 7.087 ( 5.656 -6.583 -11.435) 14.356 7.087 ( -5.656 -6.583 11.435) 14.356 7.251 ( -3.227 -3.720 -2.833) 5.681 7.251 ( 3.227 -3.720 2.833) 5.681 7.550 ( 3.981 11.299 -4.830) 12.917 7.550 ( -3.981 11.299 4.830) 12.917 7.704 ( -2.134 1.113 -0.696) 2.506 7.704 ( 2.134 1.113 0.696) 2.506 7.916 ( -6.115 0.441 -5.668) 8.350 7.916 ( 6.115 0.441 5.668) 8.350 8.233 ( -4.317 10.288 -1.383) 11.243 8.233 ( 4.317 10.288 1.383) 11.243 8.354 ( 0.401 0.740 -8.808) 8.848 8.354 ( -0.401 0.740 8.808) 8.848 8.733 ( -8.723 -1.393 -2.590) 9.205 8.733 ( 8.723 -1.393 2.590) 9.205 8.957 ( -2.224 1.786 -1.626) 3.283 8.957 ( 2.224 1.786 1.626) 3.283 9.233 ( -1.686 2.332 -7.744) 8.261 9.233 ( 1.686 2.332 7.744) 8.261 9.563 ( -0.666 2.101 -8.586) 8.865 9.563 ( 0.666 2.101 8.586) 8.865 9.786 ( -1.251 2.671 -9.827) 10.260 9.786 ( 1.251 2.671 9.827) 10.260 10.063 ( -2.579 -5.731 -0.742) 6.328 10.063 ( 2.579 -5.731 0.742) 6.328 10.422 ( 0.010 -4.222 -1.150) 4.376 10.422 ( -0.010 -4.222 1.150) 4.376 10.798 ( 2.382 -3.470 -4.358) 6.059 10.798 ( -2.382 -3.470 4.358) 6.059 11.058 ( -5.771 -0.317 -4.984) 7.632 11.058 ( 5.771 -0.317 4.984) 7.632 11.142 ( 1.734 6.722 -3.215) 7.650 11.142 ( -1.734 6.722 3.215) 7.650 11.477 ( -4.687 7.531 -5.356) 10.362 11.477 ( 4.687 7.531 5.356) 10.362 11.651 ( -2.253 -4.645 -6.171) 8.046 11.651 ( 2.253 -4.645 6.171) 8.046 11.879 ( 1.683 1.796 -9.677) 9.985 11.879 ( -1.683 1.796 9.677) 9.985 12.267 ( -1.536 -1.107 -6.097) 6.384 12.267 ( 1.536 -1.107 6.097) 6.384 12.525 ( -1.236 -0.541 -1.695) 2.166 12.525 ( 1.236 -0.541 1.695) 2.166 12.643 ( -1.918 -8.199 -2.038) 8.664 12.643 ( 1.918 -8.199 2.038) 8.664 12.954 ( -7.000 -6.800 -1.481) 9.871 12.954 ( 7.000 -6.800 1.481) 9.871 13.254 ( -2.363 -4.337 -3.249) 5.911 13.254 ( 2.363 -4.337 3.249) 5.911 13.561 ( 0.691 -7.778 -2.405) 8.170 13.561 ( -0.691 -7.778 2.405) 8.170 13.885 ( -1.378 -7.931 -1.457) 8.181 13.885 ( 1.378 -7.931 1.457) 8.181 14.296 ( -1.473 -7.216 -3.239) 8.046 14.296 ( 1.473 -7.216 3.239) 8.046 16.253 ( 1.092 -11.975 -5.773) 13.339 16.253 ( -1.092 -11.975 5.773) 13.339 17.052 ( -1.693 -13.231 -0.035) 13.339 17.052 ( 1.693 -13.231 0.035) 13.339 18.380 ( -4.093 10.803 -1.904) 11.708 18.380 ( 4.093 10.803 1.904) 11.708 18.555 ( -3.285 9.726 -1.380) 10.359 18.555 ( 3.285 9.726 1.380) 10.359 20.442 ( -1.704 8.591 -2.074) 9.000 20.442 ( 1.704 8.591 2.074) 9.000 20.506 ( -3.745 -2.555 -0.602) 4.573 20.506 ( 3.745 -2.555 0.602) 4.573 20.705 ( -2.598 -5.540 -4.545) 7.622 20.705 ( 2.598 -5.540 4.545) 7.622 21.669 ( -0.281 -12.119 -1.751) 12.248 21.669 ( 0.281 -12.119 1.751) 12.248 22.513 ( -1.494 0.002 -2.995) 3.347 22.513 ( 1.494 0.002 2.995) 3.347 22.746 ( 0.102 -2.557 -1.165) 2.812 22.746 ( -0.102 -2.557 1.165) 2.812 23.595 ( -3.093 14.748 -0.121) 15.069 23.595 ( 3.093 14.748 0.121) 15.069 23.859 ( 1.541 10.461 -3.521) 11.145 23.859 ( -1.541 10.461 3.521) 11.145 24.525 ( 3.512 7.479 -3.405) 8.936 24.525 ( -3.512 7.479 3.405) 8.936 24.890 ( 3.575 0.192 -4.126) 5.463 24.890 ( -3.575 0.192 4.126) 5.463 26.925 ( -0.109 -5.633 -1.895) 5.944 26.925 ( 0.109 -5.633 1.895) 5.944 27.024 ( -2.254 -6.135 -1.346) 6.673 27.024 ( 2.254 -6.135 1.346) 6.673 27.202 ( 0.545 1.085 -1.551) 1.970 27.202 ( -0.545 1.085 1.551) 1.970 27.383 ( 1.561 -5.396 -3.802) 6.783 27.383 ( -1.561 -5.396 3.802) 6.783 27.967 ( -2.988 -1.915 -1.586) 3.887 27.967 ( 2.988 -1.915 1.586) 3.887 28.293 ( -1.849 3.011 -2.411) 4.277 28.293 ( 1.849 3.011 2.411) 4.277 28.554 ( -3.414 5.474 -4.184) 7.689 28.554 ( 3.414 5.474 4.184) 7.689 29.006 ( -2.957 3.358 -3.484) 5.671 29.006 ( 2.957 3.358 3.484) 5.671 29.301 ( 0.663 -1.380 -3.755) 4.055 29.301 ( -0.663 -1.380 3.755) 4.055 29.724 ( -3.155 5.917 -0.269) 6.711 29.724 ( 3.155 5.917 0.269) 6.711 30.634 ( -1.906 -0.204 -0.715) 2.046 30.634 ( 1.906 -0.204 0.715) 2.046 30.851 ( 1.039 4.454 -0.471) 4.597 30.851 ( -1.039 4.454 0.471) 4.597 33.852 ( 0.456 -0.121 -0.353) 0.590 33.852 ( -0.456 -0.121 0.353) 0.590 33.986 ( 0.374 -0.842 -1.513) 1.771 33.986 ( -0.374 -0.842 1.513) 1.771 37.250 ( -0.552 -0.943 -0.290) 1.130 37.250 ( 0.552 -0.943 0.290) 1.130 37.336 ( -0.277 -1.605 -1.458) 2.186 37.336 ( 0.277 -1.605 1.458) 2.186 37.669 ( 0.231 3.114 -1.674) 3.543 37.669 ( -0.231 3.114 1.674) 3.543 37.851 ( -0.944 -0.807 -0.706) 1.429 37.851 ( 0.944 -0.807 0.706) 1.429 49.258 ( -0.061 -2.489 -1.994) 3.190 49.258 ( 0.061 -2.489 1.994) 3.190 49.603 ( 3.188 -7.108 -4.277) 8.887 49.603 ( -3.188 -7.108 4.277) 8.887 50.530 ( -0.760 0.713 -0.640) 1.223 50.530 ( 0.760 0.713 0.640) 1.223 50.819 ( 3.667 -4.210 -2.262) 6.024 50.819 ( -3.667 -4.210 2.262) 6.024 51.899 ( -0.379 6.077 -1.170) 6.201 51.899 ( 0.379 6.077 1.170) 6.201 52.457 ( -0.214 6.705 -1.184) 6.812 52.457 ( 0.214 6.705 1.184) 6.812 52.556 ( -3.910 -7.133 -7.677) 11.185 52.556 ( 3.910 -7.133 7.677) 11.185 53.245 ( -0.213 -7.949 -3.489) 8.684 53.245 ( 0.213 -7.949 3.489) 8.684 53.916 ( 0.467 0.302 -0.968) 1.116 53.916 ( -0.467 0.302 0.968) 1.116 54.196 ( -0.738 -2.661 -4.826) 5.560 54.196 ( 0.738 -2.661 4.826) 5.560 55.840 ( 0.073 -0.934 -1.486) 1.756 55.840 ( -0.073 -0.934 1.486) 1.756 55.944 ( -1.094 -3.230 -5.470) 6.446 55.944 ( 1.094 -3.230 5.470) 6.446 57.543 ( -0.218 6.863 -0.298) 6.873 57.543 ( 0.218 6.863 0.298) 6.873 57.689 ( 0.348 9.995 -2.805) 10.387 57.689 ( -0.348 9.995 2.805) 10.387 58.159 ( -0.198 -2.923 -2.368) 3.767 58.159 ( 0.198 -2.923 2.368) 3.767 58.492 ( -1.625 -9.620 -3.797) 10.469 58.492 ( 1.625 -9.620 3.797) 10.469 61.003 ( -1.351 2.951 -0.134) 3.249 61.003 ( 1.351 2.951 0.134) 3.249 61.028 ( -1.349 2.947 -0.034) 3.241 61.028 ( 1.349 2.947 0.034) 3.241 ======================= Grid point 183 (81/90) ======================= q-point: ( 0.00 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.075 ( -10.525 19.037 -11.589) 24.647 3.075 ( 10.525 19.037 11.589) 24.647 3.352 ( -1.825 13.119 -7.629) 15.285 3.352 ( 1.825 13.119 7.629) 15.285 3.687 ( 2.260 15.499 -10.072) 18.622 3.687 ( -2.260 15.499 10.072) 18.622 4.128 ( -4.715 13.158 -21.885) 25.968 4.128 ( 4.715 13.158 21.885) 25.968 4.636 ( 3.957 1.454 -6.078) 7.397 4.636 ( -3.957 1.454 6.078) 7.397 5.058 ( -5.811 -0.828 -7.073) 9.192 5.058 ( 5.811 -0.828 7.073) 9.192 5.081 ( -1.755 -0.889 -11.718) 11.882 5.081 ( 1.755 -0.889 11.718) 11.882 5.543 ( -6.435 -5.002 -10.366) 13.187 5.543 ( 6.435 -5.002 10.366) 13.187 6.019 ( 4.675 4.521 -11.174) 12.929 6.019 ( -4.675 4.521 11.174) 12.929 6.143 ( 2.497 -1.668 -4.051) 5.043 6.143 ( -2.497 -1.668 4.051) 5.043 6.488 ( -7.088 -2.374 -9.960) 12.453 6.488 ( 7.088 -2.374 9.960) 12.453 6.622 ( -6.910 3.846 -7.287) 10.754 6.622 ( 6.910 3.846 7.287) 10.754 7.019 ( 4.343 4.810 -7.479) 9.896 7.019 ( -4.343 4.810 7.479) 9.896 7.169 ( -1.927 11.457 -2.469) 11.877 7.169 ( 1.927 11.457 2.469) 11.877 7.455 ( 5.325 9.008 -5.885) 12.005 7.455 ( -5.325 9.008 5.885) 12.005 7.646 ( 5.074 1.545 -8.153) 9.727 7.646 ( -5.074 1.545 8.153) 9.727 7.895 ( -5.082 0.298 -1.314) 5.257 7.895 ( 5.082 0.298 1.314) 5.257 8.063 ( -4.530 -1.517 -1.687) 5.066 8.063 ( 4.530 -1.517 1.687) 5.066 8.542 ( -5.035 6.218 -6.984) 10.620 8.542 ( 5.035 6.218 6.984) 10.620 8.654 ( -1.124 6.634 -3.267) 7.480 8.654 ( 1.124 6.634 3.267) 7.480 9.003 ( -0.882 7.174 -4.110) 8.315 9.003 ( 0.882 7.174 4.110) 8.315 9.284 ( -7.590 4.352 -0.537) 8.766 9.284 ( 7.590 4.352 0.537) 8.766 9.379 ( 2.882 -10.371 -10.136) 14.786 9.379 ( -2.882 -10.371 10.136) 14.786 9.623 ( -2.312 -17.645 -1.483) 17.857 9.623 ( 2.312 -17.645 1.483) 17.857 9.897 ( 2.727 3.457 -4.418) 6.238 9.897 ( -2.727 3.457 4.418) 6.238 10.341 ( -0.589 -25.558 -5.041) 26.057 10.341 ( 0.589 -25.558 5.041) 26.057 10.592 ( -0.854 1.148 -4.392) 4.619 10.592 ( 0.854 1.148 4.392) 4.619 10.817 ( -2.485 0.988 -3.813) 4.657 10.817 ( 2.485 0.988 3.813) 4.657 11.117 ( -3.295 -3.239 -3.741) 5.945 11.117 ( 3.295 -3.239 3.741) 5.945 11.450 ( -1.777 -11.287 -6.222) 13.010 11.450 ( 1.777 -11.287 6.222) 13.010 11.859 ( -3.404 5.424 -6.607) 9.201 11.859 ( 3.404 5.424 6.607) 9.201 12.069 ( -6.277 0.353 -0.793) 6.337 12.069 ( 6.277 0.353 0.793) 6.337 12.327 ( -1.719 4.730 -1.888) 5.375 12.327 ( 1.719 4.730 1.888) 5.375 12.460 ( -1.632 2.903 -0.365) 3.351 12.460 ( 1.632 2.903 0.365) 3.351 12.786 ( -3.281 1.331 -3.248) 4.805 12.786 ( 3.281 1.331 3.248) 4.805 12.984 ( -0.998 4.823 -2.869) 5.700 12.984 ( 0.998 4.823 2.869) 5.700 13.334 ( -3.811 -6.406 -3.211) 8.116 13.334 ( 3.811 -6.406 3.211) 8.116 13.541 ( -0.919 -12.052 -0.616) 12.103 13.541 ( 0.919 -12.052 0.616) 12.103 14.102 ( -1.961 0.046 -2.441) 3.131 14.102 ( 1.961 0.046 2.441) 3.131 14.260 ( -3.120 1.390 -0.023) 3.415 14.260 ( 3.120 1.390 0.023) 3.415 16.146 ( -6.424 -4.334 0.025) 7.749 16.146 ( 6.424 -4.334 -0.025) 7.749 16.354 ( -5.509 -12.586 -0.303) 13.742 16.354 ( 5.509 -12.586 0.303) 13.742 18.337 ( -0.823 4.678 -0.109) 4.751 18.337 ( 0.823 4.678 0.109) 4.751 19.011 ( -0.260 6.717 -0.949) 6.789 19.011 ( 0.260 6.717 0.949) 6.789 20.265 ( -0.035 0.720 -1.088) 1.305 20.265 ( 0.035 0.720 1.088) 1.305 20.667 ( -1.765 8.033 -0.088) 8.225 20.667 ( 1.765 8.033 0.088) 8.225 20.863 ( 1.029 -5.308 -1.421) 5.590 20.863 ( -1.029 -5.308 1.421) 5.590 21.128 ( -1.633 -10.300 -0.069) 10.429 21.128 ( 1.633 -10.300 0.069) 10.429 22.470 ( -1.302 -0.402 -0.511) 1.455 22.470 ( 1.302 -0.402 0.511) 1.455 22.711 ( 0.243 -1.333 -0.621) 1.490 22.711 ( -0.243 -1.333 0.621) 1.490 24.464 ( -1.983 9.887 0.034) 10.084 24.464 ( 1.983 9.887 -0.034) 10.084 24.662 ( 2.852 10.957 -8.041) 13.887 24.662 ( -2.852 10.957 8.041) 13.887 24.740 ( 5.023 8.005 -4.365) 10.410 24.740 ( -5.023 8.005 4.365) 10.410 25.222 ( 3.160 -7.466 -3.912) 9.002 25.222 ( -3.160 -7.466 3.912) 9.002 26.769 ( 2.309 -1.423 -3.160) 4.164 26.769 ( -2.309 -1.423 3.160) 4.164 26.945 ( 1.639 -2.670 -3.265) 4.525 26.945 ( -1.639 -2.670 3.265) 4.525 27.196 ( 0.470 -1.535 -0.945) 1.863 27.196 ( -0.470 -1.535 0.945) 1.863 27.318 ( 1.269 -5.753 -2.701) 6.481 27.318 ( -1.269 -5.753 2.701) 6.481 28.061 ( 3.299 0.966 -1.516) 3.757 28.061 ( -3.299 0.966 1.516) 3.757 28.360 ( 1.329 1.558 -2.923) 3.569 28.360 ( -1.329 1.558 2.923) 3.569 28.669 ( -1.931 2.775 -0.855) 3.487 28.669 ( 1.931 2.775 0.855) 3.487 28.799 ( -3.046 -1.396 -2.694) 4.299 28.799 ( 3.046 -1.396 2.694) 4.299 29.154 ( -1.515 -0.312 -2.348) 2.812 29.154 ( 1.515 -0.312 2.348) 2.812 29.617 ( -3.900 -0.564 -2.038) 4.437 29.617 ( 3.900 -0.564 2.038) 4.437 30.740 ( -0.345 3.313 -2.184) 3.983 30.740 ( 0.345 3.313 2.184) 3.983 31.105 ( -1.209 4.598 -3.131) 5.692 31.105 ( 1.209 4.598 3.131) 5.692 33.930 ( -0.061 -0.205 -0.876) 0.902 33.930 ( 0.061 -0.205 0.876) 0.902 33.968 ( -0.830 -0.543 0.154) 1.004 33.968 ( 0.830 -0.543 -0.154) 1.004 37.153 ( -0.255 -0.687 -0.391) 0.831 37.153 ( 0.255 -0.687 0.391) 0.831 37.205 ( -0.798 -2.687 -0.775) 2.908 37.205 ( 0.798 -2.687 0.775) 2.908 37.715 ( -0.765 2.954 -0.311) 3.068 37.715 ( 0.765 2.954 0.311) 3.068 37.780 ( 0.430 0.217 -0.273) 0.554 37.780 ( -0.430 0.217 0.273) 0.554 48.801 ( 1.507 0.162 -0.698) 1.668 48.801 ( -1.507 0.162 0.698) 1.668 48.857 ( -1.247 -1.023 -0.145) 1.620 48.857 ( 1.247 -1.023 0.145) 1.620 50.576 ( -0.612 1.799 -3.368) 3.867 50.576 ( 0.612 1.799 3.368) 3.867 50.800 ( -3.550 -8.435 -8.850) 12.731 50.800 ( 3.550 -8.435 8.850) 12.731 52.060 ( -0.541 6.970 -1.405) 7.131 52.060 ( 0.541 6.970 1.405) 7.131 52.369 ( -2.113 -6.376 -1.191) 6.821 52.369 ( 2.113 -6.376 1.191) 6.821 52.577 ( 0.310 6.881 -1.123) 6.979 52.577 ( -0.310 6.881 1.123) 6.979 52.914 ( 0.393 -7.310 -2.311) 7.677 52.914 ( -0.393 -7.310 2.311) 7.677 53.852 ( 0.249 0.948 -0.343) 1.039 53.852 ( -0.249 0.948 0.343) 1.039 54.215 ( 0.771 -1.693 -1.600) 2.454 54.215 ( -0.771 -1.693 1.600) 2.454 55.795 ( 0.400 2.236 -1.761) 2.875 55.795 ( -0.400 2.236 1.761) 2.875 56.026 ( 1.325 -6.914 -5.155) 8.726 56.026 ( -1.325 -6.914 5.155) 8.726 57.682 ( -0.645 7.392 -1.723) 7.617 57.682 ( 0.645 7.392 1.723) 7.617 57.956 ( 0.312 -0.623 -4.049) 4.109 57.956 ( -0.312 -0.623 4.049) 4.109 58.208 ( -0.316 -3.902 -1.629) 4.240 58.208 ( 0.316 -3.902 1.629) 4.240 58.377 ( -3.702 -2.437 -2.605) 5.140 58.377 ( 3.702 -2.437 2.605) 5.140 61.018 ( -0.126 1.409 -0.181) 1.426 61.018 ( 0.126 1.409 0.181) 1.426 61.306 ( -0.232 2.246 -3.509) 4.173 61.306 ( 0.232 2.246 3.509) 4.173 ======================= Grid point 185 (82/90) ======================= q-point: ( 0.12 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.759 ( -10.961 22.370 -15.828) 29.514 3.177 ( 0.573 14.771 8.181) 16.895 3.307 ( -5.509 -4.024 -5.453) 8.733 3.586 ( 5.481 -0.436 5.546) 7.810 3.644 ( 6.116 26.315 8.474) 28.314 3.725 ( 6.668 31.487 -16.780) 36.296 4.084 ( 6.533 9.104 -4.412) 12.043 4.409 ( 12.669 11.486 12.795) 21.358 4.669 ( 5.278 0.450 5.520) 7.650 4.810 ( 10.848 -0.414 -4.515) 11.758 4.999 ( 0.798 -4.846 -4.465) 6.637 5.018 ( 2.953 -14.654 -9.225) 17.566 5.216 ( 1.002 5.064 0.621) 5.200 5.263 ( 9.671 -2.422 8.346) 13.002 5.448 ( 9.080 1.268 1.850) 9.353 5.735 ( 3.812 6.564 8.601) 11.472 6.010 ( -0.079 -11.265 5.413) 12.498 6.040 ( -4.246 1.079 2.233) 4.918 6.166 ( 7.415 11.363 -5.869) 14.784 6.227 ( 2.294 -0.030 -2.704) 3.546 6.283 ( -2.514 -4.038 -13.490) 14.304 6.459 ( -5.386 -7.709 -3.248) 9.949 6.600 ( 2.261 3.537 2.069) 4.680 6.825 ( 8.703 15.179 10.264) 20.286 7.023 ( 1.485 3.973 2.321) 4.836 7.080 ( 3.271 6.370 -5.015) 8.742 7.139 ( 3.278 6.534 2.404) 7.695 7.260 ( 3.715 16.079 1.105) 16.540 7.467 ( 3.994 6.897 3.403) 8.666 7.523 ( -4.452 -0.757 5.937) 7.459 7.653 ( 8.708 4.257 1.937) 9.885 7.739 ( 0.452 10.461 -2.614) 10.792 7.775 ( -0.861 -4.806 -2.135) 5.329 7.900 ( -4.135 5.904 1.970) 7.472 8.011 ( 1.867 -2.974 2.035) 4.059 8.172 ( 3.559 -2.775 -0.222) 4.518 8.429 ( -2.565 10.562 -8.238) 13.638 8.552 ( -3.669 3.704 0.760) 5.269 8.664 ( 1.138 4.018 -5.641) 7.019 8.703 ( 3.234 4.620 0.194) 5.643 8.952 ( -0.339 5.076 3.244) 6.034 9.054 ( 1.243 7.191 -6.075) 9.495 9.160 ( -3.686 1.972 1.084) 4.318 9.348 ( -0.012 -10.924 -0.639) 10.942 9.426 ( 5.495 5.257 2.288) 7.941 9.448 ( 1.697 -6.117 -2.474) 6.813 9.619 ( 4.386 -10.892 0.982) 11.783 9.723 ( 4.353 -18.669 -1.184) 19.206 9.900 ( 3.277 6.625 3.862) 8.339 9.982 ( 4.621 2.022 -0.322) 5.054 10.278 ( -0.930 -26.456 -0.377) 26.475 10.416 ( 3.267 -16.832 0.822) 17.166 10.590 ( 2.556 -2.214 0.440) 3.410 10.621 ( -0.738 2.893 -1.814) 3.493 10.753 ( -2.020 -0.560 -0.885) 2.275 10.876 ( 0.614 0.618 3.413) 3.523 11.106 ( 3.224 -1.914 -1.663) 4.101 11.214 ( 2.942 -7.349 3.555) 8.677 11.396 ( -0.285 -10.834 -3.406) 11.360 11.531 ( 4.085 -11.647 1.378) 12.419 11.761 ( -3.737 6.213 -6.036) 9.434 11.888 ( -7.998 5.653 -2.220) 10.042 11.959 ( 1.761 -1.008 7.825) 8.084 12.171 ( 3.644 -2.667 -0.637) 4.560 12.245 ( -4.834 12.537 0.517) 13.446 12.357 ( -0.010 3.917 0.191) 3.922 12.420 ( -2.397 -5.624 -0.347) 6.123 12.492 ( 0.648 7.649 -1.707) 7.864 12.654 ( -5.449 -2.513 0.858) 6.061 12.816 ( -2.992 0.272 -0.655) 3.075 12.959 ( -0.653 5.997 -0.750) 6.079 12.997 ( -0.835 3.787 2.272) 4.494 13.235 ( -3.961 -5.708 -2.064) 7.248 13.397 ( 0.881 -6.237 2.470) 6.766 13.491 ( -3.023 -11.014 -0.567) 11.436 13.555 ( -0.282 -12.463 0.387) 12.472 14.007 ( -5.364 1.737 -1.590) 5.858 14.121 ( -2.978 2.679 0.640) 4.057 14.174 ( -3.191 -2.847 0.003) 4.276 14.294 ( -0.207 -2.076 -0.440) 2.133 16.038 ( -3.275 -4.419 0.111) 5.501 16.190 ( -3.301 -11.268 0.078) 11.742 16.383 ( 9.324 -5.532 0.070) 10.841 16.513 ( 8.465 -11.470 0.006) 14.255 18.330 ( 0.394 5.483 0.182) 5.500 18.370 ( 2.217 3.950 0.183) 4.534 18.973 ( -2.950 7.343 -0.997) 7.976 18.998 ( -1.738 6.258 0.118) 6.496 20.262 ( 0.095 0.730 -0.728) 1.035 20.270 ( 0.317 -0.184 1.104) 1.163 20.633 ( -1.330 5.936 0.017) 6.083 20.703 ( 1.514 9.214 -0.605) 9.357 20.789 ( -4.266 -5.545 1.741) 7.210 20.893 ( 0.390 -2.949 -1.185) 3.202 21.139 ( 2.651 -10.322 0.430) 10.666 21.192 ( 4.050 -10.921 -0.300) 11.652 22.455 ( 0.071 0.867 -0.024) 0.870 22.505 ( 1.694 -1.552 0.091) 2.299 22.705 ( -0.426 -1.172 0.637) 1.400 22.710 ( -0.116 -1.432 -0.705) 1.600 24.316 ( -10.693 13.666 2.454) 17.525 24.510 ( -0.250 10.780 -1.232) 10.853 24.523 ( -9.603 12.761 -0.512) 15.978 24.598 ( -8.206 6.243 1.266) 10.389 24.636 ( -4.231 8.990 -1.126) 9.999 24.815 ( 2.685 5.590 -3.314) 7.032 25.060 ( -11.342 -7.560 3.482) 14.069 25.194 ( -4.858 -7.014 -1.996) 8.763 26.750 ( -0.144 -0.577 2.461) 2.531 26.814 ( 2.116 -2.377 -2.825) 4.255 26.931 ( -0.501 -2.305 2.940) 3.769 26.986 ( 2.411 -4.459 -3.008) 5.894 27.145 ( -2.123 0.712 0.418) 2.278 27.204 ( -0.032 -1.602 -1.489) 2.187 27.301 ( -1.053 -5.154 2.251) 5.722 27.338 ( 0.421 -6.393 -0.654) 6.440 27.968 ( -4.884 2.854 0.811) 5.715 28.079 ( -1.097 -1.934 -1.293) 2.572 28.366 ( 1.917 3.511 2.838) 4.905 28.409 ( 1.741 1.747 -0.336) 2.489 28.599 ( -2.939 1.023 -0.866) 3.230 28.650 ( -4.107 -0.451 -0.879) 4.224 28.788 ( 5.790 5.124 -1.901) 7.962 28.967 ( 8.247 -3.138 -1.266) 8.914 29.134 ( 0.599 0.911 0.640) 1.265 29.178 ( -0.374 -1.552 2.192) 2.712 29.565 ( 1.001 4.236 0.004) 4.353 29.747 ( 5.744 -4.509 1.080) 7.382 30.718 ( -1.257 3.782 -2.149) 4.528 30.738 ( -1.007 2.572 1.124) 2.982 31.037 ( -3.594 5.769 0.158) 6.799 31.107 ( -2.506 2.880 2.838) 4.758 33.909 ( -1.459 -0.033 0.277) 1.485 33.912 ( -1.534 -0.063 -0.198) 1.548 33.965 ( 0.235 -0.274 0.518) 0.632 33.981 ( 0.199 -0.951 -0.504) 1.095 37.158 ( 0.837 -0.596 -0.275) 1.064 37.174 ( 1.621 -0.638 0.469) 1.804 37.199 ( 0.680 -1.649 -0.271) 1.804 37.240 ( 1.827 -3.375 -0.129) 3.840 37.703 ( -0.240 3.488 -0.127) 3.499 37.736 ( 1.055 2.466 0.610) 2.751 37.769 ( -0.191 0.655 -0.183) 0.706 37.804 ( 1.395 -0.830 -0.513) 1.703 48.850 ( 5.936 -0.148 0.208) 5.942 48.876 ( 4.556 -1.107 0.187) 4.693 48.944 ( 9.929 -1.166 -1.303) 10.082 48.980 ( 9.398 -2.440 1.130) 9.775 50.549 ( -0.866 1.251 -3.606) 3.914 50.584 ( -0.684 1.861 1.126) 2.280 50.716 ( -1.631 -4.344 -6.366) 7.878 50.874 ( 0.857 -10.254 6.629) 12.240 52.038 ( -0.979 6.888 -0.423) 6.970 52.077 ( 0.431 7.433 0.589) 7.469 52.324 ( -1.794 -5.862 -0.586) 6.158 52.419 ( 2.261 -8.096 0.152) 8.407 52.581 ( 0.427 6.751 0.768) 6.808 52.591 ( 1.153 7.579 -1.019) 7.734 52.932 ( 1.814 -7.714 1.103) 8.001 52.947 ( 2.772 -7.647 -0.828) 8.176 53.857 ( 0.646 0.988 0.570) 1.311 53.865 ( 0.942 0.737 -0.281) 1.229 54.195 ( -1.519 -1.271 1.823) 2.692 54.218 ( -0.077 -2.104 -1.546) 2.612 55.781 ( -0.587 2.007 0.636) 2.186 55.812 ( 0.889 1.875 -0.519) 2.139 55.990 ( -2.837 -6.050 3.405) 7.500 56.027 ( -0.410 -6.586 -3.390) 7.419 57.663 ( -0.540 7.159 -1.041) 7.254 57.703 ( 0.767 7.663 1.540) 7.854 57.935 ( -1.128 -0.469 -0.341) 1.268 57.963 ( -0.112 0.703 0.244) 0.753 58.181 ( -1.589 -3.233 0.100) 3.604 58.191 ( -3.001 -3.046 -2.983) 5.214 58.292 ( -2.470 0.058 1.085) 2.699 58.426 ( 0.085 -6.767 1.490) 6.930 61.012 ( -0.300 1.569 -0.164) 1.606 61.022 ( 0.100 1.217 -0.137) 1.229 61.262 ( -2.833 3.025 -2.316) 4.747 61.286 ( -2.924 1.965 3.012) 4.635 ======================= Grid point 186 (83/90) ======================= q-point: ( 0.25 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.607 ( 1.449 14.075 -15.942) 21.315 3.090 ( -6.891 -1.739 -6.540) 9.658 3.298 ( 2.802 6.719 7.911) 10.751 3.497 ( -5.632 4.242 3.117) 7.710 3.859 ( 10.479 17.810 -13.604) 24.740 4.029 ( 18.258 23.711 11.019) 31.890 4.290 ( 12.301 12.178 -4.103) 17.789 4.686 ( 10.473 6.191 7.852) 14.479 4.754 ( -1.562 -10.261 4.511) 11.317 4.969 ( 1.141 -4.814 -2.114) 5.381 5.007 ( 10.280 -0.220 -7.861) 12.943 5.138 ( 5.384 -15.354 1.015) 16.302 5.339 ( 10.575 -6.883 5.661) 13.829 5.499 ( 7.683 -0.102 -10.563) 13.062 5.662 ( 5.323 7.692 3.811) 10.101 5.748 ( -1.047 3.237 -1.905) 3.899 5.925 ( -5.380 5.837 0.690) 7.968 6.007 ( 1.973 4.394 5.367) 7.212 6.146 ( -2.042 -5.300 -1.055) 5.777 6.341 ( 6.735 2.363 1.778) 7.356 6.364 ( 8.213 -3.689 -1.233) 9.088 6.512 ( 9.486 1.543 -3.664) 10.286 6.670 ( 2.828 -1.735 0.997) 3.464 6.979 ( 3.486 22.443 3.856) 23.037 7.084 ( -1.052 -13.159 -7.538) 15.202 7.095 ( 5.079 11.339 4.226) 13.124 7.292 ( -2.544 3.783 5.380) 7.052 7.334 ( 9.005 17.666 10.964) 22.658 7.412 ( -5.429 -4.054 2.972) 7.399 7.525 ( 1.418 -3.801 -0.354) 4.072 7.717 ( 2.841 13.219 0.340) 13.525 7.737 ( -2.173 8.220 6.273) 10.566 7.905 ( 8.680 18.722 2.163) 20.749 7.981 ( 11.486 1.620 -5.577) 12.871 8.039 ( 0.972 -5.997 1.303) 6.214 8.234 ( 4.316 3.457 -4.616) 7.203 8.404 ( -0.108 2.157 -3.112) 3.788 8.501 ( -2.117 5.802 -1.256) 6.303 8.584 ( -2.092 2.787 -5.308) 6.350 8.808 ( 4.565 4.205 -0.948) 6.278 8.985 ( 1.817 5.252 0.763) 5.610 9.081 ( 3.794 2.153 -0.090) 4.363 9.140 ( 1.681 2.203 0.814) 2.888 9.324 ( -1.937 1.013 -4.668) 5.154 9.449 ( 1.977 -3.745 -6.965) 8.152 9.570 ( 6.726 -4.788 2.232) 8.552 9.729 ( 5.326 -3.826 -1.282) 6.682 9.788 ( 2.044 -7.520 -3.472) 8.531 10.007 ( 3.937 2.327 5.167) 6.900 10.063 ( 1.939 4.626 1.069) 5.128 10.345 ( 7.276 -18.494 2.111) 19.985 10.434 ( -3.087 -11.054 -1.392) 11.561 10.541 ( -3.161 2.709 -2.740) 4.984 10.686 ( 0.265 -7.461 7.119) 10.316 10.782 ( 7.836 0.691 -2.068) 8.134 10.854 ( -2.175 -2.870 2.187) 4.213 11.157 ( -1.387 -3.549 -0.568) 3.853 11.228 ( 0.920 -7.880 0.655) 7.961 11.434 ( 2.344 -9.495 1.923) 9.968 11.585 ( -1.913 2.031 -5.108) 5.821 11.702 ( 1.882 -6.285 -1.903) 6.831 11.734 ( -4.292 4.453 -1.318) 6.323 11.990 ( -3.397 -3.477 8.733) 9.995 12.134 ( -5.145 8.673 -2.466) 10.382 12.232 ( 2.576 -3.088 -0.961) 4.135 12.256 ( -6.558 7.738 -0.773) 10.173 12.416 ( 0.227 -0.078 -1.713) 1.730 12.472 ( -0.793 -2.517 3.348) 4.263 12.638 ( 2.528 -2.935 0.425) 3.897 12.680 ( -7.991 -4.204 -2.431) 9.351 12.932 ( -2.011 8.099 0.526) 8.361 12.956 ( -3.285 2.880 0.574) 4.407 13.180 ( -1.156 -4.087 -0.667) 4.299 13.369 ( -3.746 -5.087 0.373) 6.329 13.430 ( -2.371 -9.016 0.064) 9.322 13.532 ( -2.074 -11.439 1.320) 11.700 13.886 ( -5.164 0.833 -2.135) 5.650 13.986 ( -7.961 3.760 0.048) 8.804 14.135 ( -2.071 -8.319 0.512) 8.588 14.249 ( -3.788 -6.580 -0.485) 7.607 16.007 ( 0.075 -4.898 -0.085) 4.900 16.125 ( -2.511 -10.623 0.318) 10.921 16.600 ( 10.146 -5.031 0.194) 11.326 16.686 ( 7.600 -9.388 0.010) 12.079 18.361 ( 2.667 6.354 0.153) 6.893 18.437 ( 4.242 3.440 0.186) 5.464 18.881 ( -5.515 8.152 -1.038) 9.897 18.939 ( -3.861 5.684 -0.118) 6.873 20.273 ( 1.408 -0.028 -0.344) 1.449 20.294 ( 1.944 -1.847 0.684) 2.768 20.613 ( -0.865 2.844 0.520) 3.018 20.683 ( -3.787 -1.814 -0.597) 4.241 20.748 ( 0.572 7.974 1.539) 8.141 20.871 ( -2.118 1.599 -1.358) 2.981 21.226 ( 5.079 -11.529 0.795) 12.623 21.283 ( 4.604 -12.039 -0.746) 12.910 22.469 ( 0.905 1.333 0.854) 1.824 22.532 ( 0.892 -1.613 -0.803) 2.011 22.698 ( -0.365 -1.215 0.273) 1.298 22.707 ( -0.011 -1.505 -0.248) 1.525 24.067 ( -12.160 16.066 2.980) 20.368 24.265 ( -13.503 13.006 -5.283) 19.479 24.367 ( -10.990 8.815 -0.345) 14.093 24.409 ( -11.834 4.590 3.133) 13.074 24.597 ( 0.873 6.721 -1.299) 6.901 24.837 ( -4.650 3.638 3.114) 6.674 24.856 ( -2.392 -3.744 -3.740) 5.807 25.063 ( -6.306 -4.884 0.690) 8.005 26.769 ( 1.177 -0.941 1.576) 2.181 26.829 ( 0.064 -2.410 -1.233) 2.708 26.928 ( -0.686 -3.604 2.271) 4.315 26.995 ( -1.031 -6.614 -2.627) 7.191 27.150 ( 2.407 2.191 -1.200) 3.469 27.204 ( 0.396 -0.743 -0.450) 0.955 27.284 ( -0.742 -3.525 1.104) 3.768 27.334 ( -0.398 -5.395 0.092) 5.410 27.895 ( -2.010 2.578 1.090) 3.445 28.031 ( -2.738 -3.321 -0.482) 4.331 28.397 ( -2.377 2.577 -0.157) 3.510 28.427 ( 1.083 2.027 1.767) 2.899 28.522 ( -1.708 3.537 -0.496) 3.960 28.639 ( 1.579 -1.031 0.469) 1.943 28.905 ( 5.433 5.285 -2.360) 7.939 29.111 ( 4.561 -4.737 -3.190) 7.309 29.168 ( 0.820 1.999 1.381) 2.564 29.188 ( 3.341 0.138 3.055) 4.529 29.634 ( 4.686 5.283 0.000) 7.061 29.839 ( 2.635 -3.731 0.621) 4.610 30.668 ( -2.856 4.083 -0.523) 5.010 30.716 ( -1.176 1.185 -0.245) 1.688 30.975 ( -2.362 4.817 0.249) 5.370 31.034 ( -4.327 2.590 1.780) 5.348 33.876 ( -1.439 0.305 0.222) 1.488 33.883 ( -1.238 -0.208 -0.069) 1.258 33.970 ( 0.089 -0.501 0.685) 0.853 33.977 ( -0.201 -0.680 -0.867) 1.120 37.183 ( 1.534 -0.239 -0.224) 1.569 37.220 ( 1.769 -0.448 -0.126) 1.829 37.222 ( 1.874 -1.679 0.991) 2.704 37.274 ( 1.466 -2.978 -0.623) 3.377 37.705 ( 0.440 3.609 -0.040) 3.636 37.752 ( -0.043 2.394 0.757) 2.511 37.777 ( 1.198 0.254 -0.564) 1.349 37.830 ( 1.010 -1.589 -0.392) 1.923 49.007 ( 7.814 -0.900 0.040) 7.866 49.008 ( 7.682 -0.874 0.199) 7.734 49.176 ( 11.639 -3.030 -2.531) 12.291 49.218 ( 11.408 -5.245 3.245) 12.969 50.527 ( -0.088 1.640 -3.174) 3.574 50.568 ( -0.577 1.179 -0.166) 1.323 50.696 ( 0.359 -1.874 -2.734) 3.334 50.866 ( -2.724 -8.776 3.569) 9.858 52.022 ( -0.476 6.846 0.266) 6.868 52.079 ( -0.292 7.992 -0.494) 8.012 52.299 ( -0.427 -6.165 1.500) 6.359 52.452 ( 0.871 -9.912 -2.113) 10.173 52.596 ( 0.771 7.620 0.894) 7.711 52.615 ( 1.339 8.339 -1.327) 8.549 52.985 ( 2.507 -8.415 1.880) 8.979 53.011 ( 3.225 -8.450 -1.336) 9.142 53.881 ( 1.399 0.673 0.837) 1.764 53.887 ( 1.228 0.597 -0.362) 1.413 54.165 ( -1.776 -0.997 2.252) 3.037 54.203 ( -0.829 -2.416 -1.845) 3.151 55.777 ( 0.109 1.301 0.529) 1.409 55.830 ( 0.936 1.040 -0.286) 1.428 55.933 ( -3.298 -4.411 2.607) 6.094 55.993 ( -1.872 -5.243 -2.705) 6.189 57.656 ( 0.123 7.088 -0.608) 7.115 57.720 ( 0.318 7.809 1.440) 7.947 57.907 ( -1.530 2.147 0.224) 2.646 57.948 ( -1.384 2.843 -1.503) 3.501 58.090 ( -3.598 0.597 -0.986) 3.778 58.163 ( -0.711 -2.279 -1.115) 2.635 58.271 ( -0.890 -5.620 2.839) 6.358 58.399 ( -2.405 -8.641 -0.186) 8.972 61.009 ( 0.217 1.694 -0.144) 1.714 61.025 ( 0.407 1.117 -0.192) 1.204 61.189 ( -3.554 3.177 -0.885) 4.848 61.214 ( -4.144 2.173 1.536) 4.925 ======================= Grid point 187 (84/90) ======================= q-point: ( 0.38 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.708 ( 10.144 2.654 -10.719) 14.994 2.973 ( -3.230 -5.802 -3.618) 7.563 3.321 ( -1.887 6.726 6.485) 9.532 3.415 ( -3.706 -0.193 3.111) 4.842 4.065 ( 11.517 12.575 -7.741) 18.727 4.404 ( 13.061 20.667 1.918) 24.523 4.484 ( 2.732 11.068 -0.478) 11.410 4.697 ( 1.985 -6.458 4.932) 8.365 4.903 ( 9.475 4.413 -0.002) 10.453 5.012 ( 1.490 -1.907 -3.626) 4.360 5.147 ( 0.363 -7.567 -3.074) 8.176 5.229 ( 6.422 -2.609 -2.814) 7.481 5.376 ( -8.054 -13.847 -0.141) 16.020 5.607 ( -8.583 3.752 -3.630) 10.046 5.638 ( 8.915 3.273 6.782) 11.670 5.742 ( 3.966 -8.378 4.813) 10.445 5.959 ( 3.580 17.687 -0.392) 18.050 6.117 ( -2.530 -2.376 -2.225) 4.123 6.179 ( 12.466 0.109 -2.921) 12.804 6.487 ( 4.405 3.684 -2.305) 6.188 6.578 ( 8.778 1.330 6.739) 11.146 6.662 ( 4.059 -0.518 2.473) 4.781 6.726 ( 6.253 -5.620 4.928) 9.745 6.955 ( -2.652 -2.438 -6.013) 7.009 7.024 ( -5.470 9.684 0.281) 11.126 7.126 ( -6.809 2.300 -1.644) 7.373 7.280 ( 0.750 6.166 5.658) 8.403 7.325 ( -3.281 -4.678 5.259) 7.766 7.469 ( 7.916 -1.968 6.275) 10.291 7.620 ( 2.568 0.892 -2.182) 3.486 7.740 ( 1.485 5.834 -5.298) 8.020 7.799 ( 4.629 14.802 6.398) 16.776 7.961 ( -1.980 10.127 -2.664) 10.657 8.131 ( 6.211 -1.819 1.482) 6.639 8.236 ( -0.132 4.685 -5.146) 6.961 8.309 ( 9.041 17.065 0.942) 19.335 8.375 ( 2.143 2.313 -6.183) 6.941 8.471 ( 2.766 8.742 7.340) 11.745 8.638 ( 5.251 5.190 -1.284) 7.494 8.871 ( 1.698 1.531 -0.727) 2.400 9.015 ( 0.613 6.161 5.763) 8.458 9.166 ( 0.620 6.780 -7.582) 10.190 9.217 ( 5.545 1.271 -3.175) 6.515 9.305 ( 3.405 8.421 2.975) 9.558 9.550 ( 9.110 -1.847 -9.052) 12.974 9.658 ( 1.097 -0.599 -5.189) 5.338 9.755 ( -3.970 0.830 2.075) 4.556 9.839 ( 5.268 -5.997 1.165) 8.067 10.007 ( -4.640 2.469 -1.735) 5.535 10.093 ( -1.117 5.001 1.656) 5.385 10.319 ( -3.883 -6.017 1.099) 7.245 10.443 ( -2.858 -2.632 0.029) 3.885 10.582 ( 7.917 -4.406 -4.289) 10.025 10.676 ( 1.139 -11.560 9.088) 14.749 10.788 ( -2.027 -13.626 3.634) 14.248 11.027 ( 2.927 2.157 4.232) 5.580 11.074 ( 3.182 -10.984 -6.699) 13.253 11.276 ( 2.310 -1.795 0.577) 2.982 11.419 ( -2.959 3.845 -2.541) 5.477 11.526 ( -2.771 -7.411 2.239) 8.223 11.671 ( -0.635 4.920 -2.846) 5.719 11.756 ( -0.370 -4.998 0.492) 5.036 11.885 ( -5.787 1.564 7.575) 9.660 11.993 ( -6.437 -2.507 -5.471) 8.812 12.169 ( -0.891 1.544 0.572) 1.872 12.305 ( 2.291 2.686 0.026) 3.531 12.409 ( -0.235 -3.853 -0.069) 3.861 12.461 ( -3.626 -7.772 -2.135) 8.838 12.530 ( -0.418 -0.059 1.163) 1.237 12.702 ( -0.106 -1.719 0.983) 1.983 12.898 ( -0.926 7.809 0.786) 7.903 12.899 ( -0.683 -1.267 -0.421) 1.500 13.155 ( -1.008 -0.136 -1.600) 1.896 13.282 ( -4.346 -3.161 -0.404) 5.389 13.395 ( -0.604 -7.584 1.638) 7.783 13.478 ( -3.139 -8.461 0.381) 9.032 13.794 ( -2.859 -1.241 -3.088) 4.387 13.834 ( -5.976 -0.264 1.583) 6.187 14.091 ( -1.731 -10.951 0.388) 11.094 14.154 ( -4.500 -10.568 -0.236) 11.489 16.026 ( 1.444 -5.522 -0.284) 5.715 16.086 ( -1.533 -8.451 0.438) 8.600 16.777 ( 6.206 -5.648 0.255) 8.395 16.813 ( 4.199 -7.536 0.012) 8.627 18.446 ( 5.410 7.392 -0.124) 9.161 18.549 ( 6.227 3.355 0.234) 7.077 18.744 ( -7.120 8.629 -0.892) 11.223 18.836 ( -5.933 4.832 0.141) 7.653 20.322 ( 3.201 -1.542 0.112) 3.555 20.354 ( 3.351 -3.337 -0.340) 4.741 20.580 ( -2.984 -3.138 1.456) 4.568 20.606 ( -2.891 -2.451 -0.057) 3.790 20.766 ( 0.680 12.762 -0.031) 12.780 20.813 ( -2.468 9.115 -0.909) 9.487 21.334 ( 4.472 -13.370 0.798) 14.121 21.367 ( 3.247 -13.682 -0.819) 14.086 22.492 ( 1.014 1.121 1.526) 2.149 22.536 ( -0.173 -0.732 -1.413) 1.601 22.693 ( -0.018 -1.454 -0.014) 1.454 22.706 ( -0.159 -1.814 -0.021) 1.821 23.882 ( -5.326 13.649 1.513) 14.729 24.000 ( -9.554 12.184 -2.413) 15.670 24.132 ( -9.818 6.053 -1.436) 11.623 24.159 ( -11.079 2.476 2.532) 11.631 24.623 ( 1.827 6.430 -1.615) 6.877 24.725 ( -4.127 2.925 2.175) 5.507 24.868 ( 1.470 1.557 -3.416) 4.032 24.958 ( -4.142 -1.619 2.394) 5.051 26.801 ( 1.460 -2.379 0.705) 2.879 26.826 ( 0.023 -2.986 0.115) 2.988 26.912 ( -1.184 -4.402 0.971) 4.661 26.947 ( -2.541 -6.410 -1.527) 7.063 27.200 ( 2.237 1.491 -2.234) 3.496 27.216 ( 0.537 0.126 1.110) 1.239 27.286 ( 0.718 -2.043 0.370) 2.196 27.326 ( -0.486 -3.489 -0.258) 3.532 27.889 ( 0.801 0.405 1.627) 1.858 27.974 ( -2.460 -3.068 -0.517) 3.966 28.344 ( -2.038 1.919 0.065) 2.800 28.377 ( -3.256 0.113 -0.967) 3.399 28.574 ( 3.630 4.849 2.786) 6.667 28.665 ( 0.287 0.598 0.152) 0.681 28.994 ( 3.635 3.623 -0.736) 5.185 29.106 ( -1.354 -0.887 -4.405) 4.693 29.245 ( 3.748 0.623 0.328) 3.814 29.266 ( 2.544 0.169 2.942) 3.893 29.735 ( 4.722 4.788 -0.202) 6.727 29.860 ( -0.619 -0.085 0.318) 0.701 30.624 ( -0.829 2.476 0.087) 2.612 30.681 ( -2.071 -0.068 -0.318) 2.096 30.938 ( -1.096 3.807 -0.335) 3.976 30.964 ( -2.516 2.763 0.896) 3.843 33.855 ( -0.593 0.185 -0.000) 0.622 33.861 ( -0.822 -0.189 0.090) 0.848 33.972 ( -0.011 -0.500 -0.740) 0.893 33.972 ( -0.076 -0.581 0.601) 0.839 37.215 ( 1.419 -0.114 -0.122) 1.428 37.239 ( 0.449 -0.544 -0.078) 0.709 37.271 ( 1.794 -1.583 1.069) 2.620 37.296 ( 0.757 -2.285 -0.770) 2.528 37.718 ( 0.733 3.343 0.068) 3.423 37.746 ( -0.520 2.459 0.089) 2.514 37.806 ( 1.442 -0.352 -0.072) 1.486 37.841 ( 0.065 -1.660 -0.219) 1.675 49.151 ( 5.420 -1.042 1.671) 5.767 49.158 ( 5.758 -1.345 -1.600) 6.126 49.380 ( 7.908 -3.822 -2.530) 9.141 49.418 ( 6.028 -6.159 3.188) 9.189 50.532 ( 1.079 1.742 -1.475) 2.525 50.561 ( -0.262 1.109 0.216) 1.160 50.704 ( 1.097 -2.176 -1.966) 3.131 50.800 ( -3.799 -5.959 1.991) 7.342 52.021 ( 0.271 6.906 1.005) 6.984 52.062 ( -0.951 7.797 -1.586) 8.013 52.321 ( 1.668 -6.909 4.023) 8.167 52.437 ( -1.371 -9.881 -4.307) 10.865 52.617 ( 0.831 8.547 1.247) 8.677 52.633 ( 0.684 8.688 -1.530) 8.849 53.038 ( 1.829 -8.833 2.414) 9.338 53.060 ( 1.709 -8.953 -2.004) 9.333 53.910 ( 1.069 0.547 -0.177) 1.213 53.913 ( 1.118 0.362 0.483) 1.270 54.141 ( -0.961 -1.214 2.820) 3.218 54.175 ( -1.205 -2.466 -2.450) 3.679 55.790 ( 1.069 0.331 0.229) 1.142 55.852 ( 1.222 0.342 -0.078) 1.271 55.873 ( -2.785 -3.089 1.765) 4.518 55.940 ( -2.389 -3.479 -1.841) 4.604 57.666 ( 0.973 7.162 -0.235) 7.232 57.719 ( -0.810 7.601 0.862) 7.692 57.877 ( -0.995 5.402 -0.900) 5.566 57.903 ( -2.072 6.721 -0.376) 7.043 58.063 ( 0.574 -1.998 0.510) 2.140 58.138 ( -1.567 -2.319 -1.146) 3.025 58.268 ( 0.075 -8.715 2.498) 9.066 58.341 ( -2.578 -9.172 -1.159) 9.598 61.023 ( 1.165 1.883 -0.082) 2.216 61.041 ( 1.199 1.221 -0.142) 1.717 61.116 ( -3.168 2.716 -0.134) 4.175 61.135 ( -3.454 2.035 0.477) 4.037 ======================= Grid point 188 (85/90) ======================= q-point: ( 0.50 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.883 ( 5.246 -4.189 -4.207) 7.922 2.883 ( -5.246 -4.189 4.207) 7.922 3.336 ( -0.598 1.129 -5.354) 5.505 3.336 ( 0.598 1.129 5.354) 5.505 4.291 ( -4.646 11.804 -5.856) 13.971 4.291 ( 4.646 11.804 5.856) 13.971 4.698 ( -9.288 6.936 -4.823) 12.555 4.698 ( 9.288 6.936 4.823) 12.555 5.088 ( -0.526 -3.329 -4.086) 5.296 5.088 ( 0.526 -3.329 4.086) 5.296 5.109 ( -0.765 0.062 -6.794) 6.837 5.109 ( 0.765 0.062 6.794) 6.837 5.399 ( -6.845 -0.348 -4.092) 7.983 5.399 ( 6.845 -0.348 4.092) 7.983 5.855 ( -3.482 -8.176 0.095) 8.887 5.855 ( 3.482 -8.176 -0.095) 8.887 5.971 ( -3.491 8.094 -4.247) 9.784 5.971 ( 3.491 8.094 4.247) 9.784 6.420 ( 9.102 0.891 -6.006) 10.942 6.420 ( -9.102 0.891 6.006) 10.942 6.731 ( -2.677 4.296 -4.064) 6.491 6.731 ( 2.677 4.296 4.064) 6.491 6.870 ( -2.382 -5.179 -5.025) 7.599 6.870 ( 2.382 -5.179 5.025) 7.599 6.978 ( -0.323 -2.848 -13.913) 14.205 6.978 ( 0.323 -2.848 13.913) 14.205 7.281 ( 0.701 7.786 -2.981) 8.367 7.281 ( -0.701 7.786 2.981) 8.367 7.613 ( -0.478 -5.198 -7.210) 8.901 7.613 ( 0.478 -5.198 7.210) 8.901 7.811 ( 4.500 2.257 -3.245) 5.990 7.811 ( -4.500 2.257 3.245) 5.990 8.018 ( -9.172 15.186 -2.979) 17.989 8.018 ( 9.172 15.186 2.979) 17.989 8.300 ( -4.191 -0.050 -1.515) 4.457 8.300 ( 4.191 -0.050 1.515) 4.457 8.515 ( -0.531 11.745 -0.595) 11.772 8.515 ( 0.531 11.745 0.595) 11.772 8.814 ( -7.488 5.611 -5.741) 10.977 8.814 ( 7.488 5.611 5.741) 10.977 9.080 ( -3.127 8.732 -8.396) 12.511 9.080 ( 3.127 8.732 8.396) 12.511 9.339 ( -2.818 8.465 -1.143) 8.995 9.339 ( 2.818 8.465 1.143) 8.995 9.618 ( 0.187 2.236 -7.502) 7.830 9.618 ( -0.187 2.236 7.502) 7.830 9.833 ( -1.073 1.130 -8.859) 8.995 9.833 ( 1.073 1.130 8.859) 8.995 9.986 ( -5.927 -1.868 -3.166) 6.974 9.986 ( 5.927 -1.868 3.166) 6.974 10.337 ( -4.021 -3.083 -3.737) 6.296 10.337 ( 4.021 -3.083 3.737) 6.296 10.705 ( 3.956 -8.269 -5.144) 10.511 10.705 ( -3.956 -8.269 5.144) 10.511 10.870 ( -8.861 -14.168 -2.839) 16.950 10.870 ( 8.861 -14.168 2.839) 16.950 11.262 ( 2.590 2.289 -3.595) 4.987 11.262 ( -2.590 2.289 3.595) 4.987 11.422 ( 3.727 -1.283 -6.062) 7.231 11.422 ( -3.727 -1.283 6.062) 7.231 11.699 ( -2.781 -0.459 0.372) 2.843 11.699 ( 2.781 -0.459 -0.372) 2.843 11.872 ( -2.531 -1.517 -6.925) 7.527 11.872 ( 2.531 -1.517 6.925) 7.527 12.233 ( -2.781 0.986 -6.867) 7.474 12.233 ( 2.781 0.986 6.867) 7.474 12.419 ( -0.633 -8.952 -3.901) 9.785 12.419 ( 0.633 -8.952 3.901) 9.785 12.619 ( -5.785 3.553 -1.722) 7.004 12.619 ( 5.785 3.553 1.722) 7.004 12.901 ( -0.182 0.724 -0.880) 1.154 12.901 ( 0.182 0.724 0.880) 1.154 13.183 ( -3.008 -0.607 0.080) 3.070 13.183 ( 3.008 -0.607 -0.080) 3.070 13.419 ( -1.718 -6.684 -2.108) 7.216 13.419 ( 1.718 -6.684 2.108) 7.216 13.764 ( 1.293 -2.343 -2.972) 3.999 13.764 ( -1.293 -2.343 2.972) 3.999 14.086 ( -0.689 -12.319 -1.094) 12.387 14.086 ( 0.689 -12.319 1.094) 12.387 16.057 ( 0.483 -6.629 -3.852) 7.682 16.057 ( -0.483 -6.629 3.852) 7.682 16.850 ( -0.759 -6.366 -0.131) 6.412 16.850 ( 0.759 -6.366 0.131) 6.412 18.579 ( -5.507 8.130 -0.188) 9.822 18.579 ( 5.507 8.130 0.188) 9.822 18.700 ( -4.573 4.088 -0.275) 6.140 18.700 ( 4.573 4.088 0.275) 6.140 20.385 ( -1.438 -3.138 -0.902) 3.568 20.385 ( 1.438 -3.138 0.902) 3.568 20.552 ( -1.216 -4.501 -1.720) 4.969 20.552 ( 1.216 -4.501 1.720) 4.969 20.779 ( 0.115 14.060 -1.308) 14.121 20.779 ( -0.115 14.060 1.308) 14.121 21.395 ( -0.146 -14.405 -1.949) 14.537 21.395 ( 0.146 -14.405 1.949) 14.537 22.519 ( -0.925 0.411 -1.792) 2.058 22.519 ( 0.925 0.411 1.792) 2.058 22.699 ( -0.071 -1.854 -0.695) 1.981 22.699 ( 0.071 -1.854 0.695) 1.981 23.865 ( -2.931 10.977 -0.726) 11.385 23.865 ( 2.931 10.977 0.726) 11.385 24.024 ( 1.007 4.635 -3.528) 5.911 24.024 ( -1.007 4.635 3.528) 5.911 24.663 ( 2.108 5.366 -1.756) 6.027 24.663 ( -2.108 5.366 1.756) 6.027 24.899 ( 2.392 0.589 -2.994) 3.878 24.899 ( -2.392 0.589 2.994) 3.878 26.825 ( 0.158 -3.527 -1.424) 3.807 26.825 ( -0.158 -3.527 1.424) 3.807 26.904 ( -0.603 -4.975 -1.091) 5.129 26.904 ( 0.603 -4.975 1.091) 5.129 27.223 ( 0.516 0.768 -2.087) 2.283 27.223 ( -0.516 0.768 2.087) 2.283 27.308 ( 0.146 -2.127 -3.166) 3.817 27.308 ( -0.146 -2.127 3.166) 3.817 27.925 ( -2.004 -1.768 -1.230) 2.942 27.925 ( 2.004 -1.768 1.230) 2.942 28.330 ( -0.642 0.911 -1.021) 1.512 28.330 ( 0.642 0.911 1.021) 1.512 28.643 ( -2.099 2.916 -1.824) 4.029 28.643 ( 2.099 2.916 1.824) 4.029 29.058 ( -2.270 1.465 -2.435) 3.637 29.058 ( 2.270 1.465 2.435) 3.637 29.292 ( 0.715 0.403 -1.744) 1.928 29.292 ( -0.715 0.403 1.744) 1.928 29.819 ( -1.734 3.174 -0.814) 3.707 29.819 ( 1.734 3.174 0.814) 3.707 30.636 ( -1.280 0.385 -0.632) 1.479 30.636 ( 1.280 0.385 0.632) 1.479 30.933 ( 0.614 3.103 -0.445) 3.195 30.933 ( -0.614 3.103 0.445) 3.195 33.851 ( 0.180 -0.036 -0.108) 0.213 33.851 ( -0.180 -0.036 0.108) 0.213 33.972 ( 0.143 -0.528 -0.831) 0.995 33.972 ( -0.143 -0.528 0.831) 0.995 37.237 ( -0.198 -0.249 -0.384) 0.499 37.237 ( 0.198 -0.249 0.384) 0.499 37.298 ( -0.229 -1.845 -1.330) 2.286 37.298 ( 0.229 -1.845 1.330) 2.286 37.733 ( -0.123 2.902 -0.884) 3.036 37.733 ( 0.123 2.902 0.884) 3.036 37.831 ( -0.359 -1.166 -0.660) 1.387 37.831 ( 0.359 -1.166 0.660) 1.387 49.217 ( 0.061 -1.397 -1.939) 2.390 49.217 ( -0.061 -1.397 1.939) 2.390 49.474 ( 1.299 -4.912 -2.907) 5.854 49.474 ( -1.299 -4.912 2.907) 5.854 50.552 ( 0.509 1.306 -0.607) 1.527 50.552 ( -0.509 1.306 0.607) 1.527 50.736 ( 2.209 -3.581 -1.817) 4.583 50.736 ( -2.209 -3.581 1.817) 4.583 52.037 ( -0.729 7.266 -1.865) 7.537 52.037 ( 0.729 7.266 1.865) 7.537 52.380 ( -2.459 -8.381 -5.097) 10.113 52.380 ( 2.459 -8.381 5.097) 10.113 52.633 ( -0.256 8.775 -1.561) 8.917 52.633 ( 0.256 8.775 1.561) 8.917 53.068 ( -0.224 -8.991 -2.708) 9.392 53.068 ( 0.224 -8.991 2.708) 9.392 53.924 ( 0.167 0.455 -0.736) 0.881 53.924 ( -0.167 0.455 0.736) 0.881 54.146 ( -0.608 -1.985 -3.008) 3.655 54.146 ( 0.608 -1.985 3.008) 3.655 55.823 ( -0.784 -0.742 -0.482) 1.182 55.823 ( 0.784 -0.742 0.482) 1.182 55.889 ( -0.908 -1.917 -2.573) 3.334 55.889 ( 0.908 -1.917 2.573) 3.334 57.693 ( -1.297 7.297 0.066) 7.411 57.693 ( 1.297 7.297 -0.066) 7.411 57.872 ( 0.583 7.300 -2.948) 7.894 57.872 ( -0.583 7.300 2.948) 7.894 58.095 ( -1.660 -2.954 -1.282) 3.623 58.095 ( 1.660 -2.954 1.282) 3.623 58.292 ( -1.623 -9.276 -1.775) 9.582 58.292 ( 1.623 -9.276 1.775) 9.582 61.058 ( -1.999 2.203 -0.129) 2.977 61.058 ( 1.999 2.203 0.129) 2.977 61.077 ( -1.788 1.597 -0.152) 2.402 61.077 ( 1.788 1.597 0.152) 2.402 ======================= Grid point 193 (86/90) ======================= q-point: ( 0.00 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 46 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.261 ( -0.000 0.000 0.000) 0.000 3.261 ( -0.000 0.000 0.000) 0.000 3.438 ( -0.000 0.000 0.000) 0.000 3.438 ( 0.000 0.000 0.000) 0.000 4.049 ( -0.000 -0.000 0.000) 0.000 4.049 ( -0.000 0.000 0.000) 0.000 4.234 ( 0.000 0.000 0.000) 0.000 4.234 ( -0.000 0.000 0.000) 0.000 4.723 ( -0.000 -0.000 -0.000) 0.000 4.723 ( 0.000 -0.000 0.000) 0.000 4.750 ( -0.000 0.000 -0.000) 0.000 4.750 ( 0.000 0.000 0.000) 0.000 5.302 ( 0.000 -0.000 0.000) 0.000 5.302 ( 0.000 0.000 0.000) 0.000 5.309 ( -0.000 -0.000 -0.000) 0.000 5.309 ( -0.000 0.000 -0.000) 0.000 6.030 ( 0.000 0.000 0.000) 0.000 6.030 ( -0.000 0.000 0.000) 0.000 6.184 ( 0.000 0.000 -0.000) 0.000 6.184 ( 0.000 0.000 0.000) 0.000 6.476 ( 0.000 0.000 0.000) 0.000 6.476 ( 0.000 0.000 0.000) 0.000 6.635 ( 0.000 0.000 0.000) 0.000 6.635 ( 0.000 0.000 0.000) 0.000 7.141 ( 0.000 0.000 -0.000) 0.000 7.141 ( 0.000 0.000 0.000) 0.000 7.181 ( 0.000 -0.000 -0.000) 0.000 7.181 ( -0.000 0.000 0.000) 0.000 7.581 ( 0.000 0.000 -0.000) 0.000 7.581 ( -0.000 0.000 0.000) 0.000 7.625 ( 0.000 -0.000 -0.000) 0.000 7.625 ( -0.000 0.000 0.000) 0.000 8.054 ( 0.000 0.000 -0.000) 0.000 8.054 ( -0.000 0.000 0.000) 0.000 8.124 ( 0.000 -0.000 -0.000) 0.000 8.124 ( -0.000 -0.000 0.000) 0.000 8.664 ( -0.000 -0.000 -0.000) 0.000 8.664 ( 0.000 -0.000 0.000) 0.000 8.739 ( 0.000 0.000 -0.000) 0.000 8.739 ( -0.000 0.000 0.000) 0.000 9.026 ( 0.000 0.000 -0.000) 0.000 9.026 ( -0.000 0.000 0.000) 0.000 9.177 ( 0.000 -0.000 -0.000) 0.000 9.177 ( -0.000 0.000 0.000) 0.000 9.345 ( -0.000 0.000 0.000) 0.000 9.345 ( 0.000 0.000 0.000) 0.000 9.560 ( 0.000 -0.000 0.000) 0.000 9.560 ( 0.000 0.000 0.000) 0.000 9.838 ( 0.000 -0.000 -0.000) 0.000 9.838 ( 0.000 0.000 0.000) 0.000 9.964 ( 0.000 0.000 -0.000) 0.000 9.964 ( -0.000 0.000 0.000) 0.000 10.633 ( 0.000 0.000 0.000) 0.000 10.633 ( -0.000 0.000 0.000) 0.000 10.810 ( -0.000 0.000 0.000) 0.000 10.810 ( -0.000 0.000 0.000) 0.000 11.157 ( 0.000 0.000 -0.000) 0.000 11.157 ( 0.000 0.000 0.000) 0.000 11.251 ( -0.000 -0.000 -0.000) 0.000 11.251 ( -0.000 -0.000 0.000) 0.000 11.933 ( -0.000 0.000 0.000) 0.000 11.933 ( 0.000 0.000 0.000) 0.000 12.067 ( 0.000 0.000 0.000) 0.000 12.067 ( 0.000 0.000 0.000) 0.000 12.389 ( -0.000 0.000 0.000) 0.000 12.389 ( 0.000 0.000 0.000) 0.000 12.476 ( 0.000 -0.000 0.000) 0.000 12.476 ( 0.000 0.000 0.000) 0.000 12.843 ( 0.000 -0.000 0.000) 0.000 12.843 ( 0.000 0.000 0.000) 0.000 13.049 ( 0.000 0.000 0.000) 0.000 13.049 ( 0.000 0.000 0.000) 0.000 13.287 ( -0.000 0.000 0.000) 0.000 13.287 ( 0.000 0.000 0.000) 0.000 13.348 ( -0.000 -0.000 0.000) 0.000 13.348 ( 0.000 0.000 0.000) 0.000 14.094 ( 0.000 0.000 0.000) 0.000 14.094 ( 0.000 0.000 0.000) 0.000 14.284 ( -0.000 0.000 0.000) 0.000 14.284 ( 0.000 0.000 0.000) 0.000 16.109 ( -0.000 0.000 0.000) 0.000 16.109 ( 0.000 0.000 0.000) 0.000 16.212 ( -0.000 0.000 0.000) 0.000 16.212 ( 0.000 0.000 0.000) 0.000 18.388 ( 0.000 0.000 -0.000) 0.000 18.388 ( -0.000 0.000 0.000) 0.000 19.079 ( 0.000 0.000 0.000) 0.000 19.079 ( -0.000 0.000 0.000) 0.000 20.281 ( 0.000 0.000 0.000) 0.000 20.281 ( -0.000 0.000 0.000) 0.000 20.750 ( 0.000 0.000 0.000) 0.000 20.750 ( 0.000 0.000 0.000) 0.000 20.865 ( -0.000 0.000 0.000) 0.000 20.865 ( -0.000 0.000 0.000) 0.000 20.955 ( 0.000 -0.000 0.000) 0.000 20.955 ( -0.000 -0.000 0.000) 0.000 22.466 ( 0.000 0.000 0.000) 0.000 22.466 ( -0.000 0.000 0.000) 0.000 22.697 ( 0.000 0.000 0.000) 0.000 22.697 ( -0.000 0.000 0.000) 0.000 24.580 ( -0.000 0.000 0.000) 0.000 24.580 ( -0.000 0.000 0.000) 0.000 24.692 ( 0.000 0.000 -0.000) 0.000 24.692 ( 0.000 0.000 -0.000) 0.000 25.000 ( 0.000 0.000 -0.000) 0.000 25.000 ( -0.000 0.000 0.000) 0.000 25.040 ( 0.000 -0.000 -0.000) 0.000 25.040 ( -0.000 -0.000 0.000) 0.000 26.754 ( -0.000 0.000 -0.000) 0.000 26.754 ( 0.000 0.000 0.000) 0.000 26.916 ( 0.000 0.000 -0.000) 0.000 26.916 ( -0.000 0.000 0.000) 0.000 27.190 ( -0.000 0.000 0.000) 0.000 27.190 ( -0.000 0.000 0.000) 0.000 27.247 ( 0.000 -0.000 0.000) 0.000 27.247 ( 0.000 0.000 0.000) 0.000 28.070 ( 0.000 0.000 0.000) 0.000 28.070 ( -0.000 0.000 0.000) 0.000 28.377 ( -0.000 0.000 0.000) 0.000 28.377 ( -0.000 0.000 0.000) 0.000 28.710 ( -0.000 -0.000 0.000) 0.000 28.710 ( -0.000 0.000 0.000) 0.000 28.774 ( 0.000 0.000 -0.000) 0.000 28.774 ( 0.000 0.000 0.000) 0.000 29.150 ( 0.000 0.000 0.000) 0.000 29.150 ( -0.000 0.000 0.000) 0.000 29.605 ( 0.000 0.000 0.000) 0.000 29.605 ( -0.000 0.000 0.000) 0.000 30.776 ( -0.000 0.000 0.000) 0.000 30.776 ( -0.000 0.000 0.000) 0.000 31.152 ( 0.000 0.000 0.000) 0.000 31.152 ( -0.000 0.000 0.000) 0.000 33.929 ( 0.000 0.000 0.000) 0.000 33.929 ( -0.000 0.000 0.000) 0.000 33.962 ( -0.000 0.000 0.000) 0.000 33.962 ( -0.000 0.000 0.000) 0.000 37.153 ( 0.000 0.000 0.000) 0.000 37.153 ( -0.000 0.000 0.000) 0.000 37.168 ( 0.000 -0.000 0.000) 0.000 37.168 ( -0.000 0.000 0.000) 0.000 37.753 ( 0.000 0.000 0.000) 0.000 37.753 ( -0.000 0.000 0.000) 0.000 37.775 ( 0.000 0.000 0.000) 0.000 37.775 ( 0.000 0.000 0.000) 0.000 48.804 ( -0.000 0.000 0.000) 0.000 48.804 ( -0.000 0.000 0.000) 0.000 48.845 ( 0.000 0.000 0.000) 0.000 48.845 ( 0.000 0.000 0.000) 0.000 50.617 ( -0.000 0.000 0.000) 0.000 50.617 ( 0.000 0.000 0.000) 0.000 50.691 ( 0.000 0.000 0.000) 0.000 50.691 ( 0.000 0.000 0.000) 0.000 52.178 ( -0.000 -0.000 0.000) 0.000 52.178 ( 0.000 0.000 0.000) 0.000 52.255 ( 0.000 0.000 0.000) 0.000 52.255 ( 0.000 0.000 0.000) 0.000 52.704 ( -0.000 -0.000 0.000) 0.000 52.704 ( 0.000 0.000 0.000) 0.000 52.785 ( 0.000 0.000 0.000) 0.000 52.785 ( -0.000 0.000 0.000) 0.000 53.863 ( 0.000 0.000 0.000) 0.000 53.863 ( 0.000 0.000 0.000) 0.000 54.196 ( -0.000 0.000 0.000) 0.000 54.196 ( 0.000 0.000 0.000) 0.000 55.832 ( -0.000 0.000 0.000) 0.000 55.832 ( 0.000 0.000 0.000) 0.000 55.942 ( -0.000 0.000 0.000) 0.000 55.942 ( 0.000 0.000 0.000) 0.000 57.792 ( -0.000 -0.000 0.000) 0.000 57.792 ( 0.000 0.000 0.000) 0.000 57.911 ( -0.000 0.000 0.000) 0.000 57.911 ( 0.000 0.000 0.000) 0.000 58.169 ( -0.000 0.000 -0.000) 0.000 58.169 ( -0.000 0.000 0.000) 0.000 58.353 ( -0.000 0.000 0.000) 0.000 58.353 ( -0.000 0.000 0.000) 0.000 61.034 ( -0.000 0.000 0.000) 0.000 61.034 ( -0.000 0.000 0.000) 0.000 61.328 ( 0.000 0.000 0.000) 0.000 61.328 ( -0.000 0.000 0.000) 0.000 ======================= Grid point 197 (87/90) ======================= q-point: ( 0.12 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.124 ( -9.710 -12.858 -11.365) 19.718 3.124 ( -9.710 12.858 -11.365) 19.718 3.430 ( -0.966 -10.452 11.331) 15.446 3.430 ( -0.966 10.452 11.331) 15.446 4.164 ( 8.099 -13.367 -0.423) 15.634 4.164 ( 8.099 13.367 -0.423) 15.634 4.338 ( 9.149 -22.829 -8.144) 25.908 4.338 ( 9.149 22.829 -8.144) 25.908 4.608 ( 0.818 -13.906 -8.979) 16.573 4.608 ( 0.818 13.906 -8.979) 16.573 4.967 ( 7.064 -16.207 15.909) 23.784 4.967 ( 7.064 16.207 15.909) 23.784 5.138 ( -1.244 -12.183 -0.972) 12.285 5.138 ( -1.244 12.183 -0.972) 12.285 5.608 ( 15.069 -14.941 -2.146) 21.328 5.608 ( 15.069 14.941 -2.146) 21.328 5.968 ( -4.384 -4.994 9.067) 11.242 5.968 ( -4.384 4.994 9.067) 11.242 6.256 ( -0.671 -2.254 -7.927) 8.269 6.256 ( -0.671 2.254 -7.927) 8.269 6.352 ( 0.754 -4.968 -3.149) 5.930 6.352 ( 0.754 4.968 -3.149) 5.930 6.736 ( 4.753 -9.283 -0.906) 10.468 6.736 ( 4.753 9.283 -0.906) 10.468 7.140 ( 1.452 -4.160 2.628) 5.130 7.140 ( 1.452 4.160 2.628) 5.130 7.352 ( 11.160 -9.173 9.038) 17.041 7.352 ( 11.160 9.173 9.038) 17.041 7.510 ( -4.357 -4.700 0.477) 6.427 7.510 ( -4.357 4.700 0.477) 6.427 7.654 ( 1.485 -12.563 -5.527) 13.805 7.654 ( 1.485 12.563 -5.527) 13.805 8.013 ( -2.338 -4.985 5.447) 7.745 8.013 ( -2.338 4.985 5.447) 7.745 8.161 ( 2.384 -11.711 -3.042) 12.332 8.161 ( 2.384 11.711 -3.042) 12.332 8.642 ( 0.164 -13.054 -4.925) 13.953 8.642 ( 0.164 13.054 -4.925) 13.953 8.789 ( -0.498 -17.714 7.701) 19.322 8.789 ( -0.498 17.714 7.701) 19.322 8.941 ( -1.294 -16.548 -1.769) 16.693 8.941 ( -1.294 16.548 -1.769) 16.693 9.220 ( 3.440 -9.918 -9.473) 14.140 9.220 ( 3.440 9.918 -9.473) 14.140 9.431 ( 4.924 -4.265 -3.147) 7.234 9.431 ( 4.924 4.265 -3.147) 7.234 9.541 ( 0.829 -14.605 4.225) 15.226 9.541 ( 0.829 14.605 4.225) 15.226 9.918 ( 4.988 -13.868 6.175) 15.980 9.918 ( 4.988 13.868 6.175) 15.980 10.028 ( 6.376 -2.725 -2.767) 7.466 10.028 ( 6.376 2.725 -2.767) 7.466 10.635 ( -0.255 -1.324 2.470) 2.814 10.635 ( -0.255 1.324 2.470) 2.814 10.817 ( 0.255 -3.527 -2.867) 4.552 10.817 ( 0.255 3.527 -2.867) 4.552 11.177 ( 1.929 -5.077 -1.242) 5.571 11.177 ( 1.929 5.077 -1.242) 5.571 11.255 ( 0.685 -10.914 1.487) 11.036 11.255 ( 0.685 10.914 1.487) 11.036 11.890 ( -4.010 -4.325 -0.504) 5.919 11.890 ( -4.010 4.325 -0.504) 5.919 12.061 ( -0.493 -7.938 -0.150) 7.955 12.061 ( -0.493 7.938 -0.150) 7.955 12.373 ( -1.320 -0.938 1.388) 2.133 12.373 ( -1.320 0.938 1.388) 2.133 12.476 ( -0.431 -8.565 -0.276) 8.580 12.476 ( -0.431 8.565 -0.276) 8.580 12.754 ( -7.199 -7.727 -0.758) 10.588 12.754 ( -7.199 7.727 -0.758) 10.588 13.052 ( -0.393 -1.827 0.588) 1.959 13.052 ( -0.393 1.827 0.588) 1.959 13.264 ( -1.718 -8.506 -0.334) 8.684 13.264 ( -1.718 8.506 -0.334) 8.684 13.353 ( -0.007 -2.795 0.459) 2.832 13.353 ( -0.007 2.795 0.459) 2.832 14.060 ( -3.165 -3.700 -0.151) 4.871 14.060 ( -3.165 3.700 -0.151) 4.871 14.235 ( -4.511 -3.837 -0.293) 5.930 14.235 ( -4.511 3.837 -0.293) 5.930 16.028 ( -3.641 -3.805 0.111) 5.268 16.028 ( -3.641 3.805 0.111) 5.268 16.362 ( 9.900 -3.208 0.072) 10.407 16.362 ( 9.900 3.208 0.072) 10.407 18.401 ( 1.336 -1.090 0.182) 1.734 18.401 ( 1.336 1.090 0.182) 1.734 19.055 ( -2.234 -0.615 -0.524) 2.375 19.055 ( -2.234 0.615 -0.524) 2.375 20.276 ( -0.347 -0.303 0.366) 0.588 20.276 ( -0.347 0.303 0.366) 0.588 20.699 ( -3.543 -2.142 -0.176) 4.144 20.699 ( -3.543 2.142 -0.176) 4.144 20.908 ( 2.961 -7.856 0.569) 8.415 20.908 ( 2.961 7.856 0.569) 8.415 20.983 ( 2.437 -6.568 -0.430) 7.019 20.983 ( 2.437 6.568 -0.430) 7.019 22.477 ( 0.940 -1.194 0.003) 1.520 22.477 ( 0.940 1.194 0.003) 1.520 22.694 ( -0.255 -0.135 -0.003) 0.289 22.694 ( -0.255 0.135 -0.003) 0.289 24.507 ( -7.145 -5.651 0.786) 9.144 24.507 ( -7.145 5.651 0.786) 9.144 24.679 ( -1.773 -3.562 -2.081) 4.490 24.679 ( -1.773 3.562 -2.081) 4.490 24.855 ( -11.313 -12.159 3.346) 16.942 24.855 ( -11.313 12.159 3.346) 16.942 25.013 ( -2.732 -10.419 -2.248) 11.003 25.013 ( -2.732 10.419 -2.248) 11.003 26.766 ( 0.878 -1.916 0.444) 2.154 26.766 ( 0.878 1.916 0.444) 2.154 26.921 ( 0.135 -1.525 -0.685) 1.677 26.921 ( 0.135 1.525 -0.685) 1.677 27.182 ( 0.104 -1.874 -1.702) 2.534 27.182 ( 0.104 1.874 -1.702) 2.534 27.247 ( -0.342 -1.308 2.037) 2.444 27.247 ( -0.342 1.308 2.037) 2.444 28.028 ( -3.369 -2.845 -0.087) 4.411 28.028 ( -3.369 2.845 -0.087) 4.411 28.415 ( 2.625 -1.153 1.071) 3.060 28.415 ( 2.625 1.153 1.071) 3.060 28.627 ( -3.847 -1.505 -1.122) 4.280 28.627 ( -3.847 1.505 -1.122) 4.280 28.889 ( 7.139 -4.511 -1.948) 8.666 28.889 ( 7.139 4.511 -1.948) 8.666 29.151 ( 0.252 -1.049 1.820) 2.116 29.151 ( 0.252 1.049 1.820) 2.116 29.650 ( 3.821 -4.474 0.311) 5.892 29.650 ( 3.821 4.474 0.311) 5.892 30.763 ( -1.244 -0.478 -0.594) 1.459 30.763 ( -1.244 0.478 -0.594) 1.459 31.117 ( -3.184 -1.823 1.084) 3.826 31.117 ( -3.184 1.823 1.084) 3.826 33.911 ( -1.415 -0.099 0.029) 1.418 33.911 ( -1.415 0.099 0.029) 1.418 33.966 ( 0.196 -0.420 0.027) 0.465 33.966 ( 0.196 0.420 0.027) 0.465 37.163 ( 1.044 -0.818 -0.033) 1.326 37.163 ( 1.044 0.818 -0.033) 1.326 37.189 ( 1.635 -1.293 -0.037) 2.085 37.189 ( 1.635 1.293 -0.037) 2.085 37.755 ( 0.204 -1.370 -0.022) 1.385 37.755 ( 0.204 1.370 -0.022) 1.385 37.782 ( 0.560 -1.254 -0.019) 1.374 37.782 ( 0.560 1.254 -0.019) 1.374 48.856 ( 5.195 -0.729 -0.077) 5.247 48.856 ( 5.195 0.729 -0.077) 5.247 48.943 ( 8.392 -1.009 0.149) 8.454 48.943 ( 8.392 1.009 0.149) 8.454 50.587 ( -1.220 -2.050 -4.283) 4.903 50.587 ( -1.220 2.050 -4.283) 4.903 50.716 ( 0.741 -4.921 3.713) 6.209 50.716 ( 0.741 4.921 3.713) 6.209 52.173 ( -0.507 -4.862 0.626) 4.929 52.173 ( -0.507 4.862 0.626) 4.929 52.255 ( 0.104 -6.118 -0.774) 6.168 52.255 ( 0.104 6.118 -0.774) 6.168 52.716 ( 1.046 -1.444 -0.466) 1.843 52.716 ( 1.046 1.444 -0.466) 1.843 52.809 ( 1.980 -1.508 0.598) 2.560 52.809 ( 1.980 1.508 0.598) 2.560 53.871 ( 0.699 -0.232 0.191) 0.761 53.871 ( 0.699 0.232 0.191) 0.761 54.188 ( -0.776 -0.633 -0.014) 1.001 54.188 ( -0.776 0.633 -0.014) 1.001 55.826 ( -0.537 -1.587 0.504) 1.750 55.826 ( -0.537 1.587 0.504) 1.750 55.934 ( -0.666 -1.676 -0.511) 1.874 55.934 ( -0.666 1.676 -0.511) 1.874 57.788 ( -0.270 -3.003 -0.310) 3.031 57.788 ( -0.270 3.003 -0.310) 3.031 57.920 ( 0.619 -3.399 0.952) 3.584 57.920 ( 0.619 3.399 0.952) 3.584 58.151 ( -1.389 -0.984 -1.581) 2.323 58.151 ( -1.389 0.984 -1.581) 2.323 58.327 ( -2.450 -3.070 0.943) 4.039 58.327 ( -2.450 3.070 0.943) 4.039 61.032 ( -0.112 -0.281 -0.164) 0.344 61.032 ( -0.112 0.281 -0.164) 0.344 61.299 ( -2.660 -0.589 0.269) 2.738 61.299 ( -2.660 0.589 0.269) 2.738 ======================= Grid point 199 (88/90) ======================= q-point: ( 0.25 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 82 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.903 ( -6.425 -13.446 -11.784) 18.998 2.903 ( -6.425 13.446 -11.784) 18.998 3.445 ( -1.979 -6.872 11.829) 13.823 3.445 ( -1.979 6.872 11.829) 13.823 4.272 ( 4.255 -16.846 -11.878) 21.047 4.272 ( 4.255 16.846 -11.878) 21.047 4.542 ( 12.478 -13.850 0.054) 18.642 4.542 ( 12.478 13.850 0.054) 18.642 4.740 ( 10.347 -9.871 -0.645) 14.315 4.740 ( 10.347 9.871 -0.645) 14.315 5.082 ( 1.909 -10.461 7.341) 12.922 5.082 ( 1.909 10.461 7.341) 12.922 5.219 ( 5.457 -14.473 -0.434) 15.474 5.219 ( 5.457 14.473 -0.434) 15.474 5.780 ( 0.023 -7.307 -7.270) 10.308 5.780 ( 0.023 7.307 -7.270) 10.308 5.977 ( 3.947 -6.058 7.918) 10.723 5.977 ( 3.947 6.058 7.918) 10.723 6.239 ( 6.862 -9.368 -1.408) 11.697 6.239 ( 6.862 9.368 -1.408) 11.697 6.467 ( 5.096 -6.313 0.442) 8.125 6.467 ( 5.096 6.313 0.442) 8.125 6.781 ( 0.274 -12.045 -0.859) 12.078 6.781 ( 0.274 12.045 -0.859) 12.078 7.217 ( 3.602 -2.910 5.333) 7.062 7.217 ( 3.602 2.910 5.333) 7.062 7.351 ( -6.558 -0.958 1.142) 6.726 7.351 ( -6.558 0.958 1.142) 6.726 7.573 ( -1.465 -5.961 2.660) 6.690 7.573 ( -1.465 5.961 2.660) 6.690 7.740 ( 11.427 -4.005 -2.436) 12.351 7.740 ( 11.427 4.005 -2.436) 12.351 8.028 ( 2.984 -11.099 6.925) 13.419 8.028 ( 2.984 11.099 6.925) 13.419 8.206 ( 3.307 -10.239 -6.197) 12.417 8.206 ( 3.307 10.239 -6.197) 12.417 8.624 ( -1.251 -7.135 -3.288) 7.955 8.624 ( -1.251 7.135 -3.288) 7.955 8.767 ( 0.359 -12.696 6.099) 14.090 8.767 ( 0.359 12.696 6.099) 14.090 9.020 ( 5.906 -3.840 -0.448) 7.059 9.020 ( 5.906 3.840 -0.448) 7.059 9.287 ( 6.195 -14.244 -10.051) 18.501 9.287 ( 6.195 14.244 -10.051) 18.501 9.461 ( 2.241 -5.680 -6.271) 8.753 9.461 ( 2.241 5.680 -6.271) 8.753 9.659 ( 5.739 -9.038 5.674) 12.117 9.659 ( 5.739 9.038 5.674) 12.117 10.036 ( 4.336 -10.740 5.199) 12.695 10.036 ( 4.336 10.740 5.199) 12.695 10.178 ( 7.098 -1.329 -0.938) 7.282 10.178 ( 7.098 1.329 -0.938) 7.282 10.608 ( -3.466 -2.322 -0.509) 4.203 10.608 ( -3.466 2.322 -0.509) 4.203 10.805 ( 0.009 -4.008 -1.661) 4.339 10.805 ( 0.009 4.008 -1.661) 4.339 11.160 ( -2.732 -6.648 3.508) 7.998 11.160 ( -2.732 6.648 3.508) 7.998 11.353 ( 6.996 -10.806 -1.513) 12.962 11.353 ( 6.996 10.806 -1.513) 12.962 11.784 ( -4.914 -2.675 -2.162) 5.999 11.784 ( -4.914 2.675 -2.162) 5.999 12.029 ( -3.300 -8.652 1.259) 9.345 12.029 ( -3.300 8.652 1.259) 9.345 12.326 ( -4.225 -6.328 -0.467) 7.623 12.326 ( -4.225 6.328 -0.467) 7.623 12.477 ( 1.424 -7.795 3.879) 8.822 12.477 ( 1.424 7.795 3.879) 8.822 12.588 ( -7.185 -7.080 -2.997) 10.523 12.588 ( -7.185 7.080 -2.997) 10.523 13.026 ( -2.276 -2.390 0.649) 3.364 13.026 ( -2.276 2.390 0.649) 3.364 13.233 ( -0.818 -8.879 -0.159) 8.918 13.233 ( -0.818 8.879 -0.159) 8.918 13.341 ( -1.248 -2.366 0.162) 2.680 13.341 ( -1.248 2.366 0.162) 2.680 13.966 ( -5.482 -6.655 -0.308) 8.628 13.966 ( -5.482 6.655 -0.308) 8.628 14.106 ( -7.312 -6.822 -0.301) 10.005 14.106 ( -7.312 6.822 -0.301) 10.005 15.985 ( -0.765 -2.863 0.167) 2.968 15.985 ( -0.765 2.863 0.167) 2.968 16.570 ( 9.289 -2.040 0.149) 9.511 16.570 ( 9.289 2.040 0.149) 9.511 18.451 ( 3.594 -2.058 0.155) 4.144 18.451 ( 3.594 2.058 0.155) 4.144 18.982 ( -4.624 -1.493 -0.676) 4.905 18.982 ( -4.624 1.493 -0.676) 4.905 20.279 ( 0.776 -0.437 0.421) 0.985 20.279 ( 0.776 0.437 0.421) 0.985 20.624 ( -3.620 -1.327 0.014) 3.855 20.624 ( -3.620 1.327 0.014) 3.855 20.976 ( 3.359 -10.625 0.614) 11.161 20.976 ( 3.359 10.625 0.614) 11.161 21.037 ( 2.624 -10.127 -0.648) 10.482 21.037 ( 2.624 10.127 -0.648) 10.482 22.499 ( 1.041 -1.576 0.048) 1.889 22.499 ( 1.041 1.576 0.048) 1.889 22.688 ( -0.268 -0.240 -0.030) 0.361 22.688 ( -0.268 0.240 -0.030) 0.361 24.304 ( -11.455 -6.737 0.620) 13.304 24.304 ( -11.455 6.737 0.620) 13.304 24.480 ( -15.581 -1.153 0.067) 15.624 24.480 ( -15.581 1.153 0.067) 15.624 24.730 ( -0.886 -6.413 -1.569) 6.662 24.730 ( -0.886 6.413 -1.569) 6.662 24.951 ( -2.470 -5.735 0.704) 6.284 24.951 ( -2.470 5.735 0.704) 6.284 26.783 ( 0.446 -1.954 0.628) 2.100 26.783 ( 0.446 1.954 0.628) 2.100 26.904 ( -1.520 -1.834 -0.799) 2.513 26.904 ( -1.520 1.834 -0.799) 2.513 27.197 ( 1.553 -1.271 -2.304) 3.055 27.197 ( 1.553 1.271 -2.304) 3.055 27.251 ( 0.352 -1.696 2.435) 2.988 27.251 ( 0.352 1.696 2.435) 2.988 27.959 ( -2.815 -3.485 0.121) 4.482 27.959 ( -2.815 3.485 0.121) 4.482 28.433 ( -2.115 -0.955 0.429) 2.361 28.433 ( -2.115 0.955 0.429) 2.361 28.596 ( 1.531 -3.088 0.061) 3.447 28.596 ( 1.531 3.088 0.061) 3.447 29.011 ( 4.599 -5.012 -3.224) 7.528 29.011 ( 4.599 5.012 -3.224) 7.528 29.188 ( 2.860 -0.477 2.597) 3.893 29.188 ( 2.860 0.477 2.597) 3.893 29.741 ( 4.361 -5.219 0.265) 6.806 29.741 ( 4.361 5.219 0.265) 6.806 30.721 ( -2.460 -0.994 -0.525) 2.705 30.721 ( -2.460 0.994 -0.525) 2.705 31.044 ( -3.601 -1.619 0.898) 4.049 31.044 ( -3.601 1.619 0.898) 4.049 33.880 ( -1.349 -0.136 0.061) 1.357 33.880 ( -1.349 0.136 0.061) 1.357 33.968 ( -0.035 -0.196 -0.035) 0.203 33.968 ( -0.035 0.196 -0.035) 0.203 37.193 ( 1.654 -1.086 0.173) 1.986 37.193 ( 1.654 1.086 0.173) 1.986 37.227 ( 1.910 -1.323 -0.184) 2.331 37.227 ( 1.910 1.323 -0.184) 2.331 37.762 ( 0.371 -1.689 -0.072) 1.731 37.762 ( 0.371 1.689 -0.072) 1.731 37.795 ( 0.660 -1.716 0.007) 1.839 37.795 ( 0.660 1.716 0.007) 1.839 48.999 ( 7.677 -0.079 -0.089) 7.678 48.999 ( 7.677 0.079 -0.089) 7.678 49.153 ( 10.585 -0.987 0.307) 10.635 49.153 ( 10.585 0.987 0.307) 10.635 50.563 ( -0.027 -1.616 -3.056) 3.457 50.563 ( -0.027 1.616 -3.056) 3.457 50.724 ( -0.735 -4.741 2.367) 5.350 50.724 ( -0.735 4.741 2.367) 5.350 52.164 ( -0.480 -6.892 1.002) 6.981 52.164 ( -0.480 6.892 1.002) 6.981 52.254 ( 0.027 -9.074 -1.325) 9.171 52.254 ( 0.027 9.074 -1.325) 9.171 52.741 ( 1.355 -2.018 -0.598) 2.503 52.741 ( 1.355 2.018 -0.598) 2.503 52.861 ( 2.546 -2.168 0.804) 3.439 52.861 ( 2.546 2.168 0.804) 3.439 53.892 ( 1.166 -0.207 0.360) 1.237 53.892 ( 1.166 0.207 0.360) 1.237 54.166 ( -1.299 -1.061 -0.090) 1.680 54.166 ( -1.299 1.061 -0.090) 1.680 55.816 ( -0.510 -2.261 0.759) 2.439 55.816 ( -0.510 2.261 0.759) 2.439 55.912 ( -1.175 -2.387 -0.773) 2.771 55.912 ( -1.175 2.387 -0.773) 2.771 57.784 ( 0.035 -4.012 -0.203) 4.018 57.784 ( 0.035 4.012 -0.203) 4.018 57.936 ( 0.547 -4.355 1.057) 4.514 57.936 ( 0.547 4.355 1.057) 4.514 58.112 ( -1.607 -2.074 -2.094) 3.357 58.112 ( -1.607 2.074 -2.094) 3.357 58.264 ( -3.627 -4.128 1.253) 5.636 58.264 ( -3.627 4.128 1.253) 5.636 61.032 ( 0.342 -0.449 -0.181) 0.592 61.032 ( 0.342 0.449 -0.181) 0.592 61.229 ( -3.839 -0.683 0.280) 3.910 61.229 ( -3.839 0.683 0.280) 3.910 ======================= Grid point 201 (89/90) ======================= q-point: ( 0.38 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.822 ( 0.889 -7.640 -7.852) 10.992 2.822 ( 0.889 7.640 -7.852) 10.992 3.391 ( -5.033 -2.145 7.487) 9.273 3.391 ( -5.033 2.145 7.487) 9.273 4.360 ( 6.613 -14.371 -3.511) 16.205 4.360 ( 6.613 14.371 -3.511) 16.205 4.776 ( 5.943 -12.304 -6.794) 15.260 4.776 ( 5.943 12.304 -6.794) 15.260 4.943 ( 6.306 -10.494 3.049) 12.617 4.943 ( 6.306 10.494 3.049) 12.617 5.041 ( -0.202 -11.256 -1.050) 11.307 5.041 ( -0.202 11.256 -1.050) 11.307 5.390 ( 8.629 -14.389 6.101) 17.852 5.390 ( 8.629 14.389 6.101) 17.853 5.720 ( -2.138 -2.173 -6.641) 7.307 5.720 ( -2.138 2.173 -6.641) 7.307 6.054 ( -0.589 -0.318 3.211) 3.280 6.054 ( -0.589 0.318 3.211) 3.280 6.396 ( 6.342 -13.393 -3.730) 15.281 6.396 ( 6.342 13.393 -3.730) 15.281 6.599 ( 7.160 -7.025 7.916) 12.778 6.599 ( 7.160 7.025 7.916) 12.778 6.787 ( 1.014 -8.956 3.244) 9.579 6.787 ( 1.014 8.956 3.244) 9.579 7.112 ( -9.747 -2.247 -4.760) 11.077 7.112 ( -9.747 2.247 -4.760) 11.077 7.390 ( 4.543 -5.798 7.069) 10.209 7.390 ( 4.543 5.798 7.069) 10.209 7.506 ( -3.255 -10.991 0.681) 11.483 7.506 ( -3.255 10.991 0.681) 11.483 7.854 ( 0.180 -4.809 -4.405) 6.524 7.854 ( 0.180 4.809 -4.405) 6.524 8.153 ( 4.038 -11.194 0.128) 11.901 8.153 ( 4.038 11.194 0.128) 11.901 8.280 ( 5.564 -4.205 -2.615) 7.448 8.280 ( 5.564 4.205 -2.615) 7.448 8.639 ( 3.539 -8.785 2.084) 9.698 8.639 ( 3.539 8.785 2.084) 9.698 8.808 ( 0.482 -11.326 3.867) 11.977 8.808 ( 0.482 11.326 3.867) 11.977 9.149 ( 6.190 -6.055 0.170) 8.660 9.149 ( 6.190 6.055 0.170) 8.660 9.404 ( 6.833 -13.706 -10.659) 18.659 9.404 ( 6.833 13.706 -10.659) 18.659 9.558 ( 8.378 -7.639 -1.347) 11.417 9.558 ( 8.378 7.639 -1.347) 11.417 9.757 ( 2.030 -6.312 4.093) 7.792 9.757 ( 2.030 6.312 4.093) 7.792 10.083 ( -1.890 -4.391 0.276) 4.788 10.083 ( -1.890 4.391 0.276) 4.788 10.278 ( 1.769 -7.596 2.962) 8.343 10.278 ( 1.769 7.596 2.962) 8.343 10.502 ( -4.916 -8.692 -1.174) 10.055 10.502 ( -4.916 8.692 -1.174) 10.055 10.797 ( -0.705 -12.321 -2.402) 12.573 10.797 ( -0.705 12.321 -2.402) 12.573 11.178 ( 4.880 -9.904 2.334) 11.285 11.178 ( 4.880 9.904 2.334) 11.285 11.430 ( -0.898 -7.730 0.199) 7.785 11.430 ( -0.898 7.730 0.199) 7.785 11.715 ( -0.890 -3.045 -1.044) 3.340 11.715 ( -0.890 3.045 -1.044) 3.340 11.928 ( -5.996 -5.355 -0.110) 8.040 11.928 ( -5.996 5.355 -0.110) 8.040 12.238 ( -2.361 -7.218 2.720) 8.066 12.238 ( -2.361 7.218 2.720) 8.066 12.424 ( -6.257 -0.743 -4.459) 7.719 12.424 ( -6.257 0.743 -4.459) 7.719 12.580 ( 5.169 -7.201 2.992) 9.355 12.580 ( 5.169 7.201 2.992) 9.355 12.962 ( -3.754 -3.277 0.348) 4.995 12.962 ( -3.754 3.277 0.348) 4.995 13.237 ( 1.227 -7.307 -0.416) 7.421 13.237 ( 1.227 7.307 -0.416) 7.421 13.307 ( -1.778 -4.633 -0.159) 4.965 13.307 ( -1.778 4.633 -0.159) 4.965 13.853 ( -4.525 -5.924 -0.491) 7.471 13.853 ( -4.525 5.924 -0.491) 7.471 13.955 ( -6.273 -6.257 0.162) 8.861 13.955 ( -6.273 6.257 0.162) 8.861 15.984 ( 0.326 -1.450 0.122) 1.491 15.984 ( 0.326 1.450 0.122) 1.491 16.728 ( 5.422 -0.859 0.164) 5.492 16.728 ( 5.422 0.859 0.164) 5.492 18.554 ( 6.172 -2.783 -0.069) 6.771 18.554 ( 6.172 2.783 -0.069) 6.771 18.861 ( -6.747 -2.451 -0.315) 7.186 18.861 ( -6.747 2.451 -0.315) 7.186 20.316 ( 2.534 -0.743 0.104) 2.642 20.316 ( 2.534 0.743 0.104) 2.642 20.546 ( -3.760 -1.238 0.225) 3.965 20.546 ( -3.760 1.238 0.225) 3.965 21.043 ( 2.568 -10.068 0.426) 10.399 21.043 ( 2.568 10.068 0.426) 10.399 21.083 ( 1.785 -10.142 -0.545) 10.313 21.083 ( 1.785 10.142 -0.545) 10.313 22.517 ( 0.621 -1.147 0.161) 1.315 22.517 ( 0.621 1.147 0.161) 1.315 22.682 ( -0.277 -0.376 -0.137) 0.487 22.682 ( -0.277 0.376 -0.137) 0.487 24.091 ( -7.819 -5.716 0.491) 9.698 24.091 ( -7.819 5.716 0.491) 9.698 24.177 ( -11.697 -1.766 -0.317) 11.834 24.177 ( -11.697 1.766 -0.317) 11.834 24.723 ( 0.101 -2.864 -1.009) 3.038 24.723 ( 0.101 2.864 -1.009) 3.038 24.916 ( -1.117 -2.491 0.754) 2.832 24.916 ( -1.117 2.491 0.754) 2.832 26.789 ( 0.042 -0.838 0.564) 1.011 26.789 ( 0.042 0.838 0.564) 1.011 26.866 ( -1.593 -0.851 -0.579) 1.897 26.866 ( -1.593 0.851 -0.579) 1.897 27.220 ( 1.057 -0.107 -1.246) 1.637 27.220 ( 1.057 0.107 -1.246) 1.637 27.274 ( 1.040 -1.314 1.110) 2.010 27.274 ( 1.040 1.314 1.110) 2.010 27.917 ( -1.230 -2.252 0.294) 2.583 27.917 ( -1.230 2.252 0.294) 2.583 28.370 ( -2.762 -0.789 -0.373) 2.897 28.370 ( -2.762 0.789 -0.373) 2.897 28.647 ( 2.136 -2.259 1.320) 3.377 28.647 ( 2.136 2.259 1.320) 3.377 29.061 ( 1.429 -2.879 -2.747) 4.228 29.061 ( 1.429 2.879 -2.747) 4.228 29.264 ( 3.027 -0.632 1.700) 3.529 29.264 ( 3.027 0.632 1.700) 3.529 29.820 ( 2.848 -3.351 0.106) 4.399 29.820 ( 2.848 3.351 0.106) 4.399 30.668 ( -2.217 -1.461 -0.175) 2.661 30.668 ( -2.217 1.461 -0.175) 2.661 30.986 ( -1.947 -0.677 0.288) 2.081 30.986 ( -1.947 0.677 0.288) 2.081 33.858 ( -0.740 -0.139 0.034) 0.753 33.858 ( -0.740 0.139 0.034) 0.753 33.966 ( -0.038 -0.023 -0.034) 0.056 33.966 ( -0.038 0.023 -0.034) 0.056 37.224 ( 1.127 -0.849 0.108) 1.415 37.224 ( 1.127 0.849 0.108) 1.415 37.261 ( 1.252 -0.809 -0.078) 1.493 37.261 ( 1.252 0.809 -0.078) 1.493 37.769 ( 0.317 -1.107 -0.077) 1.154 37.769 ( 0.317 1.107 -0.077) 1.154 37.807 ( 0.386 -1.261 0.027) 1.319 37.807 ( 0.386 1.261 0.027) 1.319 49.143 ( 5.426 -0.165 -0.050) 5.428 49.143 ( 5.426 0.165 -0.050) 5.428 49.345 ( 6.911 -0.808 0.234) 6.962 49.345 ( 6.911 0.808 0.234) 6.962 50.565 ( 0.578 -1.071 -1.361) 1.826 50.565 ( 0.578 1.071 -1.361) 1.826 50.706 ( -1.168 -2.767 0.988) 3.162 50.706 ( -1.168 2.767 0.988) 3.162 52.162 ( 0.089 -5.873 1.091) 5.974 52.162 ( 0.089 5.873 1.091) 5.974 52.246 ( -0.369 -7.635 -1.409) 7.773 52.246 ( -0.369 7.635 -1.409) 7.773 52.764 ( 0.892 -1.455 -0.377) 1.747 52.764 ( 0.892 1.455 -0.377) 1.747 52.909 ( 1.645 -1.599 0.540) 2.356 52.909 ( 1.645 1.599 0.540) 2.356 53.917 ( 1.038 -0.094 0.350) 1.099 53.917 ( 1.038 0.094 0.350) 1.099 54.138 ( -1.157 -0.943 -0.145) 1.500 54.138 ( -1.157 0.943 -0.145) 1.500 55.812 ( -0.049 -1.881 0.676) 2.000 55.812 ( -0.049 1.881 0.676) 2.000 55.885 ( -1.128 -1.972 -0.689) 2.374 55.885 ( -1.128 1.972 -0.689) 2.374 57.788 ( 0.273 -3.062 -0.038) 3.074 57.788 ( 0.273 3.062 -0.038) 3.074 57.945 ( 0.102 -2.932 0.510) 2.977 57.945 ( 0.102 2.932 0.510) 2.977 58.084 ( -0.462 -3.439 -1.369) 3.731 58.084 ( -0.462 3.440 -1.369) 3.731 58.195 ( -3.016 -3.868 0.908) 4.988 58.195 ( -3.016 3.868 0.908) 4.988 61.049 ( 1.299 -0.502 -0.120) 1.398 61.049 ( 1.299 0.502 -0.120) 1.398 61.150 ( -3.510 -0.542 0.165) 3.555 61.150 ( -3.510 0.542 0.165) 3.555 ======================= Grid point 203 (90/90) ======================= q-point: ( 0.50 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 Number of triplets: 46 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.837 ( -0.000 0.000 0.000) 0.000 2.837 ( -0.000 0.000 0.000) 0.000 3.334 ( -0.000 0.000 0.000) 0.000 3.334 ( -0.000 0.000 0.000) 0.000 4.465 ( -0.000 -0.000 -0.000) 0.000 4.465 ( 0.000 0.000 0.000) 0.000 4.732 ( -0.000 0.000 0.000) 0.000 4.732 ( -0.000 0.000 0.000) 0.000 5.006 ( -0.000 -0.000 0.000) 0.000 5.006 ( -0.000 0.000 0.000) 0.000 5.122 ( -0.000 0.000 0.000) 0.000 5.122 ( -0.000 0.000 0.000) 0.000 5.514 ( -0.000 -0.000 0.000) 0.000 5.514 ( 0.000 -0.000 0.000) 0.000 5.678 ( -0.000 0.000 -0.000) 0.000 5.678 ( -0.000 0.000 -0.000) 0.000 6.015 ( -0.000 0.000 -0.000) 0.000 6.015 ( -0.000 0.000 0.000) 0.000 6.472 ( 0.000 -0.000 0.000) 0.000 6.472 ( -0.000 0.000 0.000) 0.000 6.717 ( -0.000 0.000 -0.000) 0.000 6.717 ( 0.000 -0.000 0.000) 0.000 6.820 ( -0.000 0.000 -0.000) 0.000 6.820 ( -0.000 0.000 0.000) 0.000 6.959 ( -0.000 0.000 0.000) 0.000 6.959 ( -0.000 0.000 0.000) 0.000 7.455 ( 0.000 -0.000 -0.000) 0.000 7.455 ( -0.000 -0.000 0.000) 0.000 7.469 ( -0.000 0.000 -0.000) 0.000 7.469 ( -0.000 0.000 0.000) 0.000 7.825 ( -0.000 0.000 -0.000) 0.000 7.825 ( -0.000 0.000 0.000) 0.000 8.194 ( -0.000 0.000 -0.000) 0.000 8.194 ( -0.000 0.000 0.000) 0.000 8.337 ( -0.000 -0.000 -0.000) 0.000 8.337 ( -0.000 0.000 0.000) 0.000 8.719 ( 0.000 -0.000 0.000) 0.000 8.719 ( -0.000 0.000 0.000) 0.000 8.796 ( -0.000 -0.000 -0.000) 0.000 8.796 ( -0.000 0.000 -0.000) 0.000 9.225 ( -0.000 -0.000 0.000) 0.000 9.225 ( -0.000 -0.000 0.000) 0.000 9.483 ( 0.000 -0.000 -0.000) 0.000 9.483 ( -0.000 0.000 -0.000) 0.000 9.713 ( -0.000 -0.000 0.000) 0.000 9.713 ( -0.000 0.000 0.000) 0.000 9.751 ( 0.000 -0.000 0.000) 0.000 9.751 ( 0.000 0.000 -0.000) 0.000 10.023 ( -0.000 0.000 -0.000) 0.000 10.023 ( -0.000 0.000 0.000) 0.000 10.275 ( -0.000 -0.000 0.000) 0.000 10.275 ( -0.000 0.000 0.000) 0.000 10.456 ( -0.000 0.000 -0.000) 0.000 10.456 ( -0.000 0.000 0.000) 0.000 10.781 ( -0.000 -0.000 -0.000) 0.000 10.781 ( -0.000 0.000 0.000) 0.000 11.331 ( -0.000 0.000 -0.000) 0.000 11.331 ( -0.000 0.001 0.000) 0.001 11.333 ( 0.000 -0.001 -0.000) 0.001 11.333 ( 0.000 -0.000 0.000) 0.000 11.713 ( -0.000 -0.000 0.000) 0.000 11.713 ( -0.000 0.000 0.000) 0.000 11.841 ( -0.000 0.000 0.000) 0.000 11.841 ( -0.000 0.000 0.000) 0.000 12.254 ( 0.000 -0.000 -0.000) 0.000 12.254 ( 0.000 0.000 0.000) 0.000 12.317 ( -0.000 -0.000 -0.000) 0.000 12.317 ( -0.000 -0.000 0.000) 0.000 12.661 ( -0.000 0.000 -0.000) 0.000 12.661 ( -0.000 0.000 0.000) 0.000 12.907 ( -0.000 -0.000 0.000) 0.000 12.907 ( -0.000 0.000 0.000) 0.000 13.267 ( -0.000 0.000 0.000) 0.000 13.267 ( 0.000 0.000 0.000) 0.000 13.274 ( -0.000 -0.000 -0.000) 0.000 13.274 ( -0.000 -0.000 0.000) 0.000 13.801 ( -0.000 0.000 -0.000) 0.000 13.801 ( -0.000 0.000 0.000) 0.000 13.882 ( -0.000 -0.000 0.000) 0.000 13.882 ( -0.000 0.000 0.000) 0.000 15.989 ( -0.000 0.000 -0.000) 0.000 15.989 ( -0.000 0.000 0.000) 0.000 16.786 ( -0.000 0.000 -0.000) 0.000 16.786 ( -0.000 0.000 0.000) 0.000 18.681 ( -0.000 -0.000 0.000) 0.000 18.681 ( -0.000 0.000 0.000) 0.000 18.728 ( 0.000 -0.000 0.000) 0.000 18.728 ( 0.000 0.000 -0.000) 0.000 20.357 ( -0.000 0.000 0.000) 0.000 20.357 ( -0.000 0.000 0.000) 0.000 20.493 ( -0.000 0.000 0.000) 0.000 20.493 ( -0.000 0.000 0.000) 0.000 21.073 ( 0.000 -0.000 -0.000) 0.000 21.073 ( -0.000 0.000 -0.000) 0.000 21.102 ( -0.000 -0.000 0.000) 0.000 21.102 ( -0.000 0.000 0.000) 0.000 22.524 ( -0.000 0.000 -0.000) 0.000 22.524 ( -0.000 0.000 0.000) 0.000 22.678 ( -0.000 0.000 0.000) 0.000 22.678 ( -0.000 0.000 0.000) 0.000 24.013 ( -0.000 0.000 -0.000) 0.000 24.013 ( -0.000 0.000 -0.000) 0.000 24.040 ( 0.000 -0.000 -0.000) 0.000 24.040 ( -0.000 0.000 0.000) 0.000 24.723 ( -0.000 0.000 0.000) 0.000 24.723 ( -0.000 0.000 0.000) 0.000 24.906 ( -0.000 0.000 -0.000) 0.000 24.906 ( -0.000 0.000 0.000) 0.000 26.790 ( -0.000 -0.000 -0.000) 0.000 26.790 ( -0.000 0.000 0.000) 0.000 26.846 ( -0.000 0.000 -0.000) 0.000 26.846 ( -0.000 0.000 0.000) 0.000 27.231 ( -0.000 0.000 0.000) 0.000 27.231 ( -0.000 0.000 0.000) 0.000 27.288 ( -0.000 0.000 -0.000) 0.000 27.288 ( -0.000 0.000 0.000) 0.000 27.906 ( -0.000 0.000 0.000) 0.000 27.906 ( -0.000 0.000 0.000) 0.000 28.338 ( -0.000 0.000 -0.000) 0.000 28.338 ( -0.000 0.000 0.000) 0.000 28.673 ( -0.000 0.000 0.000) 0.000 28.673 ( -0.000 0.000 0.000) 0.000 29.070 ( -0.000 0.000 0.000) 0.000 29.070 ( -0.000 0.000 0.000) 0.000 29.301 ( -0.000 0.000 0.000) 0.000 29.301 ( -0.000 0.000 0.000) 0.000 29.851 ( -0.000 0.000 0.000) 0.000 29.851 ( -0.000 0.000 0.000) 0.000 30.642 ( -0.000 0.000 0.000) 0.000 30.642 ( -0.000 0.000 0.000) 0.000 30.966 ( -0.000 0.000 -0.000) 0.000 30.966 ( -0.000 0.000 0.000) 0.000 33.851 ( -0.000 0.000 0.000) 0.000 33.851 ( -0.000 0.000 0.000) 0.000 33.966 ( -0.000 0.000 0.000) 0.000 33.966 ( -0.000 0.000 0.000) 0.000 37.237 ( -0.000 -0.000 -0.000) 0.000 37.237 ( -0.000 -0.000 0.000) 0.000 37.275 ( -0.000 0.000 -0.000) 0.000 37.275 ( -0.000 0.000 0.000) 0.000 37.773 ( -0.000 -0.000 -0.000) 0.000 37.773 ( -0.000 0.000 0.000) 0.000 37.811 ( -0.000 -0.000 0.000) 0.000 37.811 ( -0.000 0.000 0.000) 0.000 49.203 ( -0.000 0.000 0.000) 0.000 49.203 ( -0.000 0.000 0.000) 0.000 49.420 ( -0.000 0.000 0.000) 0.000 49.420 ( -0.000 -0.000 0.000) 0.000 50.571 ( -0.000 0.000 -0.000) 0.000 50.571 ( -0.000 0.000 0.000) 0.000 50.693 ( -0.000 0.000 -0.000) 0.000 50.693 ( -0.000 0.000 0.000) 0.000 52.167 ( -0.000 -0.000 0.000) 0.000 52.167 ( -0.000 -0.000 0.000) 0.000 52.238 ( -0.000 0.000 0.000) 0.000 52.238 ( -0.000 0.000 -0.000) 0.000 52.773 ( -0.000 -0.000 -0.000) 0.000 52.773 ( -0.000 -0.000 0.000) 0.000 52.927 ( -0.000 0.000 -0.000) 0.000 52.927 ( -0.000 0.000 0.000) 0.000 53.930 ( -0.000 0.000 0.000) 0.000 53.930 ( -0.000 0.000 0.000) 0.000 54.124 ( -0.000 0.000 0.000) 0.000 54.124 ( -0.000 0.000 0.000) 0.000 55.814 ( -0.000 0.000 -0.000) 0.000 55.814 ( -0.000 0.000 0.000) 0.000 55.870 ( -0.000 -0.000 -0.000) 0.000 55.870 ( -0.000 0.000 0.000) 0.000 57.791 ( -0.000 -0.000 0.000) 0.000 57.791 ( -0.000 0.000 0.000) 0.000 57.946 ( -0.000 -0.000 0.000) 0.000 57.946 ( -0.000 0.000 0.000) 0.000 58.080 ( 0.000 0.000 0.000) 0.000 58.080 ( 0.000 0.000 0.000) 0.000 58.160 ( -0.000 0.000 0.000) 0.000 58.160 ( -0.000 0.000 0.000) 0.000 61.085 ( 0.000 -0.000 -0.000) 0.000 61.085 ( 0.000 0.000 0.000) 0.000 61.091 ( -0.000 0.000 0.000) 0.000 61.091 ( -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 3/46080 10.0 313.825 293.298 596.848 0.000 57.341 0.000 3/46080 20.0 87.552 117.489 111.733 0.000 9.749 0.000 3/46080 30.0 26.944 34.464 32.994 0.000 2.533 0.000 3/46080 40.0 13.193 16.292 15.492 0.000 1.198 0.000 3/46080 50.0 8.181 9.911 9.312 0.000 0.725 0.000 3/46080 60.0 5.749 6.886 6.413 0.000 0.506 0.000 3/46080 70.0 4.354 5.181 4.800 0.000 0.384 0.000 3/46080 80.0 3.466 4.112 3.796 0.000 0.309 0.000 3/46080 90.0 2.861 3.390 3.123 0.000 0.257 0.000 3/46080 100.0 2.425 2.877 2.645 0.000 0.220 0.000 3/46080 110.0 2.100 2.496 2.290 0.000 0.192 0.000 3/46080 120.0 1.849 2.205 2.018 0.000 0.171 0.000 3/46080 130.0 1.651 1.975 1.803 0.000 0.154 0.000 3/46080 140.0 1.490 1.789 1.629 0.000 0.139 0.000 3/46080 150.0 1.358 1.636 1.486 0.000 0.128 0.000 3/46080 160.0 1.248 1.508 1.366 0.000 0.118 0.000 3/46080 170.0 1.154 1.400 1.265 0.000 0.109 0.000 3/46080 180.0 1.074 1.307 1.177 0.000 0.102 0.000 3/46080 190.0 1.004 1.226 1.101 0.000 0.096 0.000 3/46080 200.0 0.943 1.155 1.034 0.000 0.090 0.000 3/46080 210.0 0.889 1.092 0.975 0.000 0.085 0.000 3/46080 220.0 0.841 1.036 0.923 0.000 0.080 0.000 3/46080 230.0 0.798 0.985 0.876 0.000 0.076 0.000 3/46080 240.0 0.759 0.940 0.833 0.000 0.073 0.000 3/46080 250.0 0.724 0.899 0.795 0.000 0.069 0.000 3/46080 260.0 0.693 0.861 0.760 0.000 0.066 0.000 3/46080 270.0 0.664 0.827 0.728 0.000 0.064 0.000 3/46080 280.0 0.637 0.795 0.698 0.000 0.061 0.000 3/46080 290.0 0.613 0.766 0.671 0.000 0.059 0.000 3/46080 300.0 0.590 0.739 0.646 0.000 0.056 0.000 3/46080 310.0 0.569 0.713 0.623 0.000 0.054 0.000 3/46080 320.0 0.549 0.690 0.602 0.000 0.053 0.000 3/46080 330.0 0.531 0.668 0.581 0.000 0.051 0.000 3/46080 340.0 0.514 0.648 0.563 0.000 0.049 0.000 3/46080 350.0 0.498 0.628 0.545 0.000 0.048 0.000 3/46080 360.0 0.484 0.610 0.529 0.000 0.046 0.000 3/46080 370.0 0.470 0.593 0.513 0.000 0.045 0.000 3/46080 380.0 0.456 0.577 0.499 0.000 0.043 0.000 3/46080 390.0 0.444 0.562 0.485 0.000 0.042 0.000 3/46080 400.0 0.432 0.548 0.472 0.000 0.041 0.000 3/46080 410.0 0.421 0.534 0.460 0.000 0.040 0.000 3/46080 420.0 0.410 0.521 0.448 0.000 0.039 0.000 3/46080 430.0 0.400 0.509 0.437 0.000 0.038 0.000 3/46080 440.0 0.391 0.497 0.426 0.000 0.037 0.000 3/46080 450.0 0.382 0.486 0.416 0.000 0.036 0.000 3/46080 460.0 0.373 0.475 0.407 0.000 0.035 0.000 3/46080 470.0 0.365 0.465 0.398 0.000 0.035 0.000 3/46080 480.0 0.357 0.455 0.389 0.000 0.034 0.000 3/46080 490.0 0.350 0.446 0.381 0.000 0.033 0.000 3/46080 500.0 0.342 0.437 0.373 0.000 0.032 0.000 3/46080 510.0 0.335 0.429 0.365 0.000 0.032 0.000 3/46080 520.0 0.329 0.420 0.358 0.000 0.031 0.000 3/46080 530.0 0.322 0.412 0.351 0.000 0.030 0.000 3/46080 540.0 0.316 0.405 0.344 0.000 0.030 0.000 3/46080 550.0 0.310 0.398 0.338 0.000 0.029 0.000 3/46080 560.0 0.305 0.391 0.332 0.000 0.029 0.000 3/46080 570.0 0.299 0.384 0.326 0.000 0.028 0.000 3/46080 580.0 0.294 0.377 0.320 0.000 0.028 0.000 3/46080 590.0 0.289 0.371 0.314 0.000 0.027 0.000 3/46080 600.0 0.284 0.365 0.309 0.000 0.027 0.000 3/46080 610.0 0.279 0.359 0.304 0.000 0.026 0.000 3/46080 620.0 0.275 0.353 0.299 0.000 0.026 0.000 3/46080 630.0 0.270 0.348 0.294 0.000 0.025 0.000 3/46080 640.0 0.266 0.343 0.289 0.000 0.025 0.000 3/46080 650.0 0.262 0.337 0.285 0.000 0.025 0.000 3/46080 660.0 0.258 0.332 0.280 0.000 0.024 0.000 3/46080 670.0 0.254 0.328 0.276 0.000 0.024 0.000 3/46080 680.0 0.250 0.323 0.272 0.000 0.024 0.000 3/46080 690.0 0.247 0.318 0.268 0.000 0.023 0.000 3/46080 700.0 0.243 0.314 0.264 0.000 0.023 0.000 3/46080 710.0 0.240 0.310 0.260 0.000 0.022 0.000 3/46080 720.0 0.236 0.305 0.257 0.000 0.022 0.000 3/46080 730.0 0.233 0.301 0.253 0.000 0.022 0.000 3/46080 740.0 0.230 0.297 0.250 0.000 0.022 0.000 3/46080 750.0 0.227 0.294 0.246 0.000 0.021 0.000 3/46080 760.0 0.224 0.290 0.243 0.000 0.021 0.000 3/46080 770.0 0.221 0.286 0.240 0.000 0.021 0.000 3/46080 780.0 0.218 0.283 0.237 0.000 0.020 0.000 3/46080 790.0 0.215 0.279 0.234 0.000 0.020 0.000 3/46080 800.0 0.213 0.276 0.231 0.000 0.020 0.000 3/46080 810.0 0.210 0.273 0.228 0.000 0.020 0.000 3/46080 820.0 0.208 0.269 0.225 0.000 0.019 0.000 3/46080 830.0 0.205 0.266 0.223 0.000 0.019 0.000 3/46080 840.0 0.203 0.263 0.220 0.000 0.019 0.000 3/46080 850.0 0.200 0.260 0.217 0.000 0.019 0.000 3/46080 860.0 0.198 0.257 0.215 0.000 0.018 0.000 3/46080 870.0 0.196 0.254 0.212 0.000 0.018 0.000 3/46080 880.0 0.194 0.252 0.210 0.000 0.018 0.000 3/46080 890.0 0.191 0.249 0.208 0.000 0.018 0.000 3/46080 900.0 0.189 0.246 0.205 0.000 0.018 0.000 3/46080 910.0 0.187 0.244 0.203 0.000 0.017 0.000 3/46080 920.0 0.185 0.241 0.201 0.000 0.017 0.000 3/46080 930.0 0.183 0.239 0.199 0.000 0.017 0.000 3/46080 940.0 0.181 0.236 0.197 0.000 0.017 0.000 3/46080 950.0 0.179 0.234 0.195 0.000 0.017 0.000 3/46080 960.0 0.178 0.231 0.192 0.000 0.017 0.000 3/46080 970.0 0.176 0.229 0.191 0.000 0.016 0.000 3/46080 980.0 0.174 0.227 0.189 0.000 0.016 0.000 3/46080 990.0 0.172 0.225 0.187 0.000 0.016 0.000 3/46080 1000.0 0.171 0.223 0.185 0.000 0.016 0.000 3/46080 Thermal conductivity related properties were written into "kappa-m884.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 19:58:32]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|