----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 13:45:33]------------------------- Compiled with OpenMP support (max 48 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: Pna2_1 (33) Number of symmetry operations in supercell: 8 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.205163960000000 0.000000000000000 0.000000000000000 b 0.000000000000000 8.850515449999998 0.000000000000000 c 0.000000000000000 0.000000000000000 9.182540410000000 Atomic positions (fractional): *1 Mg 0.71777248478757 0.15340939076783 0.49797387305183 24.305 *2 Mg 0.71752496290597 0.51047343003365 0.50443157603560 24.305 3 Mg 0.78222751521243 0.65340939076783 0.99797387305183 24.305 4 Mg 0.28222751521243 0.84659060923217 0.99797387305183 24.305 5 Mg 0.28247503709403 0.48952656996635 0.00443157603560 24.305 6 Mg 0.78247503709403 0.01047343003365 0.00443157603560 24.305 7 Mg 0.21752496290597 0.98952656996635 0.50443157603560 24.305 8 Mg 0.21777248478757 0.34659060923217 0.49797387305183 24.305 *9 Si 0.86682721376235 0.33942494949883 0.20204287111370 28.085 10 Si 0.36682721376235 0.16057505050117 0.20204287111370 28.085 *11 Si 0.56847525196321 0.33860422576354 0.79687647489483 28.085 12 Si 0.13317278623765 0.66057505050117 0.70204287111370 28.085 13 Si 0.43152474803679 0.66139577423646 0.29687647489483 28.085 14 Si 0.93152474803679 0.83860422576354 0.29687647489483 28.085 15 Si 0.63317278623765 0.83942494949883 0.70204287111370 28.085 16 Si 0.06847525196321 0.16139577423646 0.79687647489483 28.085 *17 O 0.46050925301487 0.00923463932078 0.12097743008725 15.999 *18 O 0.56920589272865 0.29684625438727 0.14625657658151 15.999 19 O 0.96050925301487 0.49076536067922 0.12097743008725 15.999 *20 O 0.05948117065322 0.16361379707287 0.62013066038905 15.999 *21 O 0.89748705600561 0.99686950188887 0.37774561271054 15.999 *22 O 0.62056250802590 0.84100219866331 0.87954966409373 15.999 23 O 0.55948117065322 0.33638620292713 0.62013066038905 15.999 *24 O 0.22317334574035 0.78881936563002 0.35801530104195 15.999 25 O 0.87943749197410 0.34100219866331 0.37954966409373 15.999 26 O 0.43079410727135 0.70315374561273 0.64625657658151 15.999 27 O 0.27682665425965 0.28881936563002 0.85801530104195 15.999 28 O 0.39748705600561 0.50313049811113 0.37774561271054 15.999 29 O 0.37943749197410 0.15899780133669 0.37954966409373 15.999 30 O 0.12056250802590 0.65899780133669 0.87954966409373 15.999 31 O 0.44051882934678 0.66361379707287 0.12013066038905 15.999 32 O 0.94051882934678 0.83638620292713 0.12013066038905 15.999 33 O 0.93079410727135 0.79684625438727 0.64625657658151 15.999 34 O 0.06920589272865 0.20315374561273 0.14625657658151 15.999 35 O 0.10251294399439 0.00313049811113 0.87774561271054 15.999 36 O 0.60251294399439 0.49686950188887 0.87774561271054 15.999 37 O 0.72317334574035 0.71118063436998 0.35801530104195 15.999 38 O 0.03949074698513 0.50923463932078 0.62097743008725 15.999 39 O 0.77682665425965 0.21118063436998 0.85801530104195 15.999 40 O 0.53949074698513 0.99076536067922 0.62097743008725 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.205163960000000 0.000000000000000 0.000000000000000 b 0.000000000000000 8.850515449999998 0.000000000000000 c 0.000000000000000 0.000000000000000 9.182540410000000 Atomic positions (fractional): *1 Mg 0.71777248478757 0.15340939076783 0.49797387305183 24.305 > 1 *2 Mg 0.71752496290597 0.51047343003365 0.50443157603560 24.305 > 2 3 Mg 0.78222751521243 0.65340939076783 0.99797387305183 24.305 > 3 4 Mg 0.28222751521243 0.84659060923217 0.99797387305183 24.305 > 4 5 Mg 0.28247503709403 0.48952656996635 0.00443157603560 24.305 > 5 6 Mg 0.78247503709403 0.01047343003365 0.00443157603560 24.305 > 6 7 Mg 0.21752496290597 0.98952656996635 0.50443157603560 24.305 > 7 8 Mg 0.21777248478757 0.34659060923217 0.49797387305183 24.305 > 8 *9 Si 0.86682721376235 0.33942494949883 0.20204287111370 28.085 > 9 10 Si 0.36682721376235 0.16057505050117 0.20204287111370 28.085 > 10 *11 Si 0.56847525196321 0.33860422576354 0.79687647489483 28.085 > 11 12 Si 0.13317278623765 0.66057505050117 0.70204287111370 28.085 > 12 13 Si 0.43152474803679 0.66139577423646 0.29687647489483 28.085 > 13 14 Si 0.93152474803679 0.83860422576354 0.29687647489483 28.085 > 14 15 Si 0.63317278623765 0.83942494949883 0.70204287111370 28.085 > 15 16 Si 0.06847525196321 0.16139577423646 0.79687647489483 28.085 > 16 *17 O 0.46050925301487 0.00923463932078 0.12097743008725 15.999 > 17 *18 O 0.56920589272865 0.29684625438727 0.14625657658151 15.999 > 18 19 O 0.96050925301487 0.49076536067922 0.12097743008725 15.999 > 19 *20 O 0.05948117065322 0.16361379707287 0.62013066038905 15.999 > 20 *21 O 0.89748705600561 0.99686950188887 0.37774561271054 15.999 > 21 *22 O 0.62056250802590 0.84100219866331 0.87954966409373 15.999 > 22 23 O 0.55948117065322 0.33638620292713 0.62013066038905 15.999 > 23 *24 O 0.22317334574035 0.78881936563002 0.35801530104195 15.999 > 24 25 O 0.87943749197410 0.34100219866331 0.37954966409373 15.999 > 25 26 O 0.43079410727135 0.70315374561273 0.64625657658151 15.999 > 26 27 O 0.27682665425965 0.28881936563002 0.85801530104195 15.999 > 27 28 O 0.39748705600561 0.50313049811113 0.37774561271054 15.999 > 28 29 O 0.37943749197410 0.15899780133669 0.37954966409373 15.999 > 29 30 O 0.12056250802590 0.65899780133669 0.87954966409373 15.999 > 30 31 O 0.44051882934678 0.66361379707287 0.12013066038905 15.999 > 31 32 O 0.94051882934678 0.83638620292713 0.12013066038905 15.999 > 32 33 O 0.93079410727135 0.79684625438727 0.64625657658151 15.999 > 33 34 O 0.06920589272865 0.20315374561273 0.14625657658151 15.999 > 34 35 O 0.10251294399439 0.00313049811113 0.87774561271054 15.999 > 35 36 O 0.60251294399439 0.49686950188887 0.87774561271054 15.999 > 36 37 O 0.72317334574035 0.71118063436998 0.35801530104195 15.999 > 37 38 O 0.03949074698513 0.50923463932078 0.62097743008725 15.999 > 38 39 O 0.77682665425965 0.21118063436998 0.85801530104195 15.999 > 39 40 O 0.53949074698513 0.99076536067922 0.62097743008725 15.999 > 40 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.410327920000000 0.000000000000000 0.000000000000000 b 0.000000000000000 8.850515449999998 0.000000000000000 c 0.000000000000000 0.000000000000000 9.182540410000000 Atomic positions (fractional): *1 Mg 0.35888624239378 0.15340939076783 0.49797387305183 24.305 > 1 2 Mg 0.85888624239378 0.15340939076783 0.49797387305183 24.305 > 1 *3 Mg 0.35876248145299 0.51047343003365 0.50443157603560 24.305 > 2 4 Mg 0.85876248145299 0.51047343003365 0.50443157603560 24.305 > 2 5 Mg 0.39111375760622 0.65340939076783 0.99797387305183 24.305 > 3 6 Mg 0.89111375760622 0.65340939076783 0.99797387305183 24.305 > 3 7 Mg 0.14111375760622 0.84659060923217 0.99797387305183 24.305 > 4 8 Mg 0.64111375760622 0.84659060923217 0.99797387305183 24.305 > 4 9 Mg 0.14123751854701 0.48952656996635 0.00443157603560 24.305 > 5 10 Mg 0.64123751854701 0.48952656996635 0.00443157603560 24.305 > 5 11 Mg 0.39123751854701 0.01047343003365 0.00443157603560 24.305 > 6 12 Mg 0.89123751854701 0.01047343003365 0.00443157603560 24.305 > 6 13 Mg 0.10876248145299 0.98952656996635 0.50443157603560 24.305 > 7 14 Mg 0.60876248145299 0.98952656996635 0.50443157603560 24.305 > 7 15 Mg 0.10888624239378 0.34659060923217 0.49797387305183 24.305 > 8 16 Mg 0.60888624239378 0.34659060923217 0.49797387305183 24.305 > 8 *17 Si 0.43341360688117 0.33942494949883 0.20204287111370 28.085 > 9 18 Si 0.93341360688117 0.33942494949883 0.20204287111370 28.085 > 9 19 Si 0.18341360688117 0.16057505050117 0.20204287111370 28.085 > 10 20 Si 0.68341360688117 0.16057505050117 0.20204287111370 28.085 > 10 *21 Si 0.28423762598161 0.33860422576354 0.79687647489483 28.085 > 11 22 Si 0.78423762598161 0.33860422576354 0.79687647489483 28.085 > 11 23 Si 0.06658639311883 0.66057505050117 0.70204287111370 28.085 > 12 24 Si 0.56658639311883 0.66057505050117 0.70204287111370 28.085 > 12 25 Si 0.21576237401839 0.66139577423646 0.29687647489483 28.085 > 13 26 Si 0.71576237401839 0.66139577423646 0.29687647489483 28.085 > 13 27 Si 0.46576237401839 0.83860422576354 0.29687647489483 28.085 > 14 28 Si 0.96576237401839 0.83860422576354 0.29687647489483 28.085 > 14 29 Si 0.31658639311883 0.83942494949883 0.70204287111370 28.085 > 15 30 Si 0.81658639311883 0.83942494949883 0.70204287111370 28.085 > 15 31 Si 0.03423762598161 0.16139577423646 0.79687647489483 28.085 > 16 32 Si 0.53423762598161 0.16139577423646 0.79687647489483 28.085 > 16 *33 O 0.23025462650744 0.00923463932078 0.12097743008725 15.999 > 17 34 O 0.73025462650744 0.00923463932078 0.12097743008725 15.999 > 17 *35 O 0.28460294636432 0.29684625438727 0.14625657658151 15.999 > 18 36 O 0.78460294636432 0.29684625438727 0.14625657658151 15.999 > 18 37 O 0.48025462650744 0.49076536067922 0.12097743008725 15.999 > 19 38 O 0.98025462650744 0.49076536067922 0.12097743008725 15.999 > 19 *39 O 0.02974058532661 0.16361379707287 0.62013066038905 15.999 > 20 40 O 0.52974058532661 0.16361379707287 0.62013066038905 15.999 > 20 *41 O 0.44874352800281 0.99686950188887 0.37774561271054 15.999 > 21 42 O 0.94874352800281 0.99686950188887 0.37774561271054 15.999 > 21 *43 O 0.31028125401295 0.84100219866331 0.87954966409373 15.999 > 22 44 O 0.81028125401295 0.84100219866331 0.87954966409373 15.999 > 22 45 O 0.27974058532661 0.33638620292713 0.62013066038905 15.999 > 23 46 O 0.77974058532661 0.33638620292713 0.62013066038905 15.999 > 23 *47 O 0.11158667287018 0.78881936563002 0.35801530104195 15.999 > 24 48 O 0.61158667287018 0.78881936563002 0.35801530104195 15.999 > 24 49 O 0.43971874598705 0.34100219866331 0.37954966409373 15.999 > 25 50 O 0.93971874598705 0.34100219866331 0.37954966409373 15.999 > 25 51 O 0.21539705363568 0.70315374561273 0.64625657658151 15.999 > 26 52 O 0.71539705363568 0.70315374561273 0.64625657658151 15.999 > 26 53 O 0.13841332712982 0.28881936563002 0.85801530104195 15.999 > 27 54 O 0.63841332712982 0.28881936563002 0.85801530104195 15.999 > 27 55 O 0.19874352800281 0.50313049811113 0.37774561271054 15.999 > 28 56 O 0.69874352800281 0.50313049811113 0.37774561271054 15.999 > 28 57 O 0.18971874598705 0.15899780133669 0.37954966409373 15.999 > 29 58 O 0.68971874598705 0.15899780133669 0.37954966409373 15.999 > 29 59 O 0.06028125401295 0.65899780133669 0.87954966409373 15.999 > 30 60 O 0.56028125401295 0.65899780133669 0.87954966409373 15.999 > 30 61 O 0.22025941467339 0.66361379707287 0.12013066038905 15.999 > 31 62 O 0.72025941467339 0.66361379707287 0.12013066038905 15.999 > 31 63 O 0.47025941467339 0.83638620292713 0.12013066038905 15.999 > 32 64 O 0.97025941467339 0.83638620292713 0.12013066038905 15.999 > 32 65 O 0.46539705363568 0.79684625438727 0.64625657658151 15.999 > 33 66 O 0.96539705363568 0.79684625438727 0.64625657658151 15.999 > 33 67 O 0.03460294636432 0.20315374561273 0.14625657658151 15.999 > 34 68 O 0.53460294636432 0.20315374561273 0.14625657658151 15.999 > 34 69 O 0.05125647199719 0.00313049811113 0.87774561271054 15.999 > 35 70 O 0.55125647199719 0.00313049811113 0.87774561271054 15.999 > 35 71 O 0.30125647199719 0.49686950188887 0.87774561271054 15.999 > 36 72 O 0.80125647199719 0.49686950188887 0.87774561271054 15.999 > 36 73 O 0.36158667287018 0.71118063436998 0.35801530104195 15.999 > 37 74 O 0.86158667287018 0.71118063436998 0.35801530104195 15.999 > 37 75 O 0.01974537349256 0.50923463932078 0.62097743008725 15.999 > 38 76 O 0.51974537349256 0.50923463932078 0.62097743008725 15.999 > 38 77 O 0.38841332712982 0.21118063436998 0.85801530104195 15.999 > 39 78 O 0.88841332712982 0.21118063436998 0.85801530104195 15.999 > 39 79 O 0.26974537349256 0.99076536067922 0.62097743008725 15.999 > 40 80 O 0.76974537349256 0.99076536067922 0.62097743008725 15.999 > 40 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.9191071 0.0000000 0.0000000 0.0000000 2.8926143 0.0000000 0.0000000 0.0000000 2.8918905 -------------------------- Born effective charges -------------------------- 1 Mg 2.0577749 -0.0214093 -0.0100069 -0.0283755 2.2014604 -0.0024657 0.0139763 -0.0001218 2.1989431 2 Mg 2.0206758 -0.0825751 0.0417534 -0.0544504 2.1266033 -0.0155905 0.0526341 -0.0244266 2.2119987 3 Mg 2.0577749 0.0214093 0.0100069 0.0283755 2.2014604 -0.0024657 -0.0139763 -0.0001218 2.1989431 4 Mg 2.0577749 -0.0214093 0.0100069 -0.0283755 2.2014604 0.0024657 -0.0139763 0.0001218 2.1989431 5 Mg 2.0206758 -0.0825751 -0.0417534 -0.0544504 2.1266033 0.0155905 -0.0526341 0.0244266 2.2119987 6 Mg 2.0206758 0.0825751 -0.0417534 0.0544504 2.1266033 -0.0155905 -0.0526341 -0.0244266 2.2119987 7 Mg 2.0206758 0.0825751 0.0417534 0.0544504 2.1266033 0.0155905 0.0526341 0.0244266 2.2119987 8 Mg 2.0577749 0.0214093 -0.0100069 0.0283755 2.2014604 0.0024657 0.0139763 0.0001218 2.1989431 9 Si 3.4013282 -0.1601894 -0.0622048 0.0660370 2.9510863 0.0268899 -0.0509048 -0.1378619 2.9640113 10 Si 3.4013282 0.1601894 -0.0622048 -0.0660370 2.9510863 -0.0268899 -0.0509048 0.1378619 2.9640113 11 Si 3.2888074 -0.2347459 -0.0029471 -0.0114135 3.0264635 -0.0390489 0.0079976 0.1670885 3.0029922 12 Si 3.4013282 -0.1601894 0.0622048 0.0660370 2.9510863 -0.0268899 0.0509048 0.1378619 2.9640113 13 Si 3.2888074 -0.2347459 0.0029471 -0.0114135 3.0264635 0.0390489 -0.0079976 -0.1670885 3.0029922 14 Si 3.2888074 0.2347459 0.0029471 0.0114135 3.0264635 -0.0390489 -0.0079976 0.1670885 3.0029922 15 Si 3.4013282 0.1601894 0.0622048 -0.0660370 2.9510863 0.0268899 0.0509048 -0.1378619 2.9640113 16 Si 3.2888074 0.2347459 -0.0029471 0.0114135 3.0264635 0.0390489 0.0079976 -0.1670885 3.0029922 17 O -1.6049361 0.0561687 0.1366853 0.1620836 -1.9192516 -0.3903769 0.1494251 -0.3815948 -1.5770369 18 O -2.3598386 -0.5732409 -0.0844651 -0.5517998 -1.6732121 0.0981640 -0.1015031 0.1412885 -1.3482526 19 O -1.6049361 -0.0561687 0.1366853 -0.1620836 -1.9192516 0.3903769 0.1494251 0.3815948 -1.5770369 20 O -1.5281921 -0.0294038 -0.0165014 -0.0018487 -1.5436482 -0.0819647 -0.0303352 0.0166864 -2.2030372 21 O -1.4982459 0.1006139 0.0136060 0.1060601 -1.9429504 -0.3733531 0.0012553 -0.3677117 -1.6240425 22 O -1.5456160 -0.0471457 0.0117302 -0.0094323 -1.5199337 -0.1038646 0.0235377 -0.0042174 -2.2135860 23 O -1.5281921 0.0294038 -0.0165014 0.0018487 -1.5436482 0.0819647 -0.0303352 -0.0166864 -2.2030372 24 O -2.2317577 0.7182264 -0.0288459 0.6376101 -1.7066177 -0.1878220 -0.0364430 -0.2065150 -1.4119902 25 O -1.5456160 0.0471457 -0.0117302 0.0094323 -1.5199337 -0.1038646 -0.0235377 -0.0042174 -2.2135860 26 O -2.3598386 -0.5732409 0.0844651 -0.5517998 -1.6732121 -0.0981640 0.1015031 -0.1412885 -1.3482526 27 O -2.2317577 -0.7182264 0.0288459 -0.6376101 -1.7066177 -0.1878220 0.0364430 -0.2065150 -1.4119902 28 O -1.4982459 -0.1006139 0.0136060 -0.1060601 -1.9429504 0.3733531 0.0012553 0.3677117 -1.6240425 29 O -1.5456160 -0.0471457 -0.0117302 -0.0094323 -1.5199337 0.1038646 -0.0235377 0.0042174 -2.2135860 30 O -1.5456160 0.0471457 0.0117302 0.0094323 -1.5199337 0.1038646 0.0235377 0.0042174 -2.2135860 31 O -1.5281921 0.0294038 0.0165014 0.0018487 -1.5436482 -0.0819647 0.0303352 0.0166864 -2.2030372 32 O -1.5281921 -0.0294038 0.0165014 -0.0018487 -1.5436482 0.0819647 0.0303352 -0.0166864 -2.2030372 33 O -2.3598386 0.5732409 0.0844651 0.5517998 -1.6732121 0.0981640 0.1015031 0.1412885 -1.3482526 34 O -2.3598386 0.5732409 -0.0844651 0.5517998 -1.6732121 -0.0981640 -0.1015031 -0.1412885 -1.3482526 35 O -1.4982459 0.1006139 -0.0136060 0.1060601 -1.9429504 0.3733531 -0.0012553 0.3677117 -1.6240425 36 O -1.4982459 -0.1006139 -0.0136060 -0.1060601 -1.9429504 -0.3733531 -0.0012553 -0.3677117 -1.6240425 37 O -2.2317577 -0.7182264 -0.0288459 -0.6376101 -1.7066177 0.1878220 -0.0364430 0.2065150 -1.4119902 38 O -1.6049361 -0.0561687 -0.1366853 -0.1620836 -1.9192516 -0.3903769 -0.1494251 -0.3815948 -1.5770369 39 O -2.2317577 0.7182264 0.0288459 0.6376101 -1.7066177 0.1878220 0.0364430 0.2065150 -1.4119902 40 O -1.6049361 0.0561687 -0.1366853 0.1620836 -1.9192516 0.3903769 -0.1494251 0.3815948 -1.5770369 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 240/240 Permutation basis: 14520/14520 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3690 Number of blocks in projector: 3690 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 231 eigenvectors found. (2) Complementary block size: 39 (2) Compute compressed projector. (2) Use standard solver. (2) 19 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 280 eigenvectors found. (1) Complementary block size: 40 (1) Compute compressed projector. (1) Use standard solver. (1) 20 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 280 eigenvectors found. (1) Complementary block size: 40 (1) Compute compressed projector. (1) Use standard solver. (1) 20 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 281 eigenvectors found. (1) Complementary block size: 39 (1) Compute compressed projector. (1) Use standard solver. (1) 19 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 430 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 430 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 430 Use standard eigh solver. Tree of FC basis block matrices: - (3690, 3600), data: False |-- (430, 420), data: True |-- (430, 420), data: True |-- (430, 420), data: True |-- (800, 780), data: False |-- (800, 19), data: (800, 39) @ (39, 19) |-- (300, 281), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True |-- (800, 780), data: False |-- (800, 20), data: (800, 40) @ (40, 20) |-- (300, 280), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True |-- (800, 780), data: False |-- (800, 20), data: (800, 40) @ (40, 20) |-- (300, 280), data: True |-- (500, 480), data: False |-- (500, 19), data: (500, 39) @ (39, 19) |-- (250, 231), data: True |-- (250, 230), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 1200 - Time: 0.937 Solver_block: 200 / 1200 - Time: 0.873 Solver_block: 300 / 1200 - Time: 0.876 Solver_block: 400 / 1200 - Time: 0.879 Solver_block: 500 / 1200 - Time: 0.895 Solver_block: 600 / 1200 - Time: 0.875 Solver_block: 700 / 1200 - Time: 0.877 Solver_block: 800 / 1200 - Time: 0.874 Solver_block: 900 / 1200 - Time: 0.875 Solver_block: 1000 / 1200 - Time: 0.884 Solver_block: 1100 / 1200 - Time: 0.891 Solver_block: 1200 / 1200 - Time: 0.884 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 10.825 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) Permutation basis: 240/240 Permutation basis: 14520/14520 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3690 Number of blocks in projector: 3690 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 231 eigenvectors found. (2) Complementary block size: 39 (2) Compute compressed projector. (2) Use standard solver. (2) 19 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 280 eigenvectors found. (1) Complementary block size: 40 (1) Compute compressed projector. (1) Use standard solver. (1) 20 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 280 eigenvectors found. (1) Complementary block size: 40 (1) Compute compressed projector. (1) Use standard solver. (1) 20 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 281 eigenvectors found. (1) Complementary block size: 39 (1) Compute compressed projector. (1) Use standard solver. (1) 19 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 430 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 430 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 430 Use standard eigh solver. Tree of FC basis block matrices: - (3690, 3600), data: False |-- (430, 420), data: True |-- (430, 420), data: True |-- (430, 420), data: True |-- (800, 780), data: False |-- (800, 19), data: (800, 39) @ (39, 19) |-- (300, 281), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True |-- (800, 780), data: False |-- (800, 20), data: (800, 40) @ (40, 20) |-- (300, 280), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True |-- (800, 780), data: False |-- (800, 20), data: (800, 40) @ (40, 20) |-- (300, 280), data: True |-- (500, 480), data: False |-- (500, 19), data: (500, 39) @ (39, 19) |-- (250, 231), data: True |-- (250, 230), 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 13:46:26]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 13:46:26]------------------------- Compiled with OpenMP support (max 48 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: Pna2_1 (33) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.205163960000000 0.000000000000000 0.000000000000000 b 0.000000000000000 8.850515449999998 0.000000000000000 c 0.000000000000000 0.000000000000000 9.182540410000000 Atomic positions (fractional): 1 Mg 0.71777248478757 0.15340939076783 0.49797387305183 24.305 2 Mg 0.71752496290597 0.51047343003365 0.50443157603560 24.305 3 Mg 0.78222751521243 0.65340939076783 0.99797387305183 24.305 4 Mg 0.28222751521243 0.84659060923217 0.99797387305183 24.305 5 Mg 0.28247503709403 0.48952656996635 0.00443157603560 24.305 6 Mg 0.78247503709403 0.01047343003365 0.00443157603560 24.305 7 Mg 0.21752496290597 0.98952656996635 0.50443157603560 24.305 8 Mg 0.21777248478757 0.34659060923217 0.49797387305183 24.305 9 Si 0.86682721376235 0.33942494949883 0.20204287111370 28.085 10 Si 0.36682721376235 0.16057505050117 0.20204287111370 28.085 11 Si 0.56847525196321 0.33860422576354 0.79687647489483 28.085 12 Si 0.13317278623765 0.66057505050117 0.70204287111370 28.085 13 Si 0.43152474803679 0.66139577423646 0.29687647489483 28.085 14 Si 0.93152474803679 0.83860422576354 0.29687647489483 28.085 15 Si 0.63317278623765 0.83942494949883 0.70204287111370 28.085 16 Si 0.06847525196321 0.16139577423646 0.79687647489483 28.085 17 O 0.46050925301487 0.00923463932078 0.12097743008725 15.999 18 O 0.56920589272865 0.29684625438727 0.14625657658151 15.999 19 O 0.96050925301487 0.49076536067922 0.12097743008725 15.999 20 O 0.05948117065322 0.16361379707287 0.62013066038905 15.999 21 O 0.89748705600561 0.99686950188887 0.37774561271054 15.999 22 O 0.62056250802590 0.84100219866331 0.87954966409373 15.999 23 O 0.55948117065322 0.33638620292713 0.62013066038905 15.999 24 O 0.22317334574035 0.78881936563002 0.35801530104195 15.999 25 O 0.87943749197410 0.34100219866331 0.37954966409373 15.999 26 O 0.43079410727135 0.70315374561273 0.64625657658151 15.999 27 O 0.27682665425965 0.28881936563002 0.85801530104195 15.999 28 O 0.39748705600561 0.50313049811113 0.37774561271054 15.999 29 O 0.37943749197410 0.15899780133669 0.37954966409373 15.999 30 O 0.12056250802590 0.65899780133669 0.87954966409373 15.999 31 O 0.44051882934678 0.66361379707287 0.12013066038905 15.999 32 O 0.94051882934678 0.83638620292713 0.12013066038905 15.999 33 O 0.93079410727135 0.79684625438727 0.64625657658151 15.999 34 O 0.06920589272865 0.20315374561273 0.14625657658151 15.999 35 O 0.10251294399439 0.00313049811113 0.87774561271054 15.999 36 O 0.60251294399439 0.49686950188887 0.87774561271054 15.999 37 O 0.72317334574035 0.71118063436998 0.35801530104195 15.999 38 O 0.03949074698513 0.50923463932078 0.62097743008725 15.999 39 O 0.77682665425965 0.21118063436998 0.85801530104195 15.999 40 O 0.53949074698513 0.99076536067922 0.62097743008725 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.410327920000000 0.000000000000000 0.000000000000000 b 0.000000000000000 8.850515449999998 0.000000000000000 c 0.000000000000000 0.000000000000000 9.182540410000000 Atomic positions (fractional): 1 Mg 0.35888624239378 0.15340939076783 0.49797387305183 24.305 > 1 2 Mg 0.85888624239378 0.15340939076783 0.49797387305183 24.305 > 1 3 Mg 0.35876248145299 0.51047343003365 0.50443157603560 24.305 > 3 4 Mg 0.85876248145299 0.51047343003365 0.50443157603560 24.305 > 3 5 Mg 0.39111375760622 0.65340939076783 0.99797387305183 24.305 > 5 6 Mg 0.89111375760622 0.65340939076783 0.99797387305183 24.305 > 5 7 Mg 0.14111375760622 0.84659060923217 0.99797387305183 24.305 > 7 8 Mg 0.64111375760622 0.84659060923217 0.99797387305183 24.305 > 7 9 Mg 0.14123751854701 0.48952656996635 0.00443157603560 24.305 > 9 10 Mg 0.64123751854701 0.48952656996635 0.00443157603560 24.305 > 9 11 Mg 0.39123751854701 0.01047343003365 0.00443157603560 24.305 > 11 12 Mg 0.89123751854701 0.01047343003365 0.00443157603560 24.305 > 11 13 Mg 0.10876248145299 0.98952656996635 0.50443157603560 24.305 > 13 14 Mg 0.60876248145299 0.98952656996635 0.50443157603560 24.305 > 13 15 Mg 0.10888624239378 0.34659060923217 0.49797387305183 24.305 > 15 16 Mg 0.60888624239378 0.34659060923217 0.49797387305183 24.305 > 15 17 Si 0.43341360688117 0.33942494949883 0.20204287111370 28.085 > 17 18 Si 0.93341360688117 0.33942494949883 0.20204287111370 28.085 > 17 19 Si 0.18341360688117 0.16057505050117 0.20204287111370 28.085 > 19 20 Si 0.68341360688117 0.16057505050117 0.20204287111370 28.085 > 19 21 Si 0.28423762598161 0.33860422576354 0.79687647489483 28.085 > 21 22 Si 0.78423762598161 0.33860422576354 0.79687647489483 28.085 > 21 23 Si 0.06658639311883 0.66057505050117 0.70204287111370 28.085 > 23 24 Si 0.56658639311883 0.66057505050117 0.70204287111370 28.085 > 23 25 Si 0.21576237401839 0.66139577423646 0.29687647489483 28.085 > 25 26 Si 0.71576237401839 0.66139577423646 0.29687647489483 28.085 > 25 27 Si 0.46576237401839 0.83860422576354 0.29687647489483 28.085 > 27 28 Si 0.96576237401839 0.83860422576354 0.29687647489483 28.085 > 27 29 Si 0.31658639311883 0.83942494949883 0.70204287111370 28.085 > 29 30 Si 0.81658639311883 0.83942494949883 0.70204287111370 28.085 > 29 31 Si 0.03423762598161 0.16139577423646 0.79687647489483 28.085 > 31 32 Si 0.53423762598161 0.16139577423646 0.79687647489483 28.085 > 31 33 O 0.23025462650744 0.00923463932078 0.12097743008725 15.999 > 33 34 O 0.73025462650744 0.00923463932078 0.12097743008725 15.999 > 33 35 O 0.28460294636432 0.29684625438727 0.14625657658151 15.999 > 35 36 O 0.78460294636432 0.29684625438727 0.14625657658151 15.999 > 35 37 O 0.48025462650744 0.49076536067922 0.12097743008725 15.999 > 37 38 O 0.98025462650744 0.49076536067922 0.12097743008725 15.999 > 37 39 O 0.02974058532661 0.16361379707287 0.62013066038905 15.999 > 39 40 O 0.52974058532661 0.16361379707287 0.62013066038905 15.999 > 39 41 O 0.44874352800281 0.99686950188887 0.37774561271054 15.999 > 41 42 O 0.94874352800281 0.99686950188887 0.37774561271054 15.999 > 41 43 O 0.31028125401295 0.84100219866331 0.87954966409373 15.999 > 43 44 O 0.81028125401295 0.84100219866331 0.87954966409373 15.999 > 43 45 O 0.27974058532661 0.33638620292713 0.62013066038905 15.999 > 45 46 O 0.77974058532661 0.33638620292713 0.62013066038905 15.999 > 45 47 O 0.11158667287018 0.78881936563002 0.35801530104195 15.999 > 47 48 O 0.61158667287018 0.78881936563002 0.35801530104195 15.999 > 47 49 O 0.43971874598705 0.34100219866331 0.37954966409373 15.999 > 49 50 O 0.93971874598705 0.34100219866331 0.37954966409373 15.999 > 49 51 O 0.21539705363568 0.70315374561273 0.64625657658151 15.999 > 51 52 O 0.71539705363568 0.70315374561273 0.64625657658151 15.999 > 51 53 O 0.13841332712982 0.28881936563002 0.85801530104195 15.999 > 53 54 O 0.63841332712982 0.28881936563002 0.85801530104195 15.999 > 53 55 O 0.19874352800281 0.50313049811113 0.37774561271054 15.999 > 55 56 O 0.69874352800281 0.50313049811113 0.37774561271054 15.999 > 55 57 O 0.18971874598705 0.15899780133669 0.37954966409373 15.999 > 57 58 O 0.68971874598705 0.15899780133669 0.37954966409373 15.999 > 57 59 O 0.06028125401295 0.65899780133669 0.87954966409373 15.999 > 59 60 O 0.56028125401295 0.65899780133669 0.87954966409373 15.999 > 59 61 O 0.22025941467339 0.66361379707287 0.12013066038905 15.999 > 61 62 O 0.72025941467339 0.66361379707287 0.12013066038905 15.999 > 61 63 O 0.47025941467339 0.83638620292713 0.12013066038905 15.999 > 63 64 O 0.97025941467339 0.83638620292713 0.12013066038905 15.999 > 63 65 O 0.46539705363568 0.79684625438727 0.64625657658151 15.999 > 65 66 O 0.96539705363568 0.79684625438727 0.64625657658151 15.999 > 65 67 O 0.03460294636432 0.20315374561273 0.14625657658151 15.999 > 67 68 O 0.53460294636432 0.20315374561273 0.14625657658151 15.999 > 67 69 O 0.05125647199719 0.00313049811113 0.87774561271054 15.999 > 69 70 O 0.55125647199719 0.00313049811113 0.87774561271054 15.999 > 69 71 O 0.30125647199719 0.49686950188887 0.87774561271054 15.999 > 71 72 O 0.80125647199719 0.49686950188887 0.87774561271054 15.999 > 71 73 O 0.36158667287018 0.71118063436998 0.35801530104195 15.999 > 73 74 O 0.86158667287018 0.71118063436998 0.35801530104195 15.999 > 73 75 O 0.01974537349256 0.50923463932078 0.62097743008725 15.999 > 75 76 O 0.51974537349256 0.50923463932078 0.62097743008725 15.999 > 75 77 O 0.38841332712982 0.21118063436998 0.85801530104195 15.999 > 77 78 O 0.88841332712982 0.21118063436998 0.85801530104195 15.999 > 77 79 O 0.26974537349256 0.99076536067922 0.62097743008725 15.999 > 79 80 O 0.76974537349256 0.99076536067922 0.62097743008725 15.999 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.9191071 0.0000000 0.0000000 0.0000000 2.8926143 0.0000000 0.0000000 0.0000000 2.8918905 -------------------------- Born effective charges -------------------------- 1 Mg 2.0577749 -0.0214093 -0.0100069 -0.0283755 2.2014604 -0.0024657 0.0139763 -0.0001218 2.1989431 2 Mg 2.0206758 -0.0825751 0.0417534 -0.0544504 2.1266033 -0.0155905 0.0526341 -0.0244266 2.2119987 3 Mg 2.0577749 0.0214093 0.0100069 0.0283755 2.2014604 -0.0024657 -0.0139763 -0.0001218 2.1989431 4 Mg 2.0577749 -0.0214093 0.0100069 -0.0283755 2.2014604 0.0024657 -0.0139763 0.0001218 2.1989431 5 Mg 2.0206758 -0.0825751 -0.0417534 -0.0544504 2.1266033 0.0155905 -0.0526341 0.0244266 2.2119987 6 Mg 2.0206758 0.0825751 -0.0417534 0.0544504 2.1266033 -0.0155905 -0.0526341 -0.0244266 2.2119987 7 Mg 2.0206758 0.0825751 0.0417534 0.0544504 2.1266033 0.0155905 0.0526341 0.0244266 2.2119987 8 Mg 2.0577749 0.0214093 -0.0100069 0.0283755 2.2014604 0.0024657 0.0139763 0.0001218 2.1989431 9 Si 3.4013282 -0.1601894 -0.0622048 0.0660370 2.9510863 0.0268899 -0.0509048 -0.1378619 2.9640113 10 Si 3.4013282 0.1601894 -0.0622048 -0.0660370 2.9510863 -0.0268899 -0.0509048 0.1378619 2.9640113 11 Si 3.2888074 -0.2347459 -0.0029471 -0.0114135 3.0264635 -0.0390489 0.0079976 0.1670885 3.0029922 12 Si 3.4013282 -0.1601894 0.0622048 0.0660370 2.9510863 -0.0268899 0.0509048 0.1378619 2.9640113 13 Si 3.2888074 -0.2347459 0.0029471 -0.0114135 3.0264635 0.0390489 -0.0079976 -0.1670885 3.0029922 14 Si 3.2888074 0.2347459 0.0029471 0.0114135 3.0264635 -0.0390489 -0.0079976 0.1670885 3.0029922 15 Si 3.4013282 0.1601894 0.0622048 -0.0660370 2.9510863 0.0268899 0.0509048 -0.1378619 2.9640113 16 Si 3.2888074 0.2347459 -0.0029471 0.0114135 3.0264635 0.0390489 0.0079976 -0.1670885 3.0029922 17 O -1.6049361 0.0561687 0.1366853 0.1620836 -1.9192516 -0.3903769 0.1494251 -0.3815948 -1.5770369 18 O -2.3598386 -0.5732409 -0.0844651 -0.5517998 -1.6732121 0.0981640 -0.1015031 0.1412885 -1.3482526 19 O -1.6049361 -0.0561687 0.1366853 -0.1620836 -1.9192516 0.3903769 0.1494251 0.3815948 -1.5770369 20 O -1.5281921 -0.0294038 -0.0165014 -0.0018487 -1.5436482 -0.0819647 -0.0303352 0.0166864 -2.2030372 21 O -1.4982459 0.1006139 0.0136060 0.1060601 -1.9429504 -0.3733531 0.0012553 -0.3677117 -1.6240425 22 O -1.5456160 -0.0471457 0.0117302 -0.0094323 -1.5199337 -0.1038646 0.0235377 -0.0042174 -2.2135860 23 O -1.5281921 0.0294038 -0.0165014 0.0018487 -1.5436482 0.0819647 -0.0303352 -0.0166864 -2.2030372 24 O -2.2317577 0.7182264 -0.0288459 0.6376101 -1.7066177 -0.1878220 -0.0364430 -0.2065150 -1.4119902 25 O -1.5456160 0.0471457 -0.0117302 0.0094323 -1.5199337 -0.1038646 -0.0235377 -0.0042174 -2.2135860 26 O -2.3598386 -0.5732409 0.0844651 -0.5517998 -1.6732121 -0.0981640 0.1015031 -0.1412885 -1.3482526 27 O -2.2317577 -0.7182264 0.0288459 -0.6376101 -1.7066177 -0.1878220 0.0364430 -0.2065150 -1.4119902 28 O -1.4982459 -0.1006139 0.0136060 -0.1060601 -1.9429504 0.3733531 0.0012553 0.3677117 -1.6240425 29 O -1.5456160 -0.0471457 -0.0117302 -0.0094323 -1.5199337 0.1038646 -0.0235377 0.0042174 -2.2135860 30 O -1.5456160 0.0471457 0.0117302 0.0094323 -1.5199337 0.1038646 0.0235377 0.0042174 -2.2135860 31 O -1.5281921 0.0294038 0.0165014 0.0018487 -1.5436482 -0.0819647 0.0303352 0.0166864 -2.2030372 32 O -1.5281921 -0.0294038 0.0165014 -0.0018487 -1.5436482 0.0819647 0.0303352 -0.0166864 -2.2030372 33 O -2.3598386 0.5732409 0.0844651 0.5517998 -1.6732121 0.0981640 0.1015031 0.1412885 -1.3482526 34 O -2.3598386 0.5732409 -0.0844651 0.5517998 -1.6732121 -0.0981640 -0.1015031 -0.1412885 -1.3482526 35 O -1.4982459 0.1006139 -0.0136060 0.1060601 -1.9429504 0.3733531 -0.0012553 0.3677117 -1.6240425 36 O -1.4982459 -0.1006139 -0.0136060 -0.1060601 -1.9429504 -0.3733531 -0.0012553 -0.3677117 -1.6240425 37 O -2.2317577 -0.7182264 -0.0288459 -0.6376101 -1.7066177 0.1878220 -0.0364430 0.2065150 -1.4119902 38 O -1.6049361 -0.0561687 -0.1366853 -0.1620836 -1.9192516 -0.3903769 -0.1494251 -0.3815948 -1.5770369 39 O -2.2317577 0.7182264 0.0288459 0.6376101 -1.7066177 0.1878220 0.0364430 0.2065150 -1.4119902 40 O -1.6049361 0.0561687 -0.1366853 0.1620836 -1.9192516 0.3903769 -0.1494251 0.3815948 -1.5770369 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 21, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 35, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 41, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 43, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 47, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000001 (xxx) -0.00000001 (xxx) -0.00000001 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (zx) -0.00000000 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 13:46:58]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 13:46:58]------------------------- Compiled with OpenMP support (max 48 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: Pna2_1 (33) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.205163960000000 0.000000000000000 0.000000000000000 b 0.000000000000000 8.850515449999998 0.000000000000000 c 0.000000000000000 0.000000000000000 9.182540410000000 Atomic positions (fractional): 1 Mg 0.71777248478757 0.15340939076783 0.49797387305183 24.305 2 Mg 0.71752496290597 0.51047343003365 0.50443157603560 24.305 3 Mg 0.78222751521243 0.65340939076783 0.99797387305183 24.305 4 Mg 0.28222751521243 0.84659060923217 0.99797387305183 24.305 5 Mg 0.28247503709403 0.48952656996635 0.00443157603560 24.305 6 Mg 0.78247503709403 0.01047343003365 0.00443157603560 24.305 7 Mg 0.21752496290597 0.98952656996635 0.50443157603560 24.305 8 Mg 0.21777248478757 0.34659060923217 0.49797387305183 24.305 9 Si 0.86682721376235 0.33942494949883 0.20204287111370 28.085 10 Si 0.36682721376235 0.16057505050117 0.20204287111370 28.085 11 Si 0.56847525196321 0.33860422576354 0.79687647489483 28.085 12 Si 0.13317278623765 0.66057505050117 0.70204287111370 28.085 13 Si 0.43152474803679 0.66139577423646 0.29687647489483 28.085 14 Si 0.93152474803679 0.83860422576354 0.29687647489483 28.085 15 Si 0.63317278623765 0.83942494949883 0.70204287111370 28.085 16 Si 0.06847525196321 0.16139577423646 0.79687647489483 28.085 17 O 0.46050925301487 0.00923463932078 0.12097743008725 15.999 18 O 0.56920589272865 0.29684625438727 0.14625657658151 15.999 19 O 0.96050925301487 0.49076536067922 0.12097743008725 15.999 20 O 0.05948117065322 0.16361379707287 0.62013066038905 15.999 21 O 0.89748705600561 0.99686950188887 0.37774561271054 15.999 22 O 0.62056250802590 0.84100219866331 0.87954966409373 15.999 23 O 0.55948117065322 0.33638620292713 0.62013066038905 15.999 24 O 0.22317334574035 0.78881936563002 0.35801530104195 15.999 25 O 0.87943749197410 0.34100219866331 0.37954966409373 15.999 26 O 0.43079410727135 0.70315374561273 0.64625657658151 15.999 27 O 0.27682665425965 0.28881936563002 0.85801530104195 15.999 28 O 0.39748705600561 0.50313049811113 0.37774561271054 15.999 29 O 0.37943749197410 0.15899780133669 0.37954966409373 15.999 30 O 0.12056250802590 0.65899780133669 0.87954966409373 15.999 31 O 0.44051882934678 0.66361379707287 0.12013066038905 15.999 32 O 0.94051882934678 0.83638620292713 0.12013066038905 15.999 33 O 0.93079410727135 0.79684625438727 0.64625657658151 15.999 34 O 0.06920589272865 0.20315374561273 0.14625657658151 15.999 35 O 0.10251294399439 0.00313049811113 0.87774561271054 15.999 36 O 0.60251294399439 0.49686950188887 0.87774561271054 15.999 37 O 0.72317334574035 0.71118063436998 0.35801530104195 15.999 38 O 0.03949074698513 0.50923463932078 0.62097743008725 15.999 39 O 0.77682665425965 0.21118063436998 0.85801530104195 15.999 40 O 0.53949074698513 0.99076536067922 0.62097743008725 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.410327920000000 0.000000000000000 0.000000000000000 b 0.000000000000000 8.850515449999998 0.000000000000000 c 0.000000000000000 0.000000000000000 9.182540410000000 Atomic positions (fractional): 1 Mg 0.35888624239378 0.15340939076783 0.49797387305183 24.305 > 1 2 Mg 0.85888624239378 0.15340939076783 0.49797387305183 24.305 > 1 3 Mg 0.35876248145299 0.51047343003365 0.50443157603560 24.305 > 3 4 Mg 0.85876248145299 0.51047343003365 0.50443157603560 24.305 > 3 5 Mg 0.39111375760622 0.65340939076783 0.99797387305183 24.305 > 5 6 Mg 0.89111375760622 0.65340939076783 0.99797387305183 24.305 > 5 7 Mg 0.14111375760622 0.84659060923217 0.99797387305183 24.305 > 7 8 Mg 0.64111375760622 0.84659060923217 0.99797387305183 24.305 > 7 9 Mg 0.14123751854701 0.48952656996635 0.00443157603560 24.305 > 9 10 Mg 0.64123751854701 0.48952656996635 0.00443157603560 24.305 > 9 11 Mg 0.39123751854701 0.01047343003365 0.00443157603560 24.305 > 11 12 Mg 0.89123751854701 0.01047343003365 0.00443157603560 24.305 > 11 13 Mg 0.10876248145299 0.98952656996635 0.50443157603560 24.305 > 13 14 Mg 0.60876248145299 0.98952656996635 0.50443157603560 24.305 > 13 15 Mg 0.10888624239378 0.34659060923217 0.49797387305183 24.305 > 15 16 Mg 0.60888624239378 0.34659060923217 0.49797387305183 24.305 > 15 17 Si 0.43341360688117 0.33942494949883 0.20204287111370 28.085 > 17 18 Si 0.93341360688117 0.33942494949883 0.20204287111370 28.085 > 17 19 Si 0.18341360688117 0.16057505050117 0.20204287111370 28.085 > 19 20 Si 0.68341360688117 0.16057505050117 0.20204287111370 28.085 > 19 21 Si 0.28423762598161 0.33860422576354 0.79687647489483 28.085 > 21 22 Si 0.78423762598161 0.33860422576354 0.79687647489483 28.085 > 21 23 Si 0.06658639311883 0.66057505050117 0.70204287111370 28.085 > 23 24 Si 0.56658639311883 0.66057505050117 0.70204287111370 28.085 > 23 25 Si 0.21576237401839 0.66139577423646 0.29687647489483 28.085 > 25 26 Si 0.71576237401839 0.66139577423646 0.29687647489483 28.085 > 25 27 Si 0.46576237401839 0.83860422576354 0.29687647489483 28.085 > 27 28 Si 0.96576237401839 0.83860422576354 0.29687647489483 28.085 > 27 29 Si 0.31658639311883 0.83942494949883 0.70204287111370 28.085 > 29 30 Si 0.81658639311883 0.83942494949883 0.70204287111370 28.085 > 29 31 Si 0.03423762598161 0.16139577423646 0.79687647489483 28.085 > 31 32 Si 0.53423762598161 0.16139577423646 0.79687647489483 28.085 > 31 33 O 0.23025462650744 0.00923463932078 0.12097743008725 15.999 > 33 34 O 0.73025462650744 0.00923463932078 0.12097743008725 15.999 > 33 35 O 0.28460294636432 0.29684625438727 0.14625657658151 15.999 > 35 36 O 0.78460294636432 0.29684625438727 0.14625657658151 15.999 > 35 37 O 0.48025462650744 0.49076536067922 0.12097743008725 15.999 > 37 38 O 0.98025462650744 0.49076536067922 0.12097743008725 15.999 > 37 39 O 0.02974058532661 0.16361379707287 0.62013066038905 15.999 > 39 40 O 0.52974058532661 0.16361379707287 0.62013066038905 15.999 > 39 41 O 0.44874352800281 0.99686950188887 0.37774561271054 15.999 > 41 42 O 0.94874352800281 0.99686950188887 0.37774561271054 15.999 > 41 43 O 0.31028125401295 0.84100219866331 0.87954966409373 15.999 > 43 44 O 0.81028125401295 0.84100219866331 0.87954966409373 15.999 > 43 45 O 0.27974058532661 0.33638620292713 0.62013066038905 15.999 > 45 46 O 0.77974058532661 0.33638620292713 0.62013066038905 15.999 > 45 47 O 0.11158667287018 0.78881936563002 0.35801530104195 15.999 > 47 48 O 0.61158667287018 0.78881936563002 0.35801530104195 15.999 > 47 49 O 0.43971874598705 0.34100219866331 0.37954966409373 15.999 > 49 50 O 0.93971874598705 0.34100219866331 0.37954966409373 15.999 > 49 51 O 0.21539705363568 0.70315374561273 0.64625657658151 15.999 > 51 52 O 0.71539705363568 0.70315374561273 0.64625657658151 15.999 > 51 53 O 0.13841332712982 0.28881936563002 0.85801530104195 15.999 > 53 54 O 0.63841332712982 0.28881936563002 0.85801530104195 15.999 > 53 55 O 0.19874352800281 0.50313049811113 0.37774561271054 15.999 > 55 56 O 0.69874352800281 0.50313049811113 0.37774561271054 15.999 > 55 57 O 0.18971874598705 0.15899780133669 0.37954966409373 15.999 > 57 58 O 0.68971874598705 0.15899780133669 0.37954966409373 15.999 > 57 59 O 0.06028125401295 0.65899780133669 0.87954966409373 15.999 > 59 60 O 0.56028125401295 0.65899780133669 0.87954966409373 15.999 > 59 61 O 0.22025941467339 0.66361379707287 0.12013066038905 15.999 > 61 62 O 0.72025941467339 0.66361379707287 0.12013066038905 15.999 > 61 63 O 0.47025941467339 0.83638620292713 0.12013066038905 15.999 > 63 64 O 0.97025941467339 0.83638620292713 0.12013066038905 15.999 > 63 65 O 0.46539705363568 0.79684625438727 0.64625657658151 15.999 > 65 66 O 0.96539705363568 0.79684625438727 0.64625657658151 15.999 > 65 67 O 0.03460294636432 0.20315374561273 0.14625657658151 15.999 > 67 68 O 0.53460294636432 0.20315374561273 0.14625657658151 15.999 > 67 69 O 0.05125647199719 0.00313049811113 0.87774561271054 15.999 > 69 70 O 0.55125647199719 0.00313049811113 0.87774561271054 15.999 > 69 71 O 0.30125647199719 0.49686950188887 0.87774561271054 15.999 > 71 72 O 0.80125647199719 0.49686950188887 0.87774561271054 15.999 > 71 73 O 0.36158667287018 0.71118063436998 0.35801530104195 15.999 > 73 74 O 0.86158667287018 0.71118063436998 0.35801530104195 15.999 > 73 75 O 0.01974537349256 0.50923463932078 0.62097743008725 15.999 > 75 76 O 0.51974537349256 0.50923463932078 0.62097743008725 15.999 > 75 77 O 0.38841332712982 0.21118063436998 0.85801530104195 15.999 > 77 78 O 0.88841332712982 0.21118063436998 0.85801530104195 15.999 > 77 79 O 0.26974537349256 0.99076536067922 0.62097743008725 15.999 > 79 80 O 0.76974537349256 0.99076536067922 0.62097743008725 15.999 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.9191071 0.0000000 0.0000000 0.0000000 2.8926143 0.0000000 0.0000000 0.0000000 2.8918905 -------------------------- Born effective charges -------------------------- 1 Mg 2.0577749 -0.0214093 -0.0100069 -0.0283755 2.2014604 -0.0024657 0.0139763 -0.0001218 2.1989431 2 Mg 2.0206758 -0.0825751 0.0417534 -0.0544504 2.1266033 -0.0155905 0.0526341 -0.0244266 2.2119987 3 Mg 2.0577749 0.0214093 0.0100069 0.0283755 2.2014604 -0.0024657 -0.0139763 -0.0001218 2.1989431 4 Mg 2.0577749 -0.0214093 0.0100069 -0.0283755 2.2014604 0.0024657 -0.0139763 0.0001218 2.1989431 5 Mg 2.0206758 -0.0825751 -0.0417534 -0.0544504 2.1266033 0.0155905 -0.0526341 0.0244266 2.2119987 6 Mg 2.0206758 0.0825751 -0.0417534 0.0544504 2.1266033 -0.0155905 -0.0526341 -0.0244266 2.2119987 7 Mg 2.0206758 0.0825751 0.0417534 0.0544504 2.1266033 0.0155905 0.0526341 0.0244266 2.2119987 8 Mg 2.0577749 0.0214093 -0.0100069 0.0283755 2.2014604 0.0024657 0.0139763 0.0001218 2.1989431 9 Si 3.4013282 -0.1601894 -0.0622048 0.0660370 2.9510863 0.0268899 -0.0509048 -0.1378619 2.9640113 10 Si 3.4013282 0.1601894 -0.0622048 -0.0660370 2.9510863 -0.0268899 -0.0509048 0.1378619 2.9640113 11 Si 3.2888074 -0.2347459 -0.0029471 -0.0114135 3.0264635 -0.0390489 0.0079976 0.1670885 3.0029922 12 Si 3.4013282 -0.1601894 0.0622048 0.0660370 2.9510863 -0.0268899 0.0509048 0.1378619 2.9640113 13 Si 3.2888074 -0.2347459 0.0029471 -0.0114135 3.0264635 0.0390489 -0.0079976 -0.1670885 3.0029922 14 Si 3.2888074 0.2347459 0.0029471 0.0114135 3.0264635 -0.0390489 -0.0079976 0.1670885 3.0029922 15 Si 3.4013282 0.1601894 0.0622048 -0.0660370 2.9510863 0.0268899 0.0509048 -0.1378619 2.9640113 16 Si 3.2888074 0.2347459 -0.0029471 0.0114135 3.0264635 0.0390489 0.0079976 -0.1670885 3.0029922 17 O -1.6049361 0.0561687 0.1366853 0.1620836 -1.9192516 -0.3903769 0.1494251 -0.3815948 -1.5770369 18 O -2.3598386 -0.5732409 -0.0844651 -0.5517998 -1.6732121 0.0981640 -0.1015031 0.1412885 -1.3482526 19 O -1.6049361 -0.0561687 0.1366853 -0.1620836 -1.9192516 0.3903769 0.1494251 0.3815948 -1.5770369 20 O -1.5281921 -0.0294038 -0.0165014 -0.0018487 -1.5436482 -0.0819647 -0.0303352 0.0166864 -2.2030372 21 O -1.4982459 0.1006139 0.0136060 0.1060601 -1.9429504 -0.3733531 0.0012553 -0.3677117 -1.6240425 22 O -1.5456160 -0.0471457 0.0117302 -0.0094323 -1.5199337 -0.1038646 0.0235377 -0.0042174 -2.2135860 23 O -1.5281921 0.0294038 -0.0165014 0.0018487 -1.5436482 0.0819647 -0.0303352 -0.0166864 -2.2030372 24 O -2.2317577 0.7182264 -0.0288459 0.6376101 -1.7066177 -0.1878220 -0.0364430 -0.2065150 -1.4119902 25 O -1.5456160 0.0471457 -0.0117302 0.0094323 -1.5199337 -0.1038646 -0.0235377 -0.0042174 -2.2135860 26 O -2.3598386 -0.5732409 0.0844651 -0.5517998 -1.6732121 -0.0981640 0.1015031 -0.1412885 -1.3482526 27 O -2.2317577 -0.7182264 0.0288459 -0.6376101 -1.7066177 -0.1878220 0.0364430 -0.2065150 -1.4119902 28 O -1.4982459 -0.1006139 0.0136060 -0.1060601 -1.9429504 0.3733531 0.0012553 0.3677117 -1.6240425 29 O -1.5456160 -0.0471457 -0.0117302 -0.0094323 -1.5199337 0.1038646 -0.0235377 0.0042174 -2.2135860 30 O -1.5456160 0.0471457 0.0117302 0.0094323 -1.5199337 0.1038646 0.0235377 0.0042174 -2.2135860 31 O -1.5281921 0.0294038 0.0165014 0.0018487 -1.5436482 -0.0819647 0.0303352 0.0166864 -2.2030372 32 O -1.5281921 -0.0294038 0.0165014 -0.0018487 -1.5436482 0.0819647 0.0303352 -0.0166864 -2.2030372 33 O -2.3598386 0.5732409 0.0844651 0.5517998 -1.6732121 0.0981640 0.1015031 0.1412885 -1.3482526 34 O -2.3598386 0.5732409 -0.0844651 0.5517998 -1.6732121 -0.0981640 -0.1015031 -0.1412885 -1.3482526 35 O -1.4982459 0.1006139 -0.0136060 0.1060601 -1.9429504 0.3733531 -0.0012553 0.3677117 -1.6240425 36 O -1.4982459 -0.1006139 -0.0136060 -0.1060601 -1.9429504 -0.3733531 -0.0012553 -0.3677117 -1.6240425 37 O -2.2317577 -0.7182264 -0.0288459 -0.6376101 -1.7066177 0.1878220 -0.0364430 0.2065150 -1.4119902 38 O -1.6049361 -0.0561687 -0.1366853 -0.1620836 -1.9192516 -0.3903769 -0.1494251 -0.3815948 -1.5770369 39 O -2.2317577 0.7182264 0.0288459 0.6376101 -1.7066177 0.1878220 0.0364430 0.2065150 -1.4119902 40 O -1.6049361 0.0561687 -0.1366853 0.1620836 -1.9192516 0.3903769 -0.1494251 0.3815948 -1.5770369 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000001 (xxx) -0.00000001 (xxx) -0.00000001 (xxx) Max drift of fc2: -0.00000000 (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 ... [ 10 6 5 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.55, Number of G-points: 295, Lambda: 0.10 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/72) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72 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 2.993 ( 0.000 0.000 0.000) 0.000 3.095 ( 0.000 0.000 0.000) 0.000 3.404 ( 0.000 0.000 -0.000) 0.000 4.049 ( 0.000 0.000 -0.000) 0.000 4.503 ( 0.000 0.000 0.000) 0.000 4.505 ( 0.000 0.000 0.000) 0.000 4.589 ( 0.000 0.000 0.000) 0.000 5.017 ( 0.000 0.000 0.000) 0.000 5.236 ( 0.000 0.000 0.000) 0.000 5.638 ( 0.000 0.000 0.000) 0.000 5.747 ( 0.000 0.000 0.000) 0.000 5.766 ( 0.000 0.000 -0.000) 0.000 5.817 ( 0.000 0.000 0.000) 0.000 5.933 ( 0.000 0.000 0.000) 0.000 6.032 ( 0.000 0.000 -0.000) 0.000 6.209 ( 0.000 0.000 0.000) 0.000 6.403 ( 0.000 0.000 -0.000) 0.000 6.641 ( 0.000 0.000 0.000) 0.000 6.741 ( 0.000 0.000 -0.000) 0.000 6.969 ( 0.000 0.000 0.000) 0.000 7.097 ( 0.000 0.000 0.000) 0.000 7.241 ( 0.000 0.000 -0.000) 0.000 7.325 ( 0.000 0.000 -0.000) 0.000 7.719 ( 0.000 0.000 0.000) 0.000 8.041 ( 0.000 0.000 0.000) 0.000 8.053 ( 0.000 0.000 0.000) 0.000 8.176 ( 0.000 0.000 0.000) 0.000 8.430 ( 0.000 0.000 -0.000) 0.000 8.479 ( 0.000 0.000 -0.000) 0.000 8.862 ( 0.000 0.000 0.000) 0.000 8.906 ( 0.000 0.000 -0.000) 0.000 9.012 ( 0.000 0.000 0.000) 0.000 9.179 ( 0.000 0.000 -0.000) 0.000 9.284 ( 0.000 0.000 0.000) 0.000 9.356 ( 0.000 0.000 0.000) 0.000 9.393 ( 0.000 0.000 -0.000) 0.000 9.471 ( 0.000 0.000 0.000) 0.000 9.558 ( 0.000 0.000 -0.000) 0.000 9.793 ( 0.000 0.000 -0.000) 0.000 9.840 ( 0.000 0.000 0.000) 0.000 9.848 ( 0.000 0.000 -0.000) 0.000 9.856 ( 0.000 0.000 0.000) 0.000 9.976 ( 0.000 0.000 -0.000) 0.000 10.317 ( 0.000 0.000 -0.000) 0.000 10.372 ( 0.000 0.000 0.000) 0.000 10.781 ( 0.000 0.000 -0.000) 0.000 10.894 ( 0.000 0.000 0.000) 0.000 10.989 ( 0.000 0.000 -0.000) 0.000 11.075 ( 0.000 0.000 -0.000) 0.000 11.248 ( 0.000 0.000 0.000) 0.000 11.575 ( 0.000 0.000 0.000) 0.000 11.591 ( 0.000 0.000 0.000) 0.000 11.679 ( 0.000 0.000 -0.000) 0.000 11.757 ( 0.000 0.000 -0.000) 0.000 11.829 ( 0.000 0.000 -0.000) 0.000 11.979 ( 0.000 0.000 -0.000) 0.000 12.172 ( 0.000 0.000 0.000) 0.000 12.226 ( 0.000 0.000 -0.000) 0.000 12.410 ( 0.000 0.000 -0.000) 0.000 12.530 ( 0.000 0.000 0.000) 0.000 12.915 ( 0.000 0.000 0.000) 0.000 13.020 ( 0.000 0.000 0.000) 0.000 13.047 ( 0.000 0.000 0.000) 0.000 13.145 ( 0.000 0.000 0.000) 0.000 13.397 ( 0.000 0.000 0.000) 0.000 13.566 ( 0.000 0.000 0.000) 0.000 13.599 ( 0.000 0.000 0.000) 0.000 13.653 ( 0.000 0.000 0.000) 0.000 14.051 ( 0.000 0.000 -0.000) 0.000 14.202 ( 0.000 0.000 0.000) 0.000 14.246 ( 0.000 0.000 0.000) 0.000 14.579 ( 0.000 0.000 -0.000) 0.000 14.653 ( 0.000 0.000 -0.000) 0.000 15.044 ( 0.000 0.000 -0.000) 0.000 15.094 ( 0.000 0.000 0.000) 0.000 15.225 ( 0.000 0.000 -0.000) 0.000 15.511 ( 0.000 0.000 0.000) 0.000 15.609 ( 0.000 0.000 0.000) 0.000 15.622 ( 0.000 0.000 0.000) 0.000 15.805 ( 0.000 0.000 -0.000) 0.000 15.816 ( 0.000 0.000 -0.000) 0.000 16.216 ( 0.000 0.000 -0.000) 0.000 16.267 ( 0.000 0.000 0.000) 0.000 16.720 ( 0.000 0.000 0.000) 0.000 16.943 ( 0.000 0.000 0.000) 0.000 18.643 ( 0.000 0.000 -0.000) 0.000 19.272 ( 0.000 0.000 -0.000) 0.000 19.621 ( 0.000 0.000 0.000) 0.000 19.835 ( 0.000 0.000 -0.000) 0.000 21.420 ( 0.000 0.000 -0.000) 0.000 21.480 ( 0.000 0.000 0.000) 0.000 22.057 ( 0.000 0.000 0.000) 0.000 22.107 ( 0.000 0.000 0.000) 0.000 25.840 ( 0.000 0.000 0.000) 0.000 26.093 ( 0.000 0.000 0.000) 0.000 26.107 ( 0.000 0.000 0.000) 0.000 26.476 ( 0.000 0.000 -0.000) 0.000 26.489 ( 0.000 0.000 0.000) 0.000 27.005 ( 0.000 0.000 0.000) 0.000 27.155 ( 0.000 0.000 0.000) 0.000 27.164 ( 0.000 0.000 -0.000) 0.000 27.491 ( 0.000 0.000 -0.000) 0.000 27.516 ( 0.000 0.000 0.000) 0.000 27.843 ( 0.000 0.000 0.000) 0.000 28.040 ( 0.000 0.000 0.000) 0.000 29.208 ( 0.000 0.000 0.000) 0.000 29.300 ( 0.000 0.000 0.000) 0.000 29.409 ( 0.000 0.000 0.000) 0.000 29.494 ( 0.000 0.000 -0.000) 0.000 29.775 ( 0.000 0.000 0.000) 0.000 29.956 ( 0.000 0.000 0.000) 0.000 30.263 ( 0.000 0.000 0.000) 0.000 30.387 ( 0.000 0.000 0.000) 0.000 31.122 ( 0.000 0.000 -0.000) 0.000 31.230 ( 0.000 0.000 0.000) 0.000 31.615 ( 0.000 0.000 0.000) 0.000 33.637 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/72) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.802 ( 42.233 0.000 0.000) 42.233 0.909 ( 47.075 0.000 0.000) 47.075 1.250 ( 69.312 0.000 0.000) 69.312 3.140 ( 4.762 0.000 0.000) 4.762 3.529 ( 47.175 0.000 0.000) 47.175 3.823 ( 31.245 0.000 0.000) 31.245 4.331 ( 22.776 0.000 0.000) 22.776 4.548 ( 3.051 0.000 0.000) 3.051 4.626 ( 4.528 0.000 0.000) 4.528 4.631 ( 20.452 0.000 0.000) 20.452 5.225 ( 15.181 0.000 0.000) 15.181 5.230 ( -0.907 0.000 0.000) 0.907 5.545 ( -7.590 0.000 0.000) 7.590 5.765 ( 2.125 0.000 0.000) 2.125 5.780 ( 1.944 0.000 0.000) 1.944 5.845 ( 3.606 0.000 0.000) 3.606 5.970 ( 3.363 0.000 0.000) 3.363 6.171 ( 3.930 0.000 0.000) 3.930 6.172 ( 7.718 0.000 0.000) 7.718 6.364 ( -4.960 0.000 0.000) 4.960 6.688 ( -6.135 0.000 0.000) 6.135 6.723 ( -1.421 0.000 0.000) 1.421 6.968 ( 0.204 0.000 0.000) 0.204 6.980 ( -10.569 0.000 0.000) 10.569 7.235 ( -13.284 0.000 0.000) 13.284 7.247 ( 0.558 0.000 0.000) 0.558 7.631 ( -5.277 0.000 0.000) 5.277 7.900 ( -11.727 0.000 0.000) 11.727 8.032 ( 1.637 0.000 0.000) 1.637 8.223 ( -3.170 0.000 0.000) 3.170 8.410 ( -0.872 0.000 0.000) 0.872 8.530 ( 1.573 0.000 0.000) 1.573 8.780 ( -6.309 0.000 0.000) 6.309 8.844 ( -8.747 0.000 0.000) 8.747 8.940 ( -0.357 0.000 0.000) 0.357 9.006 ( -18.723 0.000 0.000) 18.723 9.148 ( -15.715 0.000 0.000) 15.715 9.329 ( -11.592 0.000 0.000) 11.592 9.337 ( 5.569 0.000 0.000) 5.569 9.425 ( 0.830 0.000 0.000) 0.830 9.574 ( 10.115 0.000 0.000) 10.115 9.769 ( -5.174 0.000 0.000) 5.174 9.787 ( 4.111 0.000 0.000) 4.111 10.028 ( 11.879 0.000 0.000) 11.879 10.078 ( 11.846 0.000 0.000) 11.846 10.339 ( 19.484 0.000 0.000) 19.484 10.383 ( 0.461 0.000 0.000) 0.461 10.429 ( 10.598 0.000 0.000) 10.598 10.697 ( -4.999 0.000 0.000) 4.999 10.841 ( -4.317 0.000 0.000) 4.317 11.046 ( 2.148 0.000 0.000) 2.148 11.068 ( -2.304 0.000 0.000) 2.304 11.191 ( -3.837 0.000 0.000) 3.837 11.496 ( -7.396 0.000 0.000) 7.396 11.574 ( -8.710 0.000 0.000) 8.710 11.655 ( -1.365 0.000 0.000) 1.365 11.767 ( -1.455 0.000 0.000) 1.455 11.867 ( 3.830 0.000 0.000) 3.830 12.007 ( -10.082 0.000 0.000) 10.082 12.018 ( -4.312 0.000 0.000) 4.312 12.163 ( -15.283 0.000 0.000) 15.283 12.289 ( -1.307 0.000 0.000) 1.307 12.503 ( -1.531 0.000 0.000) 1.531 13.004 ( 2.771 0.000 0.000) 2.771 13.005 ( -10.630 0.000 0.000) 10.630 13.078 ( 2.846 0.000 0.000) 2.846 13.297 ( -6.790 0.000 0.000) 6.790 13.528 ( 0.017 0.000 0.000) 0.017 13.643 ( 8.415 0.000 0.000) 8.415 13.702 ( -12.535 0.000 0.000) 12.535 13.914 ( 5.721 0.000 0.000) 5.721 14.019 ( 26.681 0.000 0.000) 26.681 14.202 ( 0.017 0.000 0.000) 0.017 14.338 ( 4.191 0.000 0.000) 4.191 14.688 ( 2.424 0.000 0.000) 2.424 14.868 ( -13.058 0.000 0.000) 13.058 15.059 ( -2.888 0.000 0.000) 2.888 15.146 ( -6.677 0.000 0.000) 6.677 15.559 ( 0.859 0.000 0.000) 0.859 15.590 ( -5.594 0.000 0.000) 5.594 15.673 ( 3.306 0.000 0.000) 3.306 15.721 ( 14.002 0.000 0.000) 14.002 15.836 ( 6.778 0.000 0.000) 6.778 16.013 ( 6.222 0.000 0.000) 6.222 16.456 ( 14.479 0.000 0.000) 14.479 16.528 ( -17.329 0.000 0.000) 17.329 16.832 ( -10.528 0.000 0.000) 10.528 18.091 ( -2.633 0.000 0.000) 2.633 18.690 ( 4.701 0.000 0.000) 4.701 19.230 ( -6.516 0.000 0.000) 6.516 19.648 ( 2.885 0.000 0.000) 2.885 20.001 ( -1.956 0.000 0.000) 1.956 21.305 ( -10.118 0.000 0.000) 10.118 21.480 ( -3.112 0.000 0.000) 3.112 21.958 ( -8.490 0.000 0.000) 8.490 22.088 ( -3.112 0.000 0.000) 3.112 25.895 ( 5.260 0.000 0.000) 5.260 26.173 ( 6.141 0.000 0.000) 6.141 26.393 ( -1.200 0.000 0.000) 1.200 26.654 ( 3.044 0.000 0.000) 3.044 26.708 ( 14.827 0.000 0.000) 14.827 27.060 ( 5.513 0.000 0.000) 5.513 27.118 ( -2.448 0.000 0.000) 2.448 27.372 ( 5.461 0.000 0.000) 5.461 27.594 ( 8.676 0.000 0.000) 8.676 27.866 ( 2.366 0.000 0.000) 2.366 28.082 ( 4.165 0.000 0.000) 4.165 29.223 ( 0.966 0.000 0.000) 0.966 29.238 ( -4.802 0.000 0.000) 4.802 29.306 ( 1.260 0.000 0.000) 1.260 29.480 ( -1.593 0.000 0.000) 1.593 29.769 ( -0.613 0.000 0.000) 0.613 29.921 ( -3.607 0.000 0.000) 3.607 30.083 ( -1.338 0.000 0.000) 1.338 30.293 ( 2.793 0.000 0.000) 2.793 30.940 ( -3.082 0.000 0.000) 3.082 31.092 ( -2.518 0.000 0.000) 2.518 31.237 ( 0.460 0.000 0.000) 0.460 31.618 ( 0.322 0.000 0.000) 0.322 33.599 ( -10.814 0.000 0.000) 10.814 ======================= Grid point 2 (3/72) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.625 ( 43.315 0.000 0.000) 43.315 1.801 ( 45.423 0.000 0.000) 45.423 2.615 ( 70.613 0.000 0.000) 70.613 3.282 ( 10.028 0.000 0.000) 10.028 4.424 ( 23.057 0.000 0.000) 23.057 4.461 ( 43.271 0.000 0.000) 43.271 4.538 ( -3.846 0.000 0.000) 3.846 4.795 ( 12.139 0.000 0.000) 12.139 4.832 ( 33.466 0.000 0.000) 33.466 5.182 ( -4.343 0.000 0.000) 4.343 5.288 ( 23.620 0.000 0.000) 23.620 5.443 ( 20.344 0.000 0.000) 20.344 5.452 ( -0.462 0.000 0.000) 0.462 5.822 ( 3.452 0.000 0.000) 3.452 5.831 ( 1.112 0.000 0.000) 1.112 5.996 ( 10.554 0.000 0.000) 10.554 6.045 ( 3.996 0.000 0.000) 3.996 6.223 ( 11.890 0.000 0.000) 11.890 6.224 ( -5.942 0.000 0.000) 5.942 6.422 ( 2.973 0.000 0.000) 2.973 6.648 ( 11.353 0.000 0.000) 11.353 6.700 ( -3.309 0.000 0.000) 3.309 6.771 ( -7.516 0.000 0.000) 7.516 6.942 ( -9.685 0.000 0.000) 9.685 7.004 ( 1.016 0.000 0.000) 1.016 7.250 ( -0.784 0.000 0.000) 0.784 7.589 ( 1.375 0.000 0.000) 1.375 7.662 ( -11.872 0.000 0.000) 11.872 7.947 ( -16.167 0.000 0.000) 16.167 8.170 ( 3.963 0.000 0.000) 3.963 8.318 ( -7.724 0.000 0.000) 7.724 8.479 ( -6.519 0.000 0.000) 6.519 8.615 ( -10.880 0.000 0.000) 10.880 8.625 ( -15.726 0.000 0.000) 15.726 8.837 ( 6.658 0.000 0.000) 6.658 8.856 ( -11.084 0.000 0.000) 11.084 8.947 ( -0.076 0.000 0.000) 0.076 9.229 ( -2.440 0.000 0.000) 2.440 9.369 ( -3.552 0.000 0.000) 3.552 9.420 ( -0.438 0.000 0.000) 0.438 9.621 ( -9.912 0.000 0.000) 9.912 9.841 ( 15.282 0.000 0.000) 15.282 9.867 ( 1.552 0.000 0.000) 1.552 10.105 ( -6.650 0.000 0.000) 6.650 10.224 ( -7.159 0.000 0.000) 7.159 10.307 ( 0.179 0.000 0.000) 0.179 10.372 ( 0.882 0.000 0.000) 0.882 10.653 ( 5.506 0.000 0.000) 5.506 10.758 ( -5.437 0.000 0.000) 5.437 10.897 ( 15.076 0.000 0.000) 15.076 10.942 ( -9.534 0.000 0.000) 9.534 11.122 ( -7.598 0.000 0.000) 7.598 11.158 ( 12.222 0.000 0.000) 12.222 11.380 ( -2.598 0.000 0.000) 2.598 11.445 ( -0.853 0.000 0.000) 0.853 11.641 ( -2.947 0.000 0.000) 2.947 11.673 ( -8.018 0.000 0.000) 8.018 11.794 ( -7.891 0.000 0.000) 7.891 11.808 ( -4.882 0.000 0.000) 4.882 11.999 ( 5.738 0.000 0.000) 5.738 12.004 ( -4.596 0.000 0.000) 4.596 12.157 ( -9.691 0.000 0.000) 9.691 12.597 ( 9.263 0.000 0.000) 9.263 12.774 ( -16.064 0.000 0.000) 16.064 13.048 ( -4.920 0.000 0.000) 4.920 13.115 ( 6.829 0.000 0.000) 6.829 13.189 ( -6.736 0.000 0.000) 6.736 13.306 ( -13.316 0.000 0.000) 13.316 13.585 ( -1.463 0.000 0.000) 1.463 13.785 ( 3.855 0.000 0.000) 3.855 13.993 ( -3.354 0.000 0.000) 3.354 14.218 ( 2.493 0.000 0.000) 2.493 14.367 ( 4.114 0.000 0.000) 4.114 14.427 ( 5.391 0.000 0.000) 5.391 14.675 ( -7.993 0.000 0.000) 7.993 14.699 ( -2.407 0.000 0.000) 2.407 15.015 ( -3.216 0.000 0.000) 3.216 15.034 ( 0.524 0.000 0.000) 0.524 15.533 ( 4.913 0.000 0.000) 4.913 15.561 ( -7.500 0.000 0.000) 7.500 15.649 ( -0.298 0.000 0.000) 0.298 15.991 ( 7.156 0.000 0.000) 7.156 16.012 ( 7.793 0.000 0.000) 7.793 16.154 ( 7.025 0.000 0.000) 7.025 16.261 ( -0.487 0.000 0.000) 0.487 16.636 ( -6.310 0.000 0.000) 6.310 16.716 ( 11.164 0.000 0.000) 11.164 18.024 ( -4.299 0.000 0.000) 4.299 18.782 ( 1.543 0.000 0.000) 1.543 19.099 ( -1.982 0.000 0.000) 1.982 19.748 ( 8.262 0.000 0.000) 8.262 20.022 ( 4.825 0.000 0.000) 4.825 21.025 ( -19.372 0.000 0.000) 19.372 21.326 ( -12.565 0.000 0.000) 12.565 21.753 ( -13.084 0.000 0.000) 13.084 21.987 ( -7.523 0.000 0.000) 7.523 26.013 ( 6.255 0.000 0.000) 6.255 26.296 ( 5.352 0.000 0.000) 5.352 26.424 ( 3.926 0.000 0.000) 3.926 26.720 ( 3.280 0.000 0.000) 3.280 27.025 ( 17.094 0.000 0.000) 17.094 27.102 ( 1.101 0.000 0.000) 1.101 27.204 ( 9.206 0.000 0.000) 9.206 27.477 ( 6.311 0.000 0.000) 6.311 27.823 ( 13.427 0.000 0.000) 13.427 27.934 ( 4.691 0.000 0.000) 4.691 28.183 ( 5.713 0.000 0.000) 5.713 29.109 ( -8.482 0.000 0.000) 8.482 29.229 ( -0.012 0.000 0.000) 0.012 29.376 ( 5.901 0.000 0.000) 5.901 29.430 ( -3.417 0.000 0.000) 3.417 29.753 ( -1.031 0.000 0.000) 1.031 29.821 ( -6.583 0.000 0.000) 6.583 30.051 ( -1.932 0.000 0.000) 1.932 30.356 ( 3.498 0.000 0.000) 3.498 30.864 ( -4.617 0.000 0.000) 4.617 31.058 ( -0.294 0.000 0.000) 0.294 31.241 ( -0.141 0.000 0.000) 0.141 31.632 ( 1.337 0.000 0.000) 1.337 33.311 ( -18.462 0.000 0.000) 18.462 ======================= Grid point 3 (4/72) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.457 ( 43.003 0.000 0.000) 43.003 2.632 ( 39.972 0.000 0.000) 39.972 3.526 ( 15.700 0.000 0.000) 15.700 3.873 ( 57.193 0.000 0.000) 57.193 4.472 ( -0.647 0.000 0.000) 0.647 4.618 ( -4.027 0.000 0.000) 4.027 5.037 ( 10.481 0.000 0.000) 10.481 5.059 ( 16.783 0.000 0.000) 16.783 5.064 ( -8.756 0.000 0.000) 8.756 5.199 ( -4.150 0.000 0.000) 4.150 5.446 ( 17.895 0.000 0.000) 17.895 5.507 ( 4.786 0.000 0.000) 4.786 5.703 ( -8.542 0.000 0.000) 8.542 5.780 ( -3.218 0.000 0.000) 3.218 6.037 ( 18.530 0.000 0.000) 18.530 6.203 ( 10.230 0.000 0.000) 10.230 6.226 ( 4.186 0.000 0.000) 4.186 6.262 ( 20.483 0.000 0.000) 20.483 6.529 ( 0.017 0.000 0.000) 0.017 6.552 ( -5.723 0.000 0.000) 5.723 6.694 ( 18.520 0.000 0.000) 18.520 6.771 ( 2.870 0.000 0.000) 2.870 6.783 ( 21.304 0.000 0.000) 21.304 6.924 ( 0.629 0.000 0.000) 0.629 7.169 ( 18.511 0.000 0.000) 18.511 7.192 ( -5.938 0.000 0.000) 5.938 7.495 ( -4.014 0.000 0.000) 4.014 7.657 ( -5.061 0.000 0.000) 5.061 7.741 ( 11.626 0.000 0.000) 11.626 8.102 ( -3.607 0.000 0.000) 3.607 8.272 ( -15.210 0.000 0.000) 15.210 8.297 ( 0.579 0.000 0.000) 0.579 8.397 ( -12.024 0.000 0.000) 12.024 8.569 ( 10.469 0.000 0.000) 10.469 8.694 ( -4.007 0.000 0.000) 4.007 8.974 ( 1.063 0.000 0.000) 1.063 9.002 ( 3.392 0.000 0.000) 3.392 9.086 ( -4.968 0.000 0.000) 4.968 9.290 ( -14.350 0.000 0.000) 14.350 9.401 ( -12.439 0.000 0.000) 12.439 9.430 ( 7.798 0.000 0.000) 7.798 9.735 ( -9.858 0.000 0.000) 9.858 9.774 ( -18.143 0.000 0.000) 18.143 10.086 ( 3.131 0.000 0.000) 3.131 10.126 ( 2.930 0.000 0.000) 2.930 10.308 ( -14.883 0.000 0.000) 14.883 10.474 ( 11.959 0.000 0.000) 11.959 10.584 ( -9.487 0.000 0.000) 9.487 10.653 ( -10.280 0.000 0.000) 10.280 10.735 ( -1.632 0.000 0.000) 1.632 10.989 ( -2.570 0.000 0.000) 2.570 11.009 ( -0.822 0.000 0.000) 0.822 11.352 ( -14.746 0.000 0.000) 14.746 11.354 ( 3.794 0.000 0.000) 3.794 11.539 ( 13.395 0.000 0.000) 13.395 11.553 ( -5.852 0.000 0.000) 5.852 11.584 ( 4.412 0.000 0.000) 4.412 11.683 ( -3.434 0.000 0.000) 3.434 11.937 ( 13.247 0.000 0.000) 13.247 11.985 ( -2.269 0.000 0.000) 2.269 12.017 ( 7.385 0.000 0.000) 7.385 12.133 ( 3.942 0.000 0.000) 3.942 12.377 ( -21.808 0.000 0.000) 21.808 12.785 ( 8.838 0.000 0.000) 8.838 12.862 ( -11.921 0.000 0.000) 11.921 12.979 ( -11.373 0.000 0.000) 11.373 13.199 ( -4.731 0.000 0.000) 4.731 13.290 ( 9.998 0.000 0.000) 9.998 13.501 ( -7.419 0.000 0.000) 7.419 13.734 ( -8.478 0.000 0.000) 8.478 13.863 ( -7.989 0.000 0.000) 7.989 14.222 ( -4.589 0.000 0.000) 4.589 14.287 ( -26.880 0.000 0.000) 26.880 14.350 ( -2.202 0.000 0.000) 2.202 14.511 ( 2.886 0.000 0.000) 2.886 14.623 ( -5.959 0.000 0.000) 5.959 15.068 ( 2.545 0.000 0.000) 2.545 15.134 ( 11.720 0.000 0.000) 11.720 15.283 ( -11.781 0.000 0.000) 11.781 15.748 ( 12.192 0.000 0.000) 12.192 15.769 ( 9.003 0.000 0.000) 9.003 15.948 ( -5.534 0.000 0.000) 5.534 16.083 ( 1.963 0.000 0.000) 1.963 16.251 ( 2.662 0.000 0.000) 2.662 16.490 ( 11.018 0.000 0.000) 11.018 16.695 ( 14.112 0.000 0.000) 14.112 16.851 ( 2.296 0.000 0.000) 2.296 17.919 ( -7.059 0.000 0.000) 7.059 18.731 ( -0.312 0.000 0.000) 0.312 19.285 ( 18.054 0.000 0.000) 18.054 19.976 ( 14.972 0.000 0.000) 14.972 20.192 ( 13.123 0.000 0.000) 13.123 20.572 ( -27.116 0.000 0.000) 27.116 21.026 ( -18.125 0.000 0.000) 18.125 21.447 ( -18.626 0.000 0.000) 18.626 21.782 ( -14.202 0.000 0.000) 14.202 26.116 ( 4.350 0.000 0.000) 4.350 26.349 ( 0.119 0.000 0.000) 0.119 26.523 ( 5.810 0.000 0.000) 5.810 26.760 ( 0.646 0.000 0.000) 0.646 27.162 ( 4.770 0.000 0.000) 4.770 27.287 ( 8.230 0.000 0.000) 8.230 27.435 ( 15.336 0.000 0.000) 15.336 27.633 ( 9.786 0.000 0.000) 9.786 28.050 ( 8.959 0.000 0.000) 8.959 28.052 ( 7.786 0.000 0.000) 7.786 28.270 ( 2.371 0.000 0.000) 2.371 28.917 ( -11.378 0.000 0.000) 11.378 29.238 ( 1.091 0.000 0.000) 1.091 29.363 ( -3.148 0.000 0.000) 3.148 29.516 ( 8.179 0.000 0.000) 8.179 29.694 ( -5.548 0.000 0.000) 5.548 29.729 ( -1.543 0.000 0.000) 1.543 30.009 ( -2.571 0.000 0.000) 2.571 30.423 ( 3.493 0.000 0.000) 3.493 30.768 ( -5.179 0.000 0.000) 5.179 31.086 ( 2.741 0.000 0.000) 2.741 31.230 ( -0.925 0.000 0.000) 0.925 31.687 ( 5.083 0.000 0.000) 5.083 32.919 ( -21.682 0.000 0.000) 21.682 ======================= Grid point 4 (5/72) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.261 ( 40.060 0.000 0.000) 40.060 3.283 ( 27.250 0.000 0.000) 27.250 3.917 ( 24.728 0.000 0.000) 24.728 4.262 ( -22.157 0.000 0.000) 22.157 4.560 ( 8.510 0.000 0.000) 8.510 4.681 ( 13.898 0.000 0.000) 13.898 4.737 ( -23.121 0.000 0.000) 23.121 5.070 ( -6.722 0.000 0.000) 6.722 5.150 ( 2.116 0.000 0.000) 2.116 5.188 ( -2.126 0.000 0.000) 2.126 5.613 ( 5.598 0.000 0.000) 5.598 5.650 ( 11.411 0.000 0.000) 11.411 5.721 ( 7.075 0.000 0.000) 7.075 5.909 ( 11.499 0.000 0.000) 11.499 6.160 ( -5.351 0.000 0.000) 5.351 6.196 ( -2.788 0.000 0.000) 2.788 6.415 ( 4.948 0.000 0.000) 4.948 6.420 ( -1.777 0.000 0.000) 1.777 6.587 ( 6.816 0.000 0.000) 6.816 6.606 ( 12.914 0.000 0.000) 12.914 6.828 ( -6.316 0.000 0.000) 6.316 6.847 ( 3.866 0.000 0.000) 3.866 6.935 ( 8.272 0.000 0.000) 8.272 7.062 ( -3.187 0.000 0.000) 3.187 7.176 ( 13.158 0.000 0.000) 13.158 7.476 ( 12.803 0.000 0.000) 12.803 7.504 ( 1.403 0.000 0.000) 1.403 7.944 ( -15.540 0.000 0.000) 15.540 7.972 ( 23.463 0.000 0.000) 23.463 8.043 ( 18.862 0.000 0.000) 18.862 8.136 ( -15.292 0.000 0.000) 15.292 8.149 ( -1.166 0.000 0.000) 1.166 8.388 ( 21.105 0.000 0.000) 21.105 8.663 ( -5.851 0.000 0.000) 5.851 8.810 ( 7.198 0.000 0.000) 7.198 8.860 ( -18.801 0.000 0.000) 18.801 8.941 ( -10.504 0.000 0.000) 10.504 8.944 ( 5.458 0.000 0.000) 5.458 9.134 ( 4.467 0.000 0.000) 4.467 9.161 ( -11.750 0.000 0.000) 11.750 9.466 ( -14.453 0.000 0.000) 14.453 9.616 ( 10.092 0.000 0.000) 10.092 9.819 ( -25.048 0.000 0.000) 25.048 9.829 ( 20.765 0.000 0.000) 20.765 10.149 ( -1.214 0.000 0.000) 1.214 10.224 ( 4.130 0.000 0.000) 4.130 10.321 ( -20.503 0.000 0.000) 20.503 10.430 ( -1.445 0.000 0.000) 1.445 10.760 ( -3.221 0.000 0.000) 3.221 10.774 ( 18.718 0.000 0.000) 18.718 10.894 ( -20.466 0.000 0.000) 20.466 10.962 ( -1.555 0.000 0.000) 1.555 11.039 ( -8.105 0.000 0.000) 8.105 11.423 ( 3.606 0.000 0.000) 3.606 11.428 ( -3.424 0.000 0.000) 3.424 11.587 ( -6.927 0.000 0.000) 6.927 11.621 ( 3.597 0.000 0.000) 3.597 11.860 ( -15.802 0.000 0.000) 15.802 11.866 ( 14.912 0.000 0.000) 14.912 12.129 ( 9.973 0.000 0.000) 9.973 12.140 ( 4.295 0.000 0.000) 4.295 12.215 ( 0.508 0.000 0.000) 0.508 12.331 ( 17.462 0.000 0.000) 17.462 12.616 ( -9.762 0.000 0.000) 9.762 12.748 ( -14.124 0.000 0.000) 14.124 12.965 ( 9.000 0.000 0.000) 9.000 13.006 ( -14.942 0.000 0.000) 14.942 13.341 ( -8.201 0.000 0.000) 8.201 13.470 ( 6.447 0.000 0.000) 6.447 13.547 ( -6.727 0.000 0.000) 6.727 13.639 ( -17.390 0.000 0.000) 17.390 13.852 ( -11.671 0.000 0.000) 11.671 14.113 ( -5.531 0.000 0.000) 5.531 14.249 ( -8.012 0.000 0.000) 8.012 14.553 ( 1.663 0.000 0.000) 1.663 14.564 ( -0.080 0.000 0.000) 0.080 15.105 ( -2.618 0.000 0.000) 2.618 15.105 ( 0.873 0.000 0.000) 0.873 15.481 ( 18.290 0.000 0.000) 18.290 15.886 ( -0.676 0.000 0.000) 0.676 15.892 ( 2.715 0.000 0.000) 2.715 15.955 ( 9.650 0.000 0.000) 9.650 16.042 ( -6.712 0.000 0.000) 6.712 16.248 ( -3.301 0.000 0.000) 3.301 16.629 ( 5.393 0.000 0.000) 5.393 16.813 ( -4.761 0.000 0.000) 4.761 17.062 ( 20.479 0.000 0.000) 20.479 17.730 ( -12.812 0.000 0.000) 12.812 18.918 ( 19.696 0.000 0.000) 19.696 19.704 ( 24.416 0.000 0.000) 24.416 20.009 ( -30.856 0.000 0.000) 30.856 20.291 ( 17.395 0.000 0.000) 17.395 20.534 ( 21.994 0.000 0.000) 21.994 20.640 ( -21.959 0.000 0.000) 21.959 21.055 ( -21.517 0.000 0.000) 21.517 21.440 ( -21.080 0.000 0.000) 21.080 26.188 ( 3.425 0.000 0.000) 3.425 26.317 ( -2.900 0.000 0.000) 2.900 26.627 ( 4.686 0.000 0.000) 4.686 26.748 ( -1.697 0.000 0.000) 1.697 27.263 ( 5.135 0.000 0.000) 5.135 27.368 ( 0.993 0.000 0.000) 0.993 27.733 ( 14.492 0.000 0.000) 14.492 27.836 ( 10.567 0.000 0.000) 10.567 28.138 ( 0.069 0.000 0.000) 0.069 28.226 ( 6.868 0.000 0.000) 6.868 28.255 ( -0.705 0.000 0.000) 0.705 28.684 ( -12.441 0.000 0.000) 12.441 29.267 ( 1.683 0.000 0.000) 1.683 29.319 ( -1.505 0.000 0.000) 1.505 29.615 ( 0.314 0.000 0.000) 0.314 29.692 ( -2.315 0.000 0.000) 2.315 29.696 ( 7.515 0.000 0.000) 7.515 29.945 ( -4.286 0.000 0.000) 4.286 30.494 ( 3.934 0.000 0.000) 3.934 30.669 ( -5.103 0.000 0.000) 5.103 31.140 ( 2.488 0.000 0.000) 2.488 31.208 ( -1.361 0.000 0.000) 1.361 31.846 ( 11.621 0.000 0.000) 11.621 32.503 ( -21.029 0.000 0.000) 21.029 ======================= Grid point 5 (6/72) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 36 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.728 ( -16.545 0.000 0.000) 16.545 3.728 ( 16.545 0.000 0.000) 16.545 4.037 ( -22.576 0.000 0.000) 22.576 4.037 ( 22.576 0.000 0.000) 22.576 4.538 ( -18.014 0.000 0.000) 18.014 4.538 ( 18.014 0.000 0.000) 18.014 4.834 ( -15.308 0.000 0.000) 15.308 4.834 ( 15.308 0.000 0.000) 15.308 5.178 ( -0.676 0.000 0.000) 0.676 5.178 ( 0.676 0.000 0.000) 0.676 5.763 ( -5.585 0.000 0.000) 5.585 5.763 ( 5.585 0.000 0.000) 5.585 5.879 ( -10.648 0.000 0.000) 10.648 5.879 ( 10.648 0.000 0.000) 10.648 6.151 ( -3.883 0.000 0.000) 3.883 6.151 ( 3.883 0.000 0.000) 3.883 6.436 ( -1.956 0.000 0.000) 1.956 6.436 ( 1.956 0.000 0.000) 1.956 6.662 ( -3.619 0.000 0.000) 3.619 6.662 ( 3.619 0.000 0.000) 3.619 6.794 ( -5.990 0.000 0.000) 5.990 6.794 ( 5.990 0.000 0.000) 5.990 7.199 ( -3.112 0.000 0.000) 3.112 7.199 ( 3.112 0.000 0.000) 3.112 7.305 ( -14.183 0.000 0.000) 14.183 7.305 ( 14.183 0.000 0.000) 14.183 7.745 ( -18.111 0.000 0.000) 18.111 7.745 ( 18.111 0.000 0.000) 18.111 7.951 ( -7.832 0.000 0.000) 7.832 7.951 ( 7.832 0.000 0.000) 7.832 8.329 ( -16.801 0.000 0.000) 16.801 8.329 ( 16.801 0.000 0.000) 16.801 8.508 ( -24.459 0.000 0.000) 24.459 8.508 ( 24.459 0.000 0.000) 24.459 8.865 ( -0.255 0.000 0.000) 0.255 8.865 ( 0.255 0.000 0.000) 0.255 8.910 ( -19.590 0.000 0.000) 19.590 8.910 ( 19.590 0.000 0.000) 19.590 9.135 ( -17.523 0.000 0.000) 17.523 9.135 ( 17.523 0.000 0.000) 17.523 9.394 ( -18.348 0.000 0.000) 18.348 9.394 ( 18.348 0.000 0.000) 18.348 9.907 ( -20.559 0.000 0.000) 20.559 9.907 ( 20.559 0.000 0.000) 20.559 10.137 ( -1.505 0.000 0.000) 1.505 10.137 ( 1.505 0.000 0.000) 1.505 10.395 ( -24.662 0.000 0.000) 24.662 10.395 ( 24.662 0.000 0.000) 24.662 10.596 ( -12.761 0.000 0.000) 12.761 10.596 ( 12.761 0.000 0.000) 12.761 10.928 ( -2.973 0.000 0.000) 2.973 10.928 ( 2.973 0.000 0.000) 2.973 11.228 ( -21.460 0.000 0.000) 21.460 11.228 ( 21.460 0.000 0.000) 21.460 11.482 ( -2.293 0.000 0.000) 2.293 11.482 ( 2.293 0.000 0.000) 2.293 11.676 ( -3.212 0.000 0.000) 3.212 11.676 ( 3.212 0.000 0.000) 3.212 12.099 ( -8.305 0.000 0.000) 8.305 12.099 ( 8.305 0.000 0.000) 8.305 12.306 ( -3.341 0.000 0.000) 3.341 12.306 ( 3.341 0.000 0.000) 3.341 12.433 ( -12.498 0.000 0.000) 12.498 12.433 ( 12.498 0.000 0.000) 12.498 12.728 ( -13.827 0.000 0.000) 13.827 12.728 ( 13.827 0.000 0.000) 13.827 13.161 ( -11.220 0.000 0.000) 11.220 13.161 ( 11.220 0.000 0.000) 11.220 13.424 ( -1.384 0.000 0.000) 1.384 13.424 ( 1.384 0.000 0.000) 1.384 13.669 ( -9.310 0.000 0.000) 9.310 13.669 ( 9.310 0.000 0.000) 9.310 14.110 ( -4.886 0.000 0.000) 4.886 14.110 ( 4.886 0.000 0.000) 4.886 14.570 ( -0.076 0.000 0.000) 0.076 14.570 ( 0.076 0.000 0.000) 0.076 15.101 ( -0.883 0.000 0.000) 0.883 15.101 ( 0.883 0.000 0.000) 0.883 15.817 ( -15.128 0.000 0.000) 15.128 15.817 ( 15.128 0.000 0.000) 15.128 15.900 ( -1.717 0.000 0.000) 1.717 15.900 ( 1.717 0.000 0.000) 1.717 16.130 ( -8.178 0.000 0.000) 8.178 16.130 ( 8.178 0.000 0.000) 8.178 16.720 ( -4.527 0.000 0.000) 4.527 16.720 ( 4.527 0.000 0.000) 4.527 17.434 ( -17.764 0.000 0.000) 17.764 17.434 ( 17.764 0.000 0.000) 17.764 19.415 ( -29.927 0.000 0.000) 29.927 19.415 ( 29.927 0.000 0.000) 29.927 20.186 ( -24.958 0.000 0.000) 24.958 20.186 ( 24.958 0.000 0.000) 24.958 20.649 ( -20.077 0.000 0.000) 20.077 20.649 ( 20.077 0.000 0.000) 20.077 20.993 ( -24.596 0.000 0.000) 24.596 20.993 ( 24.596 0.000 0.000) 24.596 26.254 ( -3.459 0.000 0.000) 3.459 26.254 ( 3.459 0.000 0.000) 3.459 26.701 ( -3.125 0.000 0.000) 3.125 26.701 ( 3.125 0.000 0.000) 3.125 27.344 ( -3.081 0.000 0.000) 3.081 27.344 ( 3.081 0.000 0.000) 3.081 27.944 ( -4.448 0.000 0.000) 4.448 27.944 ( 4.448 0.000 0.000) 4.448 28.131 ( -4.437 0.000 0.000) 4.437 28.131 ( 4.437 0.000 0.000) 4.437 28.451 ( -11.692 0.000 0.000) 11.692 28.451 ( 11.692 0.000 0.000) 11.692 29.295 ( -1.231 0.000 0.000) 1.231 29.295 ( 1.231 0.000 0.000) 1.231 29.643 ( -2.440 0.000 0.000) 2.440 29.643 ( 2.440 0.000 0.000) 2.440 29.840 ( -6.655 0.000 0.000) 6.655 29.840 ( 6.655 0.000 0.000) 6.655 30.575 ( -4.570 0.000 0.000) 4.570 30.575 ( 4.570 0.000 0.000) 4.570 31.179 ( -1.658 0.000 0.000) 1.658 31.179 ( 1.658 0.000 0.000) 1.658 32.129 ( -17.496 0.000 0.000) 17.496 32.129 ( 17.496 0.000 0.000) 17.496 ======================= Grid point 11 (7/72) ======================= q-point: ( 0.00 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.904 ( 0.000 48.531 0.000) 48.531 0.959 ( 0.000 49.296 0.000) 49.296 1.290 ( 0.000 66.685 0.000) 66.685 2.954 ( 0.000 -4.335 0.000) 4.335 3.139 ( 0.000 4.249 0.000) 4.249 3.416 ( 0.000 0.781 0.000) 0.781 4.045 ( 0.000 -1.308 0.000) 1.308 4.568 ( 0.000 4.823 0.000) 4.823 4.568 ( 0.000 4.022 0.000) 4.022 4.634 ( 0.000 6.826 0.000) 6.826 4.752 ( 0.000 -26.665 0.000) 26.665 5.323 ( 0.000 -0.822 0.000) 0.822 5.463 ( 0.000 -7.788 0.000) 7.788 5.644 ( 0.000 -13.914 0.000) 13.914 5.735 ( 0.000 -2.240 0.000) 2.240 5.812 ( 0.000 -0.190 0.000) 0.190 5.830 ( 0.000 -0.780 0.000) 0.780 6.258 ( 0.000 4.890 0.000) 4.890 6.418 ( 0.000 -1.471 0.000) 1.471 6.582 ( 0.000 5.115 0.000) 5.115 6.673 ( 0.000 -15.841 0.000) 15.841 6.770 ( 0.000 9.046 0.000) 9.046 6.917 ( 0.000 -11.705 0.000) 11.705 7.061 ( 0.000 -14.448 0.000) 14.448 7.150 ( 0.000 10.981 0.000) 10.981 7.231 ( 0.000 -12.059 0.000) 12.059 7.674 ( 0.000 -2.612 0.000) 2.612 8.074 ( 0.000 0.271 0.000) 0.271 8.181 ( 0.000 6.326 0.000) 6.326 8.215 ( 0.000 7.556 0.000) 7.556 8.276 ( 0.000 -12.819 0.000) 12.819 8.677 ( 0.000 -2.634 0.000) 2.634 8.728 ( 0.000 -14.719 0.000) 14.719 8.898 ( 0.000 -0.579 0.000) 0.579 9.069 ( 0.000 7.184 0.000) 7.184 9.255 ( 0.000 1.225 0.000) 1.225 9.322 ( 0.000 3.004 0.000) 3.004 9.322 ( 0.000 4.973 0.000) 4.973 9.528 ( 0.000 5.867 0.000) 5.867 9.557 ( 0.000 9.703 0.000) 9.703 9.683 ( 0.000 -3.101 0.000) 3.101 9.693 ( 0.000 -4.835 0.000) 4.835 9.780 ( 0.000 9.894 0.000) 9.894 9.985 ( 0.000 5.595 0.000) 5.595 9.999 ( 0.000 12.350 0.000) 12.350 10.168 ( 0.000 15.541 0.000) 15.541 10.212 ( 0.000 -9.533 0.000) 9.533 10.609 ( 0.000 -0.870 0.000) 0.870 10.725 ( 0.000 -4.592 0.000) 4.592 10.829 ( 0.000 -5.956 0.000) 5.956 10.980 ( 0.000 -1.638 0.000) 1.638 11.154 ( 0.000 2.339 0.000) 2.339 11.301 ( 0.000 2.854 0.000) 2.854 11.555 ( 0.000 -3.364 0.000) 3.364 11.581 ( 0.000 0.148 0.000) 0.148 11.716 ( 0.000 -6.903 0.000) 6.903 11.755 ( 0.000 -4.785 0.000) 4.785 11.816 ( 0.000 1.245 0.000) 1.245 12.027 ( 0.000 2.513 0.000) 2.513 12.172 ( 0.000 -6.217 0.000) 6.217 12.208 ( 0.000 1.484 0.000) 1.484 12.395 ( 0.000 -0.432 0.000) 0.432 12.571 ( 0.000 3.822 0.000) 3.822 12.893 ( 0.000 -4.649 0.000) 4.649 12.977 ( 0.000 -0.609 0.000) 0.609 13.049 ( 0.000 0.189 0.000) 0.189 13.160 ( 0.000 1.181 0.000) 1.181 13.354 ( 0.000 -4.760 0.000) 4.760 13.611 ( 0.000 1.227 0.000) 1.227 13.727 ( 0.000 6.696 0.000) 6.696 13.930 ( 0.000 -2.257 0.000) 2.257 14.180 ( 0.000 0.773 0.000) 0.773 14.223 ( 0.000 -1.538 0.000) 1.538 14.563 ( 0.000 -0.925 0.000) 0.925 14.773 ( 0.000 6.559 0.000) 6.559 14.960 ( 0.000 -6.787 0.000) 6.787 14.978 ( 0.000 -6.054 0.000) 6.054 15.215 ( 0.000 -0.226 0.000) 0.226 15.327 ( 0.000 6.433 0.000) 6.433 15.610 ( 0.000 -0.020 0.000) 0.020 15.706 ( 0.000 9.858 0.000) 9.858 15.844 ( 0.000 3.908 0.000) 3.908 15.852 ( 0.000 3.569 0.000) 3.569 16.225 ( 0.000 1.009 0.000) 1.009 16.252 ( 0.000 -1.542 0.000) 1.542 16.634 ( 0.000 0.358 0.000) 0.358 16.713 ( 0.000 -0.717 0.000) 0.717 16.903 ( 0.000 -6.439 0.000) 6.439 18.666 ( 0.000 2.560 0.000) 2.560 19.223 ( 0.000 -5.261 0.000) 5.261 19.622 ( 0.000 0.132 0.000) 0.132 19.783 ( 0.000 -4.684 0.000) 4.684 21.528 ( 0.000 4.502 0.000) 4.502 21.655 ( 0.000 1.599 0.000) 1.599 22.048 ( 0.000 -1.015 0.000) 1.015 22.092 ( 0.000 -1.561 0.000) 1.561 25.999 ( 0.000 2.451 0.000) 2.451 26.092 ( 0.000 -0.137 0.000) 0.137 26.110 ( 0.000 0.385 0.000) 0.385 26.439 ( 0.000 -3.807 0.000) 3.807 26.833 ( 0.000 0.568 0.000) 0.568 26.980 ( 0.000 -2.376 0.000) 2.376 27.157 ( 0.000 0.144 0.000) 0.144 27.165 ( 0.000 0.056 0.000) 0.056 27.480 ( 0.000 -0.859 0.000) 0.859 27.510 ( 0.000 -0.664 0.000) 0.664 28.074 ( 0.000 3.122 0.000) 3.122 28.305 ( 0.000 -1.896 0.000) 1.896 29.236 ( 0.000 2.538 0.000) 2.538 29.441 ( 0.000 3.411 0.000) 3.411 29.446 ( 0.000 -3.346 0.000) 3.346 29.681 ( 0.000 3.521 0.000) 3.521 29.798 ( 0.000 3.483 0.000) 3.483 29.976 ( 0.000 2.021 0.000) 2.021 30.393 ( 0.000 0.460 0.000) 0.460 30.488 ( 0.000 -2.211 0.000) 2.211 31.113 ( 0.000 -0.768 0.000) 0.768 31.214 ( 0.000 -1.717 0.000) 1.717 33.440 ( 0.000 -0.276 0.000) 0.276 33.604 ( 0.000 -3.235 0.000) 3.235 ======================= Grid point 12 (8/72) ======================= q-point: ( 0.10 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.077 ( 23.374 31.813 0.000) 39.477 1.211 ( 28.280 36.244 0.000) 45.972 1.899 ( 49.611 46.829 0.000) 68.222 3.189 ( 6.675 2.903 0.000) 7.279 3.426 ( 39.888 -7.842 0.000) 40.651 3.803 ( 35.754 -0.618 0.000) 35.760 4.303 ( 19.550 -4.054 0.000) 19.966 4.512 ( -0.672 -1.347 0.000) 1.506 4.661 ( 7.392 1.927 0.000) 7.639 4.728 ( 15.405 6.939 0.000) 16.895 4.910 ( 11.587 -26.611 0.000) 29.024 5.274 ( -1.841 -1.307 0.000) 2.258 5.494 ( -0.331 -3.360 0.000) 3.376 5.587 ( -2.870 -7.859 0.000) 8.366 5.777 ( 0.599 -2.805 0.000) 2.869 5.865 ( 4.638 0.714 0.000) 4.693 5.964 ( 16.718 0.149 0.000) 16.719 6.219 ( -2.808 4.871 0.000) 5.623 6.294 ( -12.005 -4.527 0.000) 12.830 6.532 ( 1.413 7.541 0.000) 7.672 6.604 ( 0.428 -5.427 0.000) 5.444 6.721 ( -8.951 -4.266 0.000) 9.916 6.824 ( -3.447 2.944 0.000) 4.533 6.987 ( -4.077 -3.537 0.000) 5.397 7.170 ( 2.346 0.960 0.000) 2.535 7.302 ( -0.489 -1.786 0.000) 1.852 7.727 ( -0.761 5.223 0.000) 5.278 7.934 ( -7.807 2.603 0.000) 8.230 8.102 ( -5.145 -3.216 0.000) 6.067 8.204 ( -5.511 7.884 0.000) 9.619 8.306 ( 2.416 -7.804 0.000) 8.170 8.617 ( -3.937 1.196 0.000) 4.114 8.682 ( -2.087 -12.424 0.000) 12.598 8.814 ( -6.210 1.994 0.000) 6.522 8.990 ( -10.447 7.388 0.000) 12.795 9.060 ( -17.371 3.478 0.000) 17.716 9.170 ( -10.147 8.028 0.000) 12.939 9.351 ( 3.333 -0.749 0.000) 3.416 9.388 ( -3.488 1.011 0.000) 3.632 9.461 ( -10.497 6.532 0.000) 12.364 9.648 ( 1.087 3.845 0.000) 3.995 9.722 ( -0.425 -0.443 0.000) 0.614 9.821 ( 5.512 1.735 0.000) 5.779 10.019 ( 0.747 2.480 0.000) 2.590 10.118 ( 7.921 -3.722 0.000) 8.751 10.274 ( 4.785 -2.666 0.000) 5.477 10.392 ( 6.845 0.524 0.000) 6.865 10.589 ( 0.375 6.426 0.000) 6.437 10.633 ( 2.526 -1.488 0.000) 2.932 10.865 ( 0.916 -0.686 0.000) 1.144 11.012 ( 3.357 -1.537 0.000) 3.693 11.148 ( -0.247 6.323 0.000) 6.328 11.200 ( -4.927 2.280 0.000) 5.429 11.432 ( -5.906 -1.831 0.000) 6.183 11.578 ( -4.270 -3.334 0.000) 5.418 11.658 ( -1.720 1.500 0.000) 2.282 11.784 ( 1.246 -1.257 0.000) 1.770 11.809 ( -1.888 -3.633 0.000) 4.094 11.978 ( -9.278 -1.099 0.000) 9.343 12.100 ( -11.319 5.056 0.000) 12.397 12.258 ( -1.449 7.683 0.000) 7.819 12.267 ( -0.244 -2.114 0.000) 2.128 12.430 ( -5.236 -2.875 0.000) 5.974 12.911 ( -1.231 -4.824 0.000) 4.978 13.023 ( -0.676 -3.953 0.000) 4.010 13.073 ( -3.717 1.171 0.000) 3.897 13.269 ( -3.880 -2.918 0.000) 4.855 13.361 ( 17.089 -6.737 0.000) 18.369 13.706 ( -11.379 1.848 0.000) 11.528 13.758 ( 0.161 2.701 0.000) 2.706 13.872 ( 9.589 -1.349 0.000) 9.683 14.135 ( -0.703 4.523 0.000) 4.577 14.203 ( 0.306 -0.101 0.000) 0.322 14.449 ( 2.512 7.879 0.000) 8.270 14.688 ( -3.668 -0.382 0.000) 3.688 14.843 ( -8.368 -5.874 0.000) 10.224 14.972 ( -2.152 -0.287 0.000) 2.171 15.240 ( 0.036 4.798 0.000) 4.798 15.478 ( 2.427 -4.206 0.000) 4.856 15.630 ( 1.823 1.068 0.000) 2.112 15.695 ( -0.711 5.949 0.000) 5.991 15.800 ( 0.931 4.889 0.000) 4.977 15.894 ( 6.975 5.331 0.000) 8.779 16.081 ( 7.129 6.294 0.000) 9.510 16.433 ( 10.584 -2.185 0.000) 10.807 16.522 ( -13.059 -1.215 0.000) 13.115 16.795 ( -8.064 -3.541 0.000) 8.808 17.506 ( 28.529 -37.015 0.000) 46.733 18.683 ( 2.584 0.650 0.000) 2.665 19.163 ( -6.692 -6.475 0.000) 9.312 19.647 ( 2.851 0.089 0.000) 2.852 19.848 ( 4.293 -8.165 0.000) 9.224 21.409 ( -11.090 6.406 0.000) 12.807 21.577 ( -6.699 5.899 0.000) 8.926 21.959 ( -7.627 0.159 0.000) 7.628 22.078 ( -2.851 -1.110 0.000) 3.060 25.949 ( 3.092 4.498 0.000) 5.458 26.163 ( 5.347 -1.037 0.000) 5.446 26.340 ( 6.660 -3.376 0.000) 7.467 26.562 ( 11.461 -5.211 0.000) 12.590 26.802 ( 3.928 4.653 0.000) 6.089 27.031 ( 3.391 -2.657 0.000) 4.308 27.140 ( 0.915 1.868 0.000) 2.080 27.337 ( 7.666 -3.239 0.000) 8.322 27.574 ( 7.577 -1.466 0.000) 7.717 27.770 ( 13.897 -8.819 0.000) 16.459 28.104 ( 3.424 2.406 0.000) 4.185 28.609 ( 21.901 -29.699 0.000) 36.901 29.258 ( 2.334 2.356 0.000) 3.316 29.367 ( -4.426 1.985 0.000) 4.851 29.463 ( -0.377 -0.405 0.000) 0.554 29.727 ( 1.716 -3.085 0.000) 3.530 29.838 ( 4.954 1.574 0.000) 5.198 29.942 ( -3.609 1.912 0.000) 4.084 30.386 ( 0.344 2.640 0.000) 2.662 30.554 ( 5.019 -7.291 0.000) 8.851 31.110 ( -0.001 -0.588 0.000) 0.588 31.203 ( -0.974 -1.601 0.000) 1.873 32.739 ( -42.016 39.373 0.000) 57.581 33.547 ( -10.223 -4.997 0.000) 11.379 ======================= Grid point 13 (9/72) ======================= q-point: ( 0.20 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.734 ( 40.475 4.647 0.000) 40.741 1.876 ( 38.499 22.212 0.000) 44.447 2.975 ( 58.065 29.335 0.000) 65.055 3.325 ( 9.099 3.829 0.000) 9.872 4.160 ( 18.766 -24.423 0.000) 30.800 4.445 ( 19.633 1.198 0.000) 19.669 4.548 ( 19.419 -4.961 0.000) 20.043 4.733 ( 28.265 -5.062 0.000) 28.714 4.800 ( 5.058 -7.120 0.000) 8.734 5.106 ( 12.658 -4.687 0.000) 13.498 5.270 ( -1.130 -9.833 0.000) 9.898 5.343 ( 29.408 -3.322 0.000) 29.595 5.522 ( 1.730 -12.114 0.000) 12.237 5.548 ( 9.321 2.820 0.000) 9.739 5.808 ( 3.720 1.893 0.000) 4.174 5.984 ( 7.162 6.562 0.000) 9.714 6.100 ( 1.287 0.285 0.000) 1.319 6.236 ( 9.324 1.321 0.000) 9.417 6.396 ( 7.009 -5.072 0.000) 8.651 6.541 ( -3.377 10.940 0.000) 11.450 6.595 ( 8.572 -0.365 0.000) 8.579 6.645 ( 3.372 -4.398 0.000) 5.542 6.826 ( 4.563 12.763 0.000) 13.554 6.937 ( -1.247 -4.568 0.000) 4.735 7.145 ( -10.387 4.535 0.000) 11.334 7.234 ( 1.600 5.973 0.000) 6.184 7.646 ( -4.656 5.482 0.000) 7.192 7.752 ( -10.399 5.661 0.000) 11.840 7.986 ( -14.115 3.082 0.000) 14.448 8.100 ( -0.110 -2.695 0.000) 2.698 8.309 ( -2.277 -0.710 0.000) 2.385 8.509 ( -7.709 -1.242 0.000) 7.808 8.557 ( -9.604 -1.443 0.000) 9.712 8.699 ( -10.133 5.290 0.000) 11.431 8.813 ( 0.963 0.758 0.000) 1.226 8.908 ( -0.274 -0.255 0.000) 0.374 8.964 ( -9.068 4.486 0.000) 10.117 9.254 ( -7.097 1.147 0.000) 7.189 9.313 ( -2.467 -4.965 0.000) 5.544 9.480 ( -3.064 5.211 0.000) 6.045 9.646 ( -5.825 2.323 0.000) 6.271 9.731 ( 9.880 -8.505 0.000) 13.036 9.850 ( -12.167 -7.585 0.000) 14.338 9.959 ( 1.238 0.962 0.000) 1.568 10.216 ( 3.497 -7.547 0.000) 8.318 10.341 ( 0.708 -6.947 0.000) 6.983 10.357 ( -1.713 2.280 0.000) 2.851 10.507 ( -7.271 -5.257 0.000) 8.973 10.781 ( -3.523 -2.144 0.000) 4.125 10.931 ( 9.103 2.472 0.000) 9.433 11.075 ( -9.164 7.655 0.000) 11.941 11.130 ( 0.449 2.599 0.000) 2.638 11.178 ( 9.587 4.586 0.000) 10.628 11.433 ( 2.967 -0.794 0.000) 3.071 11.453 ( -3.018 6.252 0.000) 6.943 11.617 ( -3.859 -2.999 0.000) 4.887 11.702 ( -7.398 2.470 0.000) 7.799 11.776 ( -6.186 -1.758 0.000) 6.431 11.862 ( -3.400 5.700 0.000) 6.637 11.888 ( 1.282 -2.392 0.000) 2.714 12.157 ( -9.778 0.361 0.000) 9.785 12.213 ( -2.496 12.325 0.000) 12.575 12.509 ( 9.751 -7.915 0.000) 12.559 12.780 ( -13.584 0.352 0.000) 13.589 12.960 ( -7.594 -6.748 0.000) 10.159 13.050 ( 2.205 -5.791 0.000) 6.197 13.238 ( 0.743 2.941 0.000) 3.034 13.360 ( -14.447 4.729 0.000) 15.201 13.633 ( 2.319 3.575 0.000) 4.261 13.722 ( 0.485 -5.010 0.000) 5.034 13.927 ( -3.523 -6.961 0.000) 7.802 14.242 ( 1.364 1.122 0.000) 1.766 14.265 ( 6.044 -3.544 0.000) 7.007 14.441 ( -5.264 -3.453 0.000) 6.295 14.657 ( 1.209 -2.181 0.000) 2.493 14.704 ( -7.772 0.604 0.000) 7.796 14.974 ( 2.615 0.632 0.000) 2.690 15.200 ( -6.372 11.567 0.000) 13.206 15.442 ( 3.847 -4.705 0.000) 6.078 15.646 ( 3.002 3.590 0.000) 4.680 15.704 ( -5.972 5.038 0.000) 7.813 15.935 ( 8.387 -3.363 0.000) 9.036 16.004 ( 1.029 -1.423 0.000) 1.756 16.198 ( 3.363 2.851 0.000) 4.409 16.349 ( 7.331 9.057 0.000) 11.653 16.617 ( -4.841 -1.299 0.000) 5.012 16.720 ( 10.584 -0.289 0.000) 10.588 17.758 ( 3.670 -23.890 0.000) 24.171 18.751 ( 1.497 -2.261 0.000) 2.712 19.036 ( -1.137 -5.974 0.000) 6.081 19.746 ( 8.028 -0.026 0.000) 8.028 19.952 ( 7.480 -5.514 0.000) 9.293 21.119 ( -19.513 8.029 0.000) 21.100 21.375 ( -14.162 3.836 0.000) 14.672 21.769 ( -12.608 1.752 0.000) 12.729 21.976 ( -7.865 -1.157 0.000) 7.950 26.045 ( 5.569 2.968 0.000) 6.310 26.266 ( 4.620 -2.533 0.000) 5.269 26.452 ( 5.863 2.500 0.000) 6.374 26.711 ( 4.138 -1.228 0.000) 4.316 27.008 ( 14.308 -1.413 0.000) 14.378 27.079 ( 3.263 -1.829 0.000) 3.740 27.243 ( 8.777 3.338 0.000) 9.390 27.474 ( 7.793 -0.529 0.000) 7.811 27.783 ( 12.751 -2.863 0.000) 13.068 27.942 ( 6.830 -0.151 0.000) 6.832 28.191 ( 4.942 0.808 0.000) 5.008 28.843 ( 2.719 -23.931 0.000) 24.085 29.282 ( -1.918 3.901 0.000) 4.347 29.339 ( 3.479 -1.124 0.000) 3.656 29.448 ( -0.309 1.100 0.000) 1.142 29.727 ( -0.906 -2.920 0.000) 3.057 29.840 ( -6.739 1.792 0.000) 6.973 29.927 ( 2.848 -4.370 0.000) 5.216 30.417 ( 2.581 3.800 0.000) 4.594 30.635 ( 3.076 -9.546 0.000) 10.029 31.122 ( 0.945 1.110 0.000) 1.458 31.192 ( 0.525 -2.457 0.000) 2.512 32.148 ( -20.749 33.983 0.000) 39.817 33.262 ( -18.445 -5.059 0.000) 19.126 ======================= Grid point 14 (10/72) ======================= q-point: ( 0.30 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.530 ( 40.615 -1.551 0.000) 40.645 2.636 ( 39.697 12.591 0.000) 41.646 3.532 ( 13.177 0.972 0.000) 13.213 3.928 ( 29.734 -4.131 0.000) 30.019 4.287 ( 14.228 -10.322 0.000) 17.578 4.623 ( -2.071 0.601 0.000) 2.156 4.853 ( 2.383 -14.858 0.000) 15.048 4.969 ( 8.040 -4.721 0.000) 9.324 5.159 ( -1.225 0.791 0.000) 1.458 5.194 ( 7.990 0.123 0.000) 7.991 5.331 ( 15.844 -10.329 0.000) 18.914 5.547 ( 6.078 -3.947 0.000) 7.247 5.627 ( 3.921 -11.665 0.000) 12.307 5.762 ( 6.094 5.573 0.000) 8.258 5.969 ( 9.413 4.309 0.000) 10.353 6.210 ( 14.068 10.906 0.000) 17.800 6.365 ( -0.223 3.519 0.000) 3.526 6.398 ( -6.006 -0.389 0.000) 6.019 6.403 ( 20.772 3.933 0.000) 21.141 6.591 ( 17.052 0.163 0.000) 17.053 6.738 ( -0.197 3.146 0.000) 3.152 6.845 ( 5.202 3.063 0.000) 6.037 6.926 ( -0.222 -0.625 0.000) 0.663 7.019 ( 20.406 18.827 0.000) 27.764 7.083 ( 10.672 -4.554 0.000) 11.603 7.292 ( 4.836 8.797 0.000) 10.038 7.520 ( -5.547 2.181 0.000) 5.961 7.698 ( 0.125 -4.816 0.000) 4.817 7.751 ( -1.785 8.242 0.000) 8.433 7.993 ( -5.959 -4.849 0.000) 7.682 8.313 ( -3.367 1.875 0.000) 3.853 8.332 ( -9.553 5.331 0.000) 10.940 8.407 ( -5.376 -1.818 0.000) 5.675 8.631 ( 6.272 7.414 0.000) 9.711 8.754 ( -2.984 4.449 0.000) 5.358 8.904 ( 1.465 -4.299 0.000) 4.542 9.014 ( -1.331 -2.278 0.000) 2.638 9.061 ( -3.959 -3.264 0.000) 5.131 9.214 ( -15.007 -8.409 0.000) 17.202 9.387 ( 0.495 -1.327 0.000) 1.416 9.491 ( -8.156 5.312 0.000) 9.733 9.655 ( -4.615 -0.942 0.000) 4.710 9.838 ( -7.398 -0.612 0.000) 7.423 10.001 ( 6.586 -3.304 0.000) 7.368 10.196 ( -8.382 2.132 0.000) 8.649 10.264 ( -9.974 -4.724 0.000) 11.036 10.361 ( 4.099 -6.569 0.000) 7.743 10.386 ( -2.053 -12.358 0.000) 12.527 10.717 ( -6.306 2.951 0.000) 6.962 10.809 ( -7.234 4.059 0.000) 8.295 11.014 ( -1.722 2.211 0.000) 2.802 11.130 ( 0.960 6.470 0.000) 6.541 11.277 ( -7.871 -4.149 0.000) 8.897 11.382 ( -4.896 -2.449 0.000) 5.474 11.450 ( -1.160 4.941 0.000) 5.076 11.553 ( -1.063 -0.277 0.000) 1.098 11.695 ( -1.148 0.221 0.000) 1.169 11.730 ( 8.700 4.689 0.000) 9.883 11.891 ( 7.115 -3.063 0.000) 7.746 11.996 ( 5.629 2.948 0.000) 6.354 12.008 ( -1.788 0.200 0.000) 1.799 12.224 ( 2.814 7.354 0.000) 7.874 12.424 ( -17.238 3.898 0.000) 17.673 12.724 ( 9.436 -5.524 0.000) 10.934 12.759 ( -11.750 -7.601 0.000) 13.994 13.047 ( -12.270 2.203 0.000) 12.466 13.089 ( -2.255 -7.626 0.000) 7.953 13.316 ( 0.937 3.779 0.000) 3.893 13.572 ( -4.490 1.676 0.000) 4.793 13.689 ( -7.816 -2.290 0.000) 8.144 13.847 ( -3.716 -1.501 0.000) 4.008 14.116 ( -9.520 -10.437 0.000) 14.126 14.257 ( -13.505 0.107 0.000) 13.506 14.414 ( -7.184 2.557 0.000) 7.625 14.466 ( 1.059 -1.159 0.000) 1.570 14.631 ( -6.579 -0.527 0.000) 6.600 15.047 ( 3.579 0.041 0.000) 3.580 15.211 ( 9.847 5.788 0.000) 11.422 15.357 ( -10.492 5.424 0.000) 11.811 15.705 ( 6.466 -2.476 0.000) 6.924 15.811 ( 11.128 2.527 0.000) 11.411 15.949 ( -2.304 0.092 0.000) 2.306 16.087 ( 3.957 0.451 0.000) 3.983 16.262 ( 1.814 0.730 0.000) 1.955 16.516 ( 7.215 3.460 0.000) 8.001 16.680 ( 10.404 -0.296 0.000) 10.408 16.868 ( 4.249 0.098 0.000) 4.250 17.749 ( -4.012 -16.442 0.000) 16.925 18.740 ( 3.290 1.487 0.000) 3.611 19.233 ( 18.350 -5.142 0.000) 19.057 19.966 ( 14.661 -0.551 0.000) 14.671 20.156 ( 14.104 -3.426 0.000) 14.514 20.666 ( -26.964 8.695 0.000) 28.332 21.051 ( -19.283 1.880 0.000) 19.374 21.467 ( -18.650 2.135 0.000) 18.772 21.762 ( -14.731 -2.089 0.000) 14.878 26.137 ( 3.972 2.123 0.000) 4.504 26.326 ( 1.233 -2.117 0.000) 2.450 26.550 ( 4.257 2.472 0.000) 4.923 26.751 ( 0.240 -1.007 0.000) 1.035 27.156 ( 6.312 -0.412 0.000) 6.325 27.279 ( 10.188 -1.200 0.000) 10.258 27.448 ( 12.730 1.809 0.000) 12.858 27.654 ( 10.537 1.767 0.000) 10.685 28.015 ( 10.508 -2.098 0.000) 10.715 28.073 ( 6.720 1.001 0.000) 6.794 28.264 ( 1.887 -0.573 0.000) 1.972 28.784 ( -7.163 -13.240 0.000) 15.053 29.264 ( 0.236 2.509 0.000) 2.520 29.363 ( -1.123 0.259 0.000) 1.152 29.515 ( 6.757 0.085 0.000) 6.757 29.685 ( -4.530 -1.737 0.000) 4.851 29.729 ( -2.638 0.802 0.000) 2.757 29.944 ( -0.778 -4.304 0.000) 4.374 30.471 ( 2.947 3.872 0.000) 4.866 30.670 ( 0.424 -5.959 0.000) 5.975 31.136 ( 0.878 2.049 0.000) 2.229 31.231 ( 2.702 -0.462 0.000) 2.741 31.888 ( -6.868 18.157 0.000) 19.413 32.871 ( -21.434 -4.938 0.000) 21.996 ======================= Grid point 15 (11/72) ======================= q-point: ( 0.40 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.221 ( 29.599 -4.164 0.000) 29.890 3.380 ( 37.597 10.405 0.000) 39.010 3.847 ( 18.621 -5.504 0.000) 19.417 4.091 ( -4.580 -18.108 0.000) 18.679 4.490 ( 1.477 -3.211 0.000) 3.535 4.565 ( -6.021 -4.814 0.000) 7.708 4.759 ( -14.865 -19.198 0.000) 24.280 4.901 ( -9.561 8.354 0.000) 12.697 5.193 ( 4.474 3.558 0.000) 5.716 5.276 ( 10.427 -3.051 0.000) 10.864 5.579 ( 4.547 -7.909 0.000) 9.123 5.714 ( -0.045 -0.020 0.000) 0.049 5.752 ( 12.261 2.499 0.000) 12.513 5.922 ( 15.239 7.816 0.000) 17.126 6.078 ( -2.131 -1.428 0.000) 2.565 6.238 ( -4.891 1.517 0.000) 5.121 6.431 ( 4.827 5.190 0.000) 7.088 6.458 ( 7.948 -2.277 0.000) 8.268 6.568 ( -3.499 8.390 0.000) 9.090 6.687 ( 5.860 1.816 0.000) 6.135 6.831 ( -0.162 2.565 0.000) 2.570 6.840 ( 9.797 -0.873 0.000) 9.836 7.034 ( 2.086 7.127 0.000) 7.426 7.147 ( -0.897 8.527 0.000) 8.574 7.367 ( 3.091 16.184 0.000) 16.476 7.429 ( 6.519 -6.112 0.000) 8.936 7.507 ( 6.848 2.559 0.000) 7.310 7.787 ( 7.146 -13.705 0.000) 15.456 7.966 ( -10.912 0.500 0.000) 10.923 8.028 ( 10.817 -0.450 0.000) 10.827 8.092 ( 15.020 -3.099 0.000) 15.336 8.287 ( -3.088 9.438 0.000) 9.931 8.422 ( 12.724 4.165 0.000) 13.389 8.705 ( -6.146 0.032 0.000) 6.147 8.796 ( 2.925 -0.877 0.000) 3.053 8.872 ( -6.905 0.495 0.000) 6.923 8.905 ( -4.980 -1.235 0.000) 5.130 8.992 ( 1.024 3.066 0.000) 3.233 9.119 ( 1.248 2.455 0.000) 2.754 9.206 ( -6.619 1.124 0.000) 6.714 9.445 ( -9.130 -1.694 0.000) 9.285 9.617 ( 3.834 0.780 0.000) 3.912 9.813 ( -6.871 -0.182 0.000) 6.873 9.885 ( -1.880 3.870 0.000) 4.303 10.090 ( -0.243 -10.317 0.000) 10.320 10.146 ( -1.158 -1.480 0.000) 1.880 10.347 ( 3.039 -1.625 0.000) 3.446 10.385 ( -12.264 -0.649 0.000) 12.282 10.651 ( 7.996 -8.135 0.000) 11.407 10.823 ( -1.047 4.806 0.000) 4.919 10.939 ( -4.428 0.775 0.000) 4.496 10.967 ( -18.288 -0.217 0.000) 18.290 11.090 ( -6.203 5.211 0.000) 8.101 11.307 ( 2.854 -7.333 0.000) 7.868 11.455 ( -0.277 0.912 0.000) 0.953 11.583 ( 0.788 1.361 0.000) 1.573 11.663 ( -2.554 1.710 0.000) 3.074 11.786 ( -7.692 -4.065 0.000) 8.700 11.941 ( 3.619 3.404 0.000) 4.968 12.090 ( 6.105 -0.313 0.000) 6.113 12.191 ( 12.475 0.617 0.000) 12.491 12.246 ( 2.113 4.258 0.000) 4.753 12.354 ( 8.038 1.901 0.000) 8.260 12.531 ( -8.819 -6.577 0.000) 11.001 12.797 ( -12.607 2.627 0.000) 12.878 12.898 ( 1.528 -5.920 0.000) 6.114 12.979 ( -4.831 -4.753 0.000) 6.777 13.233 ( -7.464 -3.984 0.000) 8.461 13.414 ( -10.734 -6.758 0.000) 12.684 13.542 ( -11.729 2.978 0.000) 12.101 13.753 ( -1.992 5.060 0.000) 5.438 13.948 ( -8.839 1.404 0.000) 8.950 14.006 ( -1.215 -2.136 0.000) 2.457 14.287 ( -10.342 2.748 0.000) 10.701 14.504 ( 2.633 -3.645 0.000) 4.497 14.558 ( -0.569 -1.562 0.000) 1.662 15.105 ( 2.574 2.691 0.000) 3.724 15.206 ( -4.052 7.263 0.000) 8.317 15.496 ( 15.966 0.785 0.000) 15.985 15.805 ( 2.919 -5.510 0.000) 6.236 15.917 ( 0.789 2.159 0.000) 2.299 15.977 ( 3.307 1.082 0.000) 3.480 16.098 ( -1.195 4.850 0.000) 4.995 16.256 ( -3.099 0.515 0.000) 3.142 16.637 ( 5.309 1.028 0.000) 5.407 16.788 ( -1.927 -1.439 0.000) 2.405 17.026 ( 15.216 -4.163 0.000) 15.775 17.604 ( -11.013 -12.492 0.000) 16.653 18.987 ( 21.772 7.036 0.000) 22.881 19.656 ( 24.222 -4.622 0.000) 24.659 20.106 ( -29.502 9.137 0.000) 30.884 20.287 ( 17.299 -0.115 0.000) 17.299 20.502 ( 21.169 -3.078 0.000) 21.392 20.643 ( -22.375 -0.214 0.000) 22.376 21.073 ( -21.626 2.015 0.000) 21.720 21.412 ( -21.379 -2.930 0.000) 21.579 26.203 ( 3.100 1.526 0.000) 3.455 26.314 ( -2.083 -0.369 0.000) 2.116 26.622 ( 3.413 -0.313 0.000) 3.427 26.731 ( -2.038 -1.723 0.000) 2.669 27.285 ( 6.371 2.228 0.000) 6.749 27.393 ( 2.200 2.376 0.000) 3.238 27.711 ( 13.540 -1.878 0.000) 13.669 27.852 ( 9.241 1.138 0.000) 9.311 28.121 ( 0.216 -1.376 0.000) 1.393 28.225 ( 3.757 -0.339 0.000) 3.772 28.255 ( 2.445 0.190 0.000) 2.453 28.617 ( -9.353 -6.653 0.000) 11.478 29.281 ( 1.272 1.533 0.000) 1.992 29.336 ( -1.438 1.606 0.000) 2.155 29.608 ( 0.000 -0.929 0.000) 0.929 29.642 ( 1.610 -3.165 0.000) 3.551 29.722 ( 2.955 1.148 0.000) 3.170 29.906 ( -3.165 -3.114 0.000) 4.440 30.530 ( 3.212 3.071 0.000) 4.444 30.650 ( -2.251 -1.347 0.000) 2.623 31.166 ( 2.271 2.044 0.000) 3.055 31.256 ( -0.652 4.084 0.000) 4.136 31.886 ( 6.548 4.474 0.000) 7.931 32.464 ( -20.356 -4.058 0.000) 20.756 ======================= Grid point 16 (12/72) ======================= q-point: (-0.50 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.695 ( -20.381 -3.691 0.000) 20.712 3.695 ( 20.381 -3.691 0.000) 20.712 4.070 ( -21.595 4.234 0.000) 22.007 4.070 ( 21.595 4.234 0.000) 22.007 4.406 ( -13.697 -17.369 0.000) 22.120 4.406 ( 13.697 -17.369 0.000) 22.120 4.684 ( -10.410 -2.687 0.000) 10.751 4.684 ( 10.410 -2.687 0.000) 10.751 5.321 ( -1.693 6.292 0.000) 6.516 5.321 ( 1.693 6.292 0.000) 6.516 5.667 ( -2.481 -9.457 0.000) 9.777 5.667 ( 2.481 -9.457 0.000) 9.777 5.944 ( -6.316 5.517 0.000) 8.387 5.944 ( 6.316 5.517 0.000) 8.387 6.148 ( -2.214 0.560 0.000) 2.283 6.148 ( 2.214 0.560 0.000) 2.283 6.485 ( -1.083 4.071 0.000) 4.213 6.485 ( 1.083 4.071 0.000) 4.213 6.635 ( -1.812 -0.235 0.000) 1.827 6.635 ( 1.812 -0.235 0.000) 1.827 6.927 ( -0.918 10.241 0.000) 10.282 6.927 ( 0.918 10.241 0.000) 10.282 7.193 ( -10.913 -2.954 0.000) 11.305 7.193 ( 10.913 -2.954 0.000) 11.305 7.281 ( -11.717 2.578 0.000) 11.997 7.281 ( 11.717 2.578 0.000) 11.997 7.749 ( -11.530 -4.986 0.000) 12.562 7.749 ( 11.530 -4.986 0.000) 12.562 7.959 ( -3.463 4.991 0.000) 6.075 7.959 ( 3.463 4.991 0.000) 6.075 8.382 ( -4.159 3.305 0.000) 5.312 8.382 ( 4.159 3.305 0.000) 5.312 8.524 ( -2.221 3.965 0.000) 4.545 8.524 ( 2.221 3.965 0.000) 4.545 8.822 ( -2.287 -3.737 0.000) 4.381 8.822 ( 2.287 -3.737 0.000) 4.381 8.930 ( -18.172 1.000 0.000) 18.199 8.930 ( 18.172 1.000 0.000) 18.199 9.197 ( -11.861 5.373 0.000) 13.021 9.197 ( 11.861 5.373 0.000) 13.021 9.419 ( -19.460 2.419 0.000) 19.609 9.419 ( 19.460 2.419 0.000) 19.609 9.828 ( -14.095 -6.145 0.000) 15.377 9.828 ( 14.095 -6.145 0.000) 15.377 10.181 ( -5.239 1.347 0.000) 5.409 10.181 ( 5.239 1.347 0.000) 5.409 10.335 ( -20.843 -4.095 0.000) 21.241 10.335 ( 20.843 -4.095 0.000) 21.241 10.620 ( -5.110 1.628 0.000) 5.363 10.620 ( 5.110 1.628 0.000) 5.363 10.905 ( -0.293 -2.597 0.000) 2.614 10.905 ( 0.293 -2.597 0.000) 2.614 11.217 ( -15.163 -0.375 0.000) 15.168 11.217 ( 15.163 -0.375 0.000) 15.168 11.483 ( -0.790 1.085 0.000) 1.343 11.483 ( 0.790 1.085 0.000) 1.343 11.675 ( -0.488 -0.969 0.000) 1.085 11.675 ( 0.488 -0.969 0.000) 1.085 12.081 ( -1.719 -1.236 0.000) 2.117 12.081 ( 1.719 -1.236 0.000) 2.117 12.299 ( -1.789 -0.097 0.000) 1.792 12.299 ( 1.789 -0.097 0.000) 1.792 12.494 ( -14.648 3.797 0.000) 15.133 12.494 ( 14.648 3.797 0.000) 15.133 12.681 ( -9.588 -4.631 0.000) 10.648 12.681 ( 9.588 -4.631 0.000) 10.648 13.113 ( -6.745 -4.948 0.000) 8.365 13.113 ( 6.745 -4.948 0.000) 8.365 13.308 ( -2.271 -3.340 0.000) 4.039 13.308 ( 2.271 -3.340 0.000) 4.039 13.816 ( -2.997 4.384 0.000) 5.311 13.816 ( 2.997 4.384 0.000) 5.311 14.094 ( -6.806 1.520 0.000) 6.973 14.094 ( 6.806 1.520 0.000) 6.973 14.546 ( -0.323 -2.350 0.000) 2.372 14.546 ( 0.323 -2.350 0.000) 2.372 15.151 ( -0.392 5.089 0.000) 5.104 15.151 ( 0.392 5.089 0.000) 5.104 15.761 ( -9.242 -4.133 0.000) 10.124 15.761 ( 9.242 -4.133 0.000) 10.124 15.946 ( -2.231 2.890 0.000) 3.651 15.946 ( 2.231 2.890 0.000) 3.651 16.155 ( -4.883 2.617 0.000) 5.540 16.155 ( 4.883 2.617 0.000) 5.540 16.723 ( -2.801 0.536 0.000) 2.852 16.723 ( 2.801 0.536 0.000) 2.852 17.341 ( -15.873 -9.216 0.000) 18.354 17.341 ( 15.873 -9.216 0.000) 18.354 19.503 ( -29.621 8.543 0.000) 30.828 19.503 ( 29.621 8.543 0.000) 30.828 20.162 ( -24.759 -2.587 0.000) 24.894 20.162 ( 24.759 -2.587 0.000) 24.894 20.660 ( -19.957 1.242 0.000) 19.995 20.660 ( 19.957 1.242 0.000) 19.995 20.963 ( -24.402 -3.081 0.000) 24.596 20.963 ( 24.402 -3.081 0.000) 24.596 26.262 ( -2.295 0.815 0.000) 2.435 26.262 ( 2.295 0.815 0.000) 2.435 26.683 ( -1.551 -1.771 0.000) 2.354 26.683 ( 1.551 -1.771 0.000) 2.354 27.380 ( -1.283 3.571 0.000) 3.794 27.380 ( 1.283 3.571 0.000) 3.794 27.919 ( -5.672 -2.694 0.000) 6.280 27.919 ( 5.672 -2.694 0.000) 6.280 28.131 ( -3.420 0.108 0.000) 3.421 28.131 ( 3.420 0.108 0.000) 3.421 28.435 ( -7.550 -1.497 0.000) 7.697 28.435 ( 7.550 -1.497 0.000) 7.697 29.308 ( -0.274 1.363 0.000) 1.390 29.308 ( 0.274 1.363 0.000) 1.390 29.626 ( -1.490 -1.956 0.000) 2.459 29.626 ( 1.490 -1.956 0.000) 2.459 29.823 ( -4.556 -1.181 0.000) 4.707 29.823 ( 4.556 -1.181 0.000) 4.707 30.594 ( -0.779 1.533 0.000) 1.720 30.594 ( 0.779 1.533 0.000) 1.720 31.217 ( -0.464 3.770 0.000) 3.798 31.217 ( 0.464 3.770 0.000) 3.798 32.111 ( -15.345 -1.828 0.000) 15.453 32.111 ( 15.345 -1.828 0.000) 15.453 ======================= Grid point 22 (13/72) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.810 ( 0.000 47.405 0.000) 47.405 1.815 ( 0.000 40.233 0.000) 40.233 2.446 ( 0.000 47.124 0.000) 47.124 2.856 ( 0.000 0.823 0.000) 0.823 3.231 ( 0.000 -1.211 0.000) 1.211 3.333 ( 0.000 -8.564 0.000) 8.564 3.949 ( 0.000 -9.612 0.000) 9.612 4.248 ( 0.000 -20.879 0.000) 20.879 4.567 ( 0.000 -7.584 0.000) 7.584 4.569 ( 0.000 -3.116 0.000) 3.116 4.890 ( 0.000 17.444 0.000) 17.444 5.304 ( 0.000 -0.072 0.000) 0.072 5.342 ( 0.000 -12.344 0.000) 12.344 5.426 ( 0.000 -1.472 0.000) 1.472 5.679 ( 0.000 -2.390 0.000) 2.390 5.797 ( 0.000 -2.662 0.000) 2.662 5.853 ( 0.000 3.697 0.000) 3.697 6.126 ( 0.000 -18.380 0.000) 18.380 6.354 ( 0.000 -2.616 0.000) 2.616 6.406 ( 0.000 -0.496 0.000) 0.496 6.568 ( 0.000 -8.738 0.000) 8.738 6.771 ( 0.000 -13.187 0.000) 13.187 6.787 ( 0.000 -3.101 0.000) 3.101 6.888 ( 0.000 -10.675 0.000) 10.675 7.195 ( 0.000 15.524 0.000) 15.524 7.341 ( 0.000 8.222 0.000) 8.222 7.711 ( 0.000 8.174 0.000) 8.174 8.012 ( 0.000 -11.246 0.000) 11.246 8.065 ( 0.000 -3.416 0.000) 3.416 8.187 ( 0.000 -7.178 0.000) 7.178 8.311 ( 0.000 0.307 0.000) 0.307 8.564 ( 0.000 -8.866 0.000) 8.866 8.593 ( 0.000 5.119 0.000) 5.119 8.882 ( 0.000 -2.803 0.000) 2.803 9.200 ( 0.000 3.983 0.000) 3.983 9.225 ( 0.000 -1.620 0.000) 1.620 9.400 ( 0.000 6.569 0.000) 6.569 9.486 ( 0.000 8.642 0.000) 8.642 9.575 ( 0.000 -1.845 0.000) 1.845 9.604 ( 0.000 -1.710 0.000) 1.710 9.698 ( 0.000 7.030 0.000) 7.030 9.802 ( 0.000 9.016 0.000) 9.016 9.947 ( 0.000 6.489 0.000) 6.489 10.017 ( 0.000 -4.027 0.000) 4.027 10.112 ( 0.000 4.376 0.000) 4.376 10.261 ( 0.000 11.929 0.000) 11.929 10.423 ( 0.000 5.852 0.000) 5.852 10.526 ( 0.000 -6.533 0.000) 6.533 10.683 ( 0.000 0.853 0.000) 0.853 10.720 ( 0.000 -2.525 0.000) 2.525 10.936 ( 0.000 -1.640 0.000) 1.640 11.118 ( 0.000 -6.029 0.000) 6.029 11.372 ( 0.000 3.589 0.000) 3.589 11.478 ( 0.000 -4.852 0.000) 4.852 11.537 ( 0.000 -8.827 0.000) 8.827 11.546 ( 0.000 -4.591 0.000) 4.591 11.738 ( 0.000 3.368 0.000) 3.368 11.863 ( 0.000 2.319 0.000) 2.319 12.035 ( 0.000 -6.212 0.000) 6.212 12.044 ( 0.000 -0.783 0.000) 0.783 12.263 ( 0.000 4.733 0.000) 4.733 12.405 ( 0.000 0.510 0.000) 0.510 12.640 ( 0.000 2.694 0.000) 2.694 12.761 ( 0.000 -7.041 0.000) 7.041 13.013 ( 0.000 2.559 0.000) 2.559 13.052 ( 0.000 0.002 0.000) 0.002 13.182 ( 0.000 1.164 0.000) 1.164 13.264 ( 0.000 -4.036 0.000) 4.036 13.644 ( 0.000 2.407 0.000) 2.407 13.784 ( 0.000 -3.085 0.000) 3.085 13.984 ( 0.000 10.210 0.000) 10.210 14.200 ( 0.000 -1.145 0.000) 1.145 14.202 ( 0.000 1.744 0.000) 1.744 14.511 ( 0.000 -7.093 0.000) 7.093 14.706 ( 0.000 -4.693 0.000) 4.693 14.847 ( 0.000 -7.257 0.000) 7.257 15.033 ( 0.000 7.838 0.000) 7.838 15.199 ( 0.000 -1.580 0.000) 1.580 15.438 ( 0.000 5.354 0.000) 5.354 15.590 ( 0.000 -2.236 0.000) 2.236 15.921 ( 0.000 6.738 0.000) 6.738 15.930 ( 0.000 4.026 0.000) 4.026 15.955 ( 0.000 11.352 0.000) 11.352 16.208 ( 0.000 -3.194 0.000) 3.194 16.266 ( 0.000 4.386 0.000) 4.386 16.639 ( 0.000 -0.548 0.000) 0.548 16.695 ( 0.000 -1.160 0.000) 1.160 16.728 ( 0.000 -11.138 0.000) 11.138 18.746 ( 0.000 6.041 0.000) 6.041 19.079 ( 0.000 -9.580 0.000) 9.580 19.628 ( 0.000 0.585 0.000) 0.585 19.698 ( 0.000 -3.729 0.000) 3.729 21.622 ( 0.000 4.842 0.000) 4.842 21.688 ( 0.000 1.396 0.000) 1.396 22.027 ( 0.000 -1.013 0.000) 1.013 22.054 ( 0.000 -2.175 0.000) 2.175 26.054 ( 0.000 2.636 0.000) 2.636 26.088 ( 0.000 -0.255 0.000) 0.255 26.132 ( 0.000 2.638 0.000) 2.638 26.342 ( 0.000 -6.244 0.000) 6.244 26.850 ( 0.000 1.290 0.000) 1.290 26.929 ( 0.000 -2.780 0.000) 2.780 27.160 ( 0.000 0.196 0.000) 0.196 27.165 ( 0.000 -0.015 0.000) 0.015 27.470 ( 0.000 -0.083 0.000) 0.083 27.494 ( 0.000 -0.978 0.000) 0.978 28.139 ( 0.000 3.495 0.000) 3.495 28.258 ( 0.000 -2.846 0.000) 2.846 29.288 ( 0.000 2.802 0.000) 2.802 29.388 ( 0.000 -2.758 0.000) 2.758 29.530 ( 0.000 5.598 0.000) 5.598 29.692 ( 0.000 -1.768 0.000) 1.768 29.915 ( 0.000 7.302 0.000) 7.302 30.019 ( 0.000 1.925 0.000) 1.925 30.396 ( 0.000 -0.274 0.000) 0.274 30.436 ( 0.000 -2.960 0.000) 2.960 31.104 ( 0.000 0.092 0.000) 0.092 31.171 ( 0.000 -2.652 0.000) 2.652 33.440 ( 0.000 0.524 0.000) 0.524 33.531 ( 0.000 -4.042 0.000) 4.042 ======================= Grid point 23 (14/72) ======================= q-point: ( 0.10 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.867 ( 3.607 45.590 0.000) 45.732 1.984 ( 17.598 43.641 0.000) 47.056 2.750 ( 31.710 40.056 0.000) 51.088 3.125 ( 26.535 -12.654 0.000) 29.398 3.277 ( 5.888 -11.393 0.000) 12.824 3.716 ( 29.117 -11.294 0.000) 31.231 4.129 ( 12.697 -12.712 0.000) 17.967 4.350 ( 12.361 -12.091 0.000) 17.291 4.597 ( 7.082 -0.248 0.000) 7.086 4.679 ( 9.314 -7.169 0.000) 11.753 4.874 ( 5.130 10.347 0.000) 11.549 5.218 ( -3.099 -3.108 0.000) 4.389 5.438 ( 4.464 -4.734 0.000) 6.506 5.471 ( 0.420 -2.934 0.000) 2.964 5.743 ( 5.580 1.677 0.000) 5.826 5.886 ( 4.878 1.364 0.000) 5.065 5.919 ( 11.405 -4.541 0.000) 12.276 6.176 ( 4.827 -13.095 0.000) 13.957 6.271 ( -2.628 -3.244 0.000) 4.175 6.369 ( -1.834 6.142 0.000) 6.410 6.590 ( -0.427 -8.702 0.000) 8.713 6.696 ( -0.300 5.742 0.000) 5.749 6.810 ( 2.362 -9.095 0.000) 9.397 7.033 ( 4.850 -1.668 0.000) 5.128 7.225 ( 0.782 2.084 0.000) 2.226 7.285 ( -0.400 6.948 0.000) 6.959 7.768 ( -0.474 2.277 0.000) 2.326 7.959 ( -8.090 -1.778 0.000) 8.283 7.991 ( 2.135 -3.432 0.000) 4.042 8.217 ( 2.672 -3.673 0.000) 4.542 8.306 ( -1.612 -0.926 0.000) 1.859 8.516 ( -4.266 -5.664 0.000) 7.091 8.608 ( -0.126 3.322 0.000) 3.324 8.832 ( -4.112 -1.269 0.000) 4.303 9.098 ( -9.974 4.524 0.000) 10.952 9.215 ( -8.163 4.306 0.000) 9.229 9.293 ( -12.055 7.971 0.000) 14.452 9.399 ( -7.551 8.834 0.000) 11.621 9.452 ( -14.132 2.200 0.000) 14.302 9.539 ( 2.049 5.179 0.000) 5.570 9.636 ( 1.284 -3.695 0.000) 3.912 9.757 ( -11.463 0.638 0.000) 11.481 9.875 ( 3.022 2.104 0.000) 3.682 10.027 ( -5.775 -6.650 0.000) 8.808 10.068 ( -2.246 2.714 0.000) 3.523 10.233 ( -5.862 1.952 0.000) 6.178 10.343 ( -2.262 -3.389 0.000) 4.074 10.570 ( -1.467 -6.430 0.000) 6.595 10.693 ( 7.112 3.137 0.000) 7.773 10.836 ( 4.923 -1.473 0.000) 5.138 10.997 ( 6.059 0.895 0.000) 6.125 11.151 ( 3.551 -2.552 0.000) 4.373 11.329 ( -0.916 5.708 0.000) 5.781 11.488 ( -4.055 0.327 0.000) 4.068 11.497 ( 0.410 0.010 0.000) 0.410 11.572 ( 2.106 -6.302 0.000) 6.645 11.730 ( 1.311 2.054 0.000) 2.436 11.916 ( -0.538 7.968 0.000) 7.986 11.944 ( -1.971 -3.504 0.000) 4.020 12.171 ( -11.438 2.823 0.000) 11.781 12.195 ( 1.000 -4.919 0.000) 5.020 12.286 ( -2.734 -2.425 0.000) 3.655 12.540 ( -4.041 9.876 0.000) 10.671 12.806 ( 0.939 -5.684 0.000) 5.761 12.975 ( -6.096 -1.125 0.000) 6.199 13.047 ( -2.736 -3.740 0.000) 4.634 13.214 ( -0.284 -1.109 0.000) 1.145 13.292 ( 11.514 -2.199 0.000) 11.722 13.714 ( -1.714 -0.129 0.000) 1.719 13.756 ( -2.980 -2.569 0.000) 3.935 13.958 ( -1.447 10.049 0.000) 10.152 14.180 ( 0.247 0.596 0.000) 0.646 14.208 ( 0.843 1.094 0.000) 1.381 14.476 ( -3.553 -6.920 0.000) 7.779 14.630 ( -5.413 -2.627 0.000) 6.017 14.728 ( -5.739 -4.311 0.000) 7.178 15.061 ( 0.036 6.843 0.000) 6.843 15.259 ( 5.296 -2.486 0.000) 5.850 15.475 ( 0.203 2.812 0.000) 2.819 15.593 ( 4.010 -2.800 0.000) 4.891 15.864 ( -6.336 5.300 0.000) 8.260 15.935 ( -2.649 9.370 0.000) 9.737 15.984 ( 1.971 6.646 0.000) 6.932 16.213 ( 9.072 6.754 0.000) 11.310 16.383 ( 5.502 -3.235 0.000) 6.382 16.455 ( -5.341 -6.263 0.000) 8.231 16.742 ( -1.620 -0.343 0.000) 1.656 17.029 ( 20.085 -16.074 0.000) 25.725 18.725 ( -1.197 3.906 0.000) 4.085 19.005 ( -6.916 -9.513 0.000) 11.761 19.655 ( 2.989 0.804 0.000) 3.095 19.736 ( 4.003 -4.165 0.000) 5.777 21.527 ( -8.995 5.873 0.000) 10.743 21.641 ( -6.618 0.964 0.000) 6.688 21.969 ( -5.068 1.089 0.000) 5.183 22.046 ( -2.365 -2.169 0.000) 3.209 26.033 ( 2.145 4.124 0.000) 4.648 26.137 ( 3.812 -1.722 0.000) 4.183 26.314 ( 11.391 0.728 0.000) 11.415 26.460 ( 11.579 -5.612 0.000) 12.868 26.869 ( 3.146 2.779 0.000) 4.198 26.974 ( 3.335 -3.128 0.000) 4.572 27.179 ( 3.710 2.254 0.000) 4.341 27.275 ( 8.077 -3.061 0.000) 8.637 27.556 ( 7.203 -0.285 0.000) 7.209 27.629 ( 14.258 -5.184 0.000) 15.171 28.160 ( 2.180 3.212 0.000) 3.882 28.319 ( 5.836 -7.345 0.000) 9.381 29.303 ( 1.498 2.196 0.000) 2.658 29.372 ( -1.579 -1.241 0.000) 2.008 29.513 ( -1.506 5.169 0.000) 5.384 29.684 ( -0.800 -2.618 0.000) 2.737 29.919 ( 0.167 5.166 0.000) 5.168 29.983 ( -3.668 1.918 0.000) 4.139 30.413 ( 2.014 0.630 0.000) 2.110 30.464 ( 2.654 -3.374 0.000) 4.293 31.103 ( 0.150 0.143 0.000) 0.208 31.164 ( -0.625 -2.380 0.000) 2.460 33.150 ( -24.558 11.584 0.000) 27.153 33.434 ( -11.258 -6.492 0.000) 12.995 ======================= Grid point 24 (15/72) ======================= q-point: ( 0.20 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.065 ( 19.145 29.879 0.000) 35.487 2.435 ( 27.884 34.196 0.000) 44.124 3.350 ( 12.112 -0.862 0.000) 12.143 3.424 ( 14.010 -8.396 0.000) 16.333 3.663 ( 29.835 -7.184 0.000) 30.687 4.220 ( 27.374 -25.882 0.000) 37.673 4.474 ( 22.262 -0.182 0.000) 22.262 4.632 ( 1.592 2.621 0.000) 3.067 4.727 ( 20.237 -3.701 0.000) 20.572 4.910 ( 9.060 -10.790 0.000) 14.089 5.205 ( 11.672 0.489 0.000) 11.683 5.306 ( 11.633 -3.581 0.000) 12.172 5.440 ( 8.897 2.568 0.000) 9.261 5.525 ( 6.016 -3.281 0.000) 6.852 5.900 ( 14.840 4.244 0.000) 15.435 6.059 ( 12.176 -0.966 0.000) 12.214 6.134 ( 15.221 2.231 0.000) 15.384 6.265 ( 2.921 -1.164 0.000) 3.144 6.329 ( -0.607 -0.253 0.000) 0.658 6.456 ( 14.031 3.297 0.000) 14.413 6.589 ( 3.180 -6.702 0.000) 7.418 6.812 ( 11.578 12.468 0.000) 17.015 6.846 ( 0.986 -1.020 0.000) 1.419 7.029 ( -2.528 3.018 0.000) 3.937 7.174 ( -2.204 0.389 0.000) 2.238 7.334 ( -0.244 -1.201 0.000) 1.225 7.654 ( -6.939 -0.319 0.000) 6.946 7.816 ( -7.111 0.020 0.000) 7.111 8.095 ( 3.450 5.065 0.000) 6.129 8.192 ( -9.990 10.705 0.000) 14.643 8.305 ( 4.882 1.718 0.000) 5.176 8.434 ( -4.586 -7.818 0.000) 9.064 8.519 ( -6.895 1.580 0.000) 7.074 8.766 ( -2.223 1.552 0.000) 2.711 8.888 ( -8.055 0.719 0.000) 8.087 8.938 ( -11.164 9.299 0.000) 14.529 9.085 ( -16.614 6.684 0.000) 17.908 9.170 ( -7.019 -5.861 0.000) 9.144 9.291 ( -8.514 -0.404 0.000) 8.524 9.433 ( -18.657 -10.979 0.000) 21.647 9.648 ( 6.633 -1.407 0.000) 6.781 9.699 ( 2.385 0.419 0.000) 2.422 9.781 ( -6.984 2.759 0.000) 7.509 9.987 ( 1.994 1.165 0.000) 2.310 10.056 ( -3.122 -5.925 0.000) 6.697 10.167 ( 1.967 -9.587 0.000) 9.786 10.370 ( 0.207 0.211 0.000) 0.296 10.450 ( -9.473 -2.968 0.000) 9.927 10.749 ( 0.347 0.297 0.000) 0.457 10.892 ( 0.024 -4.427 0.000) 4.427 11.147 ( 8.016 1.071 0.000) 8.087 11.209 ( -0.525 4.087 0.000) 4.120 11.317 ( -5.099 6.494 0.000) 8.257 11.441 ( 1.618 1.958 0.000) 2.540 11.529 ( -3.187 -5.168 0.000) 6.071 11.553 ( 4.042 1.784 0.000) 4.418 11.747 ( -6.696 1.377 0.000) 6.837 11.765 ( -5.182 2.179 0.000) 5.621 11.912 ( -6.432 4.972 0.000) 8.130 12.003 ( 3.331 8.031 0.000) 8.694 12.145 ( -8.943 -1.826 0.000) 9.127 12.308 ( 6.330 -8.829 0.000) 10.864 12.487 ( -1.818 11.829 0.000) 11.968 12.786 ( -9.989 0.574 0.000) 10.006 12.835 ( -5.423 -6.288 0.000) 8.303 12.927 ( -4.893 -6.517 0.000) 8.149 13.292 ( 6.705 3.199 0.000) 7.429 13.424 ( -9.356 0.679 0.000) 9.380 13.610 ( 2.669 -3.103 0.000) 4.093 13.678 ( -3.969 -4.382 0.000) 5.913 13.855 ( -7.959 4.349 0.000) 9.070 14.209 ( -9.495 -6.602 0.000) 11.565 14.245 ( 2.695 0.652 0.000) 2.773 14.342 ( 1.292 -4.425 0.000) 4.610 14.637 ( 1.276 0.151 0.000) 1.285 14.686 ( -0.290 -1.779 0.000) 1.802 15.047 ( -0.620 6.114 0.000) 6.146 15.292 ( -6.550 -4.687 0.000) 8.054 15.474 ( 5.525 9.872 0.000) 11.313 15.712 ( -2.189 2.950 0.000) 3.674 15.743 ( 5.915 -1.226 0.000) 6.040 15.879 ( -10.117 -3.740 0.000) 10.786 16.018 ( 5.621 4.571 0.000) 7.245 16.220 ( 1.871 -1.249 0.000) 2.250 16.525 ( 12.451 5.370 0.000) 13.560 16.634 ( 2.081 2.742 0.000) 3.442 16.705 ( 5.597 3.032 0.000) 6.365 17.304 ( 8.611 -21.776 0.000) 23.417 18.729 ( 1.008 0.549 0.000) 1.148 18.903 ( 0.773 -7.425 0.000) 7.465 19.755 ( 7.921 1.149 0.000) 8.004 19.857 ( 8.756 -4.314 0.000) 9.761 21.272 ( -17.911 7.499 0.000) 19.417 21.421 ( -15.575 0.397 0.000) 15.580 21.818 ( -11.342 3.322 0.000) 11.818 21.942 ( -8.708 -2.466 0.000) 9.051 26.108 ( 4.564 3.391 0.000) 5.686 26.217 ( 4.089 -2.632 0.000) 4.863 26.509 ( 8.284 3.558 0.000) 9.015 26.665 ( 6.976 -3.680 0.000) 7.887 26.992 ( 9.323 0.040 0.000) 9.324 27.043 ( 5.211 -1.971 0.000) 5.571 27.314 ( 9.602 4.014 0.000) 10.407 27.449 ( 10.511 -2.310 0.000) 10.762 27.756 ( 12.632 0.520 0.000) 12.643 27.903 ( 12.208 -4.217 0.000) 12.916 28.214 ( 2.980 1.752 0.000) 3.457 28.444 ( 5.696 -15.136 0.000) 16.172 29.333 ( -0.587 1.038 0.000) 1.192 29.346 ( 1.174 1.180 0.000) 1.664 29.492 ( -0.072 4.028 0.000) 4.028 29.663 ( -1.336 -3.702 0.000) 3.936 29.879 ( -6.123 2.242 0.000) 6.520 29.915 ( -1.356 0.793 0.000) 1.571 30.471 ( 3.613 1.908 0.000) 4.085 30.527 ( 3.744 -3.095 0.000) 4.858 31.124 ( 2.218 -0.234 0.000) 2.230 31.153 ( -0.068 -1.708 0.000) 1.709 32.652 ( -24.806 19.796 0.000) 31.737 33.131 ( -19.136 -8.557 0.000) 20.962 ======================= Grid point 25 (16/72) ======================= q-point: ( 0.30 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.572 ( 31.246 9.777 0.000) 32.740 3.006 ( 30.318 21.700 0.000) 37.284 3.481 ( 5.038 -18.435 0.000) 19.111 3.616 ( 14.591 -7.872 0.000) 16.580 4.217 ( 17.001 -4.630 0.000) 17.620 4.530 ( 1.453 -17.366 0.000) 17.427 4.685 ( 5.604 2.758 0.000) 6.246 4.861 ( 8.215 -5.038 0.000) 9.636 5.042 ( 18.404 -8.446 0.000) 20.250 5.119 ( 13.504 -7.238 0.000) 15.322 5.238 ( -2.684 1.558 0.000) 3.103 5.333 ( 1.558 -6.391 0.000) 6.578 5.709 ( 12.061 8.103 0.000) 14.530 5.846 ( 19.965 3.234 0.000) 20.226 6.178 ( -1.967 13.323 0.000) 13.467 6.296 ( 6.390 -1.960 0.000) 6.684 6.379 ( 7.859 -3.040 0.000) 8.426 6.421 ( 21.791 8.790 0.000) 23.497 6.510 ( 7.176 0.407 0.000) 7.188 6.645 ( 18.200 5.768 0.000) 19.092 6.798 ( 11.387 -2.370 0.000) 11.631 6.851 ( 4.372 3.089 0.000) 5.353 6.870 ( -5.789 -1.869 0.000) 6.083 7.041 ( 2.936 -2.908 0.000) 4.132 7.310 ( 15.356 9.204 0.000) 17.903 7.420 ( 17.825 1.533 0.000) 17.891 7.576 ( -2.018 -2.023 0.000) 2.858 7.608 ( -13.191 7.543 0.000) 15.196 7.962 ( -10.279 11.143 0.000) 15.160 8.028 ( -8.963 7.650 0.000) 11.784 8.328 ( -14.402 -1.293 0.000) 14.460 8.377 ( -0.891 -2.885 0.000) 3.020 8.433 ( 5.585 5.033 0.000) 7.519 8.730 ( -1.980 2.946 0.000) 3.549 8.808 ( -3.108 -8.607 0.000) 9.151 8.847 ( 0.570 -7.516 0.000) 7.538 8.877 ( -3.730 4.533 0.000) 5.870 9.017 ( -5.061 1.345 0.000) 5.236 9.076 ( -5.398 -5.402 0.000) 7.636 9.305 ( 0.469 -6.571 0.000) 6.587 9.629 ( -8.651 7.517 0.000) 11.461 9.684 ( -2.268 2.140 0.000) 3.118 9.759 ( 1.762 -4.262 0.000) 4.612 9.971 ( -3.507 -5.525 0.000) 6.544 10.102 ( 7.432 -5.344 0.000) 9.154 10.169 ( -4.717 -4.561 0.000) 6.562 10.242 ( -11.684 -2.021 0.000) 11.858 10.324 ( -0.851 -0.929 0.000) 1.260 10.766 ( -1.542 3.058 0.000) 3.425 10.881 ( -2.138 2.092 0.000) 2.991 11.013 ( -7.565 -0.009 0.000) 7.565 11.159 ( -13.195 -3.082 0.000) 13.551 11.237 ( -0.556 1.779 0.000) 1.863 11.396 ( -8.321 -0.827 0.000) 8.362 11.541 ( 1.762 3.752 0.000) 4.145 11.605 ( -4.962 5.564 0.000) 7.456 11.690 ( 3.449 -0.041 0.000) 3.450 11.736 ( 4.948 -1.511 0.000) 5.174 11.860 ( 4.335 0.214 0.000) 4.340 11.998 ( -3.481 -1.733 0.000) 3.889 12.125 ( 4.331 8.634 0.000) 9.659 12.357 ( -0.127 4.278 0.000) 4.280 12.464 ( -7.372 -0.165 0.000) 7.374 12.629 ( -11.528 -5.843 0.000) 12.924 12.644 ( 2.915 -0.118 0.000) 2.918 12.885 ( -3.885 -9.860 0.000) 10.597 13.136 ( -14.700 4.233 0.000) 15.297 13.398 ( 1.434 -0.750 0.000) 1.618 13.463 ( -12.263 -2.771 0.000) 12.572 13.742 ( -3.033 3.406 0.000) 4.561 13.796 ( 5.400 -5.145 0.000) 7.459 13.908 ( -15.252 -8.622 0.000) 17.520 14.296 ( -2.663 3.271 0.000) 4.217 14.391 ( 0.550 -2.131 0.000) 2.200 14.522 ( -8.385 3.698 0.000) 9.164 14.604 ( -9.640 -1.795 0.000) 9.806 15.089 ( 4.898 4.073 0.000) 6.370 15.262 ( 6.713 -1.635 0.000) 6.909 15.464 ( -6.164 6.544 0.000) 8.990 15.665 ( -0.395 -2.389 0.000) 2.421 15.851 ( 10.887 1.868 0.000) 11.046 15.939 ( 4.769 -1.550 0.000) 5.015 16.119 ( 5.055 3.457 0.000) 6.124 16.259 ( 0.970 -1.444 0.000) 1.739 16.613 ( 1.618 4.964 0.000) 5.222 16.736 ( 7.533 6.827 0.000) 10.166 16.825 ( 3.147 -2.964 0.000) 4.323 17.383 ( -0.014 -20.466 0.000) 20.466 18.808 ( 10.592 5.857 0.000) 12.104 19.107 ( 18.235 -7.923 0.000) 19.882 19.970 ( 14.443 1.159 0.000) 14.490 20.081 ( 14.845 -4.107 0.000) 15.403 20.846 ( -25.784 9.381 0.000) 27.438 21.063 ( -21.456 -1.240 0.000) 21.492 21.529 ( -18.414 4.327 0.000) 18.916 21.705 ( -16.046 -3.922 0.000) 16.518 26.185 ( 3.340 2.721 0.000) 4.308 26.281 ( 2.367 -2.444 0.000) 3.403 26.605 ( 2.023 3.227 0.000) 3.808 26.720 ( -0.211 -2.324 0.000) 2.333 27.157 ( 9.201 0.759 0.000) 9.232 27.239 ( 12.221 -2.770 0.000) 12.531 27.511 ( 10.148 4.674 0.000) 11.172 27.669 ( 11.379 -1.068 0.000) 11.429 28.000 ( 11.599 1.462 0.000) 11.691 28.087 ( 7.390 0.279 0.000) 7.396 28.254 ( 0.811 -0.129 0.000) 0.821 28.495 ( -0.364 -14.982 0.000) 14.986 29.317 ( -0.321 2.727 0.000) 2.746 29.370 ( 0.376 0.093 0.000) 0.387 29.528 ( 3.595 1.548 0.000) 3.915 29.631 ( -2.237 -3.314 0.000) 3.998 29.767 ( -4.198 2.934 0.000) 5.122 29.885 ( -1.759 -2.575 0.000) 3.119 30.536 ( 2.874 2.614 0.000) 3.885 30.598 ( 3.117 -1.985 0.000) 3.695 31.156 ( 1.684 0.717 0.000) 1.830 31.207 ( 5.195 -1.784 0.000) 5.492 32.243 ( -17.251 17.662 0.000) 24.689 32.738 ( -20.939 -9.072 0.000) 22.820 ======================= Grid point 26 (17/72) ======================= q-point: ( 0.40 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.165 ( 28.298 0.109 0.000) 28.298 3.533 ( 23.563 -7.228 0.000) 24.646 3.744 ( 21.157 2.134 0.000) 21.264 3.860 ( 6.709 1.314 0.000) 6.837 4.275 ( -6.457 -15.823 0.000) 17.090 4.456 ( -4.706 -8.650 0.000) 9.847 4.649 ( -7.905 5.902 0.000) 9.865 5.015 ( -9.560 -2.692 0.000) 9.932 5.140 ( 11.028 -2.249 0.000) 11.255 5.221 ( 7.697 -0.631 0.000) 7.722 5.367 ( 7.416 -12.016 0.000) 14.121 5.494 ( 5.549 -12.621 0.000) 13.787 5.898 ( 7.389 8.573 0.000) 11.318 6.095 ( 3.547 0.557 0.000) 3.591 6.186 ( 1.490 12.564 0.000) 12.652 6.269 ( -6.413 2.857 0.000) 7.020 6.462 ( 4.915 2.083 0.000) 5.338 6.542 ( 1.351 2.851 0.000) 3.155 6.659 ( -1.182 3.907 0.000) 4.082 6.766 ( -2.833 3.206 0.000) 4.279 6.824 ( 10.500 1.566 0.000) 10.616 6.944 ( 8.541 8.496 0.000) 12.047 7.092 ( 8.494 -4.285 0.000) 9.514 7.249 ( 6.710 1.381 0.000) 6.851 7.383 ( -9.777 1.724 0.000) 9.927 7.517 ( 1.517 -9.871 0.000) 9.987 7.594 ( 7.824 7.667 0.000) 10.954 7.710 ( -5.710 15.018 0.000) 16.067 7.957 ( 2.331 -4.954 0.000) 5.475 8.008 ( -0.430 5.502 0.000) 5.519 8.090 ( 22.970 -0.057 0.000) 22.970 8.405 ( 5.881 -0.931 0.000) 5.954 8.539 ( 4.924 7.330 0.000) 8.831 8.651 ( -5.975 -0.942 0.000) 6.048 8.757 ( 0.090 -3.480 0.000) 3.481 8.832 ( -0.880 -4.178 0.000) 4.269 8.927 ( 2.144 2.407 0.000) 3.224 9.063 ( 5.126 4.394 0.000) 6.751 9.118 ( 2.928 -5.337 0.000) 6.087 9.245 ( -6.778 2.324 0.000) 7.166 9.462 ( -1.796 5.618 0.000) 5.898 9.646 ( -2.213 1.774 0.000) 2.836 9.785 ( -9.151 -2.833 0.000) 9.580 9.879 ( -0.097 -9.827 0.000) 9.828 9.955 ( -6.277 3.472 0.000) 7.173 10.128 ( -1.075 -1.670 0.000) 1.986 10.259 ( 5.711 -4.433 0.000) 7.229 10.370 ( 1.122 -4.608 0.000) 4.743 10.577 ( -5.817 2.613 0.000) 6.376 10.848 ( -14.055 -7.497 0.000) 15.929 10.924 ( -0.715 5.076 0.000) 5.126 11.006 ( -7.238 2.172 0.000) 7.556 11.158 ( -7.397 0.922 0.000) 7.454 11.199 ( 2.916 -3.426 0.000) 4.499 11.510 ( -2.610 4.540 0.000) 5.237 11.608 ( 1.467 0.743 0.000) 1.644 11.699 ( -2.683 2.356 0.000) 3.571 11.744 ( -5.209 1.022 0.000) 5.309 11.949 ( 1.334 -2.734 0.000) 3.042 12.065 ( 5.276 -4.629 0.000) 7.019 12.224 ( 11.169 4.110 0.000) 11.902 12.334 ( -2.913 4.295 0.000) 5.190 12.370 ( -3.392 -2.018 0.000) 3.947 12.420 ( -3.545 -2.929 0.000) 4.599 12.767 ( -5.967 -5.788 0.000) 8.313 12.811 ( 8.164 -3.491 0.000) 8.879 12.912 ( -8.566 2.294 0.000) 8.868 13.176 ( -14.259 -4.686 0.000) 15.009 13.368 ( -4.437 2.146 0.000) 4.929 13.609 ( -13.343 3.573 0.000) 13.813 13.680 ( -6.122 -10.851 0.000) 12.459 13.826 ( -2.612 -4.056 0.000) 4.824 14.177 ( -1.964 9.415 0.000) 9.618 14.334 ( -9.917 1.513 0.000) 10.032 14.441 ( 3.454 -2.057 0.000) 4.020 14.516 ( -0.676 -2.615 0.000) 2.701 15.190 ( 4.873 5.800 0.000) 7.575 15.334 ( -3.272 4.055 0.000) 5.210 15.497 ( 11.294 0.845 0.000) 11.325 15.703 ( 2.542 -5.491 0.000) 6.051 15.971 ( -0.020 2.947 0.000) 2.947 15.996 ( 2.784 0.981 0.000) 2.952 16.190 ( 1.861 4.140 0.000) 4.539 16.256 ( -1.443 -0.489 0.000) 1.524 16.677 ( 4.401 3.416 0.000) 5.571 16.809 ( -1.370 4.438 0.000) 4.644 16.910 ( 9.435 -6.988 0.000) 11.741 17.311 ( -7.164 -17.164 0.000) 18.599 19.162 ( 24.871 10.749 0.000) 27.095 19.539 ( 25.398 -7.805 0.000) 26.570 20.294 ( 9.817 4.344 0.000) 10.735 20.311 ( -20.386 8.278 0.000) 22.003 20.429 ( 20.560 -4.359 0.000) 21.017 20.609 ( -24.644 -3.836 0.000) 24.941 21.133 ( -22.040 4.387 0.000) 22.473 21.335 ( -22.004 -5.055 0.000) 22.577 26.239 ( 2.380 2.077 0.000) 3.159 26.301 ( -0.232 -0.993 0.000) 1.020 26.623 ( 0.670 0.559 0.000) 0.873 26.690 ( -2.346 -2.459 0.000) 3.398 27.340 ( 8.839 3.435 0.000) 9.483 27.433 ( 6.635 0.816 0.000) 6.685 27.692 ( 8.959 1.008 0.000) 9.015 27.845 ( 5.970 -2.625 0.000) 6.521 28.114 ( 0.556 1.320 0.000) 1.432 28.207 ( -0.488 -1.609 0.000) 1.682 28.272 ( 6.364 1.801 0.000) 6.614 28.466 ( -1.908 -8.372 0.000) 8.587 29.321 ( 0.724 2.548 0.000) 2.648 29.365 ( -0.733 1.086 0.000) 1.311 29.578 ( -0.754 -1.929 0.000) 2.071 29.585 ( -0.435 -2.628 0.000) 2.664 29.752 ( 2.372 2.251 0.000) 3.270 29.853 ( -1.608 -2.520 0.000) 2.989 30.582 ( 2.077 2.179 0.000) 3.010 30.632 ( 0.322 -0.722 0.000) 0.791 31.214 ( 4.259 3.069 0.000) 5.250 31.304 ( 3.432 0.294 0.000) 3.445 32.016 ( -5.257 8.918 0.000) 10.352 32.355 ( -18.247 -7.361 0.000) 19.676 ======================= Grid point 27 (18/72) ======================= q-point: (-0.50 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.624 ( -14.323 -2.222 0.000) 14.495 3.624 ( 14.323 -2.222 0.000) 14.495 4.003 ( -18.180 -17.018 0.000) 24.902 4.003 ( 18.180 -17.018 0.000) 24.902 4.234 ( -11.359 7.256 0.000) 13.479 4.234 ( 11.359 7.256 0.000) 13.479 4.721 ( -15.794 4.337 0.000) 16.379 4.721 ( 15.794 4.337 0.000) 16.379 5.332 ( -1.437 -4.893 0.000) 5.099 5.332 ( 1.437 -4.893 0.000) 5.099 5.452 ( -4.156 -10.437 0.000) 11.234 5.452 ( 4.156 -10.437 0.000) 11.234 6.053 ( -7.176 5.599 0.000) 9.102 6.053 ( 7.176 5.599 0.000) 9.102 6.168 ( -0.200 0.578 0.000) 0.611 6.168 ( 0.200 0.578 0.000) 0.611 6.571 ( -2.029 4.932 0.000) 5.334 6.571 ( 2.030 4.932 0.000) 5.334 6.655 ( -4.678 1.113 0.000) 4.809 6.655 ( 4.678 1.113 0.000) 4.809 7.052 ( -6.280 2.169 0.000) 6.644 7.052 ( 6.280 2.169 0.000) 6.644 7.149 ( -11.677 -0.480 0.000) 11.687 7.149 ( 11.677 -0.480 0.000) 11.687 7.434 ( -7.259 11.012 0.000) 13.190 7.434 ( 7.259 11.012 0.000) 13.190 7.590 ( -5.614 -8.198 0.000) 9.936 7.590 ( 5.614 -8.198 0.000) 9.936 8.078 ( -1.002 3.951 0.000) 4.076 8.078 ( 1.002 3.951 0.000) 4.076 8.434 ( -12.238 5.060 0.000) 13.243 8.434 ( 12.238 5.060 0.000) 13.243 8.673 ( -8.021 8.064 0.000) 11.374 8.673 ( 8.021 8.064 0.000) 11.374 8.743 ( -1.874 -3.913 0.000) 4.339 8.743 ( 1.874 -3.913 0.000) 4.339 8.914 ( -12.646 -2.813 0.000) 12.955 8.914 ( 12.646 -2.813 0.000) 12.955 9.276 ( -2.722 1.648 0.000) 3.182 9.276 ( 2.722 1.648 0.000) 3.182 9.488 ( -8.260 5.286 0.000) 9.806 9.488 ( 8.260 5.286 0.000) 9.806 9.724 ( -7.628 -4.563 0.000) 8.889 9.724 ( 7.628 -4.563 0.000) 8.889 10.115 ( -1.585 -5.855 0.000) 6.065 10.115 ( 1.585 -5.855 0.000) 6.065 10.300 ( -6.489 -1.207 0.000) 6.600 10.300 ( 6.489 -1.207 0.000) 6.600 10.648 ( -5.572 1.689 0.000) 5.823 10.648 ( 5.572 1.689 0.000) 5.823 10.838 ( -7.103 -3.885 0.000) 8.096 10.838 ( 7.103 -3.885 0.000) 8.096 11.241 ( -1.553 2.628 0.000) 3.052 11.241 ( 1.553 2.628 0.000) 3.052 11.514 ( -3.225 0.722 0.000) 3.305 11.514 ( 3.225 0.722 0.000) 3.305 11.671 ( -0.785 2.976 0.000) 3.078 11.671 ( 0.785 2.976 0.000) 3.078 12.032 ( -1.071 -5.780 0.000) 5.878 12.032 ( 1.071 -5.780 0.000) 5.878 12.302 ( -0.194 0.362 0.000) 0.410 12.302 ( 0.194 0.362 0.000) 0.410 12.442 ( -0.330 -6.399 0.000) 6.408 12.442 ( 0.330 -6.399 0.000) 6.408 12.702 ( -2.983 6.911 0.000) 7.527 12.702 ( 2.983 6.911 0.000) 7.527 13.011 ( -5.740 -6.086 0.000) 8.366 13.011 ( 5.740 -6.086 0.000) 8.366 13.342 ( -6.481 5.889 0.000) 8.757 13.342 ( 6.481 5.889 0.000) 8.757 13.717 ( -3.577 -10.876 0.000) 11.449 13.717 ( 3.577 -10.876 0.000) 11.449 14.210 ( -1.831 7.186 0.000) 7.416 14.210 ( 1.831 7.186 0.000) 7.416 14.495 ( -0.550 -2.668 0.000) 2.724 14.495 ( 0.550 -2.668 0.000) 2.724 15.269 ( -0.658 6.386 0.000) 6.419 15.269 ( 0.658 6.386 0.000) 6.419 15.682 ( -5.900 -3.942 0.000) 7.096 15.682 ( 5.900 -3.942 0.000) 7.096 15.987 ( -1.707 1.451 0.000) 2.241 15.987 ( 1.707 1.451 0.000) 2.241 16.217 ( -0.974 3.357 0.000) 3.496 16.217 ( 0.974 3.357 0.000) 3.496 16.757 ( -2.039 3.565 0.000) 4.107 16.757 ( 2.039 3.565 0.000) 4.107 17.126 ( -11.424 -12.354 0.000) 16.827 17.126 ( 11.424 -12.354 0.000) 16.827 19.695 ( -27.088 10.691 0.000) 29.121 19.695 ( 27.088 10.691 0.000) 29.121 20.088 ( -24.506 -5.236 0.000) 25.059 20.088 ( 24.506 -5.236 0.000) 25.059 20.700 ( -20.385 2.990 0.000) 20.603 20.700 ( 20.385 2.990 0.000) 20.603 20.886 ( -23.317 -4.847 0.000) 23.815 20.886 ( 23.317 -4.847 0.000) 23.815 26.279 ( -0.636 0.888 0.000) 1.092 26.279 ( 0.636 0.888 0.000) 1.092 26.647 ( -0.539 -1.708 0.000) 1.791 26.647 ( 0.539 -1.708 0.000) 1.791 27.464 ( -0.807 4.693 0.000) 4.761 27.464 ( 0.807 4.693 0.000) 4.761 27.848 ( -5.812 -4.340 0.000) 7.254 27.848 ( 5.812 -4.340 0.000) 7.254 28.137 ( -1.490 0.426 0.000) 1.550 28.137 ( 1.490 0.426 0.000) 1.550 28.406 ( -1.900 -1.386 0.000) 2.352 28.406 ( 1.900 -1.386 0.000) 2.352 29.343 ( -0.125 2.120 0.000) 2.124 29.343 ( 0.125 2.120 0.000) 2.124 29.573 ( -0.350 -3.255 0.000) 3.274 29.573 ( 0.350 -3.255 0.000) 3.274 29.812 ( -2.087 0.014 0.000) 2.087 29.812 ( 2.087 0.014 0.000) 2.087 30.617 ( -0.101 0.772 0.000) 0.779 30.617 ( 0.101 0.772 0.000) 0.779 31.299 ( -0.504 4.121 0.000) 4.152 31.299 ( 0.504 4.121 0.000) 4.152 32.070 ( -8.341 -2.114 0.000) 8.605 32.070 ( 8.341 -2.114 0.000) 8.605 ======================= Grid point 33 (19/72) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 36 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.415 ( 0.000 -21.437 0.000) 21.437 2.415 ( 0.000 21.437 0.000) 21.437 2.678 ( 0.000 -40.542 0.000) 40.542 2.678 ( 0.000 40.542 0.000) 40.542 3.383 ( 0.000 -11.948 0.000) 11.948 3.383 ( 0.000 11.948 0.000) 11.948 3.849 ( 0.000 -14.389 0.000) 14.389 3.849 ( 0.000 14.389 0.000) 14.389 4.484 ( 0.000 -3.255 0.000) 3.255 4.484 ( 0.000 3.255 0.000) 3.255 5.160 ( 0.000 -9.073 0.000) 9.073 5.160 ( 0.000 9.073 0.000) 9.073 5.376 ( 0.000 -6.321 0.000) 6.321 5.376 ( 0.000 6.321 0.000) 6.321 5.699 ( 0.000 -5.916 0.000) 5.916 5.699 ( 0.000 5.916 0.000) 5.916 5.911 ( 0.000 -3.260 0.000) 3.260 5.911 ( 0.000 3.260 0.000) 3.260 6.355 ( 0.000 -8.772 0.000) 8.772 6.355 ( 0.000 8.772 0.000) 8.772 6.552 ( 0.000 -9.890 0.000) 9.890 6.552 ( 0.000 9.890 0.000) 9.890 6.777 ( 0.000 -1.992 0.000) 1.992 6.777 ( 0.000 1.992 0.000) 1.992 7.392 ( 0.000 -4.192 0.000) 4.192 7.392 ( 0.000 4.192 0.000) 4.192 7.919 ( 0.000 -2.690 0.000) 2.690 7.919 ( 0.000 2.690 0.000) 2.690 7.984 ( 0.000 -7.798 0.000) 7.798 7.984 ( 0.000 7.798 0.000) 7.798 8.390 ( 0.000 -8.142 0.000) 8.142 8.390 ( 0.000 8.142 0.000) 8.142 8.765 ( 0.000 -9.252 0.000) 9.252 8.765 ( 0.000 9.252 0.000) 9.252 9.217 ( 0.000 -0.422 0.000) 0.422 9.217 ( 0.000 0.422 0.000) 0.422 9.533 ( 0.000 -5.586 0.000) 5.586 9.533 ( 0.000 5.586 0.000) 5.586 9.569 ( 0.000 -0.167 0.000) 0.167 9.569 ( 0.000 0.167 0.000) 0.167 9.810 ( 0.000 -4.168 0.000) 4.168 9.810 ( 0.000 4.168 0.000) 4.168 10.026 ( 0.000 -1.297 0.000) 1.297 10.026 ( 0.000 1.297 0.000) 1.297 10.277 ( 0.000 -12.254 0.000) 12.254 10.277 ( 0.000 12.254 0.000) 12.254 10.426 ( 0.000 -4.072 0.000) 4.072 10.426 ( 0.000 4.072 0.000) 4.072 10.729 ( 0.000 -1.721 0.000) 1.721 10.729 ( 0.000 1.721 0.000) 1.721 10.980 ( 0.000 -6.539 0.000) 6.539 10.980 ( 0.000 6.539 0.000) 6.539 11.437 ( 0.000 -3.640 0.000) 3.640 11.437 ( 0.000 3.640 0.000) 3.640 11.442 ( 0.000 -3.697 0.000) 3.697 11.442 ( 0.000 3.697 0.000) 3.697 11.833 ( 0.000 -5.145 0.000) 5.145 11.833 ( 0.000 5.145 0.000) 5.145 12.006 ( 0.000 -2.322 0.000) 2.322 12.006 ( 0.000 2.322 0.000) 2.322 12.367 ( 0.000 -4.881 0.000) 4.881 12.367 ( 0.000 4.881 0.000) 4.881 12.675 ( 0.000 -2.080 0.000) 2.080 12.675 ( 0.000 2.080 0.000) 2.080 13.046 ( 0.000 -0.858 0.000) 0.858 13.046 ( 0.000 0.858 0.000) 0.858 13.209 ( 0.000 -1.963 0.000) 1.963 13.209 ( 0.000 1.963 0.000) 1.963 13.705 ( 0.000 -4.046 0.000) 4.046 13.705 ( 0.000 4.046 0.000) 4.046 14.161 ( 0.000 -4.517 0.000) 4.517 14.161 ( 0.000 4.517 0.000) 4.517 14.301 ( 0.000 -11.137 0.000) 11.137 14.301 ( 0.000 11.137 0.000) 11.137 14.726 ( 0.000 -4.913 0.000) 4.913 14.726 ( 0.000 4.913 0.000) 4.913 15.148 ( 0.000 -4.195 0.000) 4.195 15.148 ( 0.000 4.195 0.000) 4.195 15.528 ( 0.000 -4.154 0.000) 4.154 15.528 ( 0.000 4.154 0.000) 4.154 15.976 ( 0.000 -0.088 0.000) 0.088 15.976 ( 0.000 0.088 0.000) 0.088 16.129 ( 0.000 -5.612 0.000) 5.612 16.129 ( 0.000 5.612 0.000) 5.612 16.448 ( 0.000 -14.090 0.000) 14.090 16.448 ( 0.000 14.090 0.000) 14.090 16.673 ( 0.000 -0.995 0.000) 0.995 16.673 ( 0.000 0.995 0.000) 0.995 18.893 ( 0.000 -9.365 0.000) 9.365 18.893 ( 0.000 9.365 0.000) 9.365 19.648 ( 0.000 -1.684 0.000) 1.684 19.648 ( 0.000 1.684 0.000) 1.684 21.688 ( 0.000 -1.742 0.000) 1.742 21.688 ( 0.000 1.742 0.000) 1.742 22.023 ( 0.000 -0.834 0.000) 0.834 22.023 ( 0.000 0.834 0.000) 0.834 26.081 ( 0.000 -0.617 0.000) 0.617 26.081 ( 0.000 0.617 0.000) 0.617 26.220 ( 0.000 -6.149 0.000) 6.149 26.220 ( 0.000 6.149 0.000) 6.149 26.882 ( 0.000 -2.127 0.000) 2.127 26.882 ( 0.000 2.127 0.000) 2.127 27.164 ( 0.000 -0.161 0.000) 0.161 27.164 ( 0.000 0.161 0.000) 0.161 27.477 ( 0.000 -0.720 0.000) 0.720 27.477 ( 0.000 0.720 0.000) 0.720 28.201 ( 0.000 -3.172 0.000) 3.172 28.201 ( 0.000 3.172 0.000) 3.172 29.339 ( 0.000 -2.587 0.000) 2.587 29.339 ( 0.000 2.587 0.000) 2.587 29.631 ( 0.000 -4.570 0.000) 4.570 29.631 ( 0.000 4.570 0.000) 4.570 30.018 ( 0.000 -2.773 0.000) 2.773 30.018 ( 0.000 2.773 0.000) 2.773 30.396 ( 0.000 -0.867 0.000) 0.867 30.396 ( 0.000 0.867 0.000) 0.867 31.124 ( 0.000 -1.997 0.000) 1.997 31.124 ( 0.000 1.997 0.000) 1.997 33.467 ( 0.000 -2.470 0.000) 2.470 33.467 ( 0.000 2.470 0.000) 2.470 ======================= Grid point 35 (20/72) ======================= q-point: ( 0.10 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.644 ( 14.298 -29.758 0.000) 33.015 2.644 ( 14.298 29.758 0.000) 33.015 2.796 ( 10.945 -32.022 0.000) 33.841 2.796 ( 10.945 32.022 0.000) 33.841 3.363 ( 9.905 -23.014 0.000) 25.056 3.363 ( 9.905 23.014 0.000) 25.056 4.154 ( 23.792 -12.495 0.000) 26.873 4.154 ( 23.792 12.495 0.000) 26.873 4.570 ( 9.830 -0.168 0.000) 9.831 4.570 ( 9.830 0.168 0.000) 9.831 5.098 ( -2.727 -10.250 0.000) 10.606 5.098 ( -2.727 10.250 0.000) 10.606 5.423 ( 2.891 -1.694 0.000) 3.351 5.423 ( 2.891 1.694 0.000) 3.351 5.827 ( 9.141 -3.931 0.000) 9.951 5.827 ( 9.141 3.931 0.000) 9.951 5.929 ( 5.171 -4.777 0.000) 7.040 5.929 ( 5.171 4.777 0.000) 7.040 6.373 ( 2.633 -8.998 0.000) 9.375 6.373 ( 2.633 8.998 0.000) 9.375 6.575 ( 2.572 -10.748 0.000) 11.051 6.575 ( 2.572 10.748 0.000) 11.051 6.879 ( 9.219 -10.425 0.000) 13.916 6.879 ( 9.219 10.425 0.000) 13.916 7.313 ( -7.035 -4.566 0.000) 8.387 7.313 ( -7.035 4.566 0.000) 8.387 7.861 ( -5.578 -4.027 0.000) 6.880 7.861 ( -5.578 4.027 0.000) 6.880 8.067 ( 7.539 -8.699 0.000) 11.511 8.067 ( 7.539 8.699 0.000) 11.511 8.373 ( -1.790 -7.272 0.000) 7.489 8.373 ( -1.790 7.272 0.000) 7.489 8.743 ( -1.643 -4.400 0.000) 4.697 8.743 ( -1.643 4.400 0.000) 4.697 9.179 ( -5.299 -3.228 0.000) 6.205 9.179 ( -5.299 3.228 0.000) 6.205 9.457 ( -8.606 -3.342 0.000) 9.232 9.457 ( -8.606 3.342 0.000) 9.232 9.566 ( -4.081 -4.913 0.000) 6.387 9.566 ( -4.081 4.913 0.000) 6.387 9.655 ( -16.645 -4.401 0.000) 17.217 9.655 ( -16.645 4.401 0.000) 17.217 9.911 ( -1.326 -1.668 0.000) 2.131 9.911 ( -1.326 1.668 0.000) 2.131 10.175 ( -9.012 -4.321 0.000) 9.994 10.175 ( -9.012 4.321 0.000) 9.994 10.416 ( -0.263 -4.526 0.000) 4.533 10.416 ( -0.263 4.526 0.000) 4.533 10.765 ( 3.279 -4.359 0.000) 5.454 10.765 ( 3.279 4.359 0.000) 5.454 11.068 ( 6.528 -4.529 0.000) 7.945 11.068 ( 6.528 4.529 0.000) 7.945 11.399 ( 1.021 -2.040 0.000) 2.281 11.399 ( 1.021 2.040 0.000) 2.281 11.542 ( 1.770 -0.369 0.000) 1.807 11.542 ( 1.770 0.369 0.000) 1.807 11.833 ( 2.083 -6.844 0.000) 7.154 11.833 ( 2.083 6.844 0.000) 7.154 12.067 ( 1.422 -5.327 0.000) 5.514 12.067 ( 1.422 5.327 0.000) 5.514 12.234 ( -9.786 -2.983 0.000) 10.230 12.234 ( -9.786 2.983 0.000) 10.231 12.697 ( 1.997 -6.136 0.000) 6.453 12.697 ( 1.997 6.136 0.000) 6.453 12.981 ( -7.008 -1.245 0.000) 7.118 12.981 ( -7.008 1.245 0.000) 7.118 13.241 ( 4.895 -2.774 0.000) 5.626 13.241 ( 4.895 2.774 0.000) 5.626 13.720 ( -2.089 -0.174 0.000) 2.097 13.720 ( -2.089 0.174 0.000) 2.097 14.143 ( -0.437 -6.054 0.000) 6.070 14.143 ( -0.437 6.054 0.000) 6.070 14.280 ( -3.138 -7.978 0.000) 8.573 14.280 ( -3.138 7.978 0.000) 8.573 14.653 ( -4.199 -0.906 0.000) 4.295 14.653 ( -4.199 0.906 0.000) 4.295 15.181 ( 2.064 -4.792 0.000) 5.218 15.181 ( 2.064 4.792 0.000) 5.218 15.535 ( 2.135 -1.269 0.000) 2.484 15.535 ( 2.135 1.269 0.000) 2.484 15.943 ( -0.637 -1.037 0.000) 1.217 15.943 ( -0.637 1.037 0.000) 1.217 16.222 ( -14.187 -5.871 0.000) 15.354 16.222 ( -14.187 5.871 0.000) 15.354 16.345 ( 14.701 -1.694 0.000) 14.798 16.345 ( 14.701 1.694 0.000) 14.798 16.813 ( 8.286 -3.049 0.000) 8.829 16.813 ( 8.286 3.049 0.000) 8.829 18.836 ( -4.830 -7.213 0.000) 8.681 18.836 ( -4.830 7.213 0.000) 8.681 19.680 ( 3.482 -1.458 0.000) 3.775 19.680 ( 3.482 1.458 0.000) 3.775 21.617 ( -7.698 -3.091 0.000) 8.296 21.617 ( -7.698 3.091 0.000) 8.296 22.002 ( -2.816 -2.166 0.000) 3.553 22.002 ( -2.816 2.166 0.000) 3.553 26.097 ( 2.505 -2.578 0.000) 3.594 26.097 ( 2.505 2.578 0.000) 3.594 26.363 ( 12.040 -4.154 0.000) 12.736 26.363 ( 12.040 4.154 0.000) 12.736 26.919 ( 3.462 -1.263 0.000) 3.685 26.919 ( 3.462 1.263 0.000) 3.685 27.223 ( 5.990 -0.945 0.000) 6.064 27.223 ( 5.990 0.945 0.000) 6.064 27.568 ( 9.419 -0.305 0.000) 9.424 27.568 ( 9.419 0.305 0.000) 9.424 28.223 ( 2.135 -3.264 0.000) 3.900 28.223 ( 2.135 3.264 0.000) 3.900 29.341 ( 0.249 -1.845 0.000) 1.862 29.341 ( 0.249 1.845 0.000) 1.862 29.614 ( -1.568 -3.488 0.000) 3.824 29.614 ( -1.568 3.488 0.000) 3.824 29.990 ( -2.870 -0.565 0.000) 2.925 29.990 ( -2.870 0.565 0.000) 2.925 30.423 ( 2.777 -0.299 0.000) 2.793 30.423 ( 2.777 0.299 0.000) 2.793 31.122 ( -0.112 -0.745 0.000) 0.753 31.122 ( -0.112 0.745 0.000) 0.753 33.310 ( -15.301 -6.864 0.000) 16.770 33.310 ( -15.301 6.864 0.000) 16.770 ======================= Grid point 37 (21/72) ======================= q-point: ( 0.20 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.753 ( 2.440 -38.307 0.000) 38.385 2.753 ( 2.440 38.307 0.000) 38.385 3.074 ( 18.924 -27.271 0.000) 33.194 3.074 ( 18.924 27.271 0.000) 33.194 3.856 ( 28.909 -6.358 0.000) 29.600 3.856 ( 28.909 6.358 0.000) 29.600 4.579 ( 22.617 -10.119 0.000) 24.777 4.579 ( 22.617 10.119 0.000) 24.777 4.743 ( 3.143 -7.453 0.000) 8.089 4.743 ( 3.143 7.453 0.000) 8.089 5.242 ( 11.007 -1.457 0.000) 11.103 5.242 ( 11.007 1.457 0.000) 11.103 5.491 ( 11.100 -0.910 0.000) 11.137 5.491 ( 11.100 0.910 0.000) 11.137 5.967 ( 13.162 -4.573 0.000) 13.934 5.967 ( 13.162 4.573 0.000) 13.934 6.180 ( 14.320 -1.886 0.000) 14.444 6.180 ( 14.320 1.886 0.000) 14.444 6.439 ( 2.882 -3.749 0.000) 4.729 6.439 ( 2.882 3.749 0.000) 4.729 6.680 ( 9.207 -12.431 0.000) 15.469 6.680 ( 9.207 12.431 0.000) 15.469 7.051 ( 3.752 -11.223 0.000) 11.834 7.051 ( 3.752 11.223 0.000) 11.834 7.180 ( -2.396 -9.719 0.000) 10.010 7.180 ( -2.396 9.719 0.000) 10.010 7.745 ( -5.171 -6.154 0.000) 8.038 7.745 ( -5.171 6.154 0.000) 8.038 8.215 ( 4.678 -5.696 0.000) 7.371 8.215 ( 4.678 5.696 0.000) 7.371 8.336 ( -0.295 -0.896 0.000) 0.944 8.336 ( -0.295 0.896 0.000) 0.944 8.682 ( -7.696 -7.977 0.000) 11.085 8.682 ( -7.696 7.977 0.000) 11.085 8.981 ( -14.344 -7.731 0.000) 16.295 8.981 ( -14.344 7.731 0.000) 16.295 9.141 ( -17.797 -8.288 0.000) 19.632 9.141 ( -17.797 8.288 0.000) 19.632 9.283 ( -10.144 -6.140 0.000) 11.857 9.283 ( -10.144 6.140 0.000) 11.857 9.634 ( 2.581 -1.926 0.000) 3.221 9.634 ( 2.581 1.926 0.000) 3.221 9.934 ( -3.650 -8.865 0.000) 9.587 9.934 ( -3.650 8.865 0.000) 9.587 10.034 ( 0.164 -1.657 0.000) 1.665 10.034 ( 0.164 1.657 0.000) 1.665 10.392 ( -3.673 -0.405 0.000) 3.696 10.392 ( -3.673 0.405 0.000) 3.696 10.802 ( 0.960 -1.939 0.000) 2.164 10.802 ( 0.960 1.939 0.000) 2.164 11.197 ( 5.642 -1.779 0.000) 5.916 11.197 ( 5.642 1.779 0.000) 5.916 11.426 ( -5.694 -4.716 0.000) 7.394 11.426 ( -5.694 4.716 0.000) 7.394 11.511 ( 2.059 -4.212 0.000) 4.688 11.511 ( 2.059 4.212 0.000) 4.688 11.781 ( -6.292 -0.428 0.000) 6.306 11.781 ( -6.292 0.428 0.000) 6.306 12.056 ( -8.138 -8.033 0.000) 11.435 12.056 ( -8.138 8.033 0.000) 11.435 12.143 ( 6.962 -4.339 0.000) 8.204 12.143 ( 6.962 4.339 0.000) 8.204 12.695 ( -4.777 -7.934 0.000) 9.261 12.695 ( -4.777 7.934 0.000) 9.261 12.827 ( -7.155 -2.669 0.000) 7.637 12.827 ( -7.155 2.669 0.000) 7.637 13.372 ( 4.455 -4.926 0.000) 6.642 13.372 ( 4.455 4.926 0.000) 6.642 13.600 ( -5.871 -0.843 0.000) 5.931 13.600 ( -5.871 0.843 0.000) 5.931 14.022 ( -12.982 -10.878 0.000) 16.937 14.022 ( -12.982 10.878 0.000) 16.937 14.281 ( 4.496 -0.876 0.000) 4.580 14.281 ( 4.496 0.876 0.000) 4.580 14.654 ( 2.043 -0.123 0.000) 2.046 14.654 ( 2.043 0.123 0.000) 2.046 15.174 ( -2.698 -3.763 0.000) 4.631 15.174 ( -2.698 3.763 0.000) 4.631 15.646 ( 6.597 -4.460 0.000) 7.964 15.646 ( 6.597 4.460 0.000) 7.964 15.795 ( -9.352 -3.102 0.000) 9.853 15.795 ( -9.352 3.102 0.000) 9.853 16.140 ( 3.154 -5.697 0.000) 6.512 16.140 ( 3.154 5.697 0.000) 6.512 16.587 ( 9.204 -1.850 0.000) 9.388 16.587 ( 9.204 1.850 0.000) 9.388 16.948 ( 5.785 -13.593 0.000) 14.773 16.948 ( 5.785 13.593 0.000) 14.773 18.782 ( 1.445 -3.617 0.000) 3.895 18.782 ( 1.445 3.617 0.000) 3.895 19.791 ( 8.374 -1.849 0.000) 8.575 19.791 ( 8.374 1.849 0.000) 8.575 21.384 ( -16.460 -3.839 0.000) 16.902 21.384 ( -16.460 3.839 0.000) 16.902 21.885 ( -9.902 -3.302 0.000) 10.438 21.885 ( -9.902 3.302 0.000) 10.438 26.166 ( 4.039 -2.604 0.000) 4.806 26.166 ( 4.039 2.604 0.000) 4.806 26.585 ( 8.880 -3.295 0.000) 9.472 26.585 ( 8.880 3.295 0.000) 9.472 27.009 ( 6.491 -0.235 0.000) 6.495 27.009 ( 6.491 0.235 0.000) 6.495 27.389 ( 10.879 -1.960 0.000) 11.054 27.389 ( 10.879 1.960 0.000) 11.054 27.808 ( 14.156 -2.005 0.000) 14.297 27.808 ( 14.156 2.005 0.000) 14.297 28.270 ( 2.188 -3.542 0.000) 4.163 28.270 ( 2.188 3.542 0.000) 4.163 29.349 ( 0.541 -0.370 0.000) 0.655 29.349 ( 0.541 0.370 0.000) 0.655 29.582 ( -1.298 -2.860 0.000) 3.140 29.582 ( -1.298 2.860 0.000) 3.140 29.914 ( -4.730 -0.197 0.000) 4.734 29.914 ( -4.730 0.197 0.000) 4.734 30.494 ( 4.284 -0.147 0.000) 4.287 30.494 ( 4.284 0.147 0.000) 4.287 31.128 ( 1.105 -0.098 0.000) 1.109 31.128 ( 1.105 0.098 0.000) 1.109 32.940 ( -21.517 -11.952 0.000) 24.614 32.940 ( -21.517 11.952 0.000) 24.614 ======================= Grid point 39 (22/72) ======================= q-point: ( 0.30 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.908 ( 14.378 -22.952 0.000) 27.084 2.908 ( 14.378 22.952 0.000) 27.084 3.486 ( 22.903 -14.411 0.000) 27.059 3.486 ( 22.903 14.411 0.000) 27.059 4.208 ( 8.076 -9.137 0.000) 12.195 4.208 ( 8.076 9.137 0.000) 12.195 4.783 ( 2.801 -3.218 0.000) 4.267 4.783 ( 2.801 3.218 0.000) 4.267 5.002 ( 15.195 -1.947 0.000) 15.319 5.002 ( 15.195 1.947 0.000) 15.319 5.269 ( 0.800 -0.565 0.000) 0.979 5.269 ( 0.800 0.565 0.000) 0.979 5.844 ( 16.481 -3.078 0.000) 16.766 5.844 ( 16.481 3.078 0.000) 16.766 6.294 ( 10.248 -0.534 0.000) 10.262 6.294 ( 10.248 0.534 0.000) 10.262 6.412 ( 8.007 -7.377 0.000) 10.887 6.412 ( 8.007 7.377 0.000) 10.887 6.603 ( 21.098 -5.225 0.000) 21.735 6.603 ( 21.098 5.225 0.000) 21.735 6.829 ( -0.333 -1.099 0.000) 1.148 6.829 ( -0.333 1.099 0.000) 1.148 6.945 ( -1.099 -3.206 0.000) 3.389 6.945 ( -1.099 3.206 0.000) 3.389 7.383 ( 17.848 -1.152 0.000) 17.885 7.383 ( 17.848 1.152 0.000) 17.885 7.663 ( -4.602 -3.554 0.000) 5.815 7.663 ( -4.602 3.554 0.000) 5.815 8.137 ( -10.947 -3.737 0.000) 11.567 8.137 ( -10.947 3.737 0.000) 11.567 8.269 ( -11.018 -2.206 0.000) 11.237 8.269 ( -11.018 2.206 0.000) 11.237 8.581 ( 5.470 -9.158 0.000) 10.667 8.581 ( 5.470 9.158 0.000) 10.667 8.789 ( -4.585 -3.003 0.000) 5.481 8.789 ( -4.585 3.003 0.000) 5.481 8.959 ( -3.973 -3.284 0.000) 5.155 8.959 ( -3.973 3.284 0.000) 5.155 9.155 ( -2.119 -8.001 0.000) 8.277 9.155 ( -2.119 8.001 0.000) 8.277 9.697 ( 1.959 -2.306 0.000) 3.026 9.697 ( 1.959 2.306 0.000) 3.026 9.800 ( -5.342 -8.388 0.000) 9.945 9.800 ( -5.342 8.388 0.000) 9.945 10.098 ( 0.730 -0.523 0.000) 0.898 10.098 ( 0.730 0.523 0.000) 0.898 10.274 ( -6.070 -2.934 0.000) 6.742 10.274 ( -6.070 2.934 0.000) 6.742 10.841 ( 3.064 -1.734 0.000) 3.521 10.841 ( 3.064 1.734 0.000) 3.521 11.077 ( -16.545 -1.973 0.000) 16.663 11.077 ( -16.545 1.973 0.000) 16.663 11.317 ( -3.232 -3.142 0.000) 4.508 11.317 ( -3.232 3.142 0.000) 4.508 11.621 ( 1.934 -3.970 0.000) 4.416 11.621 ( 1.934 3.970 0.000) 4.416 11.710 ( 1.441 -1.826 0.000) 2.326 11.710 ( 1.441 1.826 0.000) 2.326 11.925 ( -2.608 -4.211 0.000) 4.953 11.925 ( -2.608 4.211 0.000) 4.953 12.283 ( 5.127 -6.441 0.000) 8.233 12.283 ( 5.127 6.441 0.000) 8.233 12.532 ( -9.754 -4.936 0.000) 10.932 12.532 ( -9.754 4.936 0.000) 10.932 12.722 ( -3.652 -4.898 0.000) 6.109 12.722 ( -3.652 4.898 0.000) 6.109 13.245 ( -11.762 -7.347 0.000) 13.868 13.245 ( -11.762 7.347 0.000) 13.868 13.601 ( -3.325 -9.718 0.000) 10.271 13.601 ( -3.325 9.718 0.000) 10.271 13.822 ( -4.032 -2.562 0.000) 4.777 13.822 ( -4.032 2.562 0.000) 4.777 14.352 ( 1.517 -1.051 0.000) 1.846 14.352 ( 1.517 1.051 0.000) 1.846 14.572 ( -10.621 -0.364 0.000) 10.628 14.572 ( -10.621 0.364 0.000) 10.628 15.183 ( 5.479 -2.455 0.000) 6.004 15.183 ( 5.479 2.455 0.000) 6.004 15.587 ( -3.701 -5.609 0.000) 6.720 15.587 ( -3.701 5.609 0.000) 6.720 15.895 ( 9.512 -1.430 0.000) 9.619 15.895 ( 9.512 1.430 0.000) 9.619 16.202 ( 2.575 -3.831 0.000) 4.616 16.202 ( 2.575 3.831 0.000) 4.616 16.698 ( 3.362 -5.036 0.000) 6.056 16.698 ( 3.362 5.036 0.000) 6.056 17.021 ( 1.461 -17.058 0.000) 17.121 17.021 ( 1.461 17.058 0.000) 17.121 18.948 ( 16.069 -7.746 0.000) 17.838 18.948 ( 16.069 7.746 0.000) 17.838 20.011 ( 14.668 -2.263 0.000) 14.842 20.011 ( 14.668 2.263 0.000) 14.842 20.995 ( -23.720 -5.762 0.000) 24.410 20.995 ( -23.720 5.762 0.000) 24.410 21.619 ( -17.491 -4.803 0.000) 18.139 21.619 ( -17.491 4.803 0.000) 18.139 26.235 ( 2.895 -2.025 0.000) 3.533 26.235 ( 2.895 2.025 0.000) 3.533 26.667 ( 0.391 -2.004 0.000) 2.042 26.667 ( 0.391 2.004 0.000) 2.042 27.187 ( 11.477 -0.635 0.000) 11.495 27.187 ( 11.477 0.635 0.000) 11.495 27.607 ( 10.650 -3.358 0.000) 11.167 27.607 ( 10.650 3.358 0.000) 11.167 28.062 ( 11.048 -1.757 0.000) 11.187 28.062 ( 11.048 1.757 0.000) 11.187 28.291 ( 0.134 -3.223 0.000) 3.226 28.291 ( 0.134 3.223 0.000) 3.226 29.358 ( 0.304 -0.548 0.000) 0.627 29.358 ( 0.304 0.548 0.000) 0.627 29.572 ( -0.084 -1.267 0.000) 1.270 29.572 ( -0.084 1.267 0.000) 1.270 29.829 ( -3.430 -1.652 0.000) 3.808 29.829 ( -3.430 1.652 0.000) 3.808 30.571 ( 3.321 -0.198 0.000) 3.327 30.571 ( 3.321 0.198 0.000) 3.327 31.175 ( 3.951 -0.205 0.000) 3.957 31.175 ( 3.951 0.205 0.000) 3.957 32.531 ( -20.198 -12.886 0.000) 23.959 32.531 ( -20.198 12.886 0.000) 23.959 ======================= Grid point 41 (23/72) ======================= q-point: ( 0.40 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.273 ( 22.071 -11.611 0.000) 24.939 3.273 ( 22.071 11.611 0.000) 24.939 3.875 ( 11.795 -7.310 0.000) 13.877 3.875 ( 11.795 7.310 0.000) 13.877 4.233 ( -0.409 -13.040 0.000) 13.046 4.233 ( -0.409 13.040 0.000) 13.046 4.811 ( -0.361 -10.920 0.000) 10.926 4.811 ( -0.361 10.920 0.000) 10.926 5.220 ( 10.323 -1.066 0.000) 10.378 5.220 ( 10.323 1.066 0.000) 10.378 5.282 ( -1.567 -5.398 0.000) 5.621 5.282 ( -1.567 5.398 0.000) 5.621 6.039 ( 5.329 -5.695 0.000) 7.799 6.039 ( 5.329 5.695 0.000) 7.799 6.310 ( -7.243 -1.808 0.000) 7.465 6.310 ( -7.243 1.808 0.000) 7.465 6.524 ( 4.721 -2.314 0.000) 5.258 6.524 ( 4.721 2.314 0.000) 5.258 6.742 ( -2.888 -0.779 0.000) 2.992 6.742 ( -2.888 0.779 0.000) 2.992 6.930 ( 10.923 -5.327 0.000) 12.153 6.930 ( 10.923 5.327 0.000) 12.153 7.150 ( 12.428 -11.009 0.000) 16.603 7.150 ( 12.428 11.009 0.000) 16.603 7.418 ( -10.222 -3.324 0.000) 10.749 7.418 ( -10.222 3.324 0.000) 10.749 7.767 ( -0.492 -7.803 0.000) 7.818 7.767 ( -0.492 7.803 0.000) 7.818 8.007 ( 5.501 -5.645 0.000) 7.882 8.007 ( 5.501 5.645 0.000) 7.882 8.217 ( 12.933 -10.369 0.000) 16.576 8.217 ( 12.933 10.369 0.000) 16.576 8.672 ( 3.576 -5.517 0.000) 6.575 8.672 ( 3.576 5.517 0.000) 6.575 8.729 ( -3.933 -6.097 0.000) 7.256 8.729 ( -3.933 6.097 0.000) 7.256 8.990 ( 1.923 -2.810 0.000) 3.405 8.990 ( 1.923 2.810 0.000) 3.405 9.188 ( 5.655 -5.874 0.000) 8.153 9.188 ( 5.655 5.874 0.000) 8.153 9.622 ( -5.783 -6.990 0.000) 9.072 9.622 ( -5.783 6.990 0.000) 9.072 9.754 ( -5.042 -1.460 0.000) 5.250 9.754 ( -5.042 1.460 0.000) 5.250 10.039 ( -1.708 -2.247 0.000) 2.823 10.039 ( -1.708 2.247 0.000) 2.823 10.268 ( 3.255 -2.299 0.000) 3.985 10.268 ( 3.255 2.299 0.000) 3.985 10.692 ( -11.881 -5.528 0.000) 13.104 10.692 ( -11.881 5.528 0.000) 13.104 11.007 ( -2.304 -0.727 0.000) 2.416 11.007 ( -2.304 0.727 0.000) 2.416 11.161 ( -3.151 -0.068 0.000) 3.151 11.161 ( -3.151 0.068 0.000) 3.151 11.590 ( -3.222 -0.656 0.000) 3.288 11.590 ( -3.222 0.656 0.000) 3.288 11.758 ( 0.549 -2.229 0.000) 2.295 11.758 ( 0.549 2.229 0.000) 2.295 11.939 ( 0.343 -2.164 0.000) 2.191 11.939 ( 0.343 2.164 0.000) 2.191 12.308 ( -1.726 -3.697 0.000) 4.081 12.308 ( -1.726 3.697 0.000) 4.081 12.393 ( -2.329 -1.032 0.000) 2.548 12.393 ( -2.329 1.032 0.000) 2.548 12.732 ( 4.509 -0.450 0.000) 4.532 12.732 ( 4.509 0.450 0.000) 4.532 13.041 ( -9.435 -8.723 0.000) 12.849 13.041 ( -9.435 8.723 0.000) 12.849 13.465 ( -5.284 -8.060 0.000) 9.638 13.465 ( -5.284 8.060 0.000) 9.638 13.729 ( -10.340 -5.845 0.000) 11.878 13.729 ( -10.340 5.845 0.000) 11.878 14.305 ( -3.171 -3.983 0.000) 5.091 14.305 ( -3.171 3.983 0.000) 5.091 14.461 ( -0.392 -2.406 0.000) 2.438 14.461 ( -0.392 2.406 0.000) 2.438 15.302 ( 4.590 -2.696 0.000) 5.323 15.302 ( 4.590 2.696 0.000) 5.323 15.586 ( 3.023 -6.435 0.000) 7.110 15.586 ( 3.023 6.435 0.000) 7.110 16.005 ( 1.478 -0.158 0.000) 1.487 16.005 ( 1.478 0.158 0.000) 1.487 16.240 ( 1.474 -1.421 0.000) 2.047 16.240 ( 1.474 1.421 0.000) 2.047 16.765 ( 4.392 -5.530 0.000) 7.062 16.765 ( 4.392 5.530 0.000) 7.062 17.006 ( -2.718 -13.879 0.000) 14.143 17.006 ( -2.718 13.879 0.000) 14.143 19.366 ( 26.036 -9.949 0.000) 27.872 19.366 ( 26.036 9.949 0.000) 27.872 20.350 ( 19.552 -2.793 0.000) 19.750 20.350 ( 19.552 2.793 0.000) 19.750 20.493 ( -27.152 -8.089 0.000) 28.331 20.493 ( -27.152 8.089 0.000) 28.331 21.231 ( -22.336 -5.509 0.000) 23.005 21.231 ( -22.336 5.509 0.000) 23.005 26.276 ( 1.386 -0.969 0.000) 1.691 26.276 ( 1.386 0.969 0.000) 1.691 26.647 ( -1.561 -0.980 0.000) 1.843 26.647 ( -1.561 0.980 0.000) 1.843 27.406 ( 10.100 -1.294 0.000) 10.183 27.406 ( 10.100 1.294 0.000) 10.183 27.761 ( 4.710 -4.474 0.000) 6.496 27.761 ( 4.710 4.474 0.000) 6.496 28.163 ( -0.667 -2.058 0.000) 2.164 28.163 ( -0.667 2.058 0.000) 2.164 28.334 ( 4.825 -2.497 0.000) 5.433 28.334 ( 4.825 2.497 0.000) 5.433 29.363 ( 0.400 -0.276 0.000) 0.486 29.363 ( 0.400 0.276 0.000) 0.486 29.557 ( -1.626 -0.007 0.000) 1.626 29.557 ( -1.626 0.007 0.000) 1.626 29.803 ( 0.468 -1.602 0.000) 1.669 29.803 ( 0.468 1.602 0.000) 1.669 30.614 ( 1.188 -0.140 0.000) 1.196 30.614 ( 1.188 0.140 0.000) 1.196 31.274 ( 5.661 -0.691 0.000) 5.703 31.274 ( 5.661 0.691 0.000) 5.703 32.195 ( -13.924 -8.985 0.000) 16.571 32.195 ( -13.924 8.985 0.000) 16.571 ======================= Grid point 43 (24/72) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 36 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.626 ( 0.000 0.000 0.000) 0.000 3.626 ( 0.000 0.000 0.000) 0.000 3.799 ( 0.000 0.000 0.000) 0.000 3.799 ( 0.000 0.000 0.000) 0.000 4.329 ( 0.000 0.000 0.000) 0.000 4.329 ( 0.000 0.000 0.000) 0.000 4.785 ( 0.000 0.000 0.000) 0.000 4.785 ( 0.000 0.000 0.000) 0.000 5.225 ( 0.000 0.000 0.000) 0.000 5.225 ( 0.000 0.000 0.000) 0.000 5.365 ( 0.000 0.000 0.000) 0.000 5.365 ( 0.000 0.000 0.000) 0.000 6.131 ( 0.000 0.000 0.000) 0.000 6.131 ( 0.000 0.000 0.000) 0.000 6.154 ( -0.000 0.000 0.000) 0.000 6.154 ( -0.000 0.000 0.000) 0.000 6.641 ( 0.000 0.000 0.000) 0.000 6.641 ( 0.000 0.000 0.000) 0.000 6.650 ( -0.000 -0.000 0.000) 0.000 6.650 ( -0.000 -0.000 0.000) 0.000 7.094 ( 0.000 0.000 0.000) 0.000 7.094 ( 0.000 0.000 0.000) 0.000 7.115 ( 0.000 -0.000 0.000) 0.000 7.115 ( 0.000 -0.000 0.000) 0.000 7.491 ( 0.000 0.000 0.000) 0.000 7.491 ( 0.000 0.000 0.000) 0.000 7.585 ( -0.000 0.000 0.000) 0.000 7.585 ( -0.000 0.000 0.000) 0.000 8.095 ( 0.000 0.000 0.000) 0.000 8.095 ( 0.000 0.000 0.000) 0.000 8.590 ( 0.000 0.000 0.000) 0.000 8.590 ( 0.000 0.000 0.000) 0.000 8.592 ( -0.000 -0.000 0.000) 0.000 8.592 ( -0.000 -0.000 0.000) 0.000 8.802 ( 0.000 0.000 0.000) 0.000 8.802 ( 0.000 0.000 0.000) 0.000 8.862 ( -0.000 -0.000 0.000) 0.000 8.862 ( -0.000 -0.000 0.000) 0.000 9.279 ( 0.000 0.000 0.000) 0.000 9.279 ( 0.000 0.000 0.000) 0.000 9.573 ( 0.000 -0.000 0.000) 0.000 9.573 ( 0.000 -0.000 0.000) 0.000 9.661 ( 0.000 0.000 0.000) 0.000 9.661 ( 0.000 0.000 0.000) 0.000 10.050 ( 0.000 0.000 0.000) 0.000 10.050 ( 0.000 0.000 0.000) 0.000 10.279 ( 0.000 0.000 0.000) 0.000 10.279 ( 0.000 0.000 0.000) 0.000 10.674 ( 0.000 0.000 0.000) 0.000 10.674 ( 0.000 0.000 0.000) 0.000 10.791 ( 0.000 0.000 0.000) 0.000 10.791 ( 0.000 0.000 0.000) 0.000 11.275 ( 0.000 0.000 0.000) 0.000 11.275 ( 0.000 0.000 0.000) 0.000 11.510 ( 0.000 0.000 0.000) 0.000 11.510 ( 0.000 0.000 0.000) 0.000 11.769 ( 0.000 0.000 0.000) 0.000 11.769 ( 0.000 0.000 0.000) 0.000 11.901 ( 0.000 0.000 0.000) 0.000 11.901 ( 0.000 0.000 0.000) 0.000 12.313 ( -0.000 0.000 0.000) 0.000 12.313 ( -0.000 0.000 0.000) 0.000 12.379 ( 0.000 0.000 0.000) 0.000 12.379 ( 0.000 0.000 0.000) 0.000 12.829 ( 0.000 0.000 0.000) 0.000 12.829 ( 0.000 0.000 0.000) 0.000 12.898 ( 0.000 0.000 0.000) 0.000 12.898 ( 0.000 0.000 0.000) 0.000 13.500 ( 0.000 -0.000 0.000) 0.000 13.500 ( 0.000 -0.000 0.000) 0.000 13.506 ( 0.000 0.000 0.000) 0.000 13.506 ( 0.000 0.000 0.000) 0.000 14.287 ( 0.000 0.000 0.000) 0.000 14.287 ( 0.000 0.000 0.000) 0.000 14.464 ( 0.000 0.000 0.000) 0.000 14.464 ( 0.000 0.000 0.000) 0.000 15.342 ( 0.000 0.000 0.000) 0.000 15.342 ( 0.000 0.000 0.000) 0.000 15.636 ( 0.000 0.000 0.000) 0.000 15.636 ( 0.000 0.000 0.000) 0.000 16.001 ( 0.000 0.000 0.000) 0.000 16.001 ( 0.000 0.000 0.000) 0.000 16.254 ( 0.000 0.000 0.000) 0.000 16.254 ( 0.000 0.000 0.000) 0.000 16.837 ( 0.000 0.000 0.000) 0.000 16.837 ( 0.000 0.000 0.000) 0.000 16.954 ( 0.000 -0.000 0.000) 0.000 16.954 ( 0.000 -0.000 0.000) 0.000 19.835 ( 0.000 0.000 0.000) 0.000 19.835 ( 0.000 0.000 0.000) 0.000 20.004 ( -0.000 -0.000 0.000) 0.000 20.004 ( -0.000 -0.000 0.000) 0.000 20.754 ( 0.000 -0.000 0.000) 0.000 20.754 ( 0.000 -0.000 0.000) 0.000 20.812 ( -0.000 0.000 0.000) 0.000 20.812 ( -0.000 0.000 0.000) 0.000 26.289 ( 0.000 0.000 0.000) 0.000 26.289 ( 0.000 0.000 0.000) 0.000 26.629 ( 0.000 0.000 0.000) 0.000 26.629 ( 0.000 0.000 0.000) 0.000 27.520 ( 0.000 0.000 0.000) 0.000 27.520 ( 0.000 0.000 0.000) 0.000 27.795 ( 0.000 0.000 0.000) 0.000 27.795 ( 0.000 0.000 0.000) 0.000 28.142 ( 0.000 0.000 0.000) 0.000 28.142 ( 0.000 0.000 0.000) 0.000 28.391 ( 0.000 0.000 0.000) 0.000 28.391 ( 0.000 0.000 0.000) 0.000 29.370 ( 0.000 0.000 0.000) 0.000 29.370 ( 0.000 0.000 0.000) 0.000 29.534 ( 0.000 0.000 0.000) 0.000 29.534 ( 0.000 0.000 0.000) 0.000 29.814 ( 0.000 0.000 0.000) 0.000 29.814 ( 0.000 0.000 0.000) 0.000 30.624 ( 0.000 0.000 0.000) 0.000 30.624 ( 0.000 0.000 0.000) 0.000 31.343 ( 0.000 0.000 0.000) 0.000 31.343 ( 0.000 0.000 0.000) 0.000 32.047 ( 0.000 0.000 0.000) 0.000 32.047 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 77 (25/72) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.901 ( 0.000 0.000 40.653) 40.653 1.034 ( 0.000 0.000 46.042) 46.042 1.795 ( 0.000 0.000 76.750) 76.750 3.011 ( 0.000 0.000 -8.598) 8.598 3.018 ( 0.000 0.000 -3.971) 3.971 3.448 ( 0.000 0.000 3.543) 3.543 3.759 ( 0.000 0.000 -15.433) 15.433 4.485 ( 0.000 0.000 -1.407) 1.407 4.566 ( 0.000 0.000 -2.132) 2.132 4.789 ( 0.000 0.000 17.004) 17.004 4.956 ( 0.000 0.000 -6.123) 6.123 5.153 ( 0.000 0.000 -5.682) 5.682 5.416 ( 0.000 0.000 -15.220) 15.220 5.730 ( 0.000 0.000 -1.676) 1.676 5.786 ( 0.000 0.000 -5.284) 5.284 5.797 ( 0.000 0.000 2.137) 2.137 5.922 ( 0.000 0.000 -1.077) 1.077 5.946 ( 0.000 0.000 -6.579) 6.579 6.168 ( 0.000 0.000 -5.833) 5.833 6.491 ( 0.000 0.000 7.156) 7.156 6.546 ( 0.000 0.000 -10.124) 10.124 6.865 ( 0.000 0.000 4.962) 4.962 7.077 ( 0.000 0.000 6.682) 6.682 7.143 ( 0.000 0.000 -11.893) 11.893 7.184 ( 0.000 0.000 7.278) 7.278 7.265 ( 0.000 0.000 4.394) 4.394 7.810 ( 0.000 0.000 6.537) 6.537 8.028 ( 0.000 0.000 -2.112) 2.112 8.080 ( 0.000 0.000 2.916) 2.916 8.187 ( 0.000 0.000 2.599) 2.599 8.439 ( 0.000 0.000 -3.982) 3.982 8.459 ( 0.000 0.000 -2.734) 2.734 8.865 ( 0.000 0.000 0.627) 0.627 8.914 ( 0.000 0.000 0.629) 0.629 8.974 ( 0.000 0.000 -1.054) 1.054 9.193 ( 0.000 0.000 -0.458) 0.458 9.228 ( 0.000 0.000 -2.557) 2.557 9.365 ( 0.000 0.000 -2.732) 2.732 9.579 ( 0.000 0.000 0.127) 0.127 9.588 ( 0.000 0.000 7.908) 7.908 9.696 ( 0.000 0.000 -1.995) 1.995 9.800 ( 0.000 0.000 0.974) 0.974 9.861 ( 0.000 0.000 1.718) 1.718 9.930 ( 0.000 0.000 1.760) 1.760 10.062 ( 0.000 0.000 12.258) 12.258 10.136 ( 0.000 0.000 -9.798) 9.798 10.298 ( 0.000 0.000 -7.181) 7.181 10.562 ( 0.000 0.000 3.354) 3.354 10.843 ( 0.000 0.000 -4.104) 4.104 10.984 ( 0.000 0.000 1.225) 1.225 11.028 ( 0.000 0.000 -1.648) 1.648 11.307 ( 0.000 0.000 1.338) 1.338 11.368 ( 0.000 0.000 -7.500) 7.500 11.599 ( 0.000 0.000 -2.303) 2.303 11.645 ( 0.000 0.000 -2.042) 2.042 11.722 ( 0.000 0.000 9.166) 9.166 11.803 ( 0.000 0.000 2.374) 2.374 12.007 ( 0.000 0.000 -3.682) 3.682 12.146 ( 0.000 0.000 -4.615) 4.615 12.187 ( 0.000 0.000 8.303) 8.303 12.346 ( 0.000 0.000 12.824) 12.824 12.479 ( 0.000 0.000 2.446) 2.446 12.639 ( 0.000 0.000 -13.673) 13.673 12.803 ( 0.000 0.000 1.837) 1.837 13.101 ( 0.000 0.000 -4.710) 4.710 13.129 ( 0.000 0.000 3.958) 3.958 13.306 ( 0.000 0.000 -9.877) 9.877 13.371 ( 0.000 0.000 1.059) 1.059 13.549 ( 0.000 0.000 0.837) 0.837 13.625 ( 0.000 0.000 2.680) 2.680 13.840 ( 0.000 0.000 8.957) 8.957 14.005 ( 0.000 0.000 -2.409) 2.409 14.191 ( 0.000 0.000 -5.402) 5.402 14.289 ( 0.000 0.000 5.590) 5.590 14.583 ( 0.000 0.000 -1.077) 1.077 14.590 ( 0.000 0.000 -4.720) 4.720 15.042 ( 0.000 0.000 -0.812) 0.812 15.051 ( 0.000 0.000 -3.383) 3.383 15.242 ( 0.000 0.000 1.494) 1.494 15.446 ( 0.000 0.000 -4.297) 4.297 15.636 ( 0.000 0.000 2.167) 2.167 15.650 ( 0.000 0.000 -9.169) 9.169 15.667 ( 0.000 0.000 2.487) 2.487 15.764 ( 0.000 0.000 -5.927) 5.927 16.356 ( 0.000 0.000 8.839) 8.839 16.761 ( 0.000 0.000 3.356) 3.356 16.789 ( 0.000 0.000 -5.578) 5.578 16.936 ( 0.000 0.000 -0.738) 0.738 18.890 ( 0.000 0.000 -2.563) 2.563 19.129 ( 0.000 0.000 -9.677) 9.677 19.780 ( 0.000 0.000 9.620) 9.620 19.955 ( 0.000 0.000 7.362) 7.362 21.426 ( 0.000 0.000 0.574) 0.574 21.475 ( 0.000 0.000 -0.457) 0.457 22.059 ( 0.000 0.000 0.203) 0.203 22.100 ( 0.000 0.000 -0.641) 0.641 25.899 ( 0.000 0.000 5.296) 5.296 26.097 ( 0.000 0.000 0.292) 0.292 26.113 ( 0.000 0.000 -0.105) 0.105 26.416 ( 0.000 0.000 -5.400) 5.400 26.532 ( 0.000 0.000 3.844) 3.844 26.945 ( 0.000 0.000 -5.160) 5.160 27.201 ( 0.000 0.000 2.622) 2.622 27.242 ( 0.000 0.000 0.065) 0.065 27.632 ( 0.000 0.000 13.662) 13.662 27.857 ( 0.000 0.000 1.238) 1.238 28.009 ( 0.000 0.000 -2.470) 2.470 28.863 ( 0.000 0.000 -7.808) 7.808 29.271 ( 0.000 0.000 4.717) 4.717 29.318 ( 0.000 0.000 1.495) 1.495 29.395 ( 0.000 0.000 -1.179) 1.179 29.433 ( 0.000 0.000 -4.918) 4.918 29.948 ( 0.000 0.000 -0.182) 0.182 30.217 ( 0.000 0.000 -4.122) 4.122 30.289 ( 0.000 0.000 0.493) 0.493 30.375 ( 0.000 0.000 -1.067) 1.067 31.176 ( 0.000 0.000 4.667) 4.667 31.573 ( 0.000 0.000 -3.807) 3.807 33.026 ( 0.000 0.000 6.574) 6.574 33.578 ( 0.000 0.000 -5.271) 5.271 ======================= Grid point 78 (26/72) ======================= q-point: ( 0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.371 ( 30.512 0.000 34.104) 45.761 1.403 ( 39.066 0.000 31.442) 50.147 2.064 ( 30.367 0.000 63.380) 70.279 3.072 ( 6.312 0.000 -7.095) 9.497 3.345 ( 33.079 0.000 -13.834) 35.855 3.888 ( 35.564 0.000 2.086) 35.625 4.096 ( 33.722 0.000 -8.265) 34.720 4.532 ( 3.729 0.000 -1.328) 3.959 4.599 ( 3.723 0.000 -2.370) 4.413 4.925 ( 17.588 0.000 15.894) 23.705 5.115 ( -3.452 0.000 -7.599) 8.347 5.162 ( 15.480 0.000 -5.861) 16.552 5.356 ( -5.323 0.000 -14.152) 15.119 5.726 ( -0.023 0.000 -2.964) 2.964 5.823 ( 3.002 0.000 -3.791) 4.836 5.841 ( 4.489 0.000 3.499) 5.691 5.943 ( 1.681 0.000 -0.871) 1.893 6.023 ( 4.552 0.000 -9.660) 10.679 6.163 ( 5.209 0.000 -2.882) 5.953 6.442 ( -4.653 0.000 6.103) 7.674 6.553 ( 0.057 0.000 -9.535) 9.535 6.805 ( -6.055 0.000 3.835) 7.167 7.044 ( -1.899 0.000 1.599) 2.482 7.089 ( -8.144 0.000 7.544) 11.101 7.163 ( 0.781 0.000 -1.145) 1.386 7.249 ( -2.098 0.000 2.419) 3.203 7.691 ( -11.001 0.000 4.740) 11.978 7.978 ( -7.806 0.000 6.313) 10.039 7.997 ( -1.173 0.000 -2.006) 2.324 8.208 ( -1.936 0.000 -0.162) 1.943 8.449 ( -1.092 0.000 -0.985) 1.471 8.490 ( 2.182 0.000 -4.161) 4.698 8.760 ( -7.706 0.000 -0.375) 7.715 8.781 ( -11.361 0.000 -2.422) 11.616 8.950 ( -1.323 0.000 -0.352) 1.369 9.002 ( -18.045 0.000 -1.668) 18.122 9.174 ( -6.995 0.000 2.547) 7.444 9.377 ( 2.785 0.000 1.489) 3.158 9.393 ( -8.473 0.000 3.639) 9.221 9.539 ( 4.242 0.000 -0.210) 4.248 9.794 ( -5.798 0.000 1.992) 6.131 9.858 ( -0.676 0.000 3.312) 3.380 9.921 ( -3.838 0.000 11.863) 12.469 9.999 ( 10.218 0.000 -2.326) 10.480 10.228 ( 9.412 0.000 3.797) 10.149 10.321 ( 5.274 0.000 5.072) 7.317 10.322 ( 1.992 0.000 -5.888) 6.216 10.333 ( 3.463 0.000 1.665) 3.842 10.803 ( -3.308 0.000 -3.171) 4.582 10.883 ( -18.980 0.000 10.468) 21.676 10.999 ( -3.897 0.000 -3.794) 5.439 11.034 ( 2.674 0.000 0.382) 2.702 11.275 ( -3.588 0.000 4.202) 5.526 11.498 ( -12.874 0.000 1.692) 12.984 11.528 ( -5.574 0.000 -1.689) 5.824 11.652 ( 0.213 0.000 -3.284) 3.291 11.787 ( -4.010 0.000 8.584) 9.475 11.933 ( -9.110 0.000 -5.361) 10.570 12.029 ( 0.271 0.000 1.910) 1.929 12.151 ( -0.225 0.000 14.662) 14.664 12.244 ( -18.802 0.000 5.124) 19.487 12.360 ( -1.273 0.000 8.383) 8.479 12.420 ( -0.642 0.000 -6.019) 6.053 12.771 ( 7.331 0.000 -16.805) 18.334 13.025 ( -6.957 0.000 -1.502) 7.117 13.174 ( -2.808 0.000 8.845) 9.280 13.230 ( -7.478 0.000 -5.403) 9.225 13.398 ( -6.510 0.000 -7.495) 9.928 13.693 ( 10.195 0.000 -0.443) 10.205 13.696 ( -9.115 0.000 -1.494) 9.237 13.953 ( 5.872 0.000 2.953) 6.573 14.113 ( 22.804 0.000 8.647) 24.389 14.230 ( -0.161 0.000 -0.294) 0.335 14.323 ( 4.486 0.000 0.566) 4.522 14.619 ( 1.765 0.000 -4.956) 5.261 14.818 ( -11.041 0.000 -4.123) 11.786 15.011 ( -0.555 0.000 -2.484) 2.545 15.199 ( -3.179 0.000 3.972) 5.088 15.426 ( 19.977 0.000 -11.014) 22.811 15.527 ( 2.262 0.000 -3.951) 4.552 15.647 ( 5.212 0.000 0.459) 5.232 15.747 ( 7.094 0.000 0.859) 7.146 15.805 ( 7.735 0.000 -6.275) 9.961 15.933 ( 15.365 0.000 -9.370) 17.997 16.421 ( 12.173 0.000 2.246) 12.379 16.581 ( -16.247 0.000 4.320) 16.811 16.820 ( -10.836 0.000 -1.184) 10.901 17.185 ( 30.658 0.000 -35.420) 46.845 18.784 ( -6.537 0.000 1.375) 6.680 19.104 ( -4.254 0.000 -9.088) 10.034 19.760 ( 0.202 0.000 8.291) 8.293 19.970 ( 0.378 0.000 2.658) 2.685 21.321 ( -9.554 0.000 1.428) 9.661 21.463 ( -3.923 0.000 -1.540) 4.214 21.969 ( -7.829 0.000 1.001) 7.893 22.074 ( -3.509 0.000 -1.190) 3.706 25.956 ( 5.505 0.000 5.495) 7.778 26.179 ( 6.860 0.000 0.570) 6.884 26.373 ( 16.461 0.000 -10.797) 19.686 26.399 ( 0.493 0.000 -0.580) 0.761 26.680 ( 12.596 0.000 -1.390) 12.672 27.000 ( 5.529 0.000 -5.164) 7.565 27.169 ( -0.555 0.000 4.679) 4.712 27.405 ( 10.672 0.000 -1.761) 10.816 27.691 ( 6.415 0.000 12.524) 14.072 27.882 ( 2.565 0.000 1.436) 2.940 28.050 ( 4.057 0.000 -2.583) 4.810 28.905 ( 0.533 0.000 -16.785) 16.793 29.277 ( -0.031 0.000 3.832) 3.832 29.331 ( 2.272 0.000 2.313) 3.242 29.368 ( -1.221 0.000 -2.593) 2.866 29.537 ( 7.801 0.000 -7.506) 10.826 29.915 ( -3.378 0.000 0.163) 3.382 30.236 ( -3.082 0.000 4.266) 5.263 30.247 ( 2.889 0.000 -4.248) 5.137 30.496 ( 8.732 0.000 -7.060) 11.229 31.149 ( -2.287 0.000 4.995) 5.494 31.574 ( 0.121 0.000 -4.011) 4.013 32.444 ( -39.392 0.000 36.261) 53.540 33.500 ( -10.258 0.000 -7.819) 12.898 ======================= Grid point 79 (27/72) ======================= q-point: ( 0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.056 ( 38.430 0.000 21.172) 43.876 2.100 ( 33.943 0.000 33.625) 47.779 2.972 ( 58.150 0.000 31.741) 66.249 3.249 ( 11.919 0.000 -3.761) 12.498 4.035 ( 33.319 0.000 -22.123) 39.995 4.537 ( -3.248 0.000 -0.008) 3.248 4.560 ( 30.871 0.000 -1.867) 30.927 4.746 ( 10.589 0.000 -3.748) 11.233 4.886 ( 38.842 0.000 4.759) 39.132 5.052 ( -2.665 0.000 -9.240) 9.617 5.273 ( -1.357 0.000 -13.926) 13.992 5.343 ( 9.663 0.000 2.130) 9.895 5.484 ( 26.938 0.000 3.250) 27.133 5.753 ( 3.585 0.000 -8.270) 9.014 5.901 ( 6.090 0.000 -3.953) 7.260 5.916 ( -4.139 0.000 0.422) 4.161 5.987 ( 7.915 0.000 4.754) 9.233 6.092 ( 10.152 0.000 -7.057) 12.364 6.352 ( -2.750 0.000 4.818) 5.547 6.405 ( 12.329 0.000 -3.406) 12.791 6.618 ( 11.251 0.000 -3.167) 11.688 6.670 ( -6.402 0.000 2.551) 6.891 6.927 ( -8.100 0.000 6.899) 10.640 7.041 ( 2.098 0.000 5.937) 6.297 7.184 ( -4.012 0.000 -2.531) 4.744 7.186 ( 3.122 0.000 12.909) 13.282 7.525 ( -3.453 0.000 -2.790) 4.439 7.835 ( -7.042 0.000 12.737) 14.554 7.899 ( -11.325 0.000 -6.139) 12.882 8.120 ( -4.377 0.000 -0.467) 4.402 8.355 ( -6.254 0.000 1.266) 6.381 8.456 ( -6.450 0.000 -3.472) 7.325 8.584 ( -9.877 0.000 -0.079) 9.878 8.601 ( -12.183 0.000 -1.836) 12.321 8.814 ( 3.904 0.000 -3.103) 4.987 8.861 ( -6.558 0.000 0.538) 6.580 9.051 ( -2.687 0.000 7.405) 7.877 9.278 ( -0.959 0.000 4.101) 4.212 9.417 ( -2.260 0.000 -1.592) 2.764 9.594 ( -14.841 0.000 17.458) 22.914 9.605 ( -9.746 0.000 -0.414) 9.755 9.744 ( 10.686 0.000 -6.681) 12.603 9.969 ( -4.831 0.000 4.884) 6.869 10.085 ( -4.525 0.000 -0.944) 4.623 10.149 ( -4.371 0.000 -7.691) 8.846 10.319 ( -3.208 0.000 4.302) 5.367 10.355 ( 3.354 0.000 -2.883) 4.422 10.598 ( 6.068 0.000 -2.742) 6.658 10.698 ( -10.306 0.000 -4.091) 11.088 10.888 ( 12.796 0.000 0.539) 12.807 10.903 ( -3.967 0.000 -6.464) 7.584 11.131 ( -11.486 0.000 3.343) 11.963 11.185 ( 10.317 0.000 -2.184) 10.545 11.318 ( 0.848 0.000 0.115) 0.855 11.451 ( -2.445 0.000 -1.671) 2.962 11.634 ( -4.733 0.000 -0.793) 4.799 11.724 ( -7.741 0.000 -2.226) 8.055 11.734 ( -6.291 0.000 4.925) 7.989 11.894 ( -6.053 0.000 5.441) 8.139 12.073 ( -0.045 0.000 5.992) 5.992 12.161 ( -1.854 0.000 10.299) 10.465 12.290 ( -2.651 0.000 11.154) 11.465 12.531 ( 7.710 0.000 -6.169) 9.874 12.818 ( -16.329 0.000 1.966) 16.447 12.904 ( 5.843 0.000 -12.397) 13.705 13.100 ( -7.153 0.000 -6.511) 9.673 13.111 ( -2.554 0.000 3.842) 4.613 13.219 ( -8.710 0.000 -6.834) 11.071 13.533 ( -5.465 0.000 -5.014) 7.417 13.773 ( -1.931 0.000 -4.873) 5.241 14.007 ( -4.674 0.000 1.758) 4.994 14.226 ( 0.728 0.000 -0.925) 1.177 14.367 ( 1.383 0.000 1.985) 2.419 14.425 ( 4.341 0.000 0.915) 4.437 14.622 ( -2.417 0.000 -3.046) 3.889 14.655 ( -5.355 0.000 -2.926) 6.102 15.123 ( -3.920 0.000 7.437) 8.407 15.129 ( 11.722 0.000 8.127) 14.264 15.516 ( -4.858 0.000 -3.932) 6.250 15.605 ( 7.642 0.000 5.284) 9.290 15.659 ( -2.539 0.000 1.548) 2.974 15.946 ( 6.773 0.000 -4.517) 8.141 15.981 ( 12.683 0.000 -3.568) 13.175 16.135 ( 7.479 0.000 -2.560) 7.905 16.304 ( -6.846 0.000 4.476) 8.179 16.625 ( -5.832 0.000 -1.361) 5.989 16.695 ( 12.747 0.000 -0.707) 12.767 17.644 ( 14.963 0.000 -30.172) 33.678 18.729 ( 0.438 0.000 -2.162) 2.206 18.986 ( -4.527 0.000 -7.448) 8.716 19.818 ( 6.221 0.000 5.355) 8.208 20.013 ( 5.364 0.000 0.319) 5.374 21.051 ( -18.864 0.000 2.318) 19.006 21.293 ( -13.428 0.000 -2.839) 13.725 21.777 ( -12.370 0.000 2.104) 12.548 21.965 ( -7.938 0.000 -1.899) 8.161 26.082 ( 6.720 0.000 6.075) 9.059 26.323 ( 6.832 0.000 2.269) 7.199 26.449 ( 4.480 0.000 1.650) 4.774 26.605 ( 8.530 0.000 -7.354) 11.262 26.963 ( 15.697 0.000 -4.746) 16.399 27.146 ( 9.370 0.000 -5.039) 10.639 27.173 ( 1.029 0.000 6.487) 6.568 27.569 ( 6.884 0.000 2.801) 7.432 27.878 ( 11.782 0.000 7.374) 13.899 27.952 ( 4.639 0.000 1.684) 4.935 28.149 ( 5.625 0.000 -2.810) 6.288 28.836 ( -6.847 0.000 -17.866) 19.133 29.269 ( -0.349 0.000 3.053) 3.073 29.344 ( -1.356 0.000 -2.788) 3.101 29.413 ( 5.883 0.000 2.360) 6.339 29.668 ( 5.199 0.000 -8.355) 9.840 29.826 ( -5.448 0.000 1.859) 5.756 30.178 ( -3.164 0.000 7.566) 8.201 30.317 ( 4.140 0.000 -4.100) 5.827 30.640 ( 5.312 0.000 -8.985) 10.438 31.114 ( -0.740 0.000 5.118) 5.171 31.582 ( 1.082 0.000 -4.425) 4.555 31.842 ( -23.153 0.000 34.335) 41.412 33.209 ( -18.924 0.000 -9.057) 20.980 ======================= Grid point 80 (28/72) ======================= q-point: ( 0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.761 ( 35.039 0.000 24.766) 42.908 2.780 ( 35.230 0.000 12.682) 37.443 3.524 ( 16.786 0.000 -0.887) 16.810 4.047 ( 47.021 0.000 13.564) 48.939 4.476 ( -1.002 0.000 0.631) 1.184 4.497 ( 12.357 0.000 -11.333) 16.767 4.903 ( 1.959 0.000 -6.859) 7.134 4.946 ( 6.488 0.000 -3.430) 7.338 5.043 ( 2.940 0.000 -5.730) 6.440 5.133 ( -2.534 0.000 -6.337) 6.825 5.333 ( 6.639 0.000 -13.367) 14.925 5.555 ( 8.002 0.000 1.768) 8.195 5.721 ( 4.544 0.000 -3.028) 5.461 5.731 ( -9.814 0.000 3.221) 10.329 6.028 ( 7.175 0.000 -10.037) 12.338 6.062 ( 20.382 0.000 4.310) 20.833 6.169 ( 8.079 0.000 1.808) 8.279 6.336 ( -1.749 0.000 0.965) 1.997 6.513 ( 25.300 0.000 -2.695) 25.443 6.634 ( 4.958 0.000 8.440) 9.788 6.729 ( 19.660 0.000 0.141) 19.661 6.797 ( -4.278 0.000 1.732) 4.615 6.894 ( 10.681 0.000 -0.286) 10.685 7.104 ( 9.243 0.000 14.511) 17.205 7.130 ( -1.201 0.000 -2.678) 2.935 7.352 ( 11.860 0.000 17.857) 21.436 7.535 ( 4.735 0.000 -4.611) 6.609 7.700 ( -6.812 0.000 14.372) 15.905 7.730 ( -1.928 0.000 -6.194) 6.487 8.051 ( 2.496 0.000 -2.937) 3.854 8.245 ( -14.286 0.000 -2.533) 14.509 8.296 ( 0.030 0.000 -1.357) 1.357 8.388 ( -11.670 0.000 0.931) 11.707 8.549 ( 8.988 0.000 -1.088) 9.053 8.769 ( -1.788 0.000 5.035) 5.343 8.972 ( 9.293 0.000 -3.531) 9.941 9.042 ( -0.187 0.000 5.245) 5.248 9.230 ( -12.184 0.000 12.232) 17.265 9.274 ( -12.536 0.000 -3.743) 13.082 9.377 ( -13.676 0.000 0.698) 13.693 9.415 ( 2.550 0.000 1.112) 2.782 9.705 ( -11.268 0.000 -2.001) 11.445 9.771 ( -16.040 0.000 -1.061) 16.075 9.938 ( -1.292 0.000 -8.342) 8.442 10.181 ( 2.966 0.000 -2.726) 4.028 10.329 ( 3.096 0.000 -5.790) 6.566 10.338 ( -21.494 0.000 -4.644) 21.990 10.488 ( 4.134 0.000 -4.055) 5.791 10.576 ( -2.943 0.000 -0.297) 2.958 10.808 ( -9.913 0.000 0.901) 9.953 10.968 ( -1.296 0.000 -4.527) 4.708 11.090 ( 6.884 0.000 5.444) 8.776 11.294 ( 6.782 0.000 -3.032) 7.429 11.340 ( -10.769 0.000 -4.147) 11.540 11.423 ( -13.075 0.000 0.760) 13.097 11.561 ( -6.794 0.000 -1.876) 7.048 11.627 ( 18.381 0.000 3.758) 18.761 11.724 ( 2.376 0.000 -2.753) 3.637 11.956 ( 10.503 0.000 3.296) 11.008 12.045 ( -6.867 0.000 9.222) 11.498 12.137 ( 6.095 0.000 8.132) 10.163 12.319 ( 2.041 0.000 11.670) 11.847 12.429 ( -20.357 0.000 4.286) 20.803 12.626 ( 1.142 0.000 -8.454) 8.531 12.919 ( -9.855 0.000 -4.967) 11.036 12.920 ( -2.523 0.000 1.417) 2.894 13.137 ( -3.820 0.000 -5.223) 6.472 13.179 ( 9.176 0.000 -7.975) 12.158 13.420 ( -7.173 0.000 -7.995) 10.741 13.637 ( -10.544 0.000 -9.566) 14.237 13.827 ( -12.579 0.000 -0.405) 12.585 14.147 ( -13.161 0.000 -6.569) 14.709 14.354 ( -1.232 0.000 1.248) 1.754 14.358 ( -10.321 0.000 6.093) 11.986 14.548 ( -5.338 0.000 -3.959) 6.646 14.556 ( -1.743 0.000 2.310) 2.893 15.152 ( 5.920 0.000 1.609) 6.135 15.263 ( 1.962 0.000 14.235) 14.369 15.315 ( -7.297 0.000 1.466) 7.442 15.725 ( 6.832 0.000 -0.178) 6.834 15.819 ( 11.101 0.000 5.611) 12.438 16.040 ( 2.054 0.000 -4.107) 4.592 16.054 ( 0.062 0.000 5.637) 5.637 16.239 ( 3.938 0.000 -1.730) 4.302 16.424 ( 11.487 0.000 -4.187) 12.226 16.677 ( 11.411 0.000 -2.214) 11.624 16.869 ( 4.391 0.000 2.740) 5.176 17.765 ( -1.356 0.000 -13.907) 13.973 18.728 ( 2.395 0.000 0.153) 2.400 19.123 ( 18.160 0.000 -11.971) 21.751 20.010 ( 13.675 0.000 3.152) 14.034 20.191 ( 13.285 0.000 -0.256) 13.287 20.608 ( -26.539 0.000 3.281) 26.741 20.972 ( -19.481 0.000 -4.597) 20.016 21.486 ( -17.859 0.000 3.300) 18.161 21.753 ( -14.467 0.000 -2.527) 14.686 26.194 ( 4.834 0.000 6.865) 8.396 26.407 ( 1.682 0.000 4.805) 5.091 26.553 ( 5.713 0.000 2.036) 6.065 26.719 ( 3.395 0.000 -3.352) 4.771 27.215 ( 3.342 0.000 5.440) 6.385 27.225 ( 9.861 0.000 -5.028) 11.069 27.366 ( 13.958 0.000 -5.699) 15.077 27.710 ( 8.235 0.000 3.636) 9.002 28.060 ( 6.577 0.000 0.904) 6.638 28.075 ( 7.218 0.000 3.091) 7.852 28.236 ( 2.568 0.000 -2.847) 3.834 28.673 ( -9.402 0.000 -16.056) 18.607 29.274 ( 0.935 0.000 3.046) 3.187 29.319 ( -1.071 0.000 -1.467) 1.816 29.539 ( 6.499 0.000 -0.881) 6.559 29.737 ( 2.050 0.000 -5.947) 6.291 29.737 ( -2.568 0.000 6.796) 7.265 30.107 ( -4.339 0.000 9.940) 10.846 30.399 ( 4.287 0.000 -3.271) 5.393 30.687 ( -0.242 0.000 -5.876) 5.881 31.130 ( 2.195 0.000 4.452) 4.964 31.514 ( -12.034 0.000 22.083) 25.149 31.632 ( 4.616 0.000 -4.995) 6.801 32.811 ( -21.737 0.000 -9.756) 23.826 ======================= Grid point 81 (29/72) ======================= q-point: ( 0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.351 ( 24.144 0.000 6.223) 24.933 3.426 ( 33.121 0.000 14.026) 35.969 3.907 ( 21.775 0.000 -1.930) 21.861 4.252 ( -18.192 0.000 -1.478) 18.252 4.519 ( 2.907 0.000 -0.290) 2.922 4.729 ( 4.567 0.000 2.593) 5.252 4.835 ( -8.054 0.000 2.823) 8.535 4.935 ( -2.666 0.000 -8.475) 8.885 5.038 ( -0.791 0.000 -4.077) 4.154 5.147 ( 1.118 0.000 -2.438) 2.683 5.480 ( 8.057 0.000 -13.739) 15.927 5.635 ( 3.159 0.000 -9.092) 9.626 5.759 ( 12.401 0.000 1.396) 12.480 5.858 ( 7.755 0.000 5.991) 9.799 6.089 ( 0.519 0.000 -7.112) 7.130 6.193 ( -6.295 0.000 6.161) 8.808 6.293 ( 0.169 0.000 -9.328) 9.330 6.388 ( 13.448 0.000 5.156) 14.403 6.745 ( -5.144 0.000 -3.194) 6.055 6.757 ( 2.037 0.000 5.707) 6.059 6.859 ( 4.183 0.000 9.372) 10.264 6.885 ( 15.054 0.000 7.004) 16.603 7.109 ( -2.296 0.000 3.261) 3.988 7.119 ( 7.382 0.000 10.381) 12.738 7.255 ( 8.293 0.000 5.918) 10.187 7.521 ( 10.186 0.000 4.353) 11.077 7.615 ( -1.070 0.000 8.008) 8.079 7.809 ( 23.261 0.000 -7.488) 24.436 7.927 ( -18.240 0.000 -0.022) 18.240 8.077 ( 10.303 0.000 -3.460) 10.869 8.147 ( -12.018 0.000 1.620) 12.126 8.208 ( 23.346 0.000 3.925) 23.673 8.406 ( 12.400 0.000 2.962) 12.749 8.754 ( -6.737 0.000 5.668) 8.804 8.764 ( 8.123 0.000 -3.219) 8.738 8.888 ( -19.702 0.000 3.349) 19.985 8.963 ( -3.218 0.000 3.115) 4.479 8.979 ( -12.032 0.000 1.171) 12.089 9.121 ( -9.469 0.000 -1.926) 9.663 9.176 ( 8.193 0.000 2.930) 8.701 9.444 ( -17.174 0.000 -1.347) 17.226 9.546 ( 13.334 0.000 -5.258) 14.333 9.722 ( -21.351 0.000 -6.691) 22.375 9.793 ( 16.179 0.000 -2.358) 16.350 10.044 ( -4.870 0.000 -9.320) 10.515 10.205 ( 1.274 0.000 -1.997) 2.368 10.378 ( 3.661 0.000 -2.825) 4.624 10.416 ( -17.509 0.000 8.079) 19.283 10.628 ( -4.720 0.000 -5.744) 7.434 10.690 ( 13.700 0.000 -6.210) 15.042 10.871 ( -16.962 0.000 -7.515) 18.552 11.127 ( -11.138 0.000 1.271) 11.210 11.157 ( 2.390 0.000 9.904) 10.188 11.211 ( -1.801 0.000 -5.245) 5.546 11.354 ( -1.471 0.000 0.494) 1.551 11.613 ( 11.220 0.000 -7.503) 13.498 11.656 ( -11.425 0.000 -2.995) 11.811 11.889 ( 10.756 0.000 5.603) 12.128 11.985 ( -1.429 0.000 -1.066) 1.782 12.078 ( -10.371 0.000 14.436) 17.775 12.179 ( 7.354 0.000 3.205) 8.022 12.326 ( 12.813 0.000 -0.828) 12.840 12.363 ( -0.819 0.000 6.238) 6.291 12.609 ( 1.282 0.000 0.991) 1.621 12.729 ( -10.859 0.000 -1.681) 10.989 12.931 ( 4.180 0.000 -2.213) 4.729 12.981 ( -12.297 0.000 -2.530) 12.555 13.268 ( -7.902 0.000 -7.038) 10.582 13.346 ( 3.790 0.000 -9.363) 10.101 13.458 ( -3.144 0.000 -8.799) 9.344 13.536 ( -16.630 0.000 -4.809) 17.311 13.805 ( -16.009 0.000 -5.327) 16.871 14.208 ( -5.055 0.000 7.241) 8.831 14.281 ( -5.981 0.000 2.849) 6.625 14.501 ( 0.287 0.000 -3.882) 3.892 14.533 ( -0.812 0.000 -1.743) 1.923 15.156 ( 0.162 0.000 4.107) 4.110 15.256 ( -2.047 0.000 11.663) 11.842 15.465 ( 14.725 0.000 -2.477) 14.932 15.862 ( 6.842 0.000 3.058) 7.494 15.913 ( -3.079 0.000 -1.519) 3.433 16.021 ( -1.944 0.000 1.235) 2.303 16.112 ( 5.785 0.000 8.574) 10.343 16.291 ( 0.580 0.000 1.837) 1.926 16.591 ( 6.687 0.000 -2.588) 7.170 16.845 ( -5.905 0.000 4.313) 7.312 16.995 ( 18.970 0.000 -5.938) 19.877 17.632 ( -11.611 0.000 -8.807) 14.573 18.954 ( 21.064 0.000 3.402) 21.336 19.566 ( 26.061 0.000 -11.295) 28.403 20.056 ( -30.426 0.000 4.227) 30.719 20.320 ( 18.029 0.000 2.721) 18.234 20.525 ( 21.134 0.000 -1.026) 21.159 20.557 ( -23.477 0.000 -6.879) 24.464 21.105 ( -21.257 0.000 4.102) 21.649 21.410 ( -20.994 0.000 -2.719) 21.169 26.274 ( 3.710 0.000 7.468) 8.339 26.398 ( -2.159 0.000 6.797) 7.132 26.651 ( 4.299 0.000 1.568) 4.576 26.745 ( -0.353 0.000 -0.697) 0.781 27.288 ( 3.757 0.000 3.076) 4.855 27.339 ( 2.643 0.000 -2.133) 3.396 27.652 ( 14.807 0.000 -7.207) 16.468 27.880 ( 8.763 0.000 1.034) 8.824 28.117 ( -2.943 0.000 -1.108) 3.144 28.192 ( 3.917 0.000 -2.067) 4.429 28.237 ( 0.400 0.000 -1.541) 1.592 28.502 ( -7.914 0.000 -11.530) 13.985 29.296 ( 0.954 0.000 2.759) 2.919 29.307 ( -0.206 0.000 0.309) 0.371 29.630 ( 3.374 0.000 -3.829) 5.103 29.747 ( -1.020 0.000 -3.660) 3.800 29.773 ( 5.697 0.000 11.201) 12.566 30.011 ( -5.592 0.000 10.618) 12.000 30.481 ( 4.355 0.000 -2.385) 4.965 30.646 ( -3.570 0.000 -2.940) 4.625 31.185 ( 3.203 0.000 4.705) 5.692 31.346 ( -6.271 0.000 12.613) 14.086 31.777 ( 10.719 0.000 -6.169) 12.367 32.400 ( -20.457 0.000 -9.288) 22.467 ======================= Grid point 82 (30/72) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.756 ( -15.529 0.000 3.039) 15.823 3.756 ( 15.529 0.000 3.039) 15.823 4.057 ( -6.725 0.000 0.283) 6.731 4.057 ( 6.725 0.000 0.283) 6.731 4.559 ( -11.846 0.000 3.136) 12.254 4.559 ( 11.846 0.000 3.136) 12.254 4.850 ( -2.592 0.000 -2.254) 3.435 4.850 ( 2.592 0.000 -2.254) 3.435 5.093 ( -0.873 0.000 -1.617) 1.838 5.093 ( 0.873 0.000 -1.617) 1.838 5.621 ( -3.525 0.000 -14.399) 14.824 5.621 ( 3.525 0.000 -14.399) 14.824 5.970 ( -0.081 0.000 4.916) 4.917 5.970 ( 0.081 0.000 4.916) 4.917 6.072 ( -0.112 0.000 1.153) 1.158 6.072 ( 0.112 0.000 1.153) 1.158 6.366 ( -4.805 0.000 -5.713) 7.465 6.366 ( 4.805 0.000 -5.713) 7.465 6.793 ( -0.209 0.000 7.208) 7.211 6.793 ( 0.209 0.000 7.208) 7.211 6.913 ( -9.057 0.000 7.362) 11.672 6.913 ( 9.057 0.000 7.362) 11.672 7.198 ( -5.104 0.000 1.951) 5.465 7.198 ( 5.104 0.000 1.951) 5.465 7.479 ( -14.662 0.000 13.843) 20.165 7.479 ( 14.662 0.000 13.843) 20.165 7.683 ( -6.801 0.000 -4.679) 8.255 7.683 ( 6.801 0.000 -4.679) 8.255 8.021 ( -0.156 0.000 3.390) 3.393 8.021 ( 0.156 0.000 3.390) 3.393 8.302 ( -25.475 0.000 0.618) 25.482 8.302 ( 25.475 0.000 0.618) 25.482 8.600 ( -17.872 0.000 5.393) 18.668 8.600 ( 17.872 0.000 5.393) 18.668 8.793 ( -11.627 0.000 -3.478) 12.136 8.793 ( 11.627 0.000 -3.478) 12.136 8.957 ( -12.595 0.000 -3.754) 13.142 8.957 ( 12.595 0.000 -3.754) 13.142 9.048 ( -14.785 0.000 -0.955) 14.816 9.048 ( 14.785 0.000 -0.955) 14.816 9.401 ( -12.453 0.000 1.024) 12.495 9.401 ( 12.453 0.000 1.024) 12.495 9.932 ( -21.299 0.000 -3.871) 21.648 9.932 ( 21.299 0.000 -3.871) 21.648 10.014 ( -5.549 0.000 -1.534) 5.757 10.014 ( 5.549 0.000 -1.534) 5.757 10.419 ( -20.855 0.000 0.495) 20.861 10.419 ( 20.855 0.000 0.495) 20.861 10.526 ( -7.347 0.000 -5.176) 8.987 10.526 ( 7.347 0.000 -5.176) 8.987 10.920 ( -8.907 0.000 -4.060) 9.788 10.920 ( 8.907 0.000 -4.060) 9.788 11.269 ( -0.010 0.000 -2.218) 2.218 11.269 ( 0.010 0.000 -2.218) 2.218 11.361 ( -12.710 0.000 0.678) 12.728 11.361 ( 12.710 0.000 0.678) 12.728 11.833 ( -9.026 0.000 -0.420) 9.036 11.833 ( 9.026 0.000 -0.420) 9.036 12.042 ( -0.649 0.000 6.077) 6.112 12.042 ( 0.649 0.000 6.077) 6.112 12.288 ( -5.006 0.000 0.320) 5.016 12.288 ( 5.006 0.000 0.320) 5.016 12.501 ( -8.783 0.000 3.090) 9.311 12.501 ( 8.783 0.000 3.090) 9.311 12.761 ( -7.281 0.000 1.766) 7.492 12.761 ( 7.281 0.000 1.766) 7.492 13.090 ( -11.177 0.000 -4.865) 12.190 13.090 ( 11.177 0.000 -4.865) 12.190 13.320 ( -1.206 0.000 -8.174) 8.262 13.320 ( 1.206 0.000 -8.174) 8.262 13.576 ( -9.182 0.000 -7.967) 12.157 13.576 ( 9.182 0.000 -7.967) 12.157 14.186 ( -2.654 0.000 5.850) 6.424 14.186 ( 2.654 0.000 5.850) 6.424 14.518 ( -0.198 0.000 -3.777) 3.782 14.518 ( 0.198 0.000 -3.777) 3.782 15.200 ( -1.121 0.000 7.891) 7.970 15.200 ( 1.121 0.000 7.891) 7.970 15.739 ( -12.779 0.000 -6.120) 14.168 15.739 ( 12.779 0.000 -6.120) 14.168 15.972 ( -3.543 0.000 6.168) 7.113 15.972 ( 3.543 0.000 6.168) 7.113 16.237 ( -5.496 0.000 6.752) 8.706 16.237 ( 5.496 0.000 6.752) 8.706 16.713 ( -6.331 0.000 0.660) 6.365 16.713 ( 6.331 0.000 0.660) 6.365 17.349 ( -17.177 0.000 -7.533) 18.756 17.349 ( 17.177 0.000 -7.533) 18.756 19.465 ( -29.914 0.000 4.588) 30.264 19.465 ( 29.914 0.000 4.588) 30.264 20.077 ( -25.913 0.000 -9.129) 27.474 20.077 ( 25.913 0.000 -9.129) 27.474 20.695 ( -20.610 0.000 3.766) 20.952 20.695 ( 20.610 0.000 3.766) 20.952 20.970 ( -23.990 0.000 -2.207) 24.091 20.970 ( 23.990 0.000 -2.207) 24.091 26.342 ( -2.907 0.000 7.565) 8.104 26.342 ( 2.907 0.000 7.565) 8.104 26.716 ( -1.383 0.000 0.737) 1.568 26.716 ( 1.383 0.000 0.737) 1.568 27.344 ( -0.527 0.000 0.623) 0.816 27.344 ( 0.527 0.000 0.623) 0.816 27.905 ( -9.845 0.000 -6.615) 11.861 27.905 ( 9.845 0.000 -6.615) 11.861 28.106 ( -5.913 0.000 -0.128) 5.914 28.106 ( 5.913 0.000 -0.128) 5.914 28.362 ( -6.411 0.000 -5.443) 8.410 28.362 ( 6.411 0.000 -5.443) 8.410 29.306 ( -0.007 0.000 1.756) 1.756 29.306 ( 0.007 0.000 1.756) 1.756 29.700 ( -3.558 0.000 -2.473) 4.333 29.700 ( 3.558 0.000 -2.473) 4.333 29.896 ( -5.314 0.000 10.326) 11.614 29.896 ( 5.314 0.000 10.326) 11.614 30.566 ( -1.924 0.000 -2.030) 2.797 30.566 ( 1.924 0.000 -2.030) 2.797 31.251 ( -1.290 0.000 7.226) 7.340 31.251 ( 1.290 0.000 7.226) 7.340 32.041 ( -16.198 0.000 -7.865) 18.007 32.041 ( 16.198 0.000 -7.865) 18.007 ======================= Grid point 88 (31/72) ======================= q-point: ( 0.00 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.256 ( 0.000 25.349 35.039) 43.247 1.307 ( 0.000 35.233 27.241) 44.536 2.215 ( 0.000 36.667 55.902) 66.855 3.002 ( 0.000 -1.410 3.283) 3.573 3.075 ( 0.000 6.195 -6.737) 9.152 3.465 ( 0.000 1.543 3.875) 4.171 3.792 ( 0.000 3.682 -16.014) 16.432 4.439 ( 0.000 -11.321 -12.038) 16.525 4.547 ( 0.000 -3.512 -3.135) 4.707 4.732 ( 0.000 -16.154 -0.414) 16.159 4.793 ( 0.000 2.216 10.372) 10.606 5.257 ( 0.000 5.675 -3.827) 6.845 5.264 ( 0.000 -6.441 -11.135) 12.864 5.700 ( 0.000 -7.908 1.255) 8.006 5.708 ( 0.000 -4.082 -2.448) 4.760 5.830 ( 0.000 4.836 2.873) 5.625 5.884 ( 0.000 1.345 0.651) 1.494 6.224 ( 0.000 6.280 -3.871) 7.378 6.242 ( 0.000 7.514 -10.537) 12.942 6.516 ( 0.000 -2.627 0.678) 2.713 6.597 ( 0.000 5.647 -6.270) 8.438 6.839 ( 0.000 -0.309 6.313) 6.320 6.996 ( 0.000 -6.375 -7.718) 10.010 7.015 ( 0.000 -8.260 7.233) 10.980 7.188 ( 0.000 6.472 4.934) 8.138 7.239 ( 0.000 -7.910 1.919) 8.140 7.704 ( 0.000 -9.239 4.696) 10.364 8.055 ( 0.000 -2.111 0.104) 2.113 8.131 ( 0.000 3.139 -5.021) 5.921 8.225 ( 0.000 5.004 1.776) 5.310 8.297 ( 0.000 -11.810 -0.327) 11.814 8.479 ( 0.000 3.014 -8.238) 8.772 8.680 ( 0.000 -15.537 -2.793) 15.786 8.859 ( 0.000 -2.207 -2.339) 3.216 9.082 ( 0.000 5.306 1.478) 5.508 9.245 ( 0.000 5.012 -0.953) 5.101 9.292 ( 0.000 6.923 -2.581) 7.388 9.402 ( 0.000 -1.175 -1.796) 2.146 9.552 ( 0.000 0.507 2.218) 2.275 9.669 ( 0.000 3.307 0.567) 3.355 9.779 ( 0.000 6.835 3.521) 7.689 9.838 ( 0.000 0.974 -0.725) 1.214 9.849 ( 0.000 6.562 7.211) 9.750 10.058 ( 0.000 7.804 4.732) 9.127 10.101 ( 0.000 -3.795 -2.636) 4.621 10.172 ( 0.000 12.483 2.450) 12.721 10.173 ( 0.000 -12.583 8.956) 15.445 10.530 ( 0.000 0.821 -1.846) 2.020 10.793 ( 0.000 -4.281 -2.699) 5.061 10.987 ( 0.000 -0.227 1.073) 1.097 10.998 ( 0.000 -10.619 2.479) 10.904 11.103 ( 0.000 -6.675 6.064) 9.018 11.278 ( 0.000 -3.613 -3.108) 4.766 11.589 ( 0.000 -5.411 1.323) 5.571 11.592 ( 0.000 3.221 0.986) 3.369 11.729 ( 0.000 -1.041 4.634) 4.750 11.769 ( 0.000 -8.807 1.981) 9.027 11.957 ( 0.000 -5.232 1.856) 5.551 11.991 ( 0.000 1.012 -2.067) 2.302 12.066 ( 0.000 -9.129 -3.039) 9.621 12.318 ( 0.000 -2.626 7.796) 8.226 12.452 ( 0.000 -2.991 2.501) 3.899 12.617 ( 0.000 -2.088 3.955) 4.472 12.660 ( 0.000 2.246 -9.718) 9.974 13.064 ( 0.000 -1.978 -1.167) 2.297 13.111 ( 0.000 -1.711 2.397) 2.945 13.175 ( 0.000 3.087 3.232) 4.470 13.405 ( 0.000 -0.455 3.377) 3.407 13.634 ( 0.000 0.894 2.535) 2.688 13.769 ( 0.000 3.193 1.153) 3.394 13.821 ( 0.000 0.991 -4.230) 4.345 14.190 ( 0.000 0.134 -3.829) 3.831 14.211 ( 0.000 2.040 0.929) 2.242 14.534 ( 0.000 -1.689 -2.756) 3.233 14.688 ( 0.000 2.533 -6.860) 7.313 14.726 ( 0.000 17.589 -22.216) 28.336 14.962 ( 0.000 -3.821 0.199) 3.826 15.033 ( 0.000 2.420 -2.843) 3.733 15.327 ( 0.000 6.039 0.159) 6.041 15.502 ( 0.000 3.713 -7.243) 8.139 15.665 ( 0.000 4.124 -7.647) 8.688 15.745 ( 0.000 8.448 -0.171) 8.450 15.771 ( 0.000 7.038 -3.094) 7.688 15.816 ( 0.000 8.688 -7.506) 11.481 16.364 ( 0.000 0.797 8.460) 8.498 16.615 ( 0.000 -9.404 -0.394) 9.412 16.772 ( 0.000 1.304 4.874) 5.046 17.114 ( 0.000 7.614 0.037) 7.614 18.712 ( 0.000 -11.364 1.550) 11.469 19.071 ( 0.000 -6.085 -10.427) 12.073 19.747 ( 0.000 -1.768 9.013) 9.185 19.901 ( 0.000 -4.900 7.207) 8.715 21.523 ( 0.000 4.540 -0.375) 4.555 21.540 ( 0.000 7.451 -3.872) 8.397 22.051 ( 0.000 -0.939 0.186) 0.958 22.085 ( 0.000 -1.505 -0.582) 1.614 25.969 ( 0.000 5.168 1.721) 5.447 26.096 ( 0.000 -0.114 0.304) 0.325 26.111 ( 0.000 -0.032 -0.050) 0.059 26.384 ( 0.000 -3.228 -4.850) 5.827 26.617 ( 0.000 6.710 -1.500) 6.875 26.924 ( 0.000 -2.135 -4.658) 5.124 27.205 ( 0.000 0.402 2.598) 2.629 27.236 ( 0.000 -0.447 0.659) 0.797 27.620 ( 0.000 -0.747 13.192) 13.213 27.813 ( 0.000 -4.055 6.895) 7.999 28.052 ( 0.000 3.938 -1.458) 4.199 28.586 ( 0.000 -17.820 10.764) 20.819 29.228 ( 0.000 -2.388 -0.947) 2.569 29.265 ( 0.000 -1.674 -9.067) 9.220 29.485 ( 0.000 7.054 3.479) 7.865 29.596 ( 0.000 9.201 -3.746) 9.935 29.963 ( 0.000 1.447 -0.732) 1.622 30.021 ( 0.000 -7.974 7.641) 11.044 30.379 ( 0.000 0.209 -1.253) 1.270 30.382 ( 0.000 1.460 -5.762) 5.944 31.175 ( 0.000 0.067 5.333) 5.334 31.435 ( 0.000 -7.866 8.706) 11.733 33.193 ( 0.000 9.044 -8.312) 12.284 33.540 ( 0.000 -3.729 -5.650) 6.769 ======================= Grid point 89 (32/72) ======================= q-point: ( 0.10 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.383 ( 21.771 14.660 29.191) 39.255 1.706 ( 27.730 25.047 30.575) 48.282 2.484 ( 28.898 34.785 44.995) 63.794 3.108 ( 9.689 3.405 -7.573) 12.760 3.388 ( 29.457 2.313 -4.038) 29.822 3.843 ( 32.640 -3.625 1.864) 32.893 4.091 ( 28.738 -0.035 -10.954) 30.755 4.511 ( 4.749 -5.300 -7.848) 10.594 4.555 ( 2.817 -6.893 -4.462) 8.681 4.786 ( 5.560 -21.840 -4.514) 22.984 4.883 ( 10.870 -2.017 7.679) 13.461 5.263 ( 1.898 3.920 -2.975) 5.274 5.366 ( 7.890 1.016 -5.329) 9.575 5.634 ( -4.537 -5.250 -0.079) 6.939 5.779 ( 4.612 -2.225 0.456) 5.141 5.848 ( 3.924 1.706 -1.039) 4.403 5.987 ( 10.048 1.951 0.306) 10.240 6.190 ( -2.094 4.249 -1.920) 5.112 6.221 ( -2.379 3.244 -5.295) 6.650 6.445 ( -3.115 1.598 -1.747) 3.912 6.605 ( -0.618 2.503 -5.650) 6.210 6.793 ( -4.116 -0.377 5.103) 6.567 6.899 ( -4.165 -4.268 5.165) 7.890 7.049 ( -1.468 -2.988 3.548) 4.865 7.181 ( 1.944 3.478 2.707) 4.817 7.263 ( 1.316 -2.668 -1.455) 3.311 7.757 ( -0.288 0.216 2.939) 2.961 7.943 ( -8.073 1.852 1.557) 8.428 8.096 ( -4.502 -0.157 0.771) 4.571 8.140 ( -5.260 -1.049 -4.040) 6.715 8.352 ( 3.342 -5.766 0.546) 6.687 8.515 ( 0.024 0.504 -7.429) 7.446 8.649 ( -1.247 -12.640 -0.774) 12.725 8.802 ( -6.018 1.152 -0.625) 6.159 8.954 ( -12.704 4.511 -1.982) 13.626 9.077 ( -13.902 3.884 0.118) 14.435 9.185 ( -8.302 5.193 1.230) 9.869 9.353 ( -2.526 2.153 -1.862) 3.805 9.481 ( -2.161 1.155 5.785) 6.283 9.606 ( -4.039 6.677 -0.905) 7.856 9.753 ( -2.401 -6.164 4.923) 8.246 9.801 ( -7.516 -1.481 7.047) 10.409 9.922 ( 2.650 0.196 6.116) 6.668 10.015 ( 2.223 0.232 -4.841) 5.332 10.105 ( -2.886 -6.436 9.605) 11.917 10.231 ( 2.858 -3.431 -1.306) 4.652 10.384 ( 10.296 5.627 0.790) 11.759 10.539 ( 4.079 6.641 -2.625) 8.224 10.738 ( -3.831 -3.647 4.391) 6.875 10.888 ( -4.401 1.069 0.349) 4.542 11.006 ( 3.538 -0.637 -0.190) 3.600 11.060 ( -2.511 4.502 -3.345) 6.145 11.238 ( -1.696 -2.943 1.824) 3.856 11.458 ( -9.668 -1.816 1.156) 9.904 11.555 ( -5.675 0.716 -0.789) 5.774 11.672 ( 0.699 1.327 -2.219) 2.678 11.739 ( -1.976 -4.341 5.172) 7.035 11.924 ( -7.820 -2.707 -5.725) 10.062 11.997 ( -2.945 -7.134 8.332) 11.357 12.076 ( -1.498 2.045 -1.823) 3.122 12.270 ( -5.313 -1.009 3.944) 6.694 12.325 ( 0.110 -2.522 1.680) 3.033 12.506 ( -6.245 8.715 8.580) 13.732 12.754 ( 5.183 -1.466 -12.415) 13.533 13.002 ( -5.278 -2.903 0.926) 6.094 13.100 ( -1.542 -3.527 -2.598) 4.644 13.283 ( -7.066 2.816 4.497) 8.836 13.378 ( 3.206 -1.405 -0.165) 3.504 13.646 ( 2.150 -2.466 -5.504) 6.403 13.743 ( -6.827 4.296 -1.832) 8.271 13.935 ( 9.848 -4.190 5.310) 11.947 14.131 ( 0.021 2.961 -0.847) 3.080 14.243 ( 2.617 -0.004 3.546) 4.407 14.401 ( 0.103 3.827 -3.780) 5.380 14.621 ( -2.832 -0.814 -5.222) 5.996 14.810 ( -3.923 -1.881 -4.091) 5.972 14.970 ( -1.063 -0.538 1.128) 1.641 15.241 ( 5.407 1.133 -0.942) 5.604 15.333 ( 7.494 -1.472 -6.442) 9.991 15.586 ( 9.118 -0.257 -5.729) 10.772 15.693 ( -0.550 4.270 0.070) 4.306 15.774 ( 3.067 6.118 -1.090) 6.930 15.870 ( 6.439 4.798 -3.777) 8.874 16.058 ( 15.444 10.535 -7.158) 20.019 16.386 ( 7.056 -3.397 1.013) 7.896 16.574 ( -9.993 -2.392 3.624) 10.895 16.729 ( -3.366 -4.072 -1.885) 5.609 17.227 ( 14.087 0.925 -15.002) 20.599 18.672 ( -2.228 -7.774 0.210) 8.090 19.033 ( -4.526 -6.946 -9.418) 12.547 19.747 ( 0.944 -0.885 7.405) 7.517 19.908 ( 0.872 -5.111 4.539) 6.891 21.403 ( -9.770 6.504 0.115) 11.737 21.530 ( -4.719 5.462 -2.760) 7.728 21.969 ( -7.124 -0.001 0.892) 7.180 22.065 ( -3.203 -1.008 -1.128) 3.542 25.995 ( 4.374 3.473 4.341) 7.074 26.172 ( 6.294 -0.769 0.752) 6.385 26.306 ( 11.586 -2.903 -3.464) 12.437 26.437 ( 6.953 -0.110 -6.186) 9.307 26.716 ( 9.582 3.487 -2.297) 10.453 26.977 ( 5.222 -2.153 -4.318) 7.110 27.187 ( 0.736 1.605 3.884) 4.266 27.391 ( 10.811 -1.353 -1.118) 10.953 27.666 ( 5.050 -1.941 12.469) 13.592 27.859 ( 4.403 -2.555 3.962) 6.451 28.083 ( 3.170 3.139 -1.536) 4.718 28.662 ( 5.323 -18.703 0.417) 19.450 29.241 ( 1.191 -2.647 -2.596) 3.894 29.269 ( 0.593 -2.137 -5.422) 5.858 29.461 ( -1.411 7.017 3.358) 7.906 29.631 ( 2.714 6.069 -4.865) 8.239 29.926 ( -3.240 0.863 0.107) 3.355 30.050 ( 2.066 -6.860 7.436) 10.326 30.353 ( 0.146 2.803 -2.691) 3.889 30.468 ( 5.781 -2.304 -4.783) 7.849 31.152 ( -1.943 0.314 5.328) 5.680 31.430 ( -0.550 -7.826 8.890) 11.856 32.781 ( -32.208 21.052 5.413) 38.857 33.454 ( -10.406 -4.570 -7.613) 13.679 ======================= Grid point 90 (33/72) ======================= q-point: ( 0.20 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.973 ( 36.341 -1.163 21.148) 42.063 2.274 ( 31.036 17.544 29.412) 46.218 3.215 ( 31.318 12.680 9.062) 34.982 3.353 ( 27.437 16.020 12.197) 34.033 4.038 ( 30.347 -3.963 -14.383) 33.816 4.268 ( 6.584 -16.353 -2.705) 17.835 4.606 ( 14.111 -5.022 -5.199) 15.855 4.709 ( 11.483 -7.930 -9.639) 16.960 4.760 ( 20.093 -12.781 -3.862) 24.125 4.919 ( 18.893 -4.655 1.424) 19.510 5.185 ( 10.478 -0.006 -7.752) 13.034 5.403 ( 6.528 -3.906 1.620) 7.779 5.513 ( 13.676 -2.297 2.782) 14.144 5.609 ( 5.169 -1.195 1.797) 5.601 5.889 ( 8.452 3.200 1.691) 9.194 5.961 ( 7.714 3.436 -1.505) 8.578 6.074 ( -3.278 2.317 -0.742) 4.082 6.199 ( 10.911 7.034 -2.493) 13.219 6.340 ( 7.163 -5.126 -3.599) 9.515 6.449 ( 5.132 3.367 -1.901) 6.425 6.631 ( 6.420 3.587 -2.819) 7.876 6.744 ( 0.414 2.878 4.376) 5.254 6.836 ( -1.225 0.356 6.376) 6.503 7.061 ( 2.800 1.953 4.369) 5.544 7.181 ( -2.988 -0.415 3.595) 4.693 7.301 ( 4.319 6.225 4.356) 8.739 7.620 ( -8.831 8.384 1.378) 12.254 7.811 ( -7.886 0.144 1.700) 8.068 7.957 ( -10.718 5.349 -0.988) 12.019 8.066 ( -1.777 -5.118 -1.375) 5.590 8.340 ( -3.900 -0.937 -0.218) 4.016 8.463 ( -6.397 -3.394 -3.550) 8.065 8.566 ( -8.907 1.183 1.453) 9.102 8.636 ( -9.178 4.385 -2.842) 10.562 8.779 ( 0.004 -1.017 -0.751) 1.264 8.944 ( -2.320 3.010 0.102) 3.802 9.043 ( -4.723 0.356 6.422) 7.980 9.243 ( -3.825 -2.675 -0.763) 4.730 9.470 ( -7.138 1.164 0.135) 7.233 9.538 ( -12.241 -2.655 14.073) 18.840 9.631 ( 1.068 -0.465 -0.738) 1.379 9.711 ( 1.492 -0.301 -1.580) 2.194 9.865 ( -11.720 -7.210 2.484) 13.982 10.055 ( -0.009 -1.783 0.410) 1.829 10.096 ( 1.920 -5.505 -2.131) 6.208 10.241 ( -1.827 -5.743 -4.219) 7.357 10.333 ( -5.021 -3.896 -2.437) 6.806 10.596 ( 0.848 0.740 3.288) 3.475 10.750 ( -8.054 -1.598 -3.122) 8.784 10.873 ( 1.716 6.347 -5.978) 8.887 11.029 ( 0.268 3.990 0.694) 4.059 11.130 ( 0.889 3.031 -1.574) 3.529 11.210 ( 5.175 2.148 1.119) 5.713 11.346 ( 1.727 3.375 -3.511) 5.167 11.478 ( -2.603 1.934 -0.914) 3.369 11.639 ( -6.340 -2.620 0.413) 6.872 11.667 ( -7.901 -1.063 0.633) 7.997 11.759 ( -3.087 0.888 -1.685) 3.627 11.910 ( -3.746 1.749 4.646) 6.219 12.024 ( 0.079 -1.648 7.770) 7.943 12.208 ( -3.034 1.055 7.061) 7.758 12.375 ( -1.915 7.374 7.898) 10.973 12.457 ( 5.396 -4.950 -1.795) 7.540 12.787 ( -9.030 -2.996 -2.173) 9.759 12.877 ( -3.011 -1.889 -4.972) 6.112 13.020 ( -3.823 -4.969 -1.663) 6.487 13.202 ( -5.778 5.644 -3.284) 8.719 13.262 ( -6.367 3.214 -4.137) 8.246 13.580 ( -7.335 4.393 -5.965) 10.424 13.714 ( 0.710 -4.630 -3.302) 5.731 13.987 ( -4.375 -3.802 4.126) 7.115 14.201 ( 3.352 -2.007 -3.008) 4.931 14.273 ( -2.650 -5.413 0.946) 6.100 14.426 ( 1.037 -3.859 -0.397) 4.016 14.530 ( -3.319 -2.619 -3.536) 5.512 14.778 ( -2.772 6.656 -2.501) 7.631 15.014 ( 4.375 -4.817 7.719) 10.096 15.252 ( -0.528 6.424 3.097) 7.151 15.463 ( 4.843 -3.766 0.337) 6.144 15.663 ( 2.541 3.595 2.234) 4.937 15.718 ( -3.999 5.579 1.791) 7.094 15.890 ( 11.732 -5.062 -4.469) 13.536 15.993 ( 5.853 3.202 -2.517) 7.131 16.215 ( -0.213 3.490 2.226) 4.145 16.342 ( 2.498 5.880 -1.041) 6.473 16.597 ( -3.641 -1.851 -2.525) 4.802 16.710 ( 11.858 0.806 1.010) 11.928 17.513 ( 11.640 -12.350 -20.004) 26.233 18.681 ( 2.739 -3.662 -3.517) 5.768 18.930 ( -2.655 -5.456 -7.522) 9.665 19.809 ( 6.159 -0.658 4.900) 7.898 19.969 ( 6.229 -3.900 1.392) 7.480 21.134 ( -18.610 7.453 1.583) 20.110 21.343 ( -14.198 4.252 -2.679) 15.061 21.787 ( -12.146 1.102 1.665) 12.309 21.956 ( -8.270 -1.031 -1.791) 8.525 26.106 ( 6.224 2.354 5.488) 8.625 26.300 ( 6.046 -2.075 2.780) 6.970 26.461 ( 6.773 1.068 0.219) 6.860 26.612 ( 8.253 0.327 -6.510) 10.517 26.949 ( 13.315 -1.231 -3.544) 13.834 27.100 ( 6.980 -2.238 -0.920) 7.387 27.239 ( 5.288 4.330 1.829) 7.075 27.569 ( 7.729 -0.029 2.663) 8.175 27.827 ( 10.919 -4.120 7.120) 13.671 27.963 ( 6.082 0.242 1.796) 6.347 28.162 ( 4.462 1.164 -2.244) 5.128 28.699 ( -2.159 -13.141 -10.392) 16.892 29.265 ( 1.280 -1.025 -2.564) 3.044 29.286 ( 0.785 -3.258 -1.694) 3.756 29.466 ( 2.543 4.692 3.044) 6.144 29.676 ( 1.544 0.637 -5.578) 5.823 29.850 ( -4.236 2.151 1.657) 5.032 30.073 ( -0.063 -5.840 8.744) 10.515 30.383 ( 2.638 3.408 -2.995) 5.248 30.581 ( 5.350 -4.164 -4.594) 8.189 31.122 ( -0.728 0.537 4.620) 4.707 31.417 ( -0.570 -7.407 9.572) 12.117 32.217 ( -24.173 24.628 8.402) 35.517 33.162 ( -18.866 -4.786 -8.794) 21.358 ======================= Grid point 91 (34/72) ======================= q-point: ( 0.30 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.692 ( 36.639 -5.293 13.935) 39.555 2.892 ( 32.906 12.377 21.241) 41.075 3.536 ( 15.280 1.684 -0.670) 15.387 4.010 ( 16.827 -13.221 5.824) 22.178 4.338 ( 16.263 -4.677 3.066) 17.198 4.506 ( 10.506 0.325 -10.718) 15.012 4.761 ( 3.007 -14.689 -5.892) 16.110 4.897 ( 7.270 -7.483 -8.285) 13.323 4.969 ( 5.869 -0.210 -3.050) 6.617 5.190 ( 3.286 0.609 -7.946) 8.621 5.362 ( 4.677 0.408 -4.741) 6.672 5.483 ( 10.022 -4.672 4.574) 11.966 5.651 ( 4.373 -0.400 -1.483) 4.635 5.806 ( 6.815 -1.098 4.802) 8.409 6.005 ( 6.186 -0.802 1.953) 6.536 6.071 ( 3.270 7.107 -9.110) 12.009 6.242 ( 5.031 3.403 -2.484) 6.562 6.374 ( 5.344 4.326 1.034) 6.953 6.565 ( 15.894 2.977 -1.779) 16.268 6.649 ( 20.289 6.246 7.689) 22.578 6.720 ( 0.587 -1.670 1.067) 2.067 6.861 ( 8.405 1.484 2.539) 8.905 7.023 ( 15.072 7.905 -1.002) 17.049 7.059 ( 3.842 1.074 3.321) 5.190 7.215 ( 7.950 6.670 10.911) 15.058 7.393 ( 3.543 2.904 11.084) 11.993 7.555 ( 3.660 1.724 -3.619) 5.428 7.677 ( -3.506 0.331 4.902) 6.036 7.785 ( -5.005 3.949 3.076) 7.078 7.998 ( -2.076 -1.686 -1.053) 2.875 8.251 ( -8.717 0.209 -4.949) 10.026 8.309 ( -5.576 0.914 -2.023) 6.002 8.445 ( -2.207 4.601 4.314) 6.682 8.585 ( 4.531 5.227 -3.006) 7.542 8.785 ( -0.308 -0.494 1.803) 1.895 8.945 ( 3.498 -1.882 1.741) 4.337 9.024 ( -0.295 -3.807 2.040) 4.329 9.147 ( -11.779 -5.505 3.507) 13.466 9.261 ( -10.949 -4.128 5.746) 13.036 9.360 ( -2.500 0.277 1.096) 2.744 9.481 ( -10.911 4.833 -0.208) 11.935 9.656 ( -6.516 -0.884 -0.144) 6.578 9.848 ( -4.259 0.890 -8.679) 9.709 9.907 ( -4.246 -0.230 1.349) 4.461 10.120 ( -4.435 -6.494 -3.876) 8.767 10.237 ( 7.241 -6.232 -5.816) 11.185 10.314 ( -1.300 -5.454 -0.356) 5.618 10.439 ( -16.636 -0.431 -2.276) 16.796 10.615 ( -1.097 2.544 -1.993) 3.413 10.822 ( -8.924 1.791 -0.681) 9.127 10.962 ( -0.290 -0.800 -5.244) 5.313 11.171 ( 1.703 5.329 1.962) 5.929 11.296 ( -2.861 -0.520 0.129) 2.911 11.355 ( -6.952 0.500 -1.374) 7.104 11.417 ( -8.155 1.801 -0.973) 8.408 11.559 ( 9.121 -2.975 0.805) 9.628 11.575 ( -0.902 0.612 -6.789) 6.876 11.769 ( 2.850 1.450 -0.397) 3.223 11.928 ( -0.255 -1.080 3.460) 3.634 12.041 ( 6.640 -1.482 8.396) 10.806 12.182 ( 0.067 4.483 9.885) 10.854 12.366 ( 1.100 3.791 8.446) 9.322 12.453 ( -16.113 2.058 2.761) 16.477 12.566 ( 1.316 -5.005 -7.173) 8.845 12.812 ( -4.822 -5.899 0.859) 7.667 12.992 ( -6.794 1.379 -4.754) 8.406 13.056 ( -0.319 -5.347 -2.819) 6.053 13.227 ( -2.229 4.337 -5.947) 7.691 13.442 ( -7.133 -0.026 -10.433) 12.638 13.639 ( -7.495 1.444 -7.265) 10.537 13.839 ( -10.340 0.305 0.726) 10.370 14.115 ( -10.859 -6.611 -2.296) 12.919 14.215 ( -5.933 -4.400 -0.219) 7.390 14.383 ( -4.361 -2.829 -1.506) 5.412 14.510 ( 0.667 1.637 3.024) 3.503 14.644 ( -8.337 3.664 0.742) 9.137 15.118 ( 4.520 -3.858 4.701) 7.577 15.244 ( 2.386 3.236 1.914) 4.453 15.421 ( -5.167 4.580 5.664) 8.931 15.707 ( 5.523 -0.699 1.451) 5.753 15.854 ( 10.925 2.292 4.673) 12.101 16.019 ( 0.911 -1.922 1.837) 2.811 16.078 ( 3.666 3.040 0.395) 4.779 16.257 ( 4.866 0.834 -0.535) 4.966 16.448 ( 6.758 3.397 -4.832) 8.975 16.653 ( 8.622 -1.193 -2.873) 9.166 16.885 ( 4.905 0.095 2.417) 5.469 17.622 ( -0.322 -13.846 -11.309) 17.880 18.733 ( 6.015 1.026 -0.170) 6.104 19.096 ( 18.763 -2.726 -10.387) 21.619 19.998 ( 13.410 -1.010 2.844) 13.746 20.158 ( 13.541 -3.127 -0.052) 13.898 20.697 ( -26.193 8.244 2.805) 27.602 21.008 ( -20.240 3.100 -3.724) 20.812 21.495 ( -18.074 1.075 2.570) 18.288 21.735 ( -14.996 -1.961 -2.413) 15.315 26.211 ( 4.498 1.642 6.424) 8.013 26.385 ( 2.557 -1.961 4.937) 5.896 26.573 ( 4.631 1.743 1.361) 5.132 26.722 ( 3.179 0.300 -2.439) 4.018 27.151 ( 7.288 -3.427 -0.599) 8.075 27.267 ( 9.602 0.810 -0.497) 9.649 27.393 ( 10.542 3.328 -3.826) 11.699 27.725 ( 8.918 1.455 3.235) 9.598 28.025 ( 8.578 -3.355 2.164) 9.461 28.082 ( 5.678 0.676 1.000) 5.805 28.229 ( 1.925 -0.745 -2.827) 3.500 28.602 ( -6.818 -7.092 -12.423) 15.847 29.286 ( 0.266 0.103 1.336) 1.366 29.301 ( 1.547 -0.816 -2.122) 2.750 29.548 ( 4.770 1.033 -0.228) 4.886 29.678 ( -0.754 -2.911 -1.089) 3.198 29.797 ( -0.739 3.192 3.116) 4.521 30.048 ( -2.362 -4.145 10.444) 11.482 30.440 ( 2.939 2.521 -3.174) 5.006 30.659 ( 2.597 -1.714 -2.847) 4.218 31.127 ( 1.045 -0.335 3.556) 3.721 31.414 ( 0.054 -4.564 10.675) 11.610 31.877 ( -10.921 17.571 1.092) 20.717 32.767 ( -21.432 -4.528 -9.359) 23.820 ======================= Grid point 92 (35/72) ======================= q-point: ( 0.40 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.307 ( 26.229 -3.920 7.417) 27.538 3.514 ( 30.966 8.338 11.320) 34.009 3.867 ( 17.181 -2.645 0.929) 17.409 4.110 ( -2.492 -16.391 1.844) 16.682 4.416 ( -0.755 -6.714 -3.978) 7.841 4.645 ( -5.124 -3.484 3.641) 7.187 4.759 ( -1.857 -12.026 -1.403) 12.250 4.929 ( -8.117 1.857 2.110) 8.590 4.989 ( -1.590 1.192 -10.019) 10.214 5.224 ( 9.731 -2.047 -4.807) 11.045 5.479 ( 6.406 -1.088 -11.327) 13.058 5.639 ( 3.035 -3.223 -8.458) 9.546 5.795 ( 4.642 4.422 -1.728) 6.640 5.897 ( 4.666 4.056 3.911) 7.316 6.066 ( -0.826 -4.743 -2.912) 5.626 6.155 ( 0.157 -1.781 -4.947) 5.261 6.235 ( 6.347 2.712 2.542) 7.355 6.542 ( 12.527 9.448 -0.572) 15.701 6.656 ( -1.805 -2.502 -1.010) 3.246 6.790 ( -0.298 -1.145 8.725) 8.805 6.841 ( 0.774 3.353 4.273) 5.487 7.004 ( 8.604 8.584 9.202) 15.244 7.142 ( 4.940 3.096 3.260) 6.679 7.220 ( 4.656 6.069 9.415) 12.131 7.376 ( 1.047 9.545 -0.727) 9.630 7.535 ( 5.862 1.142 5.963) 8.439 7.604 ( 4.174 0.951 10.184) 11.047 7.737 ( 14.810 -6.268 -3.379) 16.433 7.917 ( -12.772 -0.599 -1.669) 12.894 8.021 ( 10.777 -2.011 0.655) 10.983 8.164 ( 6.588 -0.142 4.018) 7.718 8.308 ( 14.345 8.520 -1.482) 16.750 8.444 ( 3.501 4.610 3.937) 7.000 8.706 ( 1.252 -5.232 -2.016) 5.745 8.815 ( 3.816 2.982 2.450) 5.427 8.895 ( -10.838 0.785 3.414) 11.390 8.941 ( -6.021 0.207 0.194) 6.028 8.992 ( -7.424 -0.466 5.295) 9.131 9.140 ( -5.336 3.419 -3.139) 7.072 9.232 ( 3.419 3.845 4.844) 7.067 9.399 ( -11.903 -2.798 -2.692) 12.520 9.562 ( 7.333 0.311 -4.395) 8.555 9.711 ( -11.463 0.238 -4.487) 12.313 9.877 ( 2.443 5.676 -3.586) 7.145 10.038 ( -2.875 -1.240 -5.541) 6.365 10.152 ( -0.987 -4.885 -0.590) 5.018 10.330 ( 2.307 -4.525 -1.564) 5.315 10.399 ( -9.798 -2.366 2.394) 10.360 10.545 ( 1.323 -3.211 -2.285) 4.157 10.736 ( 3.620 1.733 -7.520) 8.524 10.893 ( -12.751 1.270 -9.097) 15.715 11.058 ( -11.246 -4.324 4.096) 12.726 11.135 ( -5.192 -4.059 -3.379) 7.407 11.257 ( 0.027 4.232 5.581) 7.004 11.363 ( -1.448 1.377 -0.208) 2.009 11.612 ( 2.407 0.681 -5.723) 6.245 11.663 ( -3.382 -0.827 -8.381) 9.075 11.837 ( 4.902 -4.415 3.653) 7.541 11.937 ( 4.290 -3.605 5.194) 7.641 12.087 ( -5.675 3.323 7.813) 10.212 12.254 ( 3.401 2.461 2.637) 4.957 12.308 ( 8.214 -0.286 1.606) 8.374 12.398 ( 0.224 2.560 4.604) 5.272 12.553 ( -0.192 -4.633 1.702) 4.939 12.733 ( -6.616 -0.219 -2.325) 7.017 12.880 ( -2.742 -3.830 -1.351) 4.900 13.005 ( -6.383 -0.810 -0.031) 6.434 13.131 ( -5.244 -6.276 -6.848) 10.667 13.319 ( -6.147 -3.201 -8.714) 11.134 13.509 ( -8.481 3.233 -3.626) 9.773 13.592 ( -9.498 3.375 -9.700) 13.989 13.833 ( -13.975 -0.069 -8.015) 16.111 14.139 ( 0.642 -1.497 7.776) 7.945 14.334 ( -4.247 2.565 2.669) 5.634 14.485 ( -1.506 -0.505 -0.570) 1.688 14.557 ( -0.959 0.873 -0.264) 1.324 15.128 ( 0.126 -1.166 3.159) 3.370 15.318 ( -1.076 5.335 7.713) 9.440 15.472 ( 12.012 -0.029 -2.414) 12.253 15.801 ( 1.598 -3.891 0.453) 4.231 15.977 ( 2.319 3.714 3.432) 5.563 16.021 ( 0.177 0.796 2.983) 3.093 16.143 ( 4.247 2.999 5.529) 7.590 16.313 ( 0.135 1.751 2.894) 3.385 16.588 ( 6.623 -0.067 -3.366) 7.430 16.795 ( -0.496 -3.269 1.213) 3.522 16.974 ( 11.396 -3.236 -4.046) 12.518 17.515 ( -10.115 -11.492 -7.894) 17.225 19.017 ( 22.960 6.383 2.857) 24.001 19.546 ( 26.218 -2.167 -9.298) 27.902 20.140 ( -28.925 8.011 3.259) 30.190 20.312 ( 17.359 -0.586 2.349) 17.527 20.494 ( 18.534 -2.772 -1.111) 18.773 20.580 ( -22.204 1.590 -5.258) 22.873 21.109 ( -21.472 0.657 3.188) 21.717 21.383 ( -21.296 -2.803 -2.605) 21.637 26.284 ( 3.284 0.979 6.998) 7.792 26.395 ( -1.190 -0.252 6.877) 6.984 26.643 ( 2.780 -0.681 1.143) 3.082 26.745 ( -0.288 -0.129 0.760) 0.823 27.270 ( 5.070 -0.672 -0.496) 5.138 27.390 ( 3.241 3.906 0.181) 5.079 27.634 ( 13.420 -1.471 -6.697) 15.070 27.895 ( 7.456 0.946 0.600) 7.540 28.088 ( -2.238 -2.598 -1.776) 3.862 28.196 ( 3.356 0.391 -1.813) 3.835 28.229 ( 1.156 -0.698 -1.662) 2.141 28.476 ( -5.651 -2.512 -9.163) 11.055 29.286 ( -0.037 -0.445 1.106) 1.193 29.335 ( 1.514 2.202 1.032) 2.865 29.606 ( 2.053 -2.184 -3.044) 4.272 29.690 ( 0.600 -4.037 -0.253) 4.089 29.817 ( 3.065 2.818 7.762) 8.809 29.989 ( -3.599 -1.656 11.167) 11.849 30.487 ( 1.917 0.032 -3.578) 4.059 30.682 ( 0.122 3.589 -0.689) 3.656 31.152 ( 1.315 -2.100 3.229) 4.070 31.397 ( -2.048 3.362 10.280) 11.008 31.820 ( 4.914 4.739 -5.691) 8.888 32.366 ( -19.724 -3.550 -8.810) 21.892 ======================= Grid point 93 (36/72) ======================= q-point: (-0.50 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.698 ( 0.000 -6.271 1.538) 6.457 3.784 ( 0.000 1.453 6.839) 6.992 3.942 ( 0.000 -0.544 -3.833) 3.872 4.233 ( 0.000 7.771 5.130) 9.312 4.384 ( -0.000 -17.182 3.349) 17.505 4.514 ( -0.000 -5.488 -1.313) 5.643 4.702 ( 0.000 -12.840 10.786) 16.769 4.727 ( 0.000 -1.366 1.464) 2.002 5.096 ( 0.000 5.772 -11.096) 12.507 5.279 ( 0.000 3.609 -7.015) 7.889 5.567 ( 0.000 -2.784 -14.003) 14.277 5.642 ( 0.000 -3.319 -10.450) 10.964 5.850 ( 0.000 -5.789 -1.702) 6.034 5.940 ( 0.000 -4.452 5.394) 6.994 6.022 ( 0.000 -1.590 -2.997) 3.393 6.144 ( 0.000 2.056 -2.997) 3.635 6.369 ( 0.000 6.147 -4.177) 7.432 6.508 ( -0.000 3.738 -0.094) 3.739 6.744 ( 0.000 -1.698 3.237) 3.656 6.820 ( 0.000 -0.219 3.530) 3.537 6.924 ( 0.000 6.568 7.509) 9.976 7.007 ( -0.000 5.740 8.648) 10.379 7.239 ( 0.000 2.701 -1.176) 2.946 7.265 ( -0.000 6.911 8.168) 10.700 7.412 ( 0.000 -1.707 10.709) 10.844 7.454 ( -0.000 -0.418 13.689) 13.695 7.720 ( 0.000 -0.193 -1.371) 1.385 7.761 ( 0.000 0.349 -7.726) 7.734 7.878 ( 0.000 -0.168 8.177) 8.179 8.144 ( 0.000 3.420 5.086) 6.129 8.325 ( 0.000 5.132 2.350) 5.644 8.375 ( -0.000 5.393 -0.941) 5.475 8.589 ( 0.000 1.710 5.533) 5.791 8.649 ( -0.000 3.808 4.830) 6.151 8.796 ( 0.000 -3.176 -1.172) 3.386 8.810 ( 0.000 1.517 -0.962) 1.796 8.903 ( 0.000 0.659 -6.419) 6.452 8.986 ( 0.000 0.542 4.311) 4.345 9.100 ( 0.000 5.740 -3.133) 6.539 9.136 ( -0.000 6.007 -3.867) 7.144 9.418 ( 0.000 2.353 -0.037) 2.353 9.426 ( -0.000 1.259 1.107) 1.677 9.810 ( 0.000 -7.714 -2.895) 8.240 9.878 ( 0.000 -4.985 1.844) 5.315 10.063 ( 0.000 3.469 -6.873) 7.698 10.097 ( -0.000 4.187 -2.469) 4.861 10.320 ( 0.000 -7.542 -2.786) 8.040 10.376 ( -0.000 -3.604 2.039) 4.141 10.477 ( -0.000 -1.326 -1.920) 2.333 10.663 ( 0.000 7.508 -5.639) 9.390 10.883 ( -0.000 -3.317 -1.513) 3.646 10.893 ( 0.000 -2.919 -5.040) 5.825 11.114 ( 0.000 -9.213 -8.371) 12.448 11.321 ( 0.000 1.624 7.279) 7.458 11.384 ( 0.000 1.017 -6.704) 6.781 11.408 ( -0.000 4.116 0.706) 4.177 11.770 ( 0.000 -2.913 0.421) 2.944 11.813 ( -0.000 -4.941 -6.159) 7.896 11.958 ( 0.000 -2.809 11.138) 11.487 12.153 ( 0.000 4.960 2.548) 5.576 12.266 ( 0.000 0.311 2.889) 2.905 12.321 ( -0.000 1.596 -0.309) 1.626 12.509 ( 0.000 2.581 2.101) 3.328 12.542 ( 0.000 -3.490 -0.823) 3.585 12.618 ( 0.000 -5.569 1.339) 5.728 12.809 ( 0.000 -1.108 5.238) 5.354 13.002 ( 0.000 -5.618 -6.177) 8.350 13.070 ( 0.000 -2.166 -3.972) 4.525 13.254 ( 0.000 -1.655 -4.036) 4.363 13.298 ( -0.000 -1.006 -2.761) 2.939 13.614 ( 0.000 0.269 -11.306) 11.309 13.651 ( -0.000 3.015 -13.812) 14.137 14.211 ( 0.000 3.071 8.524) 9.061 14.222 ( -0.000 4.165 6.440) 7.670 14.484 ( 0.000 -1.632 -3.165) 3.561 14.549 ( 0.000 0.811 -1.493) 1.699 15.138 ( 0.000 -1.179 3.903) 4.077 15.297 ( 0.000 5.415 7.650) 9.372 15.700 ( 0.000 -3.703 -5.723) 6.817 15.708 ( -0.000 -2.325 -4.229) 4.825 16.001 ( 0.000 3.645 5.372) 6.492 16.031 ( 0.000 3.425 6.414) 7.271 16.229 ( -0.000 0.361 6.706) 6.716 16.270 ( 0.000 2.295 6.454) 6.850 16.684 ( 0.000 -1.596 -0.668) 1.730 16.724 ( 0.000 0.687 -0.263) 0.736 17.260 ( -0.000 -8.885 -7.217) 11.447 17.265 ( 0.000 -8.297 -6.739) 10.688 19.517 ( 0.000 6.538 2.847) 7.131 19.575 ( -0.000 9.251 5.128) 10.577 20.038 ( 0.000 -1.867 -8.604) 8.804 20.113 ( -0.000 1.080 -6.370) 6.461 20.668 ( 0.000 -1.041 2.413) 2.628 20.716 ( -0.000 0.943 3.391) 3.520 20.934 ( 0.000 -3.320 -2.500) 4.156 20.947 ( -0.000 -2.675 -1.754) 3.199 26.330 ( 0.000 -0.288 6.609) 6.616 26.366 ( 0.000 1.541 8.189) 8.333 26.674 ( 0.000 -2.362 0.134) 2.366 26.735 ( 0.000 0.129 2.530) 2.533 27.325 ( 0.000 0.567 -1.727) 1.817 27.415 ( 0.000 4.763 1.327) 4.945 27.860 ( -0.000 -3.855 -7.750) 8.655 27.883 ( 0.000 -2.919 -5.340) 6.086 28.096 ( 0.000 -0.010 0.516) 0.516 28.131 ( -0.000 1.637 -0.451) 1.698 28.323 ( -0.000 -1.953 -4.949) 5.321 28.395 ( 0.000 1.431 -4.748) 4.959 29.286 ( 0.000 -0.463 1.479) 1.550 29.350 ( 0.000 2.989 1.770) 3.474 29.653 ( 0.000 -4.823 -2.832) 5.592 29.665 ( -0.000 -2.932 -1.155) 3.152 29.883 ( 0.000 1.110 9.448) 9.513 29.927 ( 0.000 0.795 11.284) 11.312 30.507 ( 0.000 -1.940 -4.077) 4.515 30.680 ( 0.000 6.765 0.491) 6.782 31.168 ( 0.000 -3.028 3.204) 4.408 31.368 ( 0.000 6.363 8.599) 10.698 31.995 ( 0.000 -3.092 -9.124) 9.633 32.056 ( -0.000 -0.118 -6.195) 6.196 ======================= Grid point 99 (37/72) ======================= q-point: ( 0.00 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.907 ( 0.000 40.307 15.377) 43.140 2.002 ( 0.000 34.973 16.136) 38.516 2.790 ( 0.000 4.033 11.396) 12.088 3.094 ( 0.000 26.256 27.086) 37.723 3.222 ( 0.000 7.349 -1.914) 7.594 3.381 ( 0.000 -16.208 4.472) 16.813 3.852 ( 0.000 0.817 -7.995) 8.037 4.084 ( 0.000 -11.752 -16.749) 20.461 4.428 ( 0.000 -8.212 -8.894) 12.105 4.528 ( 0.000 -12.750 0.297) 12.754 4.901 ( 0.000 9.688 0.749) 9.717 5.203 ( 0.000 -1.430 -8.371) 8.492 5.316 ( 0.000 1.642 1.278) 2.081 5.517 ( 0.000 -10.611 5.130) 11.786 5.618 ( 0.000 -3.713 -4.236) 5.633 5.840 ( 0.000 -8.574 -0.534) 8.590 5.977 ( 0.000 9.486 9.941) 13.740 6.212 ( 0.000 -3.747 7.732) 8.593 6.365 ( 0.000 4.905 1.828) 5.234 6.413 ( 0.000 -0.203 1.343) 1.358 6.511 ( 0.000 -9.605 -1.644) 9.745 6.843 ( 0.000 -3.594 3.266) 4.856 6.902 ( 0.000 -4.197 9.194) 10.107 6.964 ( 0.000 -16.466 5.451) 17.345 7.190 ( 0.000 18.329 -3.898) 18.739 7.345 ( 0.000 8.237 0.189) 8.239 7.602 ( 0.000 2.305 -6.951) 7.324 7.967 ( 0.000 -12.288 -5.478) 13.454 8.063 ( 0.000 0.258 0.224) 0.341 8.155 ( 0.000 -8.890 -3.002) 9.384 8.237 ( 0.000 -5.094 -3.572) 6.222 8.474 ( 0.000 -5.813 -6.884) 9.010 8.506 ( 0.000 1.744 -5.819) 6.074 8.758 ( 0.000 -7.582 -9.536) 12.183 9.165 ( 0.000 3.067 -1.977) 3.649 9.255 ( 0.000 -3.813 0.586) 3.858 9.441 ( 0.000 7.898 -2.567) 8.305 9.462 ( 0.000 8.846 4.277) 9.825 9.568 ( 0.000 2.197 -3.596) 4.214 9.749 ( 0.000 -4.038 6.127) 7.338 9.814 ( 0.000 1.232 12.043) 12.106 9.825 ( 0.000 2.752 0.501) 2.797 10.004 ( 0.000 5.373 3.731) 6.541 10.035 ( 0.000 4.470 3.424) 5.631 10.111 ( 0.000 0.810 3.933) 4.015 10.248 ( 0.000 9.472 -0.465) 9.483 10.391 ( 0.000 7.273 -1.348) 7.397 10.545 ( 0.000 -0.778 -0.500) 0.925 10.727 ( 0.000 -1.463 0.166) 1.472 10.782 ( 0.000 -7.152 7.485) 10.352 10.981 ( 0.000 0.620 2.522) 2.598 11.134 ( 0.000 -1.754 1.716) 2.454 11.218 ( 0.000 1.953 -10.295) 10.479 11.458 ( 0.000 -7.992 -0.342) 8.000 11.584 ( 0.000 -7.126 -1.224) 7.230 11.592 ( 0.000 -10.964 0.587) 10.980 11.697 ( 0.000 4.238 -1.427) 4.472 11.866 ( 0.000 -3.681 -1.930) 4.156 11.991 ( 0.000 1.175 -0.264) 1.205 12.056 ( 0.000 2.774 1.000) 2.949 12.277 ( 0.000 -0.857 2.082) 2.251 12.388 ( 0.000 -3.679 -1.592) 4.008 12.631 ( 0.000 1.873 0.410) 1.917 12.689 ( 0.000 0.097 -2.542) 2.544 13.044 ( 0.000 0.080 -0.824) 0.828 13.091 ( 0.000 -1.074 0.919) 1.413 13.235 ( 0.000 3.193 5.591) 6.439 13.364 ( 0.000 -3.462 8.036) 8.750 13.662 ( 0.000 2.095 2.406) 3.190 13.758 ( 0.000 -2.243 -1.132) 2.512 13.956 ( 0.000 11.347 -1.698) 11.474 14.198 ( 0.000 0.409 -1.356) 1.416 14.234 ( 0.000 1.034 1.639) 1.938 14.476 ( 0.000 -7.085 -3.288) 7.810 14.616 ( 0.000 -4.421 -7.445) 8.659 14.736 ( 0.000 -6.078 -10.257) 11.923 15.003 ( 0.000 5.009 -2.005) 5.395 15.096 ( 0.000 1.215 -6.624) 6.734 15.429 ( 0.000 4.586 -0.552) 4.619 15.533 ( 0.000 -0.352 -4.364) 4.378 15.767 ( 0.000 5.591 -9.667) 11.168 15.839 ( 0.000 2.123 -7.199) 7.505 15.934 ( 0.000 10.130 -0.543) 10.144 16.018 ( 0.000 7.423 -8.909) 11.596 16.385 ( 0.000 1.492 6.866) 7.026 16.484 ( 0.000 -4.718 1.211) 4.871 16.824 ( 0.000 4.758 9.888) 10.973 17.125 ( 0.000 -5.777 12.205) 13.503 18.615 ( 0.000 1.299 -7.433) 7.546 18.912 ( 0.000 -10.121 -11.744) 15.503 19.731 ( 0.000 0.043 7.215) 7.215 19.808 ( 0.000 -4.312 6.837) 8.083 21.617 ( 0.000 4.594 -0.467) 4.617 21.645 ( 0.000 3.623 -2.604) 4.461 22.028 ( 0.000 -1.151 0.140) 1.160 22.049 ( 0.000 -2.060 -0.422) 2.102 26.056 ( 0.000 3.585 0.875) 3.690 26.093 ( 0.000 -0.189 0.360) 0.407 26.121 ( 0.000 1.799 -0.558) 1.883 26.302 ( 0.000 -5.297 -3.370) 6.279 26.729 ( 0.000 4.961 -3.801) 6.250 26.873 ( 0.000 -3.133 -3.885) 4.991 27.214 ( 0.000 0.472 2.474) 2.519 27.228 ( 0.000 -0.377 1.521) 1.567 27.621 ( 0.000 1.072 13.225) 13.268 27.730 ( 0.000 -4.272 12.867) 13.558 28.135 ( 0.000 4.557 0.242) 4.564 28.346 ( 0.000 -8.546 7.313) 11.247 29.205 ( 0.000 -0.128 -5.615) 5.616 29.240 ( 0.000 -1.271 -9.917) 9.998 29.616 ( 0.000 6.317 5.354) 8.280 29.719 ( 0.000 3.000 -0.835) 3.114 29.958 ( 0.000 0.680 4.009) 4.066 29.994 ( 0.000 1.500 -1.722) 2.284 30.373 ( 0.000 -1.419 -4.391) 4.615 30.373 ( 0.000 -0.941 -1.942) 2.158 31.189 ( 0.000 1.659 7.159) 7.349 31.321 ( 0.000 -4.902 10.176) 11.295 33.303 ( 0.000 3.798 -9.117) 9.877 33.454 ( 0.000 -4.872 -6.526) 8.144 ======================= Grid point 100 (38/72) ======================= q-point: ( 0.10 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.924 ( 5.887 38.688 12.876) 41.197 2.271 ( 20.900 32.371 20.012) 43.419 3.060 ( 20.294 9.375 5.091) 22.927 3.208 ( 20.951 15.765 20.059) 33.013 3.329 ( 8.820 -13.199 5.321) 16.743 3.662 ( 21.588 -13.887 -3.152) 25.861 4.096 ( 19.207 -0.413 -10.080) 21.695 4.264 ( 18.475 -8.009 -8.594) 21.893 4.440 ( 4.290 -6.385 -7.450) 10.709 4.551 ( 5.331 -7.510 -3.709) 9.929 4.906 ( 5.028 4.972 2.603) 7.535 5.257 ( 1.265 -4.734 0.323) 4.910 5.351 ( 4.128 -0.442 -4.862) 6.394 5.574 ( 5.032 -3.605 6.455) 8.943 5.719 ( 9.706 -2.060 -3.280) 10.451 5.893 ( 7.310 -4.789 -1.802) 8.923 5.969 ( -0.312 4.208 7.099) 8.258 6.201 ( -3.441 -2.942 4.299) 6.243 6.332 ( -1.011 2.432 1.421) 2.993 6.395 ( 2.072 5.096 3.587) 6.567 6.541 ( 1.953 -6.176 -0.018) 6.477 6.789 ( -1.260 1.182 6.320) 6.552 6.924 ( 0.562 -4.403 6.527) 7.894 7.082 ( 6.334 -8.467 3.385) 11.103 7.193 ( -1.462 13.404 -7.550) 15.453 7.288 ( 0.099 4.541 3.039) 5.465 7.711 ( 6.886 -1.289 -4.374) 8.259 7.903 ( -4.355 -7.355 -3.540) 9.252 8.034 ( -3.346 1.604 1.212) 3.904 8.177 ( 1.155 -0.972 -2.113) 2.597 8.272 ( 2.479 -6.492 -2.045) 7.244 8.427 ( -3.625 -5.400 -6.091) 8.911 8.503 ( 0.998 -2.974 -7.306) 7.951 8.782 ( 0.518 -2.972 -5.258) 6.062 9.057 ( -9.761 4.587 -2.567) 11.086 9.179 ( -14.315 4.133 -1.662) 14.992 9.275 ( -7.825 4.730 -0.902) 9.188 9.447 ( -10.864 8.087 -2.360) 13.748 9.514 ( -0.504 2.222 3.606) 4.265 9.592 ( -7.061 -4.135 5.268) 9.731 9.718 ( -5.388 -2.563 4.611) 7.541 9.787 ( -12.506 3.854 5.897) 14.354 9.955 ( 2.340 2.201 5.906) 6.723 9.993 ( -5.710 -0.783 -1.527) 5.962 10.105 ( -0.526 1.053 3.210) 3.419 10.208 ( -5.014 2.039 -1.480) 5.611 10.361 ( -5.184 -5.706 3.566) 8.494 10.570 ( 1.990 -0.851 -0.321) 2.188 10.759 ( 3.656 1.702 2.000) 4.501 10.854 ( 4.643 -2.469 3.121) 6.115 10.994 ( 3.268 0.521 -0.715) 3.385 11.139 ( -0.196 -1.276 -2.038) 2.412 11.268 ( 5.474 7.022 -4.240) 9.861 11.403 ( -4.044 -4.283 -3.162) 6.685 11.549 ( -1.579 -5.257 0.346) 5.500 11.612 ( -0.361 1.135 2.204) 2.505 11.706 ( 0.862 -0.274 -2.056) 2.246 11.855 ( -1.212 -2.153 -5.194) 5.751 11.980 ( -2.221 1.866 2.990) 4.165 12.107 ( -1.836 0.910 -3.897) 4.403 12.227 ( -1.869 -2.438 2.831) 4.178 12.287 ( -4.378 -1.795 1.543) 4.977 12.652 ( 1.209 4.319 6.653) 8.024 12.740 ( 1.408 1.226 -3.593) 4.050 12.944 ( -5.221 -2.435 -1.753) 6.022 13.043 ( -4.574 -2.851 1.276) 5.539 13.320 ( -2.750 1.211 7.639) 8.209 13.362 ( 4.258 -0.395 4.146) 5.956 13.609 ( -1.434 -1.369 -7.627) 7.881 13.813 ( 0.233 -0.497 3.576) 3.618 13.928 ( -2.455 7.678 -2.376) 8.404 14.168 ( -3.112 0.701 -0.958) 3.331 14.237 ( 1.062 -0.708 0.485) 1.365 14.398 ( -4.046 -3.507 -5.429) 7.625 14.522 ( -6.941 -7.540 -5.671) 11.713 14.767 ( 3.725 -2.011 -2.546) 4.939 15.031 ( -0.837 4.910 -0.205) 4.986 15.208 ( 9.066 -2.314 -3.645) 10.041 15.385 ( -0.545 3.163 -3.592) 4.818 15.571 ( 6.347 -0.487 -3.773) 7.400 15.758 ( -1.780 3.267 -4.261) 5.657 15.893 ( 4.868 3.037 -4.127) 7.068 16.000 ( 1.491 8.671 -1.791) 8.979 16.236 ( 12.320 7.062 -4.034) 14.763 16.319 ( 2.524 -2.539 -0.205) 3.586 16.493 ( -1.637 -4.246 2.112) 5.016 16.744 ( -4.757 4.017 7.853) 10.022 17.170 ( 3.844 -6.256 4.661) 8.697 18.599 ( -0.606 0.587 -7.330) 7.378 18.868 ( -4.214 -9.782 -10.246) 14.779 19.737 ( 1.200 0.000 6.045) 6.163 19.819 ( 1.645 -3.849 5.307) 6.759 21.523 ( -8.502 5.720 -0.128) 10.247 21.611 ( -5.727 2.420 -2.134) 6.574 21.973 ( -5.096 0.560 0.411) 5.143 22.037 ( -2.668 -1.910 -0.834) 3.386 26.065 ( 3.342 3.525 2.895) 5.654 26.152 ( 5.018 -1.299 1.273) 5.337 26.283 ( 11.629 0.490 -2.461) 11.897 26.395 ( 9.433 -3.673 -4.661) 11.144 26.788 ( 5.764 3.570 -2.886) 7.369 26.930 ( 5.665 -2.616 -3.470) 7.140 27.219 ( 2.798 1.559 2.848) 4.286 27.363 ( 10.466 -1.384 0.220) 10.560 27.639 ( 2.555 -0.674 13.263) 13.523 27.799 ( 6.574 -3.217 8.459) 11.186 28.150 ( 1.559 3.716 -0.286) 4.040 28.385 ( 3.525 -10.086 5.108) 11.842 29.210 ( 0.482 -0.559 -6.670) 6.711 29.244 ( 0.702 -0.967 -7.961) 8.050 29.588 ( -2.204 5.719 4.895) 7.844 29.717 ( -0.692 2.597 -1.047) 2.884 29.929 ( -2.043 -0.146 1.742) 2.689 30.016 ( 1.043 1.579 2.858) 3.428 30.372 ( 1.120 -0.626 -3.144) 3.396 30.427 ( 4.272 -1.577 -3.174) 5.551 31.167 ( -1.895 1.384 6.929) 7.316 31.321 ( -0.044 -4.334 9.941) 10.845 33.066 ( -21.280 10.328 -5.577) 24.302 33.346 ( -11.533 -6.431 -7.395) 15.135 ======================= Grid point 101 (39/72) ======================= q-point: ( 0.20 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.176 ( 20.832 22.889 12.849) 33.511 2.712 ( 24.389 27.330 20.816) 42.131 3.341 ( 11.773 1.175 -2.902) 12.183 3.500 ( 5.273 -21.810 5.577) 23.121 3.805 ( 29.666 -3.872 8.915) 31.218 4.091 ( 26.661 -6.414 -4.906) 27.857 4.366 ( 9.298 -8.356 -12.989) 18.027 4.568 ( 14.164 -2.865 -7.574) 16.315 4.711 ( 8.436 0.796 -2.252) 8.768 4.824 ( 25.502 -5.115 -1.123) 26.034 5.184 ( 16.981 -3.550 0.473) 17.354 5.371 ( 10.812 -2.210 4.253) 11.827 5.415 ( 8.298 2.551 -1.996) 8.908 5.637 ( 2.044 -0.950 8.549) 8.841 5.947 ( 3.995 1.840 -1.284) 4.582 6.024 ( 18.580 2.981 1.587) 18.884 6.120 ( 12.154 1.783 0.576) 12.298 6.214 ( 7.401 -6.035 -6.029) 11.294 6.341 ( 3.416 1.737 0.973) 3.954 6.457 ( 4.515 5.029 2.408) 7.175 6.635 ( 6.208 -3.799 3.948) 8.279 6.773 ( 0.012 8.012 -1.590) 8.169 6.961 ( 4.902 0.759 5.011) 7.051 7.144 ( -0.852 1.667 -0.223) 1.885 7.171 ( 3.054 2.363 6.635) 7.677 7.357 ( 4.773 2.857 3.026) 6.332 7.731 ( -6.073 2.257 5.164) 8.285 7.826 ( -4.913 -1.100 1.177) 5.171 8.010 ( 1.065 1.670 -7.298) 7.562 8.127 ( -5.994 11.249 -4.804) 13.622 8.314 ( -0.862 -4.006 -4.581) 6.147 8.348 ( -1.362 -5.134 -0.659) 5.353 8.570 ( 2.446 -2.324 1.376) 3.644 8.715 ( -6.711 3.095 -1.402) 7.523 8.832 ( -10.970 6.166 -4.631) 13.409 8.921 ( -5.381 -1.155 1.110) 5.614 9.116 ( -11.628 3.253 2.084) 12.253 9.171 ( -10.905 -2.965 -0.919) 11.338 9.409 ( -11.911 -2.885 6.088) 13.684 9.491 ( -15.672 -5.973 7.260) 18.276 9.608 ( 4.860 -1.883 -4.921) 7.168 9.681 ( 1.053 -7.472 -2.514) 7.954 9.810 ( -6.857 3.703 3.534) 8.557 9.986 ( -2.422 0.392 -2.067) 3.208 10.067 ( -5.373 -0.624 2.512) 5.964 10.145 ( -0.378 -4.908 1.838) 5.255 10.284 ( -2.451 -0.284 -0.942) 2.641 10.590 ( -0.556 -0.969 1.785) 2.106 10.694 ( -6.554 -2.747 -2.498) 7.533 10.938 ( -0.051 -0.850 0.354) 0.922 11.103 ( 1.284 5.604 -3.242) 6.600 11.147 ( 4.322 -0.808 0.183) 4.400 11.303 ( -2.257 4.898 -1.583) 5.621 11.400 ( 2.199 -1.604 -4.982) 5.677 11.493 ( -1.436 0.697 -0.442) 1.656 11.566 ( -5.305 -2.834 -0.369) 6.026 11.697 ( -5.224 5.072 -5.465) 9.104 11.806 ( 0.009 3.954 -0.704) 4.016 11.936 ( -1.293 -0.353 5.710) 5.865 12.015 ( -4.703 -0.494 1.044) 4.842 12.213 ( 0.092 0.262 5.036) 5.044 12.302 ( 4.820 -6.135 -1.659) 7.976 12.596 ( -6.008 10.259 9.976) 15.519 12.737 ( -5.016 -1.481 -3.526) 6.308 12.845 ( -6.323 -1.599 1.886) 6.790 12.921 ( -4.901 -5.221 -0.806) 7.206 13.291 ( -5.753 3.200 -3.433) 7.424 13.310 ( -3.163 1.533 -2.661) 4.408 13.614 ( -3.566 -1.603 -4.456) 5.928 13.716 ( -3.996 5.709 -0.979) 7.037 13.877 ( -2.759 -5.142 4.640) 7.455 14.128 ( -9.980 -9.334 -4.270) 14.316 14.193 ( 0.674 -0.379 -3.013) 3.111 14.360 ( 1.405 -1.988 -2.399) 3.418 14.496 ( 2.718 -1.341 -1.691) 3.471 14.864 ( 2.897 1.369 -1.368) 3.484 14.973 ( -3.078 1.248 4.184) 5.341 15.303 ( -0.263 -1.870 0.898) 2.091 15.460 ( 6.746 4.254 -1.402) 8.098 15.700 ( -1.095 0.085 -0.862) 1.396 15.777 ( 10.468 -1.088 0.633) 10.544 15.839 ( -6.448 0.642 -1.785) 6.722 16.070 ( 6.205 4.538 1.924) 7.924 16.242 ( -3.241 0.202 1.903) 3.764 16.460 ( 8.786 3.814 -4.364) 10.525 16.618 ( 2.822 3.230 -3.848) 5.762 16.722 ( 7.208 2.698 4.909) 9.129 17.255 ( 4.527 -13.567 -4.952) 15.135 18.635 ( 4.558 -0.721 -6.025) 7.589 18.812 ( 1.639 -6.219 -7.180) 9.639 19.801 ( 6.056 -0.047 3.716) 7.106 19.896 ( 6.852 -3.348 2.523) 8.032 21.280 ( -17.186 7.089 0.864) 18.611 21.407 ( -15.067 1.682 -1.296) 15.216 21.820 ( -11.365 2.333 0.374) 11.608 21.926 ( -9.096 -2.139 -1.422) 9.452 26.158 ( 5.349 2.768 4.381) 7.448 26.258 ( 5.449 -2.171 3.513) 6.837 26.486 ( 8.945 1.588 -2.127) 9.330 26.604 ( 9.989 -1.261 -4.755) 11.135 26.927 ( 8.127 -0.891 -1.287) 8.276 27.072 ( 8.773 -0.833 -1.407) 8.924 27.319 ( 7.482 3.769 1.027) 8.441 27.566 ( 9.603 -0.421 2.819) 10.017 27.755 ( 9.776 -2.963 6.726) 12.231 27.952 ( 8.495 -1.249 2.844) 9.045 28.186 ( 1.763 1.316 -1.892) 2.902 28.447 ( 2.011 -10.986 -0.201) 11.170 29.224 ( 1.121 -1.492 -7.042) 7.285 29.273 ( 2.161 -0.062 -4.377) 4.882 29.558 ( -0.458 4.207 4.123) 5.908 29.686 ( -2.320 0.422 -2.035) 3.115 29.888 ( -2.136 1.452 3.655) 4.476 30.017 ( -0.944 -0.582 6.791) 6.881 30.410 ( 2.607 -0.329 -3.595) 4.453 30.531 ( 6.239 -0.996 -2.353) 6.742 31.133 ( -1.331 0.674 5.680) 5.873 31.323 ( 0.469 -3.291 9.303) 9.879 32.609 ( -24.006 16.565 -2.694) 29.291 33.039 ( -19.293 -8.033 -8.005) 22.379 ======================= Grid point 102 (40/72) ======================= q-point: ( 0.30 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.688 ( 30.411 6.874 11.090) 33.092 3.191 ( 24.569 15.625 14.623) 32.583 3.540 ( 5.421 -15.992 2.689) 17.099 3.621 ( 16.417 -5.222 2.712) 17.440 4.258 ( 11.861 -8.853 0.475) 14.809 4.443 ( 11.684 -13.566 -12.162) 21.644 4.546 ( 7.559 -1.184 -5.704) 9.543 4.771 ( 8.785 -2.624 -6.822) 11.429 4.944 ( 11.937 -4.070 -2.509) 12.858 5.078 ( 2.040 -5.962 -2.432) 6.754 5.381 ( -2.924 1.136 5.990) 6.761 5.457 ( 9.966 -0.593 7.147) 12.278 5.703 ( 12.143 -0.203 -1.833) 12.283 5.771 ( 13.103 4.886 -1.262) 14.042 6.040 ( 3.433 4.513 -6.340) 8.505 6.221 ( -0.988 2.807 -8.828) 9.316 6.302 ( 4.062 3.824 -1.022) 5.672 6.423 ( 5.867 0.788 -1.292) 6.059 6.614 ( 23.285 2.374 4.625) 23.858 6.701 ( 16.451 0.130 3.955) 16.920 6.784 ( 13.585 4.441 1.432) 14.364 6.864 ( 11.265 0.220 2.733) 11.594 7.046 ( 2.044 3.057 6.240) 7.243 7.141 ( 3.909 -0.391 8.341) 9.220 7.330 ( 13.706 1.108 1.289) 13.812 7.468 ( 5.013 7.824 4.987) 10.546 7.582 ( -4.369 1.624 1.288) 4.835 7.725 ( -2.242 3.209 6.889) 7.923 7.877 ( -10.229 6.339 -2.629) 12.318 8.069 ( -6.250 7.467 -1.502) 9.853 8.260 ( -0.610 0.697 -4.227) 4.327 8.341 ( -2.001 2.247 -2.608) 3.981 8.526 ( -1.019 1.630 6.578) 6.854 8.659 ( -3.652 -0.439 -4.782) 6.033 8.764 ( 2.546 0.399 -2.176) 3.373 8.860 ( -0.942 -7.303 1.883) 7.600 8.937 ( -3.622 -0.574 5.641) 6.728 9.076 ( -0.888 -2.764 4.078) 5.006 9.175 ( -9.775 -3.902 6.789) 12.525 9.309 ( -1.182 -4.833 1.600) 5.226 9.585 ( -8.901 3.036 -4.241) 10.317 9.665 ( -6.209 1.507 -0.620) 6.419 9.782 ( 4.172 -2.554 -5.943) 7.697 9.924 ( -6.150 -2.736 0.051) 6.731 10.014 ( 4.160 -7.969 -3.048) 9.492 10.081 ( -4.229 -1.350 1.094) 4.572 10.283 ( 0.269 0.912 -1.252) 1.572 10.434 ( -13.563 -1.381 3.582) 14.096 10.648 ( 1.287 1.359 -8.347) 8.555 10.895 ( -13.452 5.279 -0.131) 14.452 10.942 ( -1.960 -0.795 -3.436) 4.035 11.201 ( -4.647 -1.970 -0.061) 5.048 11.258 ( -7.908 -2.487 1.467) 8.418 11.367 ( -2.453 1.366 0.108) 2.810 11.477 ( -5.252 -0.136 -5.717) 7.765 11.525 ( 4.964 -0.465 -2.559) 5.604 11.623 ( 2.921 6.783 -9.686) 12.180 11.804 ( -3.485 2.970 4.424) 6.367 11.898 ( -3.435 -2.716 0.436) 4.401 12.012 ( 7.797 -1.944 6.878) 10.577 12.260 ( 2.210 3.047 8.055) 8.891 12.373 ( -1.547 -4.117 -4.603) 6.366 12.487 ( -4.147 2.657 4.347) 6.570 12.542 ( -7.881 2.594 1.796) 8.490 12.715 ( -6.196 -3.920 2.125) 7.634 12.895 ( -0.185 -6.293 -0.250) 6.301 13.082 ( -11.582 3.597 -3.696) 12.678 13.263 ( -6.009 -2.596 -7.552) 9.994 13.447 ( -9.326 3.631 -5.996) 11.666 13.682 ( -5.055 1.344 -7.273) 8.959 13.816 ( -5.596 -2.550 2.274) 6.557 13.915 ( -7.718 -10.176 3.009) 13.121 14.221 ( -1.009 2.279 -4.311) 4.980 14.355 ( -1.601 -0.229 -2.938) 3.354 14.528 ( 0.123 0.342 2.034) 2.067 14.701 ( -12.694 2.280 3.380) 13.332 15.062 ( 6.177 -1.794 0.870) 6.491 15.300 ( 3.297 0.842 1.138) 3.588 15.483 ( -2.880 4.247 1.924) 5.480 15.689 ( 0.735 -2.534 1.872) 3.235 15.880 ( 11.224 0.515 2.550) 11.521 15.986 ( 5.597 -1.168 2.862) 6.394 16.161 ( 3.926 4.928 3.953) 7.438 16.262 ( 4.269 0.001 -0.524) 4.301 16.543 ( 1.532 5.127 -5.028) 7.343 16.671 ( 4.986 2.688 -4.578) 7.284 16.855 ( 3.374 -1.024 2.171) 4.141 17.313 ( 0.399 -17.392 -6.276) 18.494 18.785 ( 13.287 4.545 -1.397) 14.112 19.024 ( 19.269 -4.808 -6.641) 20.941 19.985 ( 13.186 -0.085 1.626) 13.286 20.092 ( 13.687 -3.417 0.466) 14.115 20.868 ( -25.082 8.825 1.981) 26.663 21.050 ( -21.708 0.508 -1.285) 21.752 21.532 ( -18.270 2.895 0.558) 18.506 21.682 ( -16.304 -3.570 -2.011) 16.811 26.247 ( 3.799 1.987 5.396) 6.892 26.346 ( 3.520 -1.929 5.484) 6.796 26.605 ( 3.311 1.447 -0.546) 3.654 26.726 ( 2.683 0.092 -0.000) 2.684 27.098 ( 9.660 -2.041 -2.002) 10.074 27.261 ( 10.501 -0.863 -0.876) 10.573 27.483 ( 8.642 5.444 -1.763) 10.365 27.746 ( 9.211 0.011 3.569) 9.879 27.960 ( 9.547 -2.607 -0.665) 9.919 28.097 ( 6.103 0.806 0.536) 6.180 28.207 ( 0.528 -1.472 -3.111) 3.482 28.448 ( -1.506 -7.697 -3.933) 8.774 29.253 ( 1.647 -1.694 -4.259) 4.871 29.322 ( 2.933 1.403 -1.647) 3.644 29.571 ( 1.217 0.922 1.207) 1.947 29.637 ( -2.385 -1.163 -1.382) 2.991 29.856 ( -0.768 3.051 6.998) 7.673 29.989 ( -1.619 -2.283 9.568) 9.969 30.457 ( 1.899 -0.367 -4.167) 4.594 30.654 ( 6.220 0.904 -0.525) 6.307 31.119 ( -0.107 -0.388 3.268) 3.293 31.354 ( 3.024 -2.085 7.962) 8.769 32.198 ( -17.913 15.619 -3.098) 23.967 32.646 ( -20.771 -8.218 -8.160) 23.782 ======================= Grid point 103 (41/72) ======================= q-point: ( 0.40 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.252 ( 25.747 -0.260 7.533) 26.827 3.608 ( 19.148 -9.578 5.061) 22.000 3.778 ( 17.513 -0.417 3.431) 17.851 3.937 ( 11.350 4.614 7.481) 14.355 4.255 ( -2.240 -8.906 -1.842) 9.366 4.517 ( -6.352 -9.411 4.907) 12.370 4.698 ( 0.184 4.237 2.297) 4.823 4.899 ( 8.646 -4.727 -11.805) 15.377 5.021 ( -10.341 0.950 -4.649) 11.378 5.123 ( 12.335 -6.672 -4.980) 14.882 5.366 ( 6.918 -8.415 -2.079) 11.090 5.541 ( -2.288 -3.968 -2.301) 5.125 5.877 ( 2.019 1.800 0.734) 2.803 5.946 ( 1.944 -1.222 -14.864) 15.040 5.997 ( -5.229 2.951 -8.944) 10.772 6.165 ( -4.734 -0.664 -6.512) 8.078 6.366 ( 7.425 8.498 0.970) 11.326 6.568 ( 5.316 -1.021 -3.226) 6.302 6.744 ( -2.151 2.037 7.542) 8.103 6.832 ( 3.368 5.773 2.895) 7.284 6.920 ( -1.410 6.931 6.320) 9.485 7.124 ( 11.977 2.356 8.850) 15.077 7.199 ( 8.980 3.050 6.269) 11.369 7.312 ( 3.764 2.744 6.311) 7.844 7.425 ( -1.733 -2.132 3.032) 4.092 7.544 ( 3.034 -2.550 1.922) 4.405 7.664 ( 1.214 3.075 6.834) 7.591 7.735 ( 7.189 6.929 1.959) 10.176 7.946 ( 4.511 5.179 -0.173) 6.870 8.002 ( 5.779 0.152 2.249) 6.203 8.193 ( 8.599 2.774 6.522) 11.144 8.447 ( 12.464 3.995 -0.861) 13.117 8.548 ( -1.955 3.360 -0.050) 3.888 8.605 ( 4.759 -1.498 -0.164) 4.992 8.838 ( 0.484 -1.252 6.754) 6.886 8.883 ( 0.403 0.103 0.768) 0.874 8.931 ( 1.194 -3.177 3.800) 5.095 9.029 ( 1.271 5.155 -0.808) 5.370 9.169 ( -6.347 -2.403 1.964) 7.065 9.282 ( 0.687 0.748 5.460) 5.553 9.422 ( -4.874 5.705 -3.406) 8.240 9.543 ( -0.279 -1.918 -6.939) 7.204 9.722 ( -8.145 0.400 -4.634) 9.379 9.918 ( -8.670 -3.909 0.727) 9.538 9.955 ( 3.651 -2.948 0.530) 4.722 10.120 ( -2.536 -0.103 -2.811) 3.787 10.214 ( 4.612 -5.136 -0.306) 6.910 10.354 ( 0.734 -2.510 -1.336) 2.937 10.564 ( -10.528 4.496 0.057) 11.448 10.759 ( 1.888 1.162 -7.455) 7.777 10.872 ( -6.226 -4.145 -8.613) 11.407 10.998 ( -14.524 -1.677 -0.336) 14.624 11.057 ( -8.271 -2.836 -1.718) 8.911 11.338 ( -1.149 3.955 2.196) 4.668 11.397 ( -1.264 1.367 0.514) 1.931 11.600 ( -1.034 -3.733 -11.441) 12.078 11.663 ( -0.812 3.622 -8.196) 8.997 11.785 ( 1.671 -0.282 6.409) 6.630 11.877 ( 1.064 -3.367 2.221) 4.171 12.164 ( -0.620 2.750 5.612) 6.280 12.207 ( 5.399 -4.844 -2.302) 7.610 12.326 ( -2.820 0.676 4.182) 5.089 12.430 ( -1.874 1.612 3.479) 4.268 12.497 ( 0.334 -1.211 3.816) 4.017 12.677 ( 1.572 -5.467 -0.926) 5.764 12.858 ( -7.752 2.352 -2.455) 8.465 12.929 ( -0.279 -3.931 1.886) 4.369 13.075 ( -10.167 -2.729 -5.963) 12.099 13.320 ( -4.629 3.157 -5.746) 8.025 13.518 ( -8.903 -3.007 -6.070) 11.187 13.628 ( -12.888 0.878 -5.168) 13.913 13.751 ( -9.681 -5.338 -5.359) 12.286 14.217 ( 3.153 6.674 3.452) 8.148 14.360 ( 0.378 0.258 1.056) 1.151 14.485 ( -4.695 0.471 3.939) 6.147 14.549 ( -1.564 -1.548 2.241) 3.141 15.139 ( 2.526 2.001 -1.540) 3.572 15.411 ( 0.319 0.720 3.639) 3.723 15.472 ( 7.706 3.765 -1.591) 8.723 15.721 ( 0.211 -4.900 0.585) 4.940 16.029 ( 3.300 2.177 4.986) 6.363 16.052 ( 3.289 1.592 4.965) 6.164 16.218 ( 2.234 4.494 2.883) 5.788 16.329 ( 0.690 -0.589 5.212) 5.291 16.609 ( 5.213 2.782 -5.264) 7.914 16.775 ( 3.114 0.602 -3.472) 4.703 16.881 ( 3.605 -4.302 -1.768) 5.885 17.248 ( -6.993 -15.547 -5.642) 17.956 19.173 ( 25.889 9.399 1.263) 27.571 19.482 ( 26.909 -4.807 -4.984) 27.786 20.280 ( 4.482 2.976 -0.010) 5.380 20.339 ( -9.262 5.773 1.696) 11.045 20.437 ( 13.378 -2.221 0.419) 13.567 20.589 ( -24.955 -1.384 -1.911) 25.067 21.139 ( -21.980 2.697 0.763) 22.158 21.310 ( -21.930 -4.696 -2.196) 22.535 26.305 ( 2.229 1.041 5.830) 6.327 26.389 ( 0.984 -0.357 7.291) 7.365 26.633 ( 0.346 -0.230 0.543) 0.683 26.736 ( -0.715 -0.685 3.274) 3.420 27.274 ( 7.729 0.876 -3.531) 8.542 27.446 ( 7.515 1.106 -0.438) 7.609 27.633 ( 7.448 2.550 -4.620) 9.128 27.873 ( 1.815 -4.085 -0.779) 4.538 28.060 ( 1.978 0.465 -2.611) 3.309 28.197 ( 0.327 -0.746 -0.772) 1.123 28.219 ( 4.511 -0.035 -2.409) 5.114 28.422 ( -0.667 -2.725 -4.148) 5.007 29.278 ( 0.845 -0.401 -0.584) 1.102 29.382 ( 2.998 2.508 0.305) 3.921 29.566 ( -1.137 -1.603 -1.346) 2.383 29.615 ( -0.735 -3.585 -0.664) 3.719 29.871 ( 2.279 2.869 9.459) 10.144 29.961 ( -1.403 -1.471 10.887) 11.076 30.479 ( 0.464 -0.675 -5.056) 5.122 30.753 ( 3.617 3.077 2.636) 5.431 31.128 ( 0.942 -0.448 -0.453) 1.137 31.432 ( 4.205 0.455 7.322) 8.456 31.950 ( -6.912 8.396 -5.508) 12.190 32.271 ( -17.435 -6.318 -7.414) 19.971 ======================= Grid point 104 (42/72) ======================= q-point: (-0.50 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.571 ( 0.000 -5.101 0.326) 5.112 3.812 ( 0.000 2.213 11.704) 11.911 3.935 ( 0.000 -7.324 -6.795) 9.990 4.133 ( 0.000 -2.077 6.546) 6.867 4.161 ( -0.000 -14.921 9.867) 17.889 4.477 ( 0.000 6.467 6.590) 9.233 4.692 ( -0.000 6.876 1.022) 6.952 4.723 ( 0.000 -0.010 0.710) 0.711 5.133 ( 0.000 -0.954 -10.312) 10.356 5.281 ( -0.000 -1.030 -7.737) 7.806 5.448 ( 0.000 -14.621 -1.507) 14.699 5.475 ( 0.000 -7.212 -6.893) 9.977 5.834 ( 0.000 2.452 -12.558) 12.795 5.902 ( -0.000 1.451 -6.191) 6.358 6.003 ( 0.000 -0.818 -10.033) 10.067 6.098 ( -0.000 -5.657 -8.322) 10.062 6.518 ( 0.000 -0.235 0.357) 0.428 6.530 ( -0.000 7.979 -0.809) 8.020 6.728 ( -0.000 -0.012 2.335) 2.335 6.765 ( 0.000 -3.843 1.085) 3.993 7.104 ( 0.000 7.007 2.872) 7.573 7.131 ( 0.000 7.817 12.400) 14.659 7.229 ( -0.000 -2.292 1.992) 3.036 7.387 ( 0.000 0.402 14.472) 14.477 7.471 ( 0.000 5.808 6.430) 8.665 7.518 ( 0.000 9.324 6.011) 11.094 7.670 ( -0.000 -3.007 4.961) 5.801 7.675 ( 0.000 -3.025 5.725) 6.475 8.050 ( 0.000 11.373 2.758) 11.702 8.113 ( 0.000 -5.489 0.254) 5.495 8.465 ( -0.000 6.229 4.078) 7.445 8.486 ( 0.000 6.614 1.308) 6.742 8.660 ( -0.000 4.541 1.904) 4.924 8.701 ( 0.000 1.031 0.066) 1.033 8.801 ( 0.000 6.252 4.159) 7.509 8.833 ( 0.000 0.908 3.207) 3.333 8.915 ( 0.000 -0.888 -2.382) 2.542 8.946 ( -0.000 -5.616 9.113) 10.704 9.214 ( 0.000 4.879 -1.064) 4.994 9.253 ( -0.000 5.973 -7.030) 9.225 9.425 ( 0.000 -1.022 0.766) 1.277 9.482 ( -0.000 4.632 -2.487) 5.258 9.669 ( 0.000 -6.801 -3.202) 7.517 9.787 ( 0.000 -5.274 2.258) 5.737 10.031 ( 0.000 -6.402 -1.944) 6.691 10.156 ( 0.000 2.180 0.167) 2.187 10.249 ( -0.000 0.449 -5.989) 6.006 10.314 ( 0.000 -2.556 1.783) 3.117 10.450 ( -0.000 -1.088 -3.272) 3.448 10.774 ( 0.000 1.680 1.823) 2.479 10.814 ( 0.000 -1.856 -3.245) 3.739 10.829 ( -0.000 -3.276 -4.457) 5.531 10.978 ( 0.000 -3.838 -14.237) 14.746 11.339 ( 0.000 -0.430 -5.803) 5.819 11.412 ( 0.000 3.028 5.916) 6.645 11.496 ( 0.000 4.172 -8.550) 9.513 11.716 ( 0.000 -3.343 1.189) 3.548 11.748 ( -0.000 1.097 -3.784) 3.940 11.886 ( 0.000 -5.356 6.129) 8.140 12.173 ( 0.000 -6.598 -3.199) 7.332 12.292 ( 0.000 1.168 2.550) 2.805 12.346 ( -0.000 -5.282 6.647) 8.490 12.367 ( 0.000 3.431 2.483) 4.235 12.537 ( 0.000 -1.536 1.806) 2.371 12.652 ( 0.000 3.335 -2.986) 4.476 12.752 ( 0.000 -0.447 3.181) 3.212 12.935 ( -0.000 -3.690 -4.213) 5.600 13.019 ( 0.000 -3.411 -0.716) 3.486 13.286 ( 0.000 4.412 -3.996) 5.953 13.329 ( 0.000 4.638 -2.355) 5.202 13.555 ( 0.000 -5.516 -9.105) 10.645 13.612 ( 0.000 -6.360 -10.917) 12.634 14.294 ( 0.000 4.666 8.225) 9.456 14.318 ( 0.000 4.882 5.111) 7.068 14.453 ( 0.000 -1.668 -1.405) 2.181 14.539 ( 0.000 -1.573 1.606) 2.248 15.166 ( 0.000 3.460 -2.089) 4.042 15.394 ( 0.000 4.445 5.313) 6.928 15.622 ( 0.000 -4.030 -5.556) 6.864 15.670 ( 0.000 -1.552 -1.411) 2.098 16.070 ( 0.000 0.898 7.315) 7.370 16.078 ( 0.000 3.851 6.533) 7.584 16.255 ( 0.000 2.069 3.876) 4.394 16.307 ( 0.000 1.074 6.751) 6.836 16.685 ( 0.000 2.527 -3.976) 4.711 16.755 ( 0.000 2.955 -1.489) 3.309 17.054 ( -0.000 -11.708 -5.977) 13.146 17.072 ( 0.000 -11.094 -5.251) 12.274 19.672 ( 0.000 8.675 0.647) 8.699 19.775 ( -0.000 10.931 4.603) 11.860 19.998 ( 0.000 -2.661 -5.670) 6.263 20.097 ( -0.000 -3.081 -1.730) 3.534 20.670 ( 0.000 1.495 -0.291) 1.523 20.739 ( -0.000 1.847 1.844) 2.610 20.854 ( 0.000 -4.781 -2.539) 5.413 20.877 ( -0.000 -4.447 -1.124) 4.586 26.329 ( 0.000 0.071 5.662) 5.662 26.395 ( 0.000 1.311 8.450) 8.551 26.635 ( 0.000 -1.559 0.328) 1.593 26.725 ( 0.000 -0.850 4.403) 4.485 27.357 ( 0.000 2.369 -4.564) 5.142 27.514 ( 0.000 5.414 0.873) 5.484 27.777 ( 0.000 -4.316 -7.673) 8.804 27.805 ( -0.000 -4.965 -4.398) 6.632 28.102 ( 0.000 0.402 0.587) 0.711 28.164 ( 0.000 1.674 0.217) 1.688 28.290 ( 0.000 -1.470 -4.361) 4.602 28.414 ( 0.000 0.648 -3.430) 3.491 29.286 ( 0.000 0.357 1.008) 1.069 29.416 ( 0.000 3.948 1.490) 4.220 29.558 ( 0.000 -4.331 -1.848) 4.709 29.597 ( -0.000 -4.091 -0.602) 4.135 29.917 ( 0.000 1.880 8.251) 8.462 29.931 ( 0.000 -0.080 12.724) 12.724 30.482 ( 0.000 -0.955 -5.635) 5.716 30.787 ( 0.000 3.945 4.633) 6.085 31.142 ( 0.000 0.117 -3.030) 3.032 31.475 ( 0.000 4.464 8.271) 9.399 31.936 ( 0.000 -2.732 -9.728) 10.104 32.043 ( -0.000 -0.945 -4.637) 4.732 ======================= Grid point 110 (43/72) ======================= q-point: ( 0.00 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.502 ( 0.000 -9.114 9.718) 13.323 2.502 ( 0.000 9.114 9.718) 13.323 2.764 ( 0.000 -29.282 6.907) 30.086 2.764 ( 0.000 29.282 6.907) 30.086 3.436 ( 0.000 -3.860 1.704) 4.219 3.436 ( 0.000 3.860 1.704) 4.219 3.953 ( 0.000 -13.133 2.903) 13.450 3.953 ( 0.000 13.133 2.903) 13.450 4.311 ( 0.000 -0.214 -8.100) 8.103 4.311 ( 0.000 0.214 -8.100) 8.103 5.119 ( 0.000 -9.756 -6.057) 11.483 5.119 ( 0.000 9.756 -6.057) 11.483 5.367 ( 0.000 -3.791 3.536) 5.184 5.367 ( 0.000 3.791 3.536) 5.184 5.631 ( 0.000 -7.575 -2.679) 8.035 5.631 ( 0.000 7.575 -2.679) 8.035 6.142 ( 0.000 -6.244 15.755) 16.948 6.142 ( 0.000 6.244 15.755) 16.948 6.379 ( 0.000 -3.353 1.871) 3.840 6.379 ( 0.000 3.353 1.871) 3.840 6.617 ( 0.000 -14.723 4.808) 15.489 6.617 ( 0.000 14.723 4.808) 15.489 6.845 ( 0.000 -0.946 5.606) 5.685 6.845 ( 0.000 0.946 5.606) 5.685 7.408 ( 0.000 -3.726 -0.090) 3.727 7.408 ( 0.000 3.726 -0.090) 3.727 7.788 ( 0.000 -10.584 -12.294) 16.222 7.788 ( 0.000 10.584 -12.294) 16.222 7.991 ( 0.000 -0.947 0.445) 1.047 7.991 ( 0.000 0.947 0.445) 1.047 8.298 ( 0.000 -9.601 -6.658) 11.684 8.298 ( 0.000 9.601 -6.658) 11.684 8.619 ( 0.000 -6.356 -9.627) 11.536 8.619 ( 0.000 6.356 -9.627) 11.536 9.205 ( 0.000 -1.600 -1.732) 2.358 9.205 ( 0.000 1.600 -1.732) 2.358 9.535 ( 0.000 -0.001 -1.243) 1.243 9.535 ( 0.000 0.001 -1.243) 1.243 9.649 ( 0.000 -3.473 4.678) 5.826 9.649 ( 0.000 3.473 4.678) 5.826 9.852 ( 0.000 -1.660 6.471) 6.681 9.852 ( 0.000 1.660 6.471) 6.681 10.058 ( 0.000 -0.683 2.310) 2.409 10.058 ( 0.000 0.683 2.310) 2.409 10.248 ( 0.000 -8.867 -0.826) 8.905 10.248 ( 0.000 8.867 -0.826) 8.905 10.484 ( 0.000 -4.832 3.429) 5.925 10.484 ( 0.000 4.832 3.429) 5.925 10.734 ( 0.000 -0.339 0.917) 0.978 10.734 ( 0.000 0.339 0.917) 0.978 11.032 ( 0.000 -4.613 2.921) 5.460 11.032 ( 0.000 4.613 2.921) 5.460 11.327 ( 0.000 -6.054 -4.996) 7.850 11.327 ( 0.000 6.054 -4.996) 7.850 11.480 ( 0.000 -0.316 -3.200) 3.216 11.480 ( 0.000 0.316 -3.200) 3.216 11.787 ( 0.000 -4.663 -2.293) 5.196 11.787 ( 0.000 4.663 -2.293) 5.196 12.048 ( 0.000 -3.006 3.558) 4.658 12.048 ( 0.000 3.006 3.558) 4.658 12.312 ( 0.000 -3.980 -3.018) 4.995 12.312 ( 0.000 3.980 -3.018) 4.995 12.668 ( 0.000 -1.169 0.341) 1.218 12.668 ( 0.000 1.169 0.341) 1.218 13.064 ( 0.000 -1.030 -0.802) 1.305 13.064 ( 0.000 1.030 -0.802) 1.305 13.296 ( 0.000 -3.454 7.583) 8.333 13.296 ( 0.000 3.454 7.583) 8.333 13.710 ( 0.000 -1.568 1.757) 2.355 13.710 ( 0.000 1.568 1.757) 2.355 14.166 ( 0.000 -6.780 -0.564) 6.804 14.166 ( 0.000 6.780 -0.564) 6.804 14.287 ( 0.000 -7.369 -1.554) 7.531 14.287 ( 0.000 7.369 -1.554) 7.531 14.629 ( 0.000 -3.026 -8.292) 8.827 14.629 ( 0.000 3.026 -8.292) 8.827 15.079 ( 0.000 -2.620 -4.990) 5.636 15.079 ( 0.000 2.620 -4.990) 5.636 15.500 ( 0.000 -2.228 -2.018) 3.006 15.500 ( 0.000 2.228 -2.018) 3.006 15.843 ( 0.000 -1.704 -8.940) 9.101 15.843 ( 0.000 1.704 -8.940) 9.101 16.063 ( 0.000 -1.797 -4.520) 4.864 16.063 ( 0.000 1.797 -4.520) 4.864 16.421 ( 0.000 -1.426 3.322) 3.615 16.421 ( 0.000 1.426 3.322) 3.615 16.962 ( 0.000 -8.659 15.447) 17.709 16.962 ( 0.000 8.659 15.447) 17.709 18.723 ( 0.000 -8.896 -11.887) 14.847 18.723 ( 0.000 8.896 -11.887) 14.847 19.749 ( 0.000 -1.887 6.617) 6.881 19.749 ( 0.000 1.887 6.617) 6.881 21.672 ( 0.000 -0.799 -1.133) 1.387 21.672 ( 0.000 0.799 -1.133) 1.387 22.021 ( 0.000 -0.579 -0.139) 0.595 22.021 ( 0.000 0.579 -0.139) 0.595 26.087 ( 0.000 -0.459 0.540) 0.708 26.087 ( 0.000 0.459 0.540) 0.708 26.197 ( 0.000 -5.431 -1.673) 5.683 26.197 ( 0.000 5.431 -1.673) 5.683 26.809 ( 0.000 -3.617 -3.675) 5.156 26.809 ( 0.000 3.617 -3.675) 5.156 27.222 ( 0.000 -0.094 2.116) 2.118 27.222 ( 0.000 0.094 2.116) 2.118 27.661 ( 0.000 -2.654 13.836) 14.088 27.661 ( 0.000 2.654 13.836) 14.088 28.224 ( 0.000 -5.071 2.602) 5.699 28.224 ( 0.000 5.071 2.602) 5.699 29.216 ( 0.000 -1.073 -8.369) 8.438 29.216 ( 0.000 1.073 -8.369) 8.438 29.709 ( 0.000 -3.018 4.012) 5.020 29.709 ( 0.000 3.018 4.012) 5.020 29.997 ( 0.000 -1.147 -1.245) 1.693 29.997 ( 0.000 1.147 -1.245) 1.693 30.357 ( 0.000 -0.045 -2.994) 2.994 30.357 ( 0.000 0.045 -2.994) 2.994 31.240 ( 0.000 -3.541 9.105) 9.769 31.240 ( 0.000 3.541 9.105) 9.769 33.371 ( 0.000 -3.875 -7.657) 8.582 33.371 ( 0.000 3.875 -7.657) 8.582 ======================= Grid point 112 (44/72) ======================= q-point: ( 0.10 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.645 ( 0.143 0.000 2.464) 2.468 2.742 ( 15.978 -0.000 7.155) 17.507 2.818 ( 17.904 -0.000 9.238) 20.147 2.900 ( 15.573 0.000 7.467) 17.271 3.438 ( 1.895 0.000 5.105) 5.445 3.617 ( 19.743 0.000 10.087) 22.171 4.109 ( 15.420 0.000 -4.248) 15.995 4.211 ( 16.577 -0.000 1.922) 16.688 4.331 ( 10.270 0.000 -14.679) 17.915 4.467 ( 16.361 0.000 -5.549) 17.276 5.052 ( -1.529 0.000 -3.400) 3.728 5.129 ( -0.335 -0.000 -0.715) 0.789 5.365 ( 3.754 0.000 0.329) 3.769 5.521 ( 7.983 0.000 7.581) 11.009 5.725 ( 10.401 0.000 -4.898) 11.497 5.773 ( 14.447 0.000 -3.591) 14.887 6.068 ( -3.659 0.000 12.449) 12.976 6.113 ( -5.499 0.000 9.054) 10.593 6.353 ( -1.469 0.000 1.364) 2.004 6.462 ( 6.382 0.000 6.053) 8.796 6.596 ( 2.567 0.000 4.140) 4.871 6.706 ( 6.019 -0.000 6.716) 9.018 6.908 ( 4.684 0.000 3.945) 6.124 6.933 ( 6.829 0.000 2.092) 7.142 7.329 ( -5.495 0.000 -1.678) 5.746 7.366 ( -3.212 0.000 4.471) 5.505 7.703 ( -2.053 -0.000 -7.912) 8.174 7.871 ( 3.121 0.000 -11.135) 11.564 8.038 ( 1.730 0.000 3.967) 4.328 8.091 ( 7.918 0.000 -0.062) 7.919 8.287 ( -1.294 0.000 -5.278) 5.435 8.308 ( 1.351 0.000 -5.418) 5.584 8.486 ( -2.985 0.000 -12.902) 13.243 8.741 ( 3.477 0.000 -6.246) 7.149 9.115 ( -8.044 0.000 -3.672) 8.842 9.168 ( -5.755 0.000 -1.960) 6.080 9.400 ( -12.461 0.000 -4.715) 13.324 9.492 ( -9.746 0.000 -1.417) 9.848 9.535 ( -5.553 0.000 3.169) 6.394 9.592 ( -7.492 0.000 2.617) 7.936 9.684 ( -12.761 0.000 6.394) 14.273 9.845 ( -20.397 0.000 7.944) 21.889 9.946 ( 3.652 0.000 8.034) 8.825 10.031 ( -5.408 0.000 4.655) 7.135 10.080 ( -3.958 -0.000 -1.938) 4.407 10.212 ( -0.710 0.000 -5.897) 5.939 10.333 ( -10.283 0.000 6.074) 11.943 10.551 ( 3.855 0.000 2.461) 4.574 10.752 ( -2.127 0.000 0.142) 2.132 10.842 ( 7.233 0.000 4.027) 8.278 11.012 ( 2.359 0.000 -1.255) 2.672 11.114 ( 6.284 0.000 0.159) 6.287 11.324 ( -1.712 -0.000 -7.949) 8.132 11.329 ( 1.437 0.000 -2.011) 2.471 11.524 ( 5.558 0.000 0.900) 5.630 11.644 ( 1.912 0.000 2.669) 3.283 11.740 ( 0.733 0.000 -7.269) 7.306 11.790 ( 2.197 0.000 -5.306) 5.743 12.021 ( -7.427 0.000 2.209) 7.749 12.102 ( 4.085 0.000 -2.800) 4.953 12.212 ( -6.733 0.000 1.008) 6.808 12.260 ( -3.088 0.000 2.964) 4.280 12.674 ( 4.840 0.000 -0.342) 4.853 12.773 ( 3.771 0.000 2.265) 4.399 12.921 ( -8.339 0.000 -1.976) 8.570 13.011 ( -7.112 0.000 5.153) 8.782 13.334 ( 1.894 -0.000 4.772) 5.134 13.355 ( 1.350 0.000 8.356) 8.464 13.595 ( -1.756 0.000 -7.246) 7.455 13.798 ( -0.550 0.000 4.489) 4.522 14.107 ( -3.919 0.000 -3.926) 5.547 14.132 ( -5.603 -0.000 -1.827) 5.894 14.203 ( -4.460 0.000 -3.952) 5.959 14.331 ( 0.556 0.000 0.272) 0.619 14.452 ( -5.916 0.000 -7.589) 9.622 14.744 ( 5.047 0.000 -2.057) 5.450 15.092 ( -0.332 0.000 -3.005) 3.023 15.177 ( 7.108 0.000 -1.434) 7.252 15.414 ( -0.501 0.000 -4.257) 4.286 15.567 ( 4.726 0.000 -2.651) 5.419 15.800 ( -1.919 0.000 -5.399) 5.729 15.910 ( 6.043 0.000 -6.326) 8.748 16.092 ( -4.109 0.000 -2.709) 4.922 16.300 ( 9.985 -0.000 -8.519) 13.126 16.310 ( 4.020 0.000 4.165) 5.788 16.447 ( 0.616 0.000 4.914) 4.952 16.811 ( -4.995 0.000 12.058) 13.051 17.076 ( 2.847 0.000 9.727) 10.135 18.655 ( -3.970 0.000 -11.054) 11.745 18.723 ( -1.121 0.000 -9.938) 10.001 19.743 ( 0.855 -0.000 5.332) 5.400 19.776 ( 2.300 0.000 5.504) 5.965 21.594 ( -7.707 0.000 -0.943) 7.764 21.619 ( -6.614 0.000 -0.562) 6.638 21.989 ( -3.489 0.000 -0.470) 3.520 22.005 ( -2.681 -0.000 -0.205) 2.689 26.112 ( 3.285 -0.000 1.619) 3.662 26.127 ( 4.084 0.000 2.239) 4.657 26.314 ( 10.081 0.000 -3.214) 10.581 26.331 ( 11.951 -0.000 -2.994) 12.321 26.831 ( 3.435 0.000 -2.441) 4.214 26.895 ( 7.273 0.000 -3.539) 8.089 27.236 ( 3.830 0.000 2.330) 4.483 27.348 ( 9.990 0.000 0.949) 10.035 27.636 ( 0.969 0.000 14.247) 14.280 27.763 ( 7.436 0.000 9.697) 12.220 28.206 ( -0.212 0.000 0.246) 0.325 28.274 ( 3.285 0.000 3.673) 4.928 29.209 ( -0.209 0.000 -9.038) 9.040 29.233 ( 1.318 0.000 -7.090) 7.212 29.649 ( -3.109 0.000 3.316) 4.546 29.734 ( -0.536 0.000 3.573) 3.613 29.931 ( -2.724 0.000 -0.077) 2.725 30.040 ( 0.650 0.000 1.202) 1.367 30.357 ( 1.341 0.000 -3.408) 3.663 30.413 ( 4.481 0.000 -2.856) 5.314 31.191 ( -2.776 0.000 8.427) 8.873 31.270 ( 1.080 0.000 9.153) 9.216 33.215 ( -15.000 0.000 -7.291) 16.679 33.226 ( -14.359 -0.000 -7.003) 15.976 ======================= Grid point 114 (45/72) ======================= q-point: ( 0.20 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.664 ( 5.459 0.000 1.247) 5.600 2.901 ( 6.162 -0.000 8.265) 10.309 3.190 ( 18.989 -0.000 12.054) 22.492 3.282 ( 15.459 0.000 11.223) 19.103 3.684 ( 25.007 0.000 -5.203) 25.543 4.017 ( 12.704 0.000 -4.166) 13.370 4.425 ( 15.399 0.000 -8.665) 17.670 4.501 ( 23.329 0.000 1.046) 23.353 4.727 ( 5.081 0.000 -2.994) 5.898 4.764 ( 21.795 0.000 -2.887) 21.986 5.131 ( 11.235 0.000 -4.751) 12.199 5.329 ( 17.182 0.000 2.698) 17.392 5.506 ( 16.142 0.000 5.800) 17.152 5.608 ( 0.697 0.000 8.831) 8.858 6.009 ( 10.541 -0.000 3.177) 11.009 6.012 ( 5.220 0.000 -0.350) 5.231 6.079 ( 13.719 0.000 -4.094) 14.317 6.170 ( 19.673 0.000 -0.996) 19.698 6.334 ( 0.515 0.000 1.461) 1.549 6.525 ( 1.605 0.000 0.526) 1.689 6.677 ( 2.854 0.000 1.843) 3.398 6.867 ( 10.674 0.000 8.637) 13.730 6.940 ( -6.190 0.000 -6.121) 8.706 7.056 ( 11.595 -0.000 4.648) 12.492 7.226 ( -5.221 0.000 2.446) 5.765 7.437 ( 10.392 0.000 13.186) 16.789 7.722 ( 3.095 -0.000 -0.427) 3.124 7.802 ( -10.603 0.000 3.534) 11.176 8.082 ( 4.367 -0.000 -9.712) 10.649 8.184 ( -2.790 0.000 -5.509) 6.175 8.302 ( 6.195 0.000 1.314) 6.332 8.311 ( -2.230 -0.000 -7.975) 8.281 8.524 ( 3.027 0.000 -3.816) 4.871 8.735 ( -4.941 0.000 -1.115) 5.065 8.904 ( -13.801 0.000 -4.244) 14.439 8.959 ( -14.111 0.000 -0.746) 14.130 9.068 ( -13.149 0.000 -0.373) 13.154 9.208 ( -15.070 0.000 1.242) 15.121 9.389 ( -12.574 0.000 7.475) 14.628 9.395 ( -13.452 0.000 6.089) 14.766 9.572 ( 3.945 0.000 -5.710) 6.940 9.583 ( -2.529 -0.000 -3.212) 4.088 9.914 ( -6.301 0.000 -0.362) 6.311 9.965 ( -6.705 -0.000 3.348) 7.495 10.060 ( 3.819 0.000 5.175) 6.432 10.083 ( -8.709 0.000 -0.095) 8.709 10.305 ( 1.846 0.000 4.138) 4.531 10.569 ( -3.533 0.000 1.153) 3.717 10.672 ( -3.735 0.000 -5.211) 6.411 10.922 ( 1.839 0.000 3.299) 3.777 11.104 ( 3.581 0.000 -1.840) 4.026 11.236 ( 4.010 0.000 -0.266) 4.019 11.293 ( -3.253 0.000 -6.169) 6.974 11.368 ( 2.501 0.000 -3.477) 4.283 11.506 ( -5.126 0.000 -1.420) 5.319 11.532 ( -5.924 0.000 0.582) 5.953 11.833 ( 0.525 0.000 -5.092) 5.119 11.846 ( 3.601 -0.000 -6.551) 7.476 11.886 ( -5.826 0.000 3.515) 6.804 11.994 ( -7.236 0.000 0.968) 7.300 12.227 ( 1.267 0.000 7.281) 7.390 12.235 ( 3.575 0.000 -0.236) 3.583 12.707 ( -6.324 0.000 -2.892) 6.954 12.743 ( -6.722 0.000 9.399) 11.555 12.819 ( -0.108 0.000 2.605) 2.607 12.855 ( -8.975 -0.000 0.305) 8.980 13.313 ( -5.314 0.000 -3.365) 6.290 13.327 ( -3.540 0.000 -2.559) 4.368 13.603 ( 0.778 0.000 -1.836) 1.994 13.752 ( -1.183 0.000 7.989) 8.076 13.931 ( -12.623 0.000 -3.586) 13.123 13.940 ( -12.222 -0.000 -7.148) 14.158 14.193 ( 2.805 0.000 -2.982) 4.094 14.342 ( 1.942 0.000 -2.771) 3.384 14.484 ( 4.979 0.000 -1.458) 5.188 14.864 ( 6.594 0.000 0.549) 6.617 15.004 ( -8.325 0.000 0.192) 8.327 15.271 ( 2.012 0.000 2.812) 3.458 15.523 ( 9.330 0.000 -4.547) 10.379 15.680 ( -4.967 0.000 -4.584) 6.759 15.768 ( 9.608 0.000 1.543) 9.732 15.844 ( -8.404 0.000 1.501) 8.537 16.129 ( 8.863 0.000 0.068) 8.863 16.232 ( -4.931 0.000 2.507) 5.532 16.508 ( 10.711 0.000 -1.728) 10.849 16.609 ( 3.956 -0.000 -1.029) 4.088 16.829 ( 7.882 0.000 -0.752) 7.918 17.077 ( -2.061 0.000 2.696) 3.393 18.641 ( 4.447 0.000 -7.630) 8.831 18.737 ( 4.426 0.000 -6.113) 7.547 19.805 ( 6.109 -0.000 2.699) 6.679 19.859 ( 6.808 0.000 3.242) 7.540 21.368 ( -15.921 0.000 -0.209) 15.922 21.405 ( -15.773 -0.000 0.504) 15.781 21.861 ( -10.333 0.000 -1.093) 10.391 21.887 ( -10.072 -0.000 -0.536) 10.086 26.195 ( 4.629 -0.000 3.158) 5.603 26.227 ( 5.608 0.000 4.553) 7.224 26.508 ( 8.752 0.000 -3.959) 9.606 26.583 ( 12.242 0.000 -3.038) 12.613 26.919 ( 5.610 0.000 -0.354) 5.621 27.065 ( 9.578 0.000 -1.698) 9.728 27.360 ( 8.928 0.000 0.371) 8.936 27.558 ( 10.311 0.000 3.673) 10.946 27.727 ( 9.194 0.000 5.838) 10.891 27.935 ( 9.728 0.000 4.368) 10.664 28.204 ( -0.395 0.000 -2.524) 2.554 28.336 ( 2.724 0.000 2.911) 3.986 29.212 ( 0.654 0.000 -8.468) 8.494 29.272 ( 2.818 0.000 -5.158) 5.877 29.600 ( -1.823 0.000 2.887) 3.415 29.691 ( -3.236 0.000 0.405) 3.262 29.901 ( -0.762 0.000 5.723) 5.773 30.018 ( -2.683 0.000 4.498) 5.238 30.400 ( 2.836 0.000 -4.018) 4.918 30.525 ( 6.946 0.000 -2.306) 7.319 31.142 ( -2.110 0.000 6.807) 7.126 31.290 ( 1.267 0.000 8.584) 8.677 32.849 ( -21.571 0.000 -6.845) 22.631 32.874 ( -20.711 -0.000 -6.104) 21.592 ======================= Grid point 116 (46/72) ======================= q-point: ( 0.30 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.903 ( 19.292 0.000 5.117) 19.959 3.064 ( 11.606 -0.000 8.702) 14.506 3.552 ( 18.299 -0.000 6.808) 19.525 3.601 ( 19.247 0.000 8.230) 20.932 4.156 ( 18.488 -0.000 -4.044) 18.926 4.209 ( 10.360 0.000 -5.170) 11.579 4.562 ( 3.753 0.000 -10.426) 11.081 4.758 ( 4.595 0.000 -4.489) 6.424 4.887 ( 11.645 0.000 -3.677) 12.212 5.035 ( -0.638 0.000 -0.020) 0.638 5.413 ( 14.242 -0.000 11.638) 18.393 5.419 ( -4.544 0.000 6.249) 7.727 5.676 ( 9.727 0.000 -10.043) 13.981 5.888 ( 13.208 0.000 1.845) 13.336 6.099 ( 2.155 0.000 -7.345) 7.655 6.196 ( 5.616 0.000 -11.723) 12.998 6.367 ( 8.729 0.000 2.273) 9.020 6.406 ( 4.755 0.000 -0.922) 4.843 6.671 ( 27.500 0.000 5.474) 28.039 6.672 ( 14.352 -0.000 -1.895) 14.476 6.835 ( 1.059 -0.000 -1.727) 2.026 6.869 ( 22.464 0.000 9.600) 24.429 7.102 ( -5.344 -0.000 6.860) 8.696 7.105 ( 10.168 0.000 9.388) 13.839 7.322 ( 15.656 -0.000 1.829) 15.762 7.519 ( -5.194 0.000 4.476) 6.857 7.699 ( 3.325 -0.000 6.583) 7.375 7.714 ( -5.572 0.000 0.638) 5.608 8.004 ( -11.253 0.000 -4.617) 12.163 8.093 ( -5.207 0.000 -3.292) 6.160 8.328 ( 5.300 0.000 -10.298) 11.582 8.332 ( -6.590 -0.000 4.826) 8.168 8.508 ( -1.093 0.000 5.195) 5.308 8.611 ( -2.429 -0.000 -0.383) 2.459 8.781 ( 3.724 0.000 0.735) 3.796 8.817 ( -0.724 0.000 2.850) 2.941 8.955 ( -1.724 0.000 3.550) 3.946 9.027 ( -5.508 0.000 1.218) 5.642 9.181 ( -5.653 0.000 6.507) 8.620 9.212 ( -3.737 0.000 2.093) 4.283 9.605 ( -4.179 0.000 -6.943) 8.103 9.653 ( 3.244 0.000 -3.327) 4.647 9.816 ( -2.807 0.000 -8.886) 9.319 9.838 ( -1.043 -0.000 -0.712) 1.262 9.937 ( -5.284 0.000 5.530) 7.649 10.087 ( -2.476 0.000 2.237) 3.337 10.320 ( -0.098 0.000 2.743) 2.745 10.397 ( -12.582 0.000 1.615) 12.685 10.665 ( 2.988 0.000 -10.110) 10.542 10.927 ( -2.612 0.000 -0.503) 2.660 10.969 ( -15.896 0.000 -0.852) 15.918 11.182 ( -7.915 0.000 0.475) 7.929 11.213 ( -5.969 0.000 -1.350) 6.120 11.388 ( -0.783 0.000 2.441) 2.563 11.447 ( -3.037 0.000 -9.514) 9.987 11.529 ( 4.373 0.000 -4.182) 6.051 11.757 ( -4.808 0.000 -8.995) 10.199 11.795 ( -0.979 -0.000 0.288) 1.021 11.894 ( -4.311 0.000 6.283) 7.620 11.962 ( 7.533 0.000 3.283) 8.217 12.290 ( 3.247 0.000 3.652) 4.887 12.317 ( 3.794 0.000 -1.602) 4.119 12.524 ( -10.526 0.000 0.569) 10.541 12.579 ( -8.179 0.000 7.204) 10.899 12.680 ( -8.214 0.000 1.140) 8.293 12.822 ( 0.568 0.000 1.923) 2.005 13.148 ( -9.687 -0.000 -4.793) 10.808 13.188 ( -10.418 0.000 -6.162) 12.104 13.539 ( -8.493 0.000 -6.263) 10.553 13.640 ( -12.194 0.000 -3.377) 12.653 13.798 ( -1.273 0.000 3.030) 3.286 13.814 ( -2.293 -0.000 0.902) 2.464 14.249 ( 2.245 0.000 -4.748) 5.252 14.355 ( -0.800 0.000 -2.033) 2.185 14.532 ( -0.625 0.000 0.913) 1.107 14.723 ( -14.818 0.000 4.514) 15.490 15.047 ( 7.752 0.000 -2.218) 8.063 15.295 ( 2.800 0.000 2.870) 4.010 15.580 ( -2.104 0.000 0.160) 2.110 15.612 ( 0.324 0.000 0.417) 0.528 15.884 ( 10.732 0.000 1.924) 10.903 15.976 ( 7.551 0.000 3.470) 8.310 16.219 ( 3.538 0.000 2.976) 4.623 16.260 ( 3.885 0.000 2.598) 4.674 16.621 ( 0.152 0.000 -5.428) 5.430 16.649 ( 4.258 -0.000 -3.147) 5.295 16.966 ( 3.454 0.000 -2.508) 4.269 17.035 ( -1.651 0.000 -1.628) 2.319 18.864 ( 18.587 0.000 -4.021) 19.017 18.945 ( 17.515 -0.000 -2.726) 17.726 19.991 ( 13.350 -0.000 0.348) 13.355 20.052 ( 13.403 0.000 1.233) 13.460 20.988 ( -23.283 0.000 0.499) 23.289 21.023 ( -23.485 -0.000 1.260) 23.518 21.589 ( -17.668 0.000 -1.531) 17.734 21.618 ( -17.638 0.000 -0.882) 17.660 26.272 ( 3.170 0.000 4.293) 5.337 26.323 ( 4.145 0.000 6.391) 7.617 26.620 ( 2.778 0.000 -1.954) 3.396 26.726 ( 2.404 0.000 1.738) 2.966 27.078 ( 10.968 0.000 -2.662) 11.286 27.251 ( 9.921 0.000 -0.598) 9.939 27.552 ( 9.853 0.000 -2.078) 10.070 27.730 ( 7.279 0.000 5.389) 9.057 27.941 ( 10.833 0.000 -4.248) 11.636 28.106 ( 7.201 -0.000 0.700) 7.235 28.187 ( -0.813 0.000 -3.246) 3.346 28.368 ( 0.775 0.000 0.910) 1.195 29.237 ( 1.854 0.000 -5.685) 5.979 29.337 ( 3.750 0.000 -2.712) 4.628 29.576 ( -1.004 0.000 1.886) 2.137 29.631 ( -2.863 0.000 -1.412) 3.193 29.896 ( 0.292 -0.000 10.637) 10.641 29.960 ( -2.647 0.000 7.124) 7.600 30.450 ( 1.984 0.000 -4.742) 5.141 30.667 ( 7.273 0.000 -0.322) 7.280 31.116 ( -0.513 0.000 3.525) 3.562 31.334 ( 3.627 0.000 7.371) 8.215 32.434 ( -20.694 0.000 -7.002) 21.847 32.479 ( -19.409 -0.000 -5.492) 20.171 ======================= Grid point 118 (47/72) ======================= q-point: ( 0.40 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.333 ( 15.087 -0.000 4.797) 15.831 3.362 ( 26.811 0.000 7.641) 27.879 3.860 ( 12.316 0.000 -0.487) 12.326 3.948 ( 10.117 0.000 7.071) 12.343 4.292 ( 6.606 -0.000 2.033) 6.912 4.324 ( -4.491 0.000 8.866) 9.938 4.779 ( 0.425 0.000 -4.029) 4.051 4.814 ( 14.013 0.000 -1.721) 14.118 5.011 ( 5.458 0.000 -9.010) 10.535 5.038 ( 1.824 0.000 -7.540) 7.757 5.309 ( -0.732 0.000 -0.573) 0.929 5.486 ( -5.536 0.000 4.286) 7.002 5.867 ( 7.356 0.000 -10.823) 13.086 5.959 ( -2.977 0.000 -6.464) 7.117 6.079 ( -3.171 0.000 -13.971) 14.326 6.104 ( -11.177 -0.000 -11.683) 16.168 6.466 ( 3.660 0.000 -1.716) 4.042 6.559 ( 8.881 -0.000 -1.879) 9.077 6.741 ( -9.427 0.000 7.598) 12.107 6.885 ( -2.038 0.000 4.004) 4.493 7.076 ( 9.662 -0.000 3.723) 10.354 7.096 ( 6.828 0.000 9.926) 12.048 7.225 ( 13.076 0.000 7.648) 15.148 7.303 ( 10.233 0.000 11.281) 15.231 7.417 ( -6.543 0.000 2.370) 6.959 7.513 ( -0.855 0.000 5.405) 5.473 7.728 ( 1.178 -0.000 1.164) 1.656 7.780 ( 9.647 0.000 -0.412) 9.655 7.989 ( 3.533 0.000 2.432) 4.289 8.063 ( 5.340 -0.000 -2.218) 5.782 8.238 ( 7.936 -0.000 10.565) 13.213 8.418 ( 13.183 0.000 7.010) 14.931 8.587 ( -1.669 0.000 -4.386) 4.692 8.637 ( 9.945 0.000 -3.240) 10.460 8.824 ( -1.615 -0.000 7.682) 7.850 8.846 ( 0.043 0.000 7.712) 7.712 8.918 ( -2.103 0.000 -2.144) 3.003 9.093 ( 10.983 0.000 1.766) 11.124 9.159 ( -6.102 0.000 1.929) 6.400 9.242 ( 8.161 -0.000 6.954) 10.722 9.495 ( -0.585 0.000 -7.400) 7.423 9.537 ( -9.845 -0.000 -6.376) 11.729 9.711 ( -7.769 0.000 -6.452) 10.099 9.870 ( -11.775 0.000 4.885) 12.748 9.935 ( 2.192 0.000 3.043) 3.750 10.074 ( 9.005 0.000 -8.770) 12.570 10.203 ( -2.721 -0.000 3.783) 4.660 10.321 ( -0.074 0.000 0.083) 0.111 10.634 ( -14.622 0.000 -0.450) 14.629 10.778 ( -8.641 -0.000 -0.010) 8.641 10.799 ( 6.269 0.000 -12.571) 14.047 10.985 ( -14.096 0.000 -3.480) 14.519 11.033 ( -9.286 0.000 -2.851) 9.714 11.389 ( -3.416 -0.000 -9.360) 9.964 11.397 ( 2.894 0.000 9.300) 9.740 11.561 ( -1.744 0.000 -11.261) 11.395 11.711 ( 0.080 0.000 -8.506) 8.506 11.802 ( 0.109 0.000 3.031) 3.033 11.834 ( -2.601 -0.000 2.912) 3.905 12.099 ( 1.765 0.000 3.428) 3.856 12.228 ( -3.375 0.000 -2.682) 4.311 12.327 ( -0.871 -0.000 5.943) 6.006 12.466 ( 3.179 -0.000 6.501) 7.237 12.476 ( -4.123 0.000 2.656) 4.904 12.614 ( 2.739 0.000 -1.637) 3.191 12.850 ( 1.487 0.000 -0.594) 1.601 12.969 ( -11.515 0.000 -4.411) 12.331 13.004 ( -4.594 0.000 -1.264) 4.765 13.406 ( -2.928 0.000 -5.174) 5.945 13.417 ( -8.934 -0.000 -4.587) 10.043 13.651 ( -13.531 0.000 -4.633) 14.302 13.695 ( -10.955 0.000 -3.600) 11.531 14.295 ( 3.187 0.000 0.411) 3.214 14.355 ( 1.315 0.000 2.668) 2.974 14.503 ( -7.113 0.000 5.010) 8.700 14.517 ( -0.221 -0.000 2.541) 2.551 15.169 ( 4.497 0.000 -4.429) 6.312 15.387 ( 5.086 0.000 1.367) 5.267 15.571 ( 0.316 0.000 -0.641) 0.715 15.633 ( 1.721 0.000 1.981) 2.624 16.053 ( 2.137 0.000 5.122) 5.550 16.068 ( 6.346 0.000 4.436) 7.743 16.283 ( -0.363 0.000 3.394) 3.413 16.301 ( 2.450 -0.000 5.506) 6.027 16.664 ( 4.808 0.000 -7.060) 8.542 16.733 ( 5.632 -0.000 -3.758) 6.771 16.955 ( -3.723 0.000 -3.183) 4.899 16.994 ( -3.404 0.000 -2.542) 4.248 19.318 ( 27.258 0.000 -1.780) 27.316 19.385 ( 27.072 -0.000 -0.569) 27.078 20.303 ( 16.477 -0.000 -1.469) 16.542 20.368 ( 17.794 0.000 -0.682) 17.808 20.494 ( -26.119 0.000 1.264) 26.150 20.531 ( -24.984 -0.000 1.683) 25.041 21.199 ( -22.325 0.000 -1.628) 22.384 21.229 ( -22.233 0.000 -0.978) 22.254 26.316 ( 1.462 0.000 4.994) 5.203 26.385 ( 2.309 0.000 7.763) 8.099 26.632 ( -0.740 0.000 0.128) 0.751 26.728 ( -0.996 0.000 4.553) 4.661 27.286 ( 9.293 0.000 -5.041) 10.572 27.446 ( 10.061 0.000 -1.225) 10.135 27.698 ( 4.748 0.000 -3.535) 5.919 27.793 ( -1.581 -0.000 -1.068) 1.908 28.076 ( 3.227 0.000 -3.585) 4.823 28.182 ( 0.897 0.000 0.156) 0.910 28.221 ( 4.325 0.000 -2.712) 5.105 28.393 ( 2.108 0.000 -1.445) 2.556 29.274 ( 1.668 0.000 -1.564) 2.286 29.411 ( 3.989 0.000 -0.343) 4.003 29.552 ( -1.440 0.000 0.326) 1.477 29.574 ( -3.327 -0.000 -1.283) 3.566 29.913 ( 1.320 -0.000 12.839) 12.907 29.934 ( -0.121 0.000 8.079) 8.080 30.471 ( 0.318 0.000 -5.663) 5.672 30.783 ( 4.258 0.000 4.097) 5.909 31.126 ( 1.519 0.000 -2.424) 2.861 31.432 ( 6.281 0.000 6.549) 9.075 32.081 ( -15.297 0.000 -7.842) 17.190 32.162 ( -12.682 -0.000 -4.660) 13.512 ======================= Grid point 120 (48/72) ======================= q-point: (-0.50 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.529 ( 0.000 0.000 -0.795) 0.795 3.810 ( 0.000 0.000 -0.459) 0.459 3.888 ( -0.000 0.000 15.292) 15.292 3.943 ( 0.000 -0.000 10.433) 10.433 4.166 ( -0.000 0.000 1.093) 1.093 4.562 ( 0.000 0.000 7.544) 7.544 4.720 ( 0.000 0.000 -1.308) 1.308 4.797 ( 0.000 0.000 -3.720) 3.720 5.146 ( 0.000 0.000 -0.684) 0.684 5.226 ( -0.000 -0.000 -6.419) 6.419 5.283 ( 0.000 -0.000 -2.099) 2.099 5.372 ( 0.000 0.000 -6.956) 6.956 5.872 ( 0.000 0.000 -15.281) 15.281 5.969 ( -0.000 0.000 -10.328) 10.328 5.990 ( 0.000 0.000 -12.359) 12.359 5.991 ( -0.000 -0.000 -12.191) 12.191 6.520 ( 0.000 0.000 -1.985) 1.985 6.606 ( 0.000 -0.000 3.702) 3.702 6.721 ( 0.000 0.000 -0.344) 0.344 6.735 ( -0.000 0.000 -0.225) 0.225 7.152 ( 0.000 0.000 1.222) 1.222 7.203 ( 0.000 0.000 4.843) 4.843 7.287 ( 0.000 0.000 14.709) 14.709 7.296 ( 0.000 -0.000 11.386) 11.386 7.552 ( 0.000 0.000 4.254) 4.254 7.616 ( -0.000 0.000 10.337) 10.337 7.648 ( 0.000 0.000 10.104) 10.104 7.688 ( -0.000 0.000 3.964) 3.964 8.025 ( 0.000 0.000 -0.761) 0.761 8.180 ( 0.000 0.000 3.370) 3.370 8.504 ( -0.000 0.000 -3.841) 3.841 8.598 ( 0.000 -0.000 5.940) 5.940 8.699 ( 0.000 0.000 -4.250) 4.250 8.762 ( 0.000 -0.000 10.123) 10.123 8.821 ( 0.000 -0.000 11.760) 11.760 8.858 ( 0.000 0.000 0.606) 0.606 8.864 ( -0.000 0.000 3.410) 3.410 8.900 ( 0.000 -0.000 0.169) 0.169 9.257 ( 0.000 0.000 1.964) 1.964 9.317 ( 0.000 0.000 -5.586) 5.586 9.424 ( 0.000 -0.000 -0.873) 0.873 9.576 ( -0.000 0.000 -4.810) 4.810 9.583 ( 0.000 0.000 -4.218) 4.218 9.681 ( -0.000 0.000 0.775) 0.775 9.961 ( 0.000 0.000 0.761) 0.761 10.180 ( 0.000 0.000 4.210) 4.210 10.257 ( 0.000 0.000 -5.025) 5.025 10.288 ( 0.000 0.000 0.802) 0.802 10.444 ( -0.000 0.000 -4.702) 4.702 10.743 ( 0.000 0.000 0.991) 0.991 10.794 ( -0.000 0.000 -4.479) 4.479 10.825 ( 0.000 0.000 0.577) 0.577 10.960 ( 0.000 0.000 -18.373) 18.373 11.331 ( 0.000 0.000 -8.649) 8.649 11.452 ( 0.000 0.000 8.210) 8.210 11.529 ( 0.000 0.000 -17.080) 17.080 11.718 ( 0.000 -0.000 7.216) 7.216 11.793 ( -0.000 -0.000 -9.006) 9.006 11.798 ( 0.000 0.000 5.996) 5.996 12.024 ( 0.000 0.000 -0.861) 0.861 12.307 ( 0.000 0.000 3.761) 3.761 12.334 ( 0.000 0.000 7.293) 7.293 12.426 ( 0.000 0.000 4.847) 4.847 12.484 ( 0.000 0.000 3.173) 3.173 12.693 ( 0.000 0.000 -6.710) 6.710 12.806 ( -0.000 0.000 -2.407) 2.407 12.852 ( 0.000 0.000 -2.125) 2.125 12.973 ( 0.000 0.000 1.854) 1.854 13.362 ( 0.000 -0.000 -7.740) 7.740 13.452 ( 0.000 -0.000 -3.700) 3.700 13.469 ( 0.000 0.000 -3.488) 3.488 13.470 ( -0.000 0.000 -6.423) 6.423 14.346 ( 0.000 0.000 7.200) 7.200 14.374 ( 0.000 0.000 4.059) 4.059 14.429 ( 0.000 0.000 -0.600) 0.600 14.517 ( 0.000 0.000 2.285) 2.285 15.212 ( 0.000 0.000 -4.519) 4.519 15.441 ( 0.000 0.000 3.881) 3.881 15.576 ( 0.000 0.000 -5.456) 5.456 15.654 ( 0.000 0.000 0.280) 0.280 16.078 ( 0.000 0.000 7.438) 7.438 16.120 ( 0.000 0.000 8.218) 8.218 16.280 ( 0.000 0.000 2.099) 2.099 16.312 ( 0.000 0.000 5.484) 5.484 16.749 ( 0.000 0.000 -5.553) 5.553 16.830 ( -0.000 0.000 -2.409) 2.409 16.885 ( 0.000 -0.000 -4.685) 4.685 16.924 ( 0.000 -0.000 -3.929) 3.929 19.778 ( 0.000 0.000 -1.090) 1.090 19.927 ( 0.000 0.000 4.194) 4.194 19.955 ( -0.000 0.000 -3.189) 3.189 20.023 ( -0.000 -0.000 0.525) 0.525 20.704 ( 0.000 -0.000 -1.927) 1.927 20.788 ( 0.000 0.000 -2.222) 2.222 20.790 ( -0.000 -0.000 0.921) 0.921 20.798 ( -0.000 0.000 -0.833) 0.833 26.330 ( 0.000 0.000 5.249) 5.249 26.408 ( 0.000 0.000 8.502) 8.502 26.620 ( 0.000 0.000 0.516) 0.516 26.715 ( 0.000 0.000 5.117) 5.117 27.386 ( 0.000 0.000 -5.974) 5.974 27.584 ( 0.000 0.000 0.666) 0.666 27.729 ( 0.000 0.000 -7.207) 7.207 27.738 ( 0.000 -0.000 -4.093) 4.093 28.106 ( 0.000 0.000 0.520) 0.520 28.183 ( 0.000 0.000 0.988) 0.988 28.274 ( 0.000 0.000 -4.523) 4.523 28.420 ( 0.000 0.000 -2.779) 2.779 29.291 ( 0.000 0.000 0.691) 0.691 29.477 ( 0.000 0.000 1.523) 1.523 29.514 ( 0.000 0.000 -1.496) 1.496 29.535 ( 0.000 0.000 -0.557) 0.557 29.930 ( 0.000 0.000 13.176) 13.176 29.937 ( 0.000 0.000 8.029) 8.029 30.472 ( 0.000 0.000 -6.227) 6.227 30.823 ( 0.000 0.000 6.982) 6.982 31.149 ( 0.000 0.000 -6.290) 6.290 31.519 ( 0.000 0.000 7.855) 7.855 31.907 ( 0.000 0.000 -9.844) 9.844 32.032 ( 0.000 0.000 -3.954) 3.954 ======================= Grid point 154 (49/72) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.752 ( 0.000 0.000 36.913) 36.913 1.968 ( 0.000 0.000 38.623) 38.623 2.448 ( 0.000 0.000 -22.832) 22.832 2.664 ( 0.000 0.000 -24.195) 24.195 3.525 ( 0.000 0.000 2.851) 2.851 3.546 ( 0.000 0.000 21.562) 21.562 3.618 ( 0.000 0.000 36.568) 36.568 4.464 ( 0.000 0.000 0.202) 0.202 4.504 ( 0.000 0.000 -3.021) 3.021 4.639 ( 0.000 0.000 -28.740) 28.740 5.069 ( 0.000 0.000 -0.917) 0.917 5.132 ( 0.000 0.000 14.624) 14.624 5.143 ( 0.000 0.000 -8.191) 8.191 5.494 ( 0.000 0.000 -19.323) 19.323 5.710 ( 0.000 0.000 0.899) 0.899 5.795 ( 0.000 0.000 -6.480) 6.480 5.843 ( 0.000 0.000 2.097) 2.097 5.888 ( 0.000 0.000 -1.931) 1.931 6.095 ( 0.000 0.000 0.434) 0.434 6.230 ( 0.000 0.000 -12.843) 12.843 6.670 ( 0.000 0.000 8.465) 8.465 6.834 ( 0.000 0.000 -5.930) 5.930 7.059 ( 0.000 0.000 3.879) 3.879 7.151 ( 0.000 0.000 -1.356) 1.356 7.359 ( 0.000 0.000 6.945) 6.945 7.403 ( 0.000 0.000 3.997) 3.997 7.942 ( 0.000 0.000 4.163) 4.163 7.986 ( 0.000 0.000 -1.259) 1.259 8.159 ( 0.000 0.000 4.967) 4.967 8.275 ( 0.000 0.000 4.660) 4.660 8.306 ( 0.000 0.000 -7.568) 7.568 8.378 ( 0.000 0.000 -4.514) 4.514 8.896 ( 0.000 0.000 1.848) 1.848 8.922 ( 0.000 0.000 -0.253) 0.253 9.029 ( 0.000 0.000 5.986) 5.986 9.158 ( 0.000 0.000 -3.820) 3.820 9.216 ( 0.000 0.000 1.517) 1.517 9.283 ( 0.000 0.000 -4.135) 4.135 9.574 ( 0.000 0.000 0.115) 0.115 9.619 ( 0.000 0.000 -4.161) 4.161 9.766 ( 0.000 0.000 7.846) 7.846 9.834 ( 0.000 0.000 1.305) 1.305 9.912 ( 0.000 0.000 -0.982) 0.982 9.922 ( 0.000 0.000 3.432) 3.432 9.950 ( 0.000 0.000 -5.340) 5.340 10.082 ( 0.000 0.000 -11.024) 11.024 10.395 ( 0.000 0.000 14.522) 14.522 10.594 ( 0.000 0.000 -2.638) 2.638 10.795 ( 0.000 0.000 1.854) 1.854 10.931 ( 0.000 0.000 -8.198) 8.198 11.064 ( 0.000 0.000 5.406) 5.406 11.199 ( 0.000 0.000 -7.198) 7.198 11.398 ( 0.000 0.000 10.528) 10.528 11.629 ( 0.000 0.000 2.481) 2.481 11.639 ( 0.000 0.000 -1.055) 1.055 11.724 ( 0.000 0.000 -14.798) 14.798 11.869 ( 0.000 0.000 5.192) 5.192 11.894 ( 0.000 0.000 5.733) 5.733 12.042 ( 0.000 0.000 -4.126) 4.126 12.162 ( 0.000 0.000 -17.105) 17.105 12.539 ( 0.000 0.000 18.032) 18.032 12.636 ( 0.000 0.000 11.921) 11.921 12.739 ( 0.000 0.000 8.688) 8.688 12.832 ( 0.000 0.000 -0.196) 0.196 12.941 ( 0.000 0.000 -9.036) 9.036 12.997 ( 0.000 0.000 -16.319) 16.319 13.207 ( 0.000 0.000 4.416) 4.416 13.328 ( 0.000 0.000 -5.081) 5.081 13.624 ( 0.000 0.000 5.073) 5.073 13.684 ( 0.000 0.000 1.034) 1.034 13.968 ( 0.000 0.000 -0.588) 0.588 14.033 ( 0.000 0.000 -7.079) 7.079 14.121 ( 0.000 0.000 15.633) 15.633 14.401 ( 0.000 0.000 4.525) 4.525 14.446 ( 0.000 0.000 -12.106) 12.106 14.492 ( 0.000 0.000 -4.084) 4.084 15.003 ( 0.000 0.000 -0.173) 0.173 15.021 ( 0.000 0.000 -1.110) 1.110 15.287 ( 0.000 0.000 2.614) 2.614 15.356 ( 0.000 0.000 -3.754) 3.754 15.531 ( 0.000 0.000 -0.798) 0.798 15.609 ( 0.000 0.000 -6.869) 6.869 15.684 ( 0.000 0.000 1.786) 1.786 15.700 ( 0.000 0.000 0.407) 0.407 16.527 ( 0.000 0.000 6.714) 6.714 16.660 ( 0.000 0.000 -5.884) 5.884 16.842 ( 0.000 0.000 3.629) 3.629 16.906 ( 0.000 0.000 -2.125) 2.125 18.868 ( 0.000 0.000 1.061) 1.061 18.946 ( 0.000 0.000 -6.236) 6.236 19.980 ( 0.000 0.000 7.180) 7.180 20.054 ( 0.000 0.000 0.762) 0.762 21.443 ( 0.000 0.000 0.865) 0.865 21.461 ( 0.000 0.000 -0.790) 0.790 22.067 ( 0.000 0.000 0.553) 0.553 22.083 ( 0.000 0.000 -0.825) 0.825 26.057 ( 0.000 0.000 8.738) 8.738 26.104 ( 0.000 0.000 0.296) 0.296 26.109 ( 0.000 0.000 -0.207) 0.207 26.255 ( 0.000 0.000 -8.839) 8.839 26.648 ( 0.000 0.000 6.553) 6.553 26.803 ( 0.000 0.000 -7.317) 7.317 27.235 ( 0.000 0.000 0.722) 0.722 27.242 ( 0.000 0.000 -0.055) 0.055 27.895 ( 0.000 0.000 2.179) 2.179 27.949 ( 0.000 0.000 -2.743) 2.743 28.057 ( 0.000 0.000 23.393) 23.393 28.555 ( 0.000 0.000 -20.125) 20.125 29.355 ( 0.000 0.000 1.478) 1.478 29.355 ( 0.000 0.000 2.029) 2.029 29.359 ( 0.000 0.000 -1.220) 1.220 29.366 ( 0.000 0.000 -1.251) 1.251 29.981 ( 0.000 0.000 3.710) 3.710 30.098 ( 0.000 0.000 -6.209) 6.209 30.310 ( 0.000 0.000 1.379) 1.379 30.345 ( 0.000 0.000 -1.637) 1.637 31.307 ( 0.000 0.000 6.941) 6.941 31.458 ( 0.000 0.000 -6.448) 6.448 33.211 ( 0.000 0.000 9.664) 9.664 33.419 ( 0.000 0.000 -8.916) 8.916 ======================= Grid point 155 (50/72) ======================= q-point: ( 0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.112 ( 33.373 0.000 33.102) 47.005 2.148 ( 17.799 0.000 34.279) 38.625 2.772 ( 10.865 0.000 -21.513) 24.102 2.781 ( 31.276 0.000 -24.575) 39.776 3.462 ( 7.854 0.000 41.843) 42.574 3.883 ( 27.494 0.000 -4.477) 27.857 4.158 ( 42.150 0.000 17.602) 45.678 4.508 ( 4.108 0.000 -0.215) 4.114 4.538 ( 3.458 0.000 -2.654) 4.360 4.810 ( 17.978 0.000 -26.670) 32.164 5.004 ( -5.775 0.000 -1.341) 5.929 5.083 ( -5.723 0.000 -8.772) 10.474 5.283 ( 13.728 0.000 14.002) 19.609 5.593 ( 5.662 0.000 -13.182) 14.347 5.718 ( 2.371 0.000 -0.339) 2.395 5.809 ( 2.018 0.000 -8.052) 8.301 5.896 ( 4.669 0.000 1.836) 5.017 5.927 ( 3.875 0.000 -1.002) 4.002 6.130 ( 6.289 0.000 1.354) 6.433 6.273 ( 5.199 0.000 -12.233) 13.292 6.609 ( -5.736 0.000 8.470) 10.229 6.775 ( -5.659 0.000 -5.845) 8.135 7.064 ( 1.082 0.000 5.314) 5.423 7.188 ( 3.636 0.000 -2.756) 4.562 7.252 ( -9.131 0.000 7.043) 11.532 7.329 ( -7.532 0.000 1.187) 7.625 7.830 ( -10.711 0.000 7.851) 13.280 7.967 ( -4.909 0.000 -2.883) 5.693 8.147 ( -0.640 0.000 8.916) 8.939 8.242 ( -1.424 0.000 3.499) 3.778 8.346 ( 2.079 0.000 -8.588) 8.836 8.355 ( -1.640 0.000 -6.103) 6.320 8.801 ( -6.653 0.000 3.965) 7.745 8.815 ( -14.171 0.000 4.895) 14.993 8.899 ( -3.674 0.000 -4.064) 5.479 8.934 ( -17.562 0.000 -4.721) 18.186 9.245 ( 1.064 0.000 3.445) 3.605 9.325 ( 2.530 0.000 -4.066) 4.789 9.503 ( -4.352 0.000 7.085) 8.315 9.661 ( -4.470 0.000 8.981) 10.032 9.707 ( 0.922 0.000 -10.845) 10.884 9.820 ( -7.305 0.000 -2.755) 7.808 9.970 ( 7.104 0.000 2.887) 7.668 10.063 ( 8.841 0.000 2.861) 9.292 10.139 ( 4.747 0.000 -9.856) 10.940 10.145 ( 13.611 0.000 -5.059) 14.521 10.455 ( 7.413 0.000 11.682) 13.836 10.573 ( -2.196 0.000 4.221) 4.758 10.771 ( -2.935 0.000 1.945) 3.521 10.885 ( -5.276 0.000 -6.783) 8.593 10.953 ( -14.993 0.000 0.213) 14.995 11.025 ( -7.830 0.000 -3.644) 8.637 11.379 ( -3.237 0.000 6.551) 7.307 11.505 ( -8.822 0.000 -2.657) 9.213 11.650 ( 0.600 0.000 2.155) 2.237 11.665 ( -16.031 0.000 12.197) 20.143 11.752 ( 0.334 0.000 -8.015) 8.022 11.876 ( -4.365 0.000 -2.415) 4.988 12.041 ( -0.513 0.000 0.036) 0.515 12.188 ( -4.531 0.000 -12.074) 12.896 12.410 ( -10.972 0.000 7.836) 13.483 12.520 ( -2.787 0.000 17.863) 18.079 12.540 ( -1.246 0.000 -4.472) 4.642 12.611 ( -1.959 0.000 12.997) 13.143 12.863 ( -6.773 0.000 -11.264) 13.143 12.963 ( -2.902 0.000 -16.857) 17.105 13.378 ( 0.454 0.000 9.274) 9.285 13.438 ( -12.595 0.000 7.994) 14.917 13.576 ( 6.799 0.000 -8.565) 10.935 13.611 ( -11.219 0.000 -6.461) 12.947 14.030 ( 6.919 0.000 4.136) 8.061 14.138 ( 5.423 0.000 -5.719) 7.881 14.380 ( 17.632 0.000 14.887) 23.076 14.403 ( 1.566 0.000 4.918) 5.162 14.510 ( 1.565 0.000 -4.913) 5.157 14.682 ( 1.380 0.000 -10.252) 10.345 15.005 ( 7.207 0.000 2.603) 7.663 15.151 ( 26.163 0.000 -11.436) 28.553 15.296 ( 0.941 0.000 4.876) 4.966 15.412 ( 3.272 0.000 -5.689) 6.563 15.682 ( 11.536 0.000 -0.982) 11.577 15.693 ( 2.273 0.000 2.765) 3.580 15.742 ( 3.477 0.000 -1.380) 3.741 15.754 ( 13.262 0.000 -6.442) 14.744 16.553 ( 4.684 0.000 7.726) 9.035 16.687 ( -14.104 0.000 4.816) 14.904 16.749 ( 9.079 0.000 -11.375) 14.554 16.775 ( -12.040 0.000 -3.072) 12.426 18.817 ( -4.444 0.000 2.746) 5.224 18.921 ( -3.153 0.000 -6.855) 7.545 19.939 ( -2.580 0.000 6.806) 7.278 20.018 ( -2.646 0.000 -0.188) 2.653 21.364 ( -7.997 0.000 2.366) 8.340 21.418 ( -5.868 0.000 -2.435) 6.354 22.000 ( -6.277 0.000 1.727) 6.510 22.040 ( -4.645 0.000 -1.842) 4.997 26.119 ( 5.966 0.000 8.876) 10.695 26.199 ( 8.676 0.000 1.326) 8.776 26.243 ( 11.802 0.000 -3.049) 12.189 26.309 ( 5.185 0.000 -7.563) 9.169 26.716 ( 6.985 0.000 4.932) 8.550 26.858 ( 5.584 0.000 -7.232) 9.137 27.270 ( 3.956 0.000 4.036) 5.651 27.346 ( 8.494 0.000 -3.119) 9.049 27.926 ( 3.084 0.000 2.480) 3.957 27.986 ( 3.678 0.000 -2.993) 4.742 28.082 ( 2.613 0.000 21.515) 21.673 28.543 ( -1.482 0.000 -19.053) 19.111 29.342 ( -0.821 0.000 0.419) 0.922 29.348 ( -0.352 0.000 2.539) 2.563 29.375 ( 1.676 0.000 0.525) 1.756 29.397 ( 2.500 0.000 -4.690) 5.315 29.969 ( -1.066 0.000 5.220) 5.328 30.116 ( 1.857 0.000 -7.226) 7.461 30.314 ( 0.733 0.000 3.458) 3.534 30.392 ( 4.155 0.000 -3.815) 5.641 31.291 ( -1.463 0.000 7.469) 7.611 31.452 ( -0.502 0.000 -6.867) 6.885 32.968 ( -22.140 0.000 17.234) 28.057 33.282 ( -13.849 0.000 -12.109) 18.396 ======================= Grid point 156 (51/72) ======================= q-point: ( 0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.595 ( 27.012 0.000 25.418) 37.090 2.815 ( 34.698 0.000 31.222) 46.678 3.056 ( 17.902 0.000 -15.240) 23.510 3.456 ( 33.921 0.000 -25.827) 42.634 3.846 ( 32.054 0.000 36.691) 48.720 4.431 ( 26.161 0.000 -13.719) 29.540 4.557 ( 0.014 0.000 2.921) 2.921 4.662 ( 9.013 0.000 -4.691) 10.161 4.893 ( -5.415 0.000 -2.871) 6.129 4.980 ( -2.097 0.000 -10.224) 10.437 5.007 ( 36.702 0.000 9.056) 37.803 5.279 ( 23.418 0.000 -10.333) 25.596 5.518 ( 12.446 0.000 0.641) 12.462 5.589 ( -3.071 0.000 -5.419) 6.228 5.855 ( 11.942 0.000 0.953) 11.980 5.951 ( 16.148 0.000 -5.869) 17.181 5.957 ( -0.004 0.000 3.614) 3.614 6.031 ( 5.646 0.000 -2.003) 5.991 6.370 ( 16.207 0.000 1.802) 16.307 6.488 ( 16.614 0.000 -7.563) 18.254 6.492 ( -4.695 0.000 8.427) 9.646 6.658 ( -4.806 0.000 -5.320) 7.170 7.065 ( -9.360 0.000 6.656) 11.485 7.143 ( 8.516 0.000 5.480) 10.126 7.166 ( -7.755 0.000 -1.722) 7.944 7.295 ( 8.316 0.000 -5.453) 9.945 7.607 ( -8.424 0.000 10.687) 13.608 7.806 ( -9.058 0.000 -4.642) 10.178 8.115 ( -3.682 0.000 11.599) 12.170 8.176 ( -8.553 0.000 6.982) 11.041 8.325 ( -5.141 0.000 -7.883) 9.411 8.343 ( -2.163 0.000 -4.150) 4.680 8.572 ( -11.368 0.000 1.293) 11.442 8.668 ( -6.989 0.000 7.150) 9.998 8.689 ( -1.439 0.000 -7.411) 7.550 8.823 ( -3.509 0.000 -5.087) 6.180 9.210 ( -3.046 0.000 6.275) 6.975 9.328 ( -3.554 0.000 -5.198) 6.297 9.445 ( -0.057 0.000 10.957) 10.957 9.621 ( -4.579 0.000 0.997) 4.686 9.651 ( -5.283 0.000 -1.527) 5.499 9.707 ( -1.195 0.000 -10.499) 10.567 10.017 ( -11.358 0.000 5.073) 12.439 10.097 ( 2.530 0.000 3.090) 3.993 10.099 ( -19.590 0.000 -1.256) 19.630 10.229 ( 4.015 0.000 -7.613) 8.607 10.479 ( -6.337 0.000 10.324) 12.114 10.601 ( 0.521 0.000 0.602) 0.796 10.644 ( -11.060 0.000 0.197) 11.061 10.727 ( -9.235 0.000 -7.113) 11.657 10.888 ( 14.302 0.000 1.627) 14.394 11.057 ( 10.428 0.000 -9.490) 14.100 11.235 ( -10.546 0.000 5.153) 11.738 11.354 ( -7.242 0.000 -5.749) 9.246 11.457 ( -2.658 0.000 11.584) 11.885 11.663 ( -0.686 0.000 2.942) 3.021 11.708 ( -11.142 0.000 -8.520) 14.027 11.714 ( -3.579 0.000 -0.846) 3.677 12.002 ( 1.028 0.000 6.181) 6.266 12.152 ( 1.771 0.000 -4.214) 4.571 12.418 ( -7.110 0.000 13.232) 15.022 12.463 ( 8.335 0.000 5.401) 9.932 12.569 ( -3.127 0.000 12.082) 12.481 12.657 ( 9.140 0.000 -9.902) 13.476 12.722 ( -7.655 0.000 -8.923) 11.756 12.901 ( -3.892 0.000 -13.165) 13.728 13.195 ( -11.296 0.000 6.547) 13.056 13.276 ( -8.455 0.000 10.794) 13.711 13.378 ( -11.286 0.000 -8.633) 14.209 13.550 ( -7.447 0.000 -13.255) 15.204 14.071 ( -4.687 0.000 3.785) 6.025 14.160 ( -3.089 0.000 -4.180) 5.198 14.471 ( -3.201 0.000 6.044) 6.839 14.484 ( 4.841 0.000 3.713) 6.101 14.560 ( 3.308 0.000 -3.027) 4.484 14.584 ( -6.207 0.000 -4.006) 7.387 15.278 ( -4.122 0.000 6.451) 7.656 15.369 ( 21.557 0.000 13.414) 25.389 15.408 ( -4.394 0.000 -5.615) 7.130 15.644 ( 19.317 0.000 -7.424) 20.694 15.732 ( 1.532 0.000 5.095) 5.321 15.860 ( 6.234 0.000 2.314) 6.649 15.864 ( 9.101 0.000 -6.422) 11.138 16.010 ( 10.174 0.000 -8.195) 13.064 16.436 ( -8.039 0.000 6.682) 10.453 16.563 ( -6.357 0.000 -4.487) 7.781 16.752 ( 14.890 0.000 7.029) 16.466 17.041 ( 20.789 0.000 -20.733) 29.360 18.737 ( -2.667 0.000 2.714) 3.805 18.835 ( -4.180 0.000 -6.035) 7.341 19.941 ( 3.736 0.000 5.139) 6.354 20.014 ( 3.468 0.000 -1.284) 3.698 21.121 ( -17.426 0.000 3.943) 17.866 21.213 ( -15.384 0.000 -4.244) 15.959 21.837 ( -10.769 0.000 3.237) 11.245 21.909 ( -9.108 0.000 -3.128) 9.630 26.257 ( 7.555 0.000 9.219) 11.919 26.385 ( 9.402 0.000 3.357) 9.983 26.430 ( 6.724 0.000 -4.958) 8.354 26.472 ( 10.727 0.000 -4.808) 11.755 26.904 ( 11.955 0.000 1.311) 12.027 27.009 ( 9.792 0.000 -6.768) 11.903 27.349 ( 3.604 0.000 8.614) 9.338 27.516 ( 8.181 0.000 -6.114) 10.213 28.004 ( 4.755 0.000 2.988) 5.616 28.077 ( 5.203 0.000 -3.521) 6.282 28.152 ( 4.126 0.000 15.512) 16.052 28.488 ( -4.233 0.000 -14.948) 15.536 29.333 ( 0.027 0.000 2.241) 2.241 29.344 ( 0.156 0.000 3.701) 3.705 29.416 ( 2.398 0.000 -2.294) 3.318 29.459 ( 3.658 0.000 -8.952) 9.671 29.953 ( -0.153 0.000 9.295) 9.296 30.168 ( 3.524 0.000 -9.189) 9.842 30.333 ( 0.976 0.000 6.820) 6.889 30.479 ( 4.259 0.000 -6.679) 7.922 31.267 ( -0.564 0.000 8.305) 8.324 31.447 ( 0.347 0.000 -7.672) 7.680 32.487 ( -25.532 0.000 24.559) 35.426 32.930 ( -21.460 0.000 -16.472) 27.053 ======================= Grid point 157 (52/72) ======================= q-point: ( 0.30 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.119 ( 25.799 0.000 16.675) 30.719 3.380 ( 25.116 0.000 29.533) 38.768 3.424 ( 19.569 0.000 -9.625) 21.808 3.976 ( 18.997 0.000 -23.268) 30.038 4.516 ( 28.652 0.000 15.219) 32.443 4.540 ( 0.112 0.000 6.787) 6.788 4.767 ( -1.073 0.000 -11.029) 11.082 4.829 ( 12.757 0.000 -12.088) 17.574 4.896 ( 8.992 0.000 0.850) 9.032 5.052 ( 8.295 0.000 -11.204) 13.941 5.141 ( -7.527 0.000 11.601) 13.829 5.422 ( -3.978 0.000 -10.733) 11.446 5.738 ( 16.006 0.000 3.262) 16.335 5.859 ( 11.830 0.000 -6.699) 13.595 5.868 ( -7.665 0.000 8.990) 11.814 6.076 ( -1.606 0.000 -8.896) 9.040 6.237 ( 24.013 0.000 9.295) 25.749 6.413 ( 25.099 0.000 -6.590) 25.950 6.468 ( 0.766 0.000 9.245) 9.277 6.645 ( 2.712 0.000 -6.008) 6.592 6.724 ( 20.315 0.000 1.085) 20.344 6.809 ( 18.845 0.000 -6.074) 19.799 6.950 ( -0.027 0.000 8.964) 8.964 7.082 ( -0.051 0.000 -3.184) 3.184 7.334 ( 9.402 0.000 5.397) 10.841 7.462 ( -2.416 0.000 -5.571) 6.073 7.602 ( 8.575 0.000 9.187) 12.567 7.813 ( 13.626 0.000 5.475) 14.685 7.963 ( -4.416 0.000 2.044) 4.866 7.982 ( -10.051 0.000 10.199) 14.320 8.153 ( -11.841 0.000 -5.914) 13.236 8.194 ( -3.778 0.000 -8.418) 9.227 8.520 ( -9.003 0.000 11.132) 14.317 8.615 ( 12.672 0.000 8.157) 15.070 8.766 ( -2.962 0.000 -7.804) 8.347 8.837 ( 14.177 0.000 -9.422) 17.022 9.156 ( -3.616 0.000 4.140) 5.497 9.197 ( -8.907 0.000 -0.954) 8.958 9.405 ( -13.745 0.000 5.755) 14.901 9.450 ( -9.867 0.000 5.492) 11.292 9.523 ( -17.152 0.000 -1.101) 17.187 9.624 ( -3.094 0.000 -9.797) 10.274 9.721 ( -4.505 0.000 8.572) 9.684 9.932 ( -17.294 0.000 6.141) 18.352 9.964 ( 7.083 0.000 -11.877) 13.829 10.124 ( -19.787 0.000 -10.800) 22.543 10.363 ( -5.257 0.000 7.707) 9.330 10.498 ( 1.604 0.000 3.340) 3.705 10.548 ( -4.140 0.000 -5.271) 6.703 10.657 ( 1.624 0.000 -10.697) 10.819 11.006 ( -14.224 0.000 7.153) 15.921 11.145 ( 7.159 0.000 2.175) 7.482 11.182 ( -11.198 0.000 -8.290) 13.933 11.263 ( 9.117 0.000 -5.329) 10.560 11.523 ( 1.974 0.000 4.497) 4.911 11.543 ( -10.760 0.000 6.203) 12.420 11.653 ( -5.073 0.000 -3.746) 6.306 11.656 ( 12.773 0.000 -3.386) 13.214 12.063 ( 5.356 0.000 6.682) 8.563 12.204 ( 2.945 0.000 -4.119) 5.064 12.273 ( -7.577 0.000 10.404) 12.871 12.443 ( -9.646 0.000 -3.157) 10.150 12.604 ( -3.936 0.000 11.289) 11.955 12.619 ( 7.581 0.000 8.608) 11.470 12.804 ( -5.923 0.000 -6.028) 8.451 12.839 ( 8.091 0.000 -9.292) 12.320 13.041 ( -5.566 0.000 0.017) 5.566 13.123 ( -5.280 0.000 5.596) 7.694 13.193 ( -8.368 0.000 -11.027) 13.842 13.358 ( -10.766 0.000 -13.939) 17.612 13.879 ( -14.682 0.000 4.415) 15.331 13.999 ( -14.132 0.000 -6.417) 15.520 14.411 ( -2.581 0.000 3.356) 4.234 14.479 ( -4.391 0.000 -2.865) 5.243 14.488 ( -5.246 0.000 5.217) 7.398 14.566 ( -3.794 0.000 -1.619) 4.125 15.206 ( -0.174 0.000 3.364) 3.369 15.288 ( -3.409 0.000 -3.529) 4.907 15.594 ( 2.057 0.000 14.963) 15.104 15.832 ( 8.812 0.000 9.011) 12.603 15.867 ( 1.432 0.000 -8.555) 8.674 15.987 ( 9.211 0.000 6.036) 11.013 16.037 ( 8.470 0.000 -7.647) 11.411 16.145 ( 5.905 0.000 -6.782) 8.992 16.438 ( 6.768 0.000 5.983) 9.033 16.586 ( 7.797 0.000 -6.091) 9.894 17.024 ( 9.870 0.000 12.059) 15.583 17.377 ( 9.552 0.000 -19.146) 21.396 18.762 ( 7.161 0.000 3.384) 7.920 18.888 ( 12.657 0.000 -8.384) 15.182 20.096 ( 12.326 0.000 4.117) 12.995 20.168 ( 12.452 0.000 -2.181) 12.641 20.709 ( -24.832 0.000 5.748) 25.489 20.846 ( -22.231 0.000 -6.468) 23.153 21.576 ( -16.468 0.000 4.686) 17.122 21.677 ( -15.249 0.000 -4.293) 15.842 26.386 ( 5.664 0.000 9.714) 11.245 26.526 ( 4.742 0.000 5.430) 7.209 26.551 ( 5.640 0.000 -3.842) 6.825 26.633 ( 5.798 0.000 -4.407) 7.283 27.142 ( 11.755 0.000 -0.429) 11.762 27.223 ( 12.166 0.000 -6.484) 13.786 27.403 ( 2.143 0.000 11.190) 11.394 27.647 ( 5.526 0.000 -9.220) 10.749 28.096 ( 4.612 0.000 2.461) 5.228 28.163 ( 3.201 0.000 -3.468) 4.719 28.210 ( 1.100 0.000 8.149) 8.223 28.392 ( -5.067 0.000 -9.377) 10.659 29.346 ( 1.227 0.000 4.675) 4.833 29.359 ( 1.331 0.000 4.513) 4.706 29.463 ( 2.477 0.000 -4.796) 5.398 29.526 ( 3.010 0.000 -10.810) 11.221 29.979 ( 3.118 0.000 13.273) 13.634 30.249 ( 4.713 0.000 -10.370) 11.391 30.337 ( -0.901 0.000 10.078) 10.118 30.535 ( 1.220 0.000 -8.065) 8.157 31.282 ( 2.246 0.000 8.864) 9.144 31.480 ( 3.435 0.000 -8.592) 9.253 32.040 ( -20.365 0.000 23.966) 31.450 32.505 ( -21.894 0.000 -18.061) 28.382 ======================= Grid point 158 (53/72) ======================= q-point: ( 0.40 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.543 ( 18.634 0.000 10.870) 21.573 3.782 ( 16.642 0.000 -9.574) 19.199 3.798 ( 17.285 0.000 18.218) 25.113 4.136 ( -3.462 0.000 -10.846) 11.386 4.595 ( 4.775 0.000 6.826) 8.331 4.714 ( -1.455 0.000 0.055) 1.456 4.768 ( 0.420 0.000 -7.203) 7.215 4.807 ( -8.215 0.000 -6.118) 10.243 5.048 ( 5.575 0.000 4.408) 7.107 5.171 ( 4.043 0.000 6.806) 7.916 5.230 ( 8.122 0.000 -10.083) 12.948 5.384 ( -1.100 0.000 -11.303) 11.356 5.800 ( 3.799 0.000 6.645) 7.654 5.987 ( 5.747 0.000 3.172) 6.564 6.025 ( 8.261 0.000 0.008) 8.261 6.032 ( -0.303 0.000 -12.511) 12.515 6.444 ( -3.023 0.000 12.643) 12.999 6.574 ( 8.563 0.000 9.654) 12.904 6.682 ( 0.869 0.000 -8.404) 8.449 6.696 ( 6.118 0.000 -1.436) 6.284 6.989 ( 1.066 0.000 4.146) 4.281 7.106 ( 13.071 0.000 7.559) 15.099 7.141 ( 11.027 0.000 -7.044) 13.085 7.174 ( 8.299 0.000 1.201) 8.386 7.385 ( 10.550 0.000 4.227) 11.366 7.510 ( 5.643 0.000 -7.206) 9.153 7.750 ( -13.294 0.000 6.056) 14.609 7.833 ( 22.374 0.000 12.252) 25.509 7.899 ( -13.951 0.000 -5.323) 14.932 8.041 ( 11.666 0.000 -2.887) 12.018 8.260 ( 22.608 0.000 2.900) 22.793 8.327 ( -10.270 0.000 15.479) 18.576 8.373 ( 14.517 0.000 -6.311) 15.829 8.680 ( -6.860 0.000 -13.651) 15.278 8.853 ( 2.832 0.000 10.190) 10.577 8.971 ( -19.444 0.000 2.512) 19.605 8.993 ( -13.140 0.000 1.998) 13.291 8.993 ( -6.291 0.000 -1.400) 6.445 9.210 ( -14.345 0.000 8.508) 16.679 9.241 ( 10.337 0.000 2.258) 10.581 9.366 ( 16.272 0.000 -9.716) 18.952 9.383 ( -21.489 0.000 -5.729) 22.239 9.656 ( -10.379 0.000 2.972) 10.796 9.820 ( -4.208 0.000 -10.092) 10.934 9.874 ( 11.578 0.000 10.576) 15.682 10.127 ( 6.122 0.000 -9.189) 11.042 10.334 ( 5.093 0.000 4.925) 7.085 10.517 ( -6.183 0.000 0.928) 6.252 10.541 ( 6.471 0.000 -9.630) 11.602 10.633 ( -15.132 0.000 -7.658) 16.959 10.689 ( -9.728 0.000 8.945) 13.216 10.950 ( -10.252 0.000 -11.539) 15.435 11.189 ( -0.314 0.000 0.273) 0.415 11.290 ( -3.761 0.000 -8.783) 9.554 11.303 ( -11.946 0.000 6.474) 13.588 11.474 ( -12.774 0.000 -9.411) 15.866 11.712 ( 15.085 0.000 14.976) 21.257 11.943 ( 13.387 0.000 -3.651) 13.876 12.135 ( -7.133 0.000 10.166) 12.419 12.208 ( 7.839 0.000 1.454) 7.973 12.279 ( -6.849 0.000 -0.244) 6.854 12.289 ( 8.319 0.000 -3.901) 9.189 12.523 ( -5.560 0.000 9.936) 11.386 12.683 ( -7.147 0.000 -3.323) 7.882 12.742 ( 4.267 0.000 11.006) 11.804 12.909 ( 2.274 0.000 -0.984) 2.478 12.920 ( -7.714 0.000 -0.317) 7.721 13.056 ( -5.354 0.000 -10.588) 11.865 13.141 ( 1.805 0.000 -6.909) 7.141 13.211 ( 0.374 0.000 -11.270) 11.277 13.529 ( -19.980 0.000 3.685) 20.317 13.656 ( -18.761 0.000 -7.212) 20.099 14.357 ( -2.984 0.000 3.648) 4.713 14.365 ( -5.094 0.000 6.432) 8.205 14.429 ( -0.921 0.000 -3.009) 3.147 14.475 ( -3.901 0.000 -3.693) 5.372 15.259 ( 5.402 0.000 5.034) 7.384 15.372 ( 9.632 0.000 -5.236) 10.963 15.536 ( -6.241 0.000 12.857) 14.291 15.781 ( -8.531 0.000 -9.161) 12.518 16.016 ( 8.858 0.000 9.404) 12.919 16.120 ( 3.869 0.000 6.126) 7.245 16.188 ( 6.855 0.000 -3.842) 7.858 16.253 ( 4.188 0.000 -5.108) 6.606 16.615 ( 10.691 0.000 6.781) 12.660 16.818 ( 15.178 0.000 -9.786) 18.059 17.047 ( -6.772 0.000 13.564) 15.161 17.369 ( -8.598 0.000 -14.543) 16.894 19.073 ( 24.276 0.000 7.736) 25.478 19.293 ( 26.892 0.000 -12.188) 29.525 20.187 ( -29.003 0.000 7.676) 30.001 20.375 ( -26.464 0.000 -9.099) 27.984 20.400 ( 18.729 0.000 4.124) 19.178 20.481 ( 19.716 0.000 -3.047) 19.950 21.212 ( -20.964 0.000 5.417) 21.653 21.326 ( -20.884 0.000 -4.755) 21.418 26.477 ( 3.932 0.000 9.911) 10.662 26.568 ( -0.026 0.000 7.651) 7.651 26.641 ( 3.636 0.000 -3.896) 5.329 26.697 ( 1.218 0.000 -3.978) 4.160 27.326 ( 7.136 0.000 2.371) 7.520 27.431 ( 0.618 0.000 10.395) 10.414 27.459 ( 11.810 0.000 -8.951) 14.818 27.715 ( 0.752 0.000 -13.868) 13.888 28.172 ( 2.028 0.000 0.355) 2.059 28.185 ( -2.534 0.000 6.200) 6.697 28.198 ( 1.853 0.000 -1.753) 2.551 28.319 ( -2.779 0.000 -6.074) 6.679 29.374 ( 1.440 0.000 6.258) 6.421 29.386 ( 1.112 0.000 5.315) 5.430 29.514 ( 2.768 0.000 -6.086) 6.686 29.565 ( 0.947 0.000 -10.221) 10.264 30.069 ( 5.937 0.000 14.337) 15.517 30.291 ( -3.982 0.000 12.496) 13.115 30.346 ( 5.311 0.000 -10.090) 11.403 30.521 ( -2.567 0.000 -8.402) 8.786 31.355 ( 5.410 0.000 10.329) 11.660 31.591 ( 8.338 0.000 -10.403) 13.332 31.711 ( -14.030 0.000 19.167) 23.753 32.113 ( -18.503 0.000 -16.594) 24.854 ======================= Grid point 159 (54/72) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.866 ( -11.105 0.000 6.592) 12.914 3.866 ( 11.105 0.000 6.592) 12.914 4.004 ( -1.315 0.000 -5.095) 5.261 4.004 ( 1.315 0.000 -5.095) 5.261 4.658 ( -0.545 0.000 4.418) 4.451 4.658 ( 0.545 0.000 4.418) 4.451 4.750 ( -0.060 0.000 -4.547) 4.547 4.750 ( 0.060 0.000 -4.547) 4.547 5.145 ( -3.687 0.000 5.561) 6.673 5.145 ( 3.687 0.000 5.561) 6.673 5.341 ( -1.079 0.000 -11.170) 11.222 5.341 ( 1.079 0.000 -11.170) 11.222 5.948 ( -2.807 0.000 3.072) 4.162 5.948 ( 2.808 0.000 3.072) 4.162 6.100 ( -0.610 0.000 -7.784) 7.808 6.100 ( 0.610 0.000 -7.784) 7.808 6.443 ( -2.073 0.000 13.453) 13.611 6.443 ( 2.073 0.000 13.453) 13.611 6.720 ( -1.084 0.000 -10.230) 10.288 6.720 ( 1.084 0.000 -10.230) 10.288 7.166 ( -7.607 0.000 12.353) 14.507 7.166 ( 7.607 0.000 12.353) 14.507 7.302 ( -0.068 0.000 3.231) 3.232 7.302 ( 0.068 0.000 3.231) 3.232 7.556 ( -1.567 0.000 -2.278) 2.765 7.556 ( 1.567 0.000 -2.278) 2.765 7.657 ( -8.447 0.000 -4.649) 9.642 7.657 ( 8.447 0.000 -4.649) 9.642 8.160 ( -6.571 0.000 14.618) 16.027 8.160 ( 6.571 0.000 14.618) 16.027 8.394 ( -24.063 0.000 2.676) 24.212 8.394 ( 24.063 0.000 2.676) 24.212 8.584 ( -13.953 0.000 -5.019) 14.828 8.584 ( 13.953 0.000 -5.019) 14.828 8.670 ( -16.329 0.000 -10.264) 19.287 8.670 ( 16.329 0.000 -10.264) 19.287 8.915 ( -9.240 0.000 6.320) 11.194 8.915 ( 9.240 0.000 6.320) 11.194 9.047 ( -7.687 0.000 -3.537) 8.461 9.047 ( 7.687 0.000 -3.537) 8.461 9.519 ( -9.065 0.000 9.883) 13.411 9.519 ( 9.065 0.000 9.883) 13.411 9.741 ( -10.907 0.000 -9.212) 14.277 9.741 ( 10.907 0.000 -9.212) 14.277 10.137 ( -19.822 0.000 7.062) 21.042 10.137 ( 19.822 0.000 7.062) 21.042 10.296 ( -14.621 0.000 -8.383) 16.854 10.296 ( 14.621 0.000 -8.383) 16.854 10.532 ( -11.041 0.000 6.422) 12.773 10.532 ( 11.041 0.000 6.422) 12.773 10.766 ( -12.179 0.000 -11.192) 16.541 10.766 ( 12.179 0.000 -11.192) 16.541 11.190 ( -0.022 0.000 -1.296) 1.297 11.190 ( 0.022 0.000 -1.296) 1.297 11.261 ( -4.714 0.000 -7.485) 8.845 11.261 ( 4.714 0.000 -7.485) 8.845 11.971 ( -10.436 0.000 12.453) 16.248 11.971 ( 10.436 0.000 12.453) 16.248 12.149 ( -7.491 0.000 -1.761) 7.695 12.149 ( 7.491 0.000 -1.761) 7.695 12.365 ( -9.695 0.000 6.244) 11.532 12.365 ( 9.695 0.000 6.244) 11.532 12.505 ( -11.186 0.000 -4.707) 12.136 12.505 ( 11.186 0.000 -4.707) 12.136 12.797 ( -1.253 0.000 5.257) 5.405 12.797 ( 1.253 0.000 5.257) 5.405 12.984 ( -1.107 0.000 -7.954) 8.030 12.984 ( 1.107 0.000 -7.954) 8.030 13.203 ( -10.859 0.000 2.083) 11.057 13.203 ( 10.859 0.000 2.083) 11.057 13.365 ( -10.692 0.000 -10.157) 14.747 13.365 ( 10.692 0.000 -10.157) 14.747 14.320 ( -0.023 0.000 5.879) 5.879 14.320 ( 0.023 0.000 5.879) 5.879 14.431 ( -0.260 0.000 -4.317) 4.325 14.431 ( 0.260 0.000 -4.317) 4.325 15.394 ( -5.421 0.000 9.162) 10.646 15.394 ( 5.421 0.000 9.162) 10.646 15.583 ( -10.959 0.000 -8.033) 13.588 15.583 ( 10.959 0.000 -8.033) 13.588 16.132 ( -1.648 0.000 7.854) 8.025 16.132 ( 1.648 0.000 7.854) 8.025 16.277 ( -1.163 0.000 -3.987) 4.154 16.277 ( 1.163 0.000 -3.987) 4.154 16.843 ( -12.513 0.000 11.412) 16.935 16.843 ( 12.513 0.000 11.412) 16.935 17.123 ( -15.474 0.000 -12.641) 19.981 17.123 ( 15.474 0.000 -12.641) 19.981 19.613 ( -29.649 0.000 8.888) 30.953 19.613 ( 29.649 0.000 8.888) 30.953 19.840 ( -28.286 0.000 -11.456) 30.517 19.840 ( 28.286 0.000 -11.456) 30.517 20.795 ( -21.652 0.000 5.027) 22.228 20.795 ( 21.652 0.000 5.027) 22.228 20.899 ( -22.796 0.000 -4.213) 23.182 20.899 ( 22.796 0.000 -4.213) 23.182 26.540 ( -1.457 0.000 9.268) 9.382 26.540 ( 1.457 0.000 9.268) 9.382 26.691 ( -0.500 0.000 -3.910) 3.942 26.691 ( 0.500 0.000 -3.910) 3.942 27.416 ( -0.890 0.000 6.971) 7.027 27.416 ( 0.890 0.000 6.971) 7.027 27.651 ( -6.445 0.000 -13.488) 14.949 27.651 ( 6.445 0.000 -13.488) 14.949 28.165 ( -0.607 0.000 4.326) 4.368 28.165 ( 0.607 0.000 4.326) 4.368 28.262 ( -2.903 0.000 -4.274) 5.166 28.262 ( 2.903 0.000 -4.274) 5.166 29.393 ( -0.049 0.000 6.260) 6.260 29.393 ( 0.049 0.000 6.260) 6.260 29.559 ( -0.931 0.000 -8.187) 8.240 29.559 ( 0.931 0.000 -8.187) 8.240 30.190 ( -4.496 0.000 13.836) 14.548 30.190 ( 4.496 0.000 13.836) 14.548 30.446 ( -2.303 0.000 -9.049) 9.338 30.446 ( 2.303 0.000 -9.049) 9.338 31.492 ( -5.575 0.000 13.909) 14.984 31.492 ( 5.575 0.000 13.909) 14.984 31.803 ( -12.058 0.000 -13.459) 18.071 31.803 ( 12.058 0.000 -13.459) 18.071 ======================= Grid point 165 (55/72) ======================= q-point: ( 0.00 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.971 ( 0.000 21.224 31.118) 37.667 2.083 ( 0.000 12.422 35.889) 37.978 2.594 ( 0.000 13.760 -18.415) 22.988 2.775 ( 0.000 11.049 -22.158) 24.760 3.540 ( 0.000 1.726 2.031) 2.665 3.551 ( 0.000 -4.003 9.123) 9.962 3.633 ( 0.000 6.013 29.445) 30.053 4.136 ( 0.000 -24.928 -13.927) 28.554 4.532 ( 0.000 -0.555 5.991) 6.017 4.727 ( 0.000 -2.785 -2.677) 3.863 4.941 ( 0.000 -5.089 2.243) 5.561 5.042 ( 0.000 -2.943 -9.488) 9.934 5.261 ( 0.000 7.997 7.061) 10.669 5.586 ( 0.000 5.564 -16.117) 17.051 5.683 ( 0.000 -5.963 1.147) 6.072 5.770 ( 0.000 -2.851 -7.433) 7.961 5.913 ( 0.000 11.121 4.161) 11.874 6.027 ( 0.000 12.168 -7.419) 14.251 6.209 ( 0.000 10.132 3.205) 10.626 6.360 ( 0.000 12.471 -11.016) 16.640 6.617 ( 0.000 -5.683 6.225) 8.429 6.762 ( 0.000 -5.903 -7.385) 9.455 7.002 ( 0.000 -3.463 6.639) 7.488 7.109 ( 0.000 -2.341 -0.879) 2.501 7.332 ( 0.000 -1.968 6.622) 6.908 7.364 ( 0.000 -5.688 4.742) 7.405 7.847 ( 0.000 -9.783 6.584) 11.792 7.985 ( 0.000 -4.501 -6.945) 8.276 8.109 ( 0.000 -6.683 4.538) 8.079 8.244 ( 0.000 -9.849 -5.820) 11.440 8.275 ( 0.000 2.785 2.440) 3.703 8.332 ( 0.000 2.123 -3.963) 4.496 8.682 ( 0.000 -17.435 3.684) 17.820 8.789 ( 0.000 -11.482 -4.434) 12.308 9.124 ( 0.000 3.569 2.411) 4.307 9.197 ( 0.000 5.029 -3.617) 6.194 9.266 ( 0.000 6.141 1.073) 6.235 9.329 ( 0.000 0.175 -3.993) 3.997 9.590 ( 0.000 1.693 0.826) 1.883 9.619 ( 0.000 4.572 -2.829) 5.376 9.850 ( 0.000 6.365 3.350) 7.193 9.861 ( 0.000 0.070 2.641) 2.642 9.961 ( 0.000 8.027 1.839) 8.235 9.990 ( 0.000 7.035 -3.727) 7.962 10.078 ( 0.000 10.903 1.298) 10.980 10.191 ( 0.000 6.455 -6.375) 9.072 10.408 ( 0.000 1.670 13.583) 13.685 10.557 ( 0.000 -2.747 0.915) 2.896 10.772 ( 0.000 -2.086 2.729) 3.435 10.924 ( 0.000 -0.896 -7.067) 7.124 11.016 ( 0.000 -3.955 0.360) 3.971 11.034 ( 0.000 -10.203 -5.291) 11.493 11.420 ( 0.000 -5.503 10.575) 11.922 11.590 ( 0.000 -6.991 -3.238) 7.704 11.623 ( 0.000 3.346 2.274) 4.045 11.738 ( 0.000 3.277 -9.185) 9.752 11.809 ( 0.000 -15.908 1.367) 15.967 11.821 ( 0.000 -11.505 1.148) 11.562 11.971 ( 0.000 4.084 1.069) 4.222 12.077 ( 0.000 -4.879 -7.473) 8.925 12.437 ( 0.000 -6.241 5.930) 8.609 12.487 ( 0.000 -9.920 4.946) 11.085 12.704 ( 0.000 -4.677 3.832) 6.046 12.723 ( 0.000 -1.156 5.971) 6.082 12.966 ( 0.000 1.394 -3.835) 4.080 13.051 ( 0.000 1.410 -7.520) 7.651 13.283 ( 0.000 6.466 5.954) 8.790 13.406 ( 0.000 6.353 -4.008) 7.512 13.701 ( 0.000 4.916 0.822) 4.984 13.706 ( 0.000 1.942 2.602) 3.247 13.943 ( 0.000 -2.300 5.479) 5.942 14.051 ( 0.000 1.306 -7.197) 7.315 14.219 ( 0.000 4.013 4.174) 5.790 14.424 ( 0.000 -2.239 -9.449) 9.710 14.496 ( 0.000 7.483 -1.549) 7.641 14.529 ( 0.000 1.401 -4.680) 4.886 14.976 ( 0.000 -1.486 1.083) 1.839 15.001 ( 0.000 -1.056 -1.119) 1.539 15.340 ( 0.000 4.808 1.202) 4.956 15.390 ( 0.000 3.488 -3.519) 4.955 15.551 ( 0.000 2.591 -0.806) 2.713 15.628 ( 0.000 2.044 -6.934) 7.229 15.772 ( 0.000 8.070 1.238) 8.165 15.783 ( 0.000 7.814 0.183) 7.816 16.516 ( 0.000 -1.002 5.185) 5.281 16.592 ( 0.000 -4.731 -2.024) 5.146 16.898 ( 0.000 5.717 6.190) 8.426 17.029 ( 0.000 10.078 -5.702) 11.579 18.754 ( 0.000 -10.704 3.118) 11.149 18.867 ( 0.000 -8.066 -7.468) 10.992 19.931 ( 0.000 -3.934 6.611) 7.692 19.998 ( 0.000 -4.962 0.845) 5.033 21.506 ( 0.000 5.572 -0.149) 5.574 21.513 ( 0.000 4.756 -0.527) 4.785 22.057 ( 0.000 -1.031 0.454) 1.126 22.070 ( 0.000 -1.288 -0.694) 1.463 26.075 ( 0.000 1.686 7.039) 7.238 26.103 ( 0.000 -0.097 0.291) 0.307 26.108 ( 0.000 -0.039 -0.148) 0.153 26.243 ( 0.000 -1.258 -7.663) 7.766 26.671 ( 0.000 2.208 4.949) 5.419 26.799 ( 0.000 -0.450 -6.286) 6.302 27.238 ( 0.000 0.219 0.629) 0.666 27.243 ( 0.000 0.038 0.055) 0.067 27.896 ( 0.000 0.054 2.383) 2.384 27.911 ( 0.000 -2.272 4.273) 4.839 28.126 ( 0.000 5.390 15.538) 16.446 28.527 ( 0.000 -3.083 -14.685) 15.005 29.162 ( 0.000 -8.382 -0.193) 8.384 29.194 ( 0.000 -7.417 -2.003) 7.683 29.545 ( 0.000 9.165 1.174) 9.240 29.550 ( 0.000 8.914 -0.394) 8.922 29.982 ( 0.000 0.121 3.055) 3.057 30.066 ( 0.000 -2.680 -2.778) 3.860 30.313 ( 0.000 -0.136 -0.081) 0.159 30.343 ( 0.000 -0.410 -1.924) 1.967 31.323 ( 0.000 1.660 7.560) 7.740 31.465 ( 0.000 0.423 -4.269) 4.290 33.198 ( 0.000 -1.043 6.257) 6.343 33.376 ( 0.000 -4.151 -8.781) 9.713 ======================= Grid point 166 (56/72) ======================= q-point: ( 0.10 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.091 ( 16.091 6.754 32.338) 36.746 2.412 ( 25.436 18.849 32.076) 45.068 2.723 ( 14.899 3.525 -21.542) 26.428 3.053 ( 25.112 18.294 -20.218) 37.068 3.535 ( 9.477 6.622 26.894) 29.273 3.826 ( 20.179 -5.748 -4.809) 21.525 4.044 ( 31.145 -11.497 8.047) 34.160 4.257 ( 13.435 -19.063 -10.215) 25.461 4.583 ( 6.924 -0.248 8.925) 11.299 4.759 ( 2.925 -7.768 -0.941) 8.354 4.952 ( 1.901 -1.415 0.356) 2.397 5.116 ( 7.905 4.056 -11.686) 14.680 5.380 ( 11.201 4.337 7.558) 14.191 5.604 ( 0.247 0.850 -5.428) 5.499 5.717 ( 2.764 -1.517 -3.891) 5.009 5.785 ( 2.784 3.972 -6.219) 7.887 5.969 ( 6.084 4.727 0.536) 7.723 6.050 ( 3.535 9.159 -7.338) 12.257 6.213 ( 1.274 7.693 3.676) 8.621 6.343 ( -0.886 7.941 -8.384) 11.582 6.585 ( -1.953 -1.488 6.197) 6.665 6.754 ( -0.819 -1.177 -8.667) 8.785 6.984 ( -0.710 -3.924 8.920) 9.771 7.120 ( -1.320 -4.911 -0.690) 5.132 7.286 ( -1.505 0.727 4.800) 5.083 7.325 ( -3.369 -1.229 2.370) 4.299 7.836 ( -2.517 -4.201 5.227) 7.163 7.977 ( -3.003 -1.296 -5.244) 6.181 8.087 ( -3.762 -7.028 5.982) 9.967 8.164 ( -3.916 -3.448 3.448) 6.254 8.300 ( 1.145 -2.742 -4.530) 5.417 8.334 ( -1.100 -0.137 -7.818) 7.896 8.690 ( 0.196 -11.529 4.192) 12.269 8.784 ( -1.287 -6.965 -2.910) 7.658 8.943 ( -13.525 6.699 2.760) 15.343 9.035 ( -12.813 6.683 -3.810) 14.945 9.226 ( -3.456 0.199 2.315) 4.165 9.291 ( -3.062 -1.149 -3.551) 4.828 9.573 ( -2.744 4.085 3.017) 5.772 9.654 ( -0.825 1.171 -0.793) 1.637 9.718 ( -4.040 -1.217 1.601) 4.513 9.824 ( -2.977 1.889 -1.908) 4.008 9.908 ( -2.366 -0.506 0.359) 2.446 10.020 ( -0.734 0.600 -5.761) 5.838 10.183 ( 3.700 3.827 6.355) 8.290 10.310 ( 3.071 2.918 -2.506) 4.922 10.511 ( 9.748 4.641 6.200) 12.450 10.547 ( -0.653 -1.010 6.342) 6.455 10.775 ( -1.927 -0.406 2.584) 3.249 10.874 ( -9.334 -2.739 0.353) 9.734 10.917 ( -3.311 0.470 -8.002) 8.673 10.982 ( -0.242 -0.281 -5.475) 5.487 11.391 ( -2.791 -3.257 9.113) 10.072 11.495 ( -10.156 -6.145 2.010) 12.039 11.553 ( -8.321 -0.451 1.281) 8.431 11.644 ( -2.082 -2.132 -2.335) 3.786 11.762 ( -2.655 -3.225 -3.574) 5.497 11.804 ( -3.512 -7.624 -2.433) 8.739 12.018 ( 0.835 0.966 -1.073) 1.668 12.073 ( -0.196 -5.675 -3.810) 6.838 12.350 ( -3.869 -2.768 6.223) 7.833 12.440 ( -1.563 -6.031 2.143) 6.589 12.620 ( 0.883 4.161 5.779) 7.176 12.743 ( -3.796 8.233 9.042) 12.804 12.891 ( -4.009 -0.355 -8.675) 9.563 13.000 ( -5.061 5.535 -7.619) 10.691 13.379 ( -4.984 0.805 3.815) 6.328 13.447 ( -5.275 0.112 4.658) 7.038 13.525 ( 2.245 -2.353 -2.449) 4.071 13.649 ( -9.117 3.698 -6.761) 11.938 14.032 ( 5.168 -2.243 2.989) 6.377 14.101 ( 1.329 -0.881 -2.869) 3.283 14.327 ( 7.691 -5.207 5.140) 10.616 14.378 ( 1.011 -2.764 1.612) 3.355 14.533 ( 0.207 -0.081 -1.218) 1.238 14.652 ( 3.608 -2.531 -9.415) 10.395 15.036 ( 7.335 3.126 4.380) 9.097 15.148 ( 17.635 0.311 -5.667) 18.526 15.318 ( 0.615 1.868 2.939) 3.536 15.428 ( 5.702 0.737 -7.053) 9.100 15.681 ( 5.667 1.195 0.705) 5.835 15.753 ( 6.625 2.218 -4.231) 8.167 15.809 ( 6.521 9.274 1.538) 11.441 15.883 ( 12.623 10.843 -5.275) 17.457 16.491 ( -2.023 -4.240 5.582) 7.296 16.584 ( -2.591 -6.316 -2.640) 7.320 16.799 ( -7.143 7.797 6.859) 12.604 16.974 ( -2.357 11.382 -9.222) 14.838 18.713 ( -3.343 -9.654 3.732) 10.877 18.838 ( -3.118 -8.232 -7.658) 11.668 19.905 ( -1.536 -2.842 5.959) 6.778 19.971 ( -1.779 -4.147 0.194) 4.516 21.426 ( -7.780 5.543 1.810) 9.723 21.474 ( -5.810 5.001 -2.442) 8.045 21.996 ( -5.784 -0.336 1.564) 6.001 22.033 ( -4.279 -0.722 -1.688) 4.656 26.130 ( 5.744 1.081 7.506) 9.513 26.195 ( 8.395 -0.386 1.464) 8.531 26.234 ( 10.704 -0.652 -2.489) 11.009 26.307 ( 6.425 -0.495 -7.071) 9.567 26.737 ( 6.634 1.943 3.905) 7.940 26.855 ( 5.702 -0.322 -6.234) 8.454 27.273 ( 4.077 0.312 3.568) 5.427 27.341 ( 8.196 -0.477 -2.785) 8.669 27.923 ( 2.769 -0.345 2.804) 3.956 27.945 ( 3.506 -2.538 3.661) 5.669 28.143 ( 1.588 4.525 13.933) 14.735 28.513 ( -1.647 -3.190 -14.270) 14.715 29.180 ( 1.832 -7.817 -0.554) 8.048 29.206 ( 1.409 -7.426 -2.247) 7.886 29.524 ( -1.309 8.551 1.679) 8.812 29.556 ( 0.057 7.737 -1.811) 7.947 29.974 ( -0.556 0.620 4.822) 4.894 30.091 ( 2.382 -1.985 -3.703) 4.830 30.322 ( 1.080 0.357 1.224) 1.671 30.381 ( 3.586 -1.186 -3.422) 5.097 31.307 ( -1.417 1.718 8.024) 8.328 31.458 ( -0.584 0.389 -4.590) 4.644 32.981 ( -20.155 1.288 11.761) 23.372 33.242 ( -13.522 -3.925 -11.404) 18.119 ======================= Grid point 167 (57/72) ======================= q-point: ( 0.20 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.525 ( 27.169 -2.410 26.625) 38.116 2.928 ( 26.619 7.839 18.482) 33.341 3.078 ( 19.899 4.987 -4.221) 20.944 3.606 ( 27.992 12.525 -23.740) 38.782 3.881 ( 23.020 2.041 19.229) 30.064 4.153 ( 13.617 -21.047 -9.382) 26.766 4.465 ( 11.262 -13.546 0.731) 17.632 4.568 ( 13.418 -13.473 -3.085) 19.263 4.794 ( 9.954 0.484 3.399) 10.529 4.877 ( 7.844 -5.183 -4.053) 10.238 5.182 ( 25.185 11.882 8.188) 29.026 5.394 ( 15.116 0.203 -3.739) 15.573 5.565 ( 7.392 -5.101 0.498) 8.995 5.625 ( 6.979 8.608 -1.230) 11.150 5.784 ( 5.066 0.714 -8.107) 9.586 5.834 ( 2.824 5.079 -5.072) 7.714 6.103 ( 3.092 2.932 1.819) 4.633 6.160 ( 9.730 5.428 -2.359) 11.388 6.346 ( 14.280 -0.706 4.193) 14.899 6.436 ( 11.318 1.034 -1.478) 11.461 6.605 ( 6.541 9.409 1.457) 11.552 6.712 ( -4.137 0.003 -5.900) 7.206 7.001 ( 1.382 -0.160 6.340) 6.490 7.058 ( -1.554 -4.345 -0.054) 4.615 7.278 ( 1.711 4.719 3.495) 6.116 7.363 ( 7.973 4.621 -1.242) 9.299 7.691 ( -10.846 6.550 4.763) 13.537 7.827 ( -10.738 2.617 -3.134) 11.488 7.987 ( -5.742 -9.284 7.532) 13.263 8.150 ( -0.149 -2.894 7.436) 7.981 8.216 ( -6.577 -5.362 -7.939) 11.620 8.364 ( 0.706 -2.560 -7.974) 8.405 8.609 ( -8.445 3.800 3.905) 10.050 8.660 ( -8.951 3.047 1.315) 9.546 8.785 ( -2.840 3.998 2.054) 5.317 8.885 ( -2.287 3.392 -4.816) 6.319 9.172 ( -2.987 -2.930 4.240) 5.956 9.231 ( -1.286 -6.326 -1.560) 6.642 9.480 ( -6.506 0.735 3.860) 7.600 9.578 ( -3.647 -4.173 -2.440) 6.055 9.674 ( -6.344 2.159 1.165) 6.801 9.747 ( -2.585 -1.059 -4.241) 5.079 9.890 ( -2.448 -6.671 1.839) 7.340 9.967 ( -9.856 -4.322 -1.262) 10.836 10.156 ( -3.568 -1.582 1.292) 4.111 10.214 ( -6.418 -1.338 -1.404) 6.705 10.423 ( -7.207 -3.359 11.818) 14.244 10.591 ( -2.589 -1.081 -2.914) 4.045 10.678 ( -7.970 0.000 -0.842) 8.014 10.745 ( -8.235 3.936 -5.209) 10.509 10.997 ( 11.240 8.993 -1.023) 14.431 11.095 ( 9.318 3.163 -6.431) 11.755 11.259 ( -10.273 0.845 6.484) 12.178 11.366 ( -3.741 0.547 -1.040) 3.921 11.431 ( -1.784 0.196 2.786) 3.314 11.565 ( -5.763 -8.013 -6.220) 11.667 11.695 ( -5.497 -2.337 0.854) 6.033 11.731 ( -2.256 0.668 -2.125) 3.171 12.011 ( 0.647 1.293 4.535) 4.759 12.102 ( 2.597 -3.718 -2.521) 5.189 12.357 ( 0.418 -4.725 6.898) 8.372 12.449 ( 2.062 -4.342 4.623) 6.669 12.643 ( -3.555 4.367 5.538) 7.898 12.664 ( -0.157 6.599 2.507) 7.060 12.791 ( -4.775 3.808 -6.356) 8.815 12.924 ( -3.653 1.812 -9.577) 10.409 13.170 ( -11.200 -0.875 5.672) 12.585 13.295 ( -8.259 0.848 2.295) 8.614 13.424 ( -11.561 3.910 -4.976) 13.180 13.544 ( -5.281 0.327 -10.026) 11.337 14.059 ( -3.704 -1.647 2.910) 4.990 14.129 ( 0.342 -2.555 -3.466) 4.320 14.333 ( -3.177 -8.763 3.861) 10.090 14.403 ( -1.939 -9.166 -2.192) 9.621 14.555 ( 2.889 1.328 4.742) 5.709 14.676 ( 0.388 3.274 -5.586) 6.486 15.208 ( 2.779 -3.918 7.443) 8.859 15.300 ( -0.001 -1.422 -0.357) 1.466 15.474 ( 11.993 0.125 4.402) 12.776 15.678 ( 16.248 0.421 -9.828) 18.994 15.742 ( 2.087 0.195 3.052) 3.702 15.794 ( 4.046 0.436 -0.265) 4.078 15.969 ( 6.730 7.774 3.279) 10.792 16.137 ( 8.244 8.329 -9.323) 14.975 16.397 ( -4.521 -1.986 6.073) 7.827 16.520 ( -2.905 -2.105 -4.572) 5.811 16.811 ( 10.078 4.526 8.381) 13.867 17.080 ( 12.996 2.595 -16.666) 21.293 18.670 ( 0.156 -5.916 2.484) 6.419 18.772 ( -1.901 -5.973 -6.392) 8.953 19.920 ( 4.002 -1.872 4.528) 6.326 19.982 ( 3.953 -2.883 -0.882) 4.971 21.189 ( -17.007 6.315 3.344) 18.447 21.270 ( -15.301 5.191 -3.790) 16.596 21.838 ( -10.892 0.098 2.864) 11.263 21.903 ( -9.393 -0.625 -2.889) 9.847 26.265 ( 7.329 0.731 8.229) 11.044 26.370 ( 8.372 -1.348 2.882) 8.956 26.424 ( 8.800 -0.262 -3.368) 9.426 26.485 ( 10.493 0.772 -5.536) 11.889 26.913 ( 11.126 0.908 1.554) 11.270 27.007 ( 9.707 -0.163 -5.813) 11.315 27.359 ( 4.280 1.027 7.370) 8.584 27.511 ( 8.488 -0.508 -5.914) 10.358 27.998 ( 4.880 -0.638 3.185) 5.862 28.041 ( 6.056 -2.652 1.631) 6.810 28.178 ( 1.729 1.810 9.962) 10.271 28.458 ( -4.029 -2.999 -12.103) 13.104 29.226 ( 2.776 -6.042 -0.374) 6.659 29.251 ( 3.211 -6.656 -2.020) 7.661 29.506 ( -0.442 6.531 0.884) 6.605 29.555 ( -0.002 5.201 -4.113) 6.631 29.970 ( 0.356 1.782 8.798) 8.984 30.147 ( 3.299 -1.573 -4.558) 5.842 30.351 ( 1.667 1.062 3.016) 3.606 30.463 ( 4.380 -1.578 -5.777) 7.420 31.282 ( -0.828 1.538 8.760) 8.932 31.450 ( -0.026 0.084 -5.170) 5.171 32.529 ( -24.681 4.036 17.690) 30.633 32.897 ( -21.054 -3.273 -15.122) 26.128 ======================= Grid point 168 (58/72) ======================= q-point: ( 0.30 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.067 ( 27.388 -4.130 18.599) 33.363 3.387 ( 20.089 0.010 1.112) 20.119 3.481 ( 22.826 6.571 15.127) 28.161 4.017 ( 13.626 2.502 -20.831) 25.017 4.184 ( 9.853 -20.939 5.942) 23.892 4.402 ( 10.250 -14.632 -8.972) 19.992 4.682 ( 10.774 -8.703 0.773) 13.871 4.746 ( 7.985 -8.963 -2.543) 12.270 4.972 ( 6.306 3.076 0.806) 7.063 5.048 ( 7.028 1.140 -3.227) 7.817 5.348 ( 0.318 13.693 4.089) 14.294 5.484 ( -3.502 5.677 -6.026) 8.990 5.659 ( 1.311 -3.664 6.462) 7.543 5.812 ( 0.414 0.861 -6.372) 6.443 5.974 ( 17.318 -5.601 1.776) 18.288 6.054 ( 13.290 1.065 -3.204) 13.712 6.221 ( 8.486 4.343 6.208) 11.376 6.394 ( 6.653 -0.256 -6.416) 9.246 6.538 ( 8.693 7.868 6.116) 13.224 6.665 ( 11.043 1.271 -4.436) 11.968 6.851 ( 22.478 4.564 3.000) 23.132 6.867 ( 15.526 6.935 -1.025) 17.036 7.009 ( 3.268 5.845 2.762) 7.243 7.073 ( 5.986 2.085 -1.574) 6.531 7.407 ( 4.539 6.109 3.607) 8.422 7.487 ( -9.541 1.315 -0.658) 9.653 7.558 ( 8.382 -3.509 4.242) 10.028 7.765 ( 8.745 -3.505 -1.576) 9.553 7.904 ( 2.629 -0.349 6.009) 6.568 8.028 ( -9.800 -0.061 6.186) 11.589 8.148 ( -0.458 1.273 -2.963) 3.257 8.255 ( -10.085 4.789 -4.311) 11.967 8.546 ( 1.360 0.884 5.446) 5.682 8.622 ( 3.120 3.337 5.144) 6.880 8.775 ( 2.107 -0.922 -2.159) 3.154 8.888 ( 5.018 3.211 -7.190) 9.337 9.118 ( -3.307 -3.563 4.149) 6.391 9.155 ( -8.359 -2.941 -0.267) 8.866 9.317 ( -10.962 -3.908 4.531) 12.489 9.442 ( -13.609 -1.893 -4.156) 14.355 9.558 ( -6.428 -1.313 5.290) 8.428 9.644 ( -8.886 -0.016 -3.066) 9.400 9.709 ( -2.794 1.012 3.935) 4.931 9.917 ( 5.475 -2.276 -11.401) 12.851 9.993 ( -12.671 4.122 6.734) 14.930 10.177 ( -9.087 0.770 -9.279) 13.010 10.300 ( -5.104 -3.992 8.944) 11.045 10.443 ( -6.102 -0.391 2.959) 6.793 10.541 ( -2.546 -2.883 -4.676) 6.054 10.679 ( 0.330 2.167 -10.091) 10.326 11.005 ( -13.716 -0.066 6.362) 15.120 11.145 ( -1.892 -0.508 -4.172) 4.609 11.197 ( -4.648 1.539 -3.737) 6.159 11.283 ( 2.773 1.111 -7.610) 8.175 11.489 ( -6.193 -4.088 3.435) 8.177 11.502 ( 1.879 -2.325 4.722) 5.589 11.607 ( -0.146 -2.256 1.535) 2.732 11.704 ( 3.904 2.657 -5.017) 6.890 12.039 ( 1.794 -1.839 5.780) 6.325 12.155 ( 2.848 -3.495 -2.669) 5.240 12.321 ( -3.466 2.328 5.743) 7.100 12.416 ( -7.149 -2.703 -1.056) 7.716 12.599 ( 1.233 0.045 9.796) 9.873 12.630 ( -1.708 1.631 7.816) 8.165 12.788 ( -0.538 -2.441 -2.966) 3.879 12.849 ( -0.785 1.619 -7.639) 7.848 13.019 ( -5.357 -1.541 0.582) 5.604 13.138 ( -8.234 -0.889 -5.192) 9.775 13.224 ( -8.267 4.648 -2.295) 9.758 13.398 ( -8.263 3.711 -12.271) 15.252 13.897 ( -13.709 1.197 4.128) 14.367 14.007 ( -13.844 0.126 -5.727) 14.982 14.280 ( -1.419 -8.341 4.014) 9.364 14.349 ( -2.366 -6.760 -2.153) 7.479 14.584 ( -1.183 3.059 3.470) 4.775 14.641 ( -4.854 3.914 -1.360) 6.382 15.193 ( 0.362 -1.651 2.641) 3.136 15.248 ( -1.588 -1.384 -1.895) 2.833 15.602 ( 0.388 -0.921 10.515) 10.562 15.768 ( 3.035 -3.279 -0.373) 4.484 15.932 ( 10.595 1.408 1.050) 10.740 16.036 ( 12.975 1.831 -5.698) 14.288 16.046 ( 3.395 6.246 6.606) 9.704 16.215 ( 2.923 4.927 -6.056) 8.336 16.417 ( 5.915 -0.739 4.481) 7.458 16.553 ( 6.481 -2.122 -6.117) 9.161 17.017 ( 6.970 -1.664 10.187) 12.455 17.309 ( 6.469 -6.987 -15.520) 18.208 18.760 ( 10.707 0.220 3.161) 11.166 18.881 ( 15.243 -0.496 -8.062) 17.251 20.075 ( 12.102 -1.974 3.687) 12.804 20.139 ( 12.312 -2.699 -1.915) 12.749 20.784 ( -24.539 7.046 4.997) 26.015 20.903 ( -22.382 5.246 -5.536) 23.646 21.571 ( -16.895 -0.505 4.137) 17.401 21.663 ( -15.760 -1.492 -4.000) 16.328 26.388 ( 5.364 0.235 8.790) 10.300 26.499 ( 5.106 -1.777 3.069) 6.217 26.567 ( 5.449 0.867 -0.928) 5.595 26.649 ( 6.160 1.516 -4.546) 7.805 27.132 ( 10.702 -0.965 0.834) 10.777 27.213 ( 11.363 -0.818 -5.289) 12.561 27.432 ( 3.420 2.833 8.530) 9.617 27.651 ( 5.908 0.251 -9.191) 10.929 28.097 ( 5.006 -0.045 2.370) 5.539 28.149 ( 4.329 -1.548 -0.834) 4.673 28.193 ( -0.433 -1.426 6.332) 6.505 28.372 ( -4.321 -1.971 -8.588) 9.814 29.286 ( 3.412 -4.067 1.522) 5.523 29.320 ( 3.763 -3.682 0.203) 5.268 29.507 ( 0.373 3.695 -1.420) 3.976 29.560 ( 0.447 2.321 -6.134) 6.574 29.999 ( 2.889 2.066 12.365) 12.865 30.212 ( 3.240 -2.392 -2.264) 4.620 30.375 ( 0.573 2.130 2.854) 3.607 30.532 ( 2.488 -0.198 -7.777) 8.167 31.286 ( 1.387 0.495 9.417) 9.531 31.471 ( 2.622 -0.845 -5.716) 6.346 32.089 ( -20.237 4.765 17.371) 27.092 32.479 ( -21.485 -2.580 -16.516) 27.222 ======================= Grid point 169 (59/72) ======================= q-point: ( 0.40 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.517 ( 18.987 -2.833 11.049) 22.149 3.712 ( 13.559 -3.407 -2.222) 14.156 3.912 ( 19.668 7.380 9.603) 23.097 4.122 ( -1.300 -2.713 -4.016) 5.018 4.395 ( 10.181 -13.401 3.393) 17.168 4.567 ( 9.546 -9.328 -10.933) 17.254 4.724 ( -6.331 -3.712 2.802) 7.856 4.815 ( -2.432 -3.247 -3.705) 5.494 5.083 ( 6.416 0.013 1.246) 6.536 5.113 ( 1.206 -3.627 -0.253) 3.831 5.313 ( -4.126 3.896 -1.895) 5.983 5.416 ( -2.084 2.744 -9.163) 9.789 5.696 ( 3.784 -4.842 0.112) 6.146 5.824 ( 3.101 -6.539 -8.447) 11.124 6.146 ( -1.824 2.733 1.910) 3.800 6.175 ( -5.718 -9.825 2.027) 11.547 6.314 ( 8.249 7.212 8.359) 13.782 6.513 ( 8.854 -0.898 -6.336) 10.925 6.717 ( 6.690 6.131 9.685) 13.272 6.835 ( -4.720 3.538 -0.750) 5.946 6.972 ( 7.786 -1.310 3.649) 8.698 7.111 ( 5.705 4.477 -5.257) 8.957 7.192 ( 7.634 5.292 6.281) 11.213 7.314 ( 7.257 8.870 -4.372) 12.266 7.405 ( 11.877 2.810 5.669) 13.457 7.542 ( 10.441 3.428 -5.766) 12.410 7.747 ( -0.430 -0.355 6.209) 6.234 7.821 ( -0.973 0.030 6.229) 6.305 7.926 ( 3.959 1.840 2.808) 5.191 8.063 ( 6.423 -0.079 -2.108) 6.760 8.254 ( 10.091 1.524 4.266) 11.061 8.307 ( 19.273 2.580 2.907) 19.661 8.468 ( -3.307 4.213 1.879) 5.676 8.683 ( -2.823 -0.326 -8.929) 9.370 8.822 ( -0.283 -1.276 5.339) 5.496 8.937 ( -6.860 1.099 -2.480) 7.377 9.026 ( -10.009 2.145 2.721) 10.592 9.058 ( -11.286 3.259 3.800) 12.347 9.139 ( 3.849 -2.908 4.948) 6.910 9.292 ( -4.850 0.364 -4.779) 6.819 9.371 ( 5.700 4.726 2.858) 7.937 9.479 ( -8.921 3.725 -2.633) 10.020 9.695 ( -11.456 3.620 1.213) 12.076 9.783 ( 0.727 -1.922 -4.107) 4.592 9.938 ( 1.005 5.040 2.544) 5.735 10.115 ( 4.273 -1.314 -7.082) 8.375 10.283 ( 4.744 -4.597 3.596) 7.521 10.446 ( 3.703 -5.595 -2.339) 7.105 10.521 ( -3.283 -1.577 -3.366) 4.959 10.669 ( -4.590 0.882 -9.122) 10.250 10.683 ( -16.016 0.582 9.324) 18.542 10.948 ( -10.828 -0.295 -11.528) 15.819 11.168 ( -4.965 -2.621 1.260) 5.755 11.219 ( -6.616 -4.260 -3.807) 8.742 11.324 ( -5.390 -0.289 -1.959) 5.742 11.439 ( -10.389 -3.203 -8.999) 14.112 11.697 ( 11.310 -0.893 13.369) 17.534 11.910 ( 10.977 -2.690 -2.883) 11.664 12.076 ( 0.066 -5.437 6.188) 8.237 12.173 ( -2.976 -3.942 -1.291) 5.106 12.261 ( 2.558 0.973 1.285) 3.024 12.352 ( 2.173 3.174 -1.743) 4.223 12.537 ( -6.017 1.279 9.591) 11.394 12.684 ( 0.155 -3.145 8.065) 8.658 12.702 ( -4.498 0.326 -1.671) 4.809 12.865 ( 0.466 -3.325 1.172) 3.556 12.948 ( -2.763 -1.947 -5.231) 6.229 13.006 ( -3.889 -2.429 -5.456) 7.127 13.135 ( -0.405 1.627 -2.692) 3.171 13.282 ( -2.476 5.302 -12.288) 13.610 13.546 ( -20.509 1.073 2.702) 20.714 13.659 ( -19.329 -0.394 -7.170) 20.620 14.284 ( 2.227 -1.847 5.053) 5.823 14.352 ( 2.115 -1.185 -1.213) 2.711 14.505 ( -6.170 4.859 1.881) 8.075 14.541 ( -4.198 3.927 -1.256) 5.884 15.229 ( 4.129 -2.780 5.507) 7.423 15.351 ( 9.454 -1.227 -5.129) 10.826 15.545 ( -5.220 0.340 9.566) 10.903 15.739 ( -6.410 -3.247 -6.935) 9.986 16.084 ( 5.994 5.657 7.240) 10.970 16.140 ( 5.155 2.423 6.492) 8.637 16.221 ( 6.369 2.706 -1.676) 7.120 16.286 ( 3.493 3.077 -4.971) 6.811 16.585 ( 10.329 -2.622 4.967) 11.758 16.751 ( 13.441 -5.743 -7.545) 16.449 17.011 ( -6.634 -4.172 10.038) 12.735 17.282 ( -8.193 -8.619 -12.793) 17.466 19.120 ( 25.602 4.697 6.815) 26.907 19.313 ( 27.448 1.922 -10.614) 29.491 20.248 ( -25.729 5.422 6.394) 27.060 20.370 ( 7.919 -1.287 0.373) 8.032 20.425 ( -8.495 2.423 -3.549) 9.520 20.472 ( 8.649 0.181 -3.470) 9.321 21.200 ( -21.251 -1.218 4.791) 21.819 21.304 ( -21.189 -2.316 -4.443) 21.774 26.471 ( 3.324 -0.469 8.940) 9.549 26.566 ( 1.769 -0.364 6.568) 6.812 26.631 ( 1.684 -0.318 -1.939) 2.588 26.722 ( 1.734 1.881 -3.864) 4.634 27.299 ( 6.448 -2.057 3.823) 7.773 27.422 ( 8.836 -1.417 -2.960) 9.426 27.493 ( 3.672 3.455 1.987) 5.419 27.718 ( 0.272 0.068 -13.119) 13.122 28.167 ( -1.122 -1.319 6.020) 6.264 28.178 ( 1.835 0.203 0.848) 2.032 28.195 ( 1.983 -0.262 -1.298) 2.384 28.313 ( -1.972 -0.565 -6.314) 6.639 29.347 ( 2.467 -1.844 4.554) 5.498 29.389 ( 3.134 -0.524 2.869) 4.281 29.517 ( 0.654 0.598 -3.957) 4.055 29.565 ( -0.059 -0.123 -7.297) 7.299 30.078 ( 4.903 0.915 13.372) 14.272 30.258 ( 0.821 -1.926 7.522) 7.808 30.374 ( -0.189 1.227 -3.503) 3.716 30.554 ( -0.060 3.138 -9.804) 10.295 31.335 ( 3.571 -1.758 11.487) 12.157 31.559 ( 6.318 -2.301 -5.136) 8.461 31.771 ( -12.205 5.036 10.704) 16.997 32.098 ( -17.648 -1.504 -15.085) 23.266 ======================= Grid point 170 (60/72) ======================= q-point: (-0.50 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.760 ( 0.000 -6.950 4.141) 8.090 3.861 ( 0.000 -5.239 -4.395) 6.839 3.982 ( 0.000 6.908 10.571) 12.627 4.198 ( 0.000 10.595 -7.801) 13.157 4.540 ( 0.000 -9.677 10.834) 14.527 4.553 ( -0.000 -6.619 5.948) 8.899 4.726 ( 0.000 -4.529 -8.957) 10.036 4.768 ( 0.000 1.158 -3.251) 3.451 5.068 ( 0.000 -5.188 -3.372) 6.188 5.162 ( 0.000 -0.692 14.467) 14.484 5.258 ( -0.000 -2.532 -13.582) 13.816 5.417 ( 0.000 0.457 -9.227) 9.238 5.778 ( 0.000 -8.401 -0.228) 8.404 5.915 ( 0.000 -9.584 -9.476) 13.478 6.022 ( 0.000 -4.300 3.566) 5.586 6.118 ( -0.000 -6.498 -3.416) 7.341 6.398 ( 0.000 6.905 8.577) 11.012 6.603 ( 0.000 3.369 9.144) 9.744 6.626 ( -0.000 0.846 -9.975) 10.011 6.792 ( 0.000 -2.036 -5.975) 6.312 7.121 ( 0.000 2.596 8.818) 9.192 7.241 ( 0.000 1.162 -0.446) 1.245 7.333 ( 0.000 8.724 15.292) 17.606 7.450 ( 0.000 7.653 6.925) 10.321 7.495 ( -0.000 1.037 -0.128) 1.044 7.588 ( 0.000 -1.470 -7.470) 7.614 7.655 ( 0.000 5.305 -3.294) 6.245 7.686 ( -0.000 -0.044 0.589) 0.590 8.166 ( 0.000 3.345 15.706) 16.058 8.208 ( 0.000 -0.257 8.504) 8.508 8.392 ( -0.000 1.944 -1.847) 2.682 8.450 ( 0.000 1.471 -2.653) 3.033 8.607 ( -0.000 4.032 0.899) 4.131 8.620 ( 0.000 4.318 -0.837) 4.399 8.737 ( 0.000 7.530 -4.801) 8.931 8.755 ( -0.000 5.318 -8.722) 10.216 8.853 ( 0.000 1.281 4.355) 4.540 8.994 ( 0.000 0.982 -6.876) 6.946 9.055 ( -0.000 7.386 7.685) 10.659 9.164 ( 0.000 5.208 0.062) 5.208 9.511 ( 0.000 -1.203 7.268) 7.367 9.526 ( -0.000 0.828 9.564) 9.600 9.680 ( -0.000 -4.381 -7.201) 8.429 9.754 ( 0.000 -0.141 -10.025) 10.026 10.094 ( 0.000 -2.280 6.068) 6.482 10.170 ( -0.000 1.726 6.647) 6.867 10.214 ( 0.000 -4.627 -4.981) 6.798 10.345 ( -0.000 0.719 -8.467) 8.498 10.517 ( 0.000 0.551 3.216) 3.263 10.542 ( -0.000 -0.684 6.397) 6.433 10.738 ( -0.000 -2.512 -9.372) 9.703 10.755 ( 0.000 -1.486 -12.452) 12.540 11.054 ( 0.000 -7.589 3.547) 8.377 11.221 ( 0.000 -2.768 -11.445) 11.774 11.252 ( -0.000 -1.168 -3.398) 3.593 11.288 ( 0.000 3.038 -7.015) 7.645 11.889 ( 0.000 -6.151 12.311) 13.762 11.935 ( 0.000 -3.589 11.550) 12.095 12.093 ( 0.000 -4.590 -1.042) 4.706 12.137 ( 0.000 -3.630 -7.977) 8.764 12.369 ( 0.000 1.761 4.821) 5.133 12.397 ( -0.000 1.228 7.559) 7.658 12.500 ( -0.000 0.196 -5.079) 5.083 12.501 ( 0.000 0.057 -2.389) 2.390 12.704 ( 0.000 -4.270 7.271) 8.433 12.884 ( 0.000 2.393 5.990) 6.450 12.925 ( 0.000 -1.075 -10.338) 10.394 12.988 ( 0.000 -4.179 1.695) 4.510 13.207 ( 0.000 1.912 -3.080) 3.625 13.226 ( -0.000 0.976 3.790) 3.914 13.336 ( 0.000 0.042 -13.104) 13.104 13.384 ( -0.000 -0.123 -9.511) 9.512 14.341 ( 0.000 2.798 4.416) 5.227 14.379 ( 0.000 4.495 6.456) 7.867 14.419 ( 0.000 0.433 -3.002) 3.033 14.490 ( 0.000 3.780 -3.860) 5.403 15.301 ( 0.000 -5.241 10.019) 11.307 15.458 ( 0.000 2.885 6.909) 7.487 15.526 ( 0.000 -4.315 -9.772) 10.682 15.596 ( 0.000 0.521 -5.830) 5.854 16.146 ( 0.000 3.334 7.384) 8.101 16.193 ( 0.000 3.737 7.747) 8.601 16.292 ( 0.000 3.043 -4.728) 5.622 16.315 ( 0.000 1.974 -1.519) 2.490 16.797 ( -0.000 -3.632 8.608) 9.343 16.800 ( 0.000 -4.609 10.961) 11.891 17.044 ( -0.000 -7.352 -11.916) 14.002 17.061 ( 0.000 -6.520 -11.524) 13.240 19.629 ( 0.000 3.903 7.337) 8.311 19.723 ( -0.000 8.260 8.289) 11.702 19.824 ( 0.000 0.981 -10.138) 10.185 19.925 ( -0.000 5.479 -9.764) 11.196 20.753 ( 0.000 -2.896 4.793) 5.600 20.801 ( 0.000 -0.524 4.216) 4.248 20.857 ( 0.000 -3.417 -4.411) 5.580 20.888 ( -0.000 -1.825 -3.521) 3.966 26.508 ( 0.000 -1.408 8.482) 8.598 26.576 ( 0.000 1.917 9.777) 9.963 26.647 ( 0.000 -2.113 -3.575) 4.152 26.735 ( 0.000 2.012 -3.730) 4.238 27.366 ( 0.000 -2.087 6.608) 6.930 27.480 ( 0.000 3.486 5.636) 6.627 27.600 ( 0.000 -3.110 -13.473) 13.828 27.673 ( 0.000 0.285 -11.321) 11.324 28.167 ( 0.000 0.130 4.893) 4.895 28.168 ( -0.000 0.392 3.314) 3.337 28.243 ( 0.000 -0.868 -3.284) 3.397 28.282 ( 0.000 1.039 -5.367) 5.466 29.371 ( 0.000 -0.787 6.024) 6.075 29.424 ( 0.000 1.776 5.237) 5.529 29.525 ( 0.000 -2.360 -7.414) 7.781 29.562 ( -0.000 -0.666 -6.639) 6.672 30.147 ( 0.000 -1.517 12.462) 12.554 30.245 ( 0.000 2.649 15.525) 15.749 30.378 ( 0.000 -2.748 -8.310) 8.752 30.548 ( 0.000 5.799 -11.331) 12.729 31.390 ( 0.000 -4.879 14.966) 15.742 31.595 ( 0.000 4.984 11.957) 12.954 31.728 ( 0.000 -4.055 -14.772) 15.318 31.858 ( 0.000 2.215 -11.325) 11.540 ======================= Grid point 176 (61/72) ======================= q-point: ( 0.00 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.433 ( 0.000 24.133 27.527) 36.608 2.437 ( 0.000 24.849 20.888) 32.462 2.849 ( 0.000 8.905 -5.352) 10.389 3.050 ( 0.000 17.515 -16.795) 24.266 3.478 ( 0.000 -1.315 2.986) 3.262 3.508 ( 0.000 -17.612 5.126) 18.343 3.686 ( 0.000 -10.262 -12.247) 15.978 3.716 ( 0.000 -1.365 -4.793) 4.983 4.441 ( 0.000 -5.238 11.088) 12.263 4.567 ( 0.000 -10.123 0.686) 10.146 4.931 ( 0.000 1.715 2.489) 3.022 5.034 ( 0.000 -0.923 -6.771) 6.834 5.425 ( 0.000 7.912 11.085) 13.619 5.551 ( 0.000 -8.691 -1.301) 8.788 5.557 ( 0.000 -3.500 -0.264) 3.510 5.764 ( 0.000 1.620 -9.745) 9.878 6.194 ( 0.000 16.196 8.031) 18.077 6.301 ( 0.000 14.920 -1.015) 14.955 6.414 ( 0.000 8.064 1.926) 8.291 6.477 ( 0.000 -2.681 -3.675) 4.549 6.520 ( 0.000 0.484 9.354) 9.366 6.783 ( 0.000 6.294 -14.252) 15.580 6.975 ( 0.000 1.208 6.612) 6.721 7.073 ( 0.000 -3.163 2.842) 4.252 7.211 ( 0.000 -6.850 6.520) 9.457 7.313 ( 0.000 0.071 -3.648) 3.649 7.588 ( 0.000 -13.912 5.087) 14.813 7.772 ( 0.000 -15.618 -10.389) 18.758 8.042 ( 0.000 0.243 -2.115) 2.129 8.059 ( 0.000 -8.249 -4.389) 9.344 8.261 ( 0.000 -10.993 5.004) 12.078 8.353 ( 0.000 -5.042 -3.757) 6.288 8.430 ( 0.000 -1.443 0.365) 1.489 8.546 ( 0.000 -9.167 -8.857) 12.746 9.148 ( 0.000 0.201 0.890) 0.913 9.210 ( 0.000 -3.274 -3.948) 5.129 9.392 ( 0.000 6.567 -0.737) 6.608 9.424 ( 0.000 7.280 -3.350) 8.014 9.644 ( 0.000 4.465 5.798) 7.318 9.748 ( 0.000 4.879 -3.854) 6.218 9.872 ( 0.000 1.786 3.745) 4.149 9.930 ( 0.000 2.145 -0.850) 2.307 10.117 ( 0.000 5.131 3.211) 6.053 10.124 ( 0.000 6.377 4.006) 7.531 10.257 ( 0.000 2.528 3.529) 4.341 10.266 ( 0.000 7.593 0.507) 7.610 10.452 ( 0.000 2.918 8.765) 9.238 10.539 ( 0.000 0.263 1.526) 1.548 10.745 ( 0.000 -0.444 2.395) 2.435 10.873 ( 0.000 -4.702 -2.667) 5.405 10.952 ( 0.000 1.051 -8.673) 8.737 10.973 ( 0.000 0.480 -3.755) 3.786 11.261 ( 0.000 -6.852 8.115) 10.620 11.417 ( 0.000 -10.399 -4.896) 11.494 11.510 ( 0.000 -12.187 -2.594) 12.460 11.516 ( 0.000 -15.324 -3.483) 15.715 11.715 ( 0.000 3.889 2.337) 4.537 11.791 ( 0.000 0.985 -3.864) 3.988 12.065 ( 0.000 2.618 3.101) 4.058 12.081 ( 0.000 5.712 0.838) 5.773 12.337 ( 0.000 -6.633 1.870) 6.892 12.340 ( 0.000 -4.556 -0.516) 4.585 12.671 ( 0.000 0.729 3.195) 3.277 12.717 ( 0.000 0.196 1.477) 1.490 12.978 ( 0.000 0.242 -1.552) 1.571 13.044 ( 0.000 -1.900 -4.744) 5.110 13.398 ( 0.000 4.971 7.532) 9.024 13.489 ( 0.000 1.270 0.663) 1.432 13.760 ( 0.000 3.751 5.975) 7.055 13.804 ( 0.000 4.670 4.825) 6.715 13.938 ( 0.000 4.284 0.571) 4.322 14.084 ( 0.000 2.563 -9.068) 9.423 14.230 ( 0.000 -1.893 -0.460) 1.948 14.334 ( 0.000 -8.040 -8.762) 11.892 14.506 ( 0.000 -2.440 -1.094) 2.674 14.536 ( 0.000 -2.537 -4.710) 5.350 14.974 ( 0.000 0.844 -0.338) 0.909 14.997 ( 0.000 0.089 -2.608) 2.610 15.426 ( 0.000 3.438 0.370) 3.458 15.454 ( 0.000 2.242 -2.434) 3.309 15.626 ( 0.000 4.567 -2.210) 5.074 15.674 ( 0.000 2.209 -6.042) 6.433 15.933 ( 0.000 7.542 0.230) 7.546 15.940 ( 0.000 7.224 -0.716) 7.259 16.498 ( 0.000 -0.686 3.203) 3.276 16.522 ( 0.000 -2.515 0.856) 2.657 17.046 ( 0.000 9.468 9.479) 13.397 17.200 ( 0.000 6.110 -3.540) 7.061 18.550 ( 0.000 -8.328 1.862) 8.534 18.674 ( 0.000 -11.104 -8.951) 14.263 19.870 ( 0.000 -2.071 4.632) 5.074 19.907 ( 0.000 -4.001 1.556) 4.293 21.606 ( 0.000 4.356 -0.352) 4.370 21.608 ( 0.000 4.441 -0.708) 4.497 22.033 ( 0.000 -1.366 0.255) 1.390 22.040 ( 0.000 -1.712 -0.392) 1.756 26.099 ( 0.000 0.236 1.524) 1.542 26.101 ( 0.000 -0.087 0.311) 0.322 26.122 ( 0.000 2.029 1.957) 2.819 26.210 ( 0.000 -2.134 -4.649) 5.116 26.718 ( 0.000 2.468 1.909) 3.120 26.785 ( 0.000 -1.052 -3.863) 4.004 27.242 ( 0.000 0.219 0.480) 0.527 27.244 ( 0.000 0.086 0.254) 0.268 27.886 ( 0.000 -0.402 6.047) 6.061 27.895 ( 0.000 -0.193 3.318) 3.323 28.230 ( 0.000 5.402 10.731) 12.014 28.441 ( 0.000 -5.675 -2.879) 6.364 29.061 ( 0.000 -2.565 -3.981) 4.736 29.089 ( 0.000 -3.745 -4.533) 5.880 29.687 ( 0.000 5.474 -0.658) 5.514 29.688 ( 0.000 5.553 0.637) 5.589 29.987 ( 0.000 0.453 1.672) 1.733 30.021 ( 0.000 -1.833 0.383) 1.873 30.300 ( 0.000 -0.951 -1.242) 1.564 30.322 ( 0.000 -1.708 -2.377) 2.927 31.368 ( 0.000 3.005 7.896) 8.448 31.461 ( 0.000 -1.023 0.869) 1.342 33.187 ( 0.000 0.207 -0.029) 0.209 33.286 ( 0.000 -4.790 -7.672) 9.044 ======================= Grid point 177 (62/72) ======================= q-point: ( 0.10 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.378 ( 5.088 22.521 24.961) 34.002 2.797 ( 16.821 18.494 23.173) 34.088 2.878 ( 14.684 13.210 -12.824) 23.549 3.383 ( 23.099 12.966 -16.972) 31.460 3.527 ( 7.437 -20.370 6.407) 22.612 3.654 ( 9.092 -5.822 3.284) 11.285 3.818 ( 19.340 -4.342 -3.130) 20.067 3.993 ( 21.678 -9.276 -12.932) 26.892 4.496 ( 7.873 -5.198 9.752) 13.568 4.592 ( 5.118 -8.153 2.008) 9.833 4.975 ( 6.059 0.795 4.565) 7.628 5.124 ( 7.383 -4.190 -8.325) 11.890 5.439 ( 2.597 5.236 11.046) 12.497 5.626 ( 7.925 -4.509 -4.018) 9.964 5.664 ( 10.899 2.202 2.502) 11.397 5.825 ( 6.138 0.179 -7.245) 9.497 6.149 ( -4.821 11.103 7.210) 14.089 6.251 ( -7.011 7.853 -1.610) 10.650 6.367 ( -0.993 7.406 2.862) 8.002 6.434 ( 0.515 5.380 -0.555) 5.433 6.625 ( 6.118 4.384 5.072) 9.076 6.808 ( -0.016 5.060 -11.351) 12.428 6.970 ( 1.404 2.553 3.336) 4.429 7.030 ( -3.986 -4.097 1.973) 6.047 7.218 ( 2.941 -5.212 6.434) 8.787 7.347 ( 2.062 1.935 -1.770) 3.337 7.659 ( 7.338 -11.179 0.795) 13.396 7.765 ( 0.421 -14.765 -7.777) 16.693 8.052 ( 0.040 1.634 1.719) 2.372 8.132 ( 3.415 -2.637 -3.241) 5.397 8.261 ( -3.005 -3.712 1.947) 5.158 8.335 ( -3.654 -3.516 -4.226) 6.601 8.434 ( 6.486 -9.788 4.337) 12.517 8.609 ( 5.725 -8.274 -9.680) 13.962 9.039 ( -9.901 2.621 1.857) 10.409 9.120 ( -9.719 0.700 -4.147) 10.590 9.276 ( -9.464 5.373 1.503) 10.986 9.349 ( -7.968 6.428 -4.999) 11.393 9.597 ( -5.926 -0.197 3.245) 6.759 9.638 ( -9.591 -2.384 -0.247) 9.886 9.795 ( -6.606 6.930 3.455) 10.179 9.879 ( -6.274 3.163 -2.042) 7.317 9.961 ( -8.876 4.513 4.167) 10.794 10.063 ( -3.418 2.843 -2.919) 5.318 10.196 ( -3.384 -1.674 6.671) 7.665 10.281 ( -3.209 -3.366 3.120) 5.600 10.513 ( -2.743 -3.002 8.126) 9.087 10.552 ( 2.853 0.928 2.426) 3.858 10.746 ( -4.681 -2.045 -1.450) 5.310 10.867 ( 1.998 2.662 -5.807) 6.694 10.976 ( 6.542 1.807 0.791) 6.833 11.039 ( 4.443 3.177 -5.595) 7.819 11.276 ( 2.174 -3.275 4.286) 5.816 11.359 ( -3.393 -8.088 -1.604) 8.917 11.498 ( -1.687 -5.596 -1.539) 6.044 11.576 ( 1.455 -4.854 -7.361) 8.937 11.669 ( -3.064 0.329 2.586) 4.023 11.756 ( -3.253 -1.591 -4.399) 5.697 12.044 ( -0.774 1.820 2.329) 3.055 12.067 ( -1.953 2.511 -0.378) 3.203 12.307 ( -1.446 -2.786 3.590) 4.769 12.339 ( -0.289 -3.767 1.601) 4.103 12.677 ( 1.201 2.023 2.215) 3.231 12.774 ( 3.378 -1.898 -3.170) 5.007 12.938 ( -2.147 2.963 6.531) 7.486 13.089 ( -1.526 2.980 -2.063) 3.933 13.396 ( -5.378 0.610 0.757) 5.466 13.433 ( -3.422 -1.292 -2.711) 4.553 13.553 ( -8.759 4.987 8.881) 13.433 13.769 ( -8.013 9.102 -8.447) 14.779 13.967 ( 1.874 -3.723 5.988) 7.296 14.100 ( -2.664 -0.793 -5.208) 5.904 14.217 ( 0.439 -5.402 -0.247) 5.425 14.275 ( -2.500 -7.610 -5.298) 9.604 14.497 ( 1.539 -1.983 3.334) 4.173 14.619 ( 5.329 -1.156 -7.544) 9.308 15.092 ( 8.478 2.102 3.697) 9.485 15.151 ( 13.675 -0.211 -1.945) 13.814 15.355 ( -1.949 1.716 1.020) 2.790 15.443 ( 1.864 0.981 -6.373) 6.712 15.712 ( 4.106 1.840 0.435) 4.520 15.781 ( 7.511 0.637 -5.282) 9.204 15.992 ( 4.792 7.923 1.698) 9.414 16.069 ( 10.537 7.169 -5.663) 13.946 16.435 ( -3.123 -1.253 5.317) 6.292 16.508 ( -1.119 -1.951 -1.221) 2.559 16.963 ( -6.980 8.931 10.193) 15.244 17.147 ( -4.509 5.862 -5.878) 9.446 18.532 ( -0.899 -7.395 1.699) 7.641 18.650 ( -1.884 -10.253 -8.478) 13.436 19.858 ( -0.516 -1.727 4.179) 4.551 19.895 ( -0.448 -3.320 1.027) 3.504 21.532 ( -7.169 4.936 1.034) 8.765 21.565 ( -5.893 3.846 -1.901) 7.289 21.989 ( -4.561 -0.369 1.020) 4.688 22.014 ( -3.533 -1.238 -1.189) 3.928 26.151 ( 5.585 0.931 4.440) 7.195 26.186 ( 7.699 -0.483 1.753) 7.910 26.231 ( 9.450 0.488 -1.786) 9.629 26.288 ( 7.918 -1.441 -5.081) 9.518 26.779 ( 6.091 2.246 1.706) 6.712 26.845 ( 6.033 -0.832 -3.930) 7.248 27.280 ( 4.367 0.401 2.584) 5.090 27.331 ( 7.486 -0.511 -2.092) 7.789 27.909 ( 2.383 -0.722 5.901) 6.405 27.919 ( 2.722 -0.493 2.991) 4.074 28.225 ( -0.517 4.117 9.666) 10.519 28.430 ( -1.177 -5.036 -4.040) 6.563 29.075 ( 1.523 -3.316 -3.025) 4.740 29.109 ( 2.126 -3.120 -4.729) 6.052 29.653 ( -2.458 4.574 0.961) 5.281 29.673 ( -1.973 4.719 -1.500) 5.330 29.992 ( 0.925 1.182 4.161) 4.423 30.061 ( 3.205 -0.990 -0.485) 3.389 30.314 ( 1.462 -1.055 -0.807) 1.975 30.351 ( 2.986 -1.744 -3.277) 4.764 31.352 ( -1.488 2.876 8.400) 9.003 31.455 ( -0.571 -0.878 0.527) 1.173 33.015 ( -16.568 2.285 2.300) 16.882 33.154 ( -13.225 -4.924 -9.062) 16.771 ======================= Grid point 178 (63/72) ======================= q-point: ( 0.20 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.602 ( 17.965 11.171 23.736) 31.795 3.072 ( 15.754 7.302 -12.195) 21.219 3.270 ( 19.728 13.878 18.514) 30.407 3.620 ( 6.990 -22.119 4.451) 23.621 3.799 ( 14.188 -1.704 -12.199) 18.789 3.914 ( 13.905 -8.471 -11.682) 20.039 4.217 ( 19.697 -5.171 3.281) 20.627 4.389 ( 18.323 -3.070 -7.087) 19.885 4.755 ( 11.362 -4.465 3.082) 12.591 4.794 ( 15.211 -4.376 0.653) 15.841 5.249 ( 21.879 -6.848 4.491) 23.361 5.354 ( 20.244 -3.129 -3.469) 20.776 5.550 ( 7.375 11.109 12.419) 18.222 5.789 ( -0.476 6.170 0.410) 6.202 5.874 ( 8.424 4.182 -3.440) 10.014 5.953 ( 2.022 5.068 -5.319) 7.620 6.144 ( 12.947 -1.076 2.240) 13.183 6.180 ( 8.812 -0.074 -0.382) 8.821 6.411 ( 7.307 6.116 5.011) 10.766 6.497 ( 6.305 5.222 0.783) 8.224 6.673 ( -5.599 -1.510 -0.837) 5.859 6.721 ( -1.805 -0.395 -4.812) 5.154 7.037 ( 6.797 4.659 2.821) 8.710 7.089 ( 7.911 5.267 -1.833) 9.679 7.307 ( 5.615 -1.106 7.234) 9.223 7.437 ( 7.821 3.745 -0.237) 8.675 7.758 ( -1.319 0.256 -2.303) 2.666 7.807 ( 2.240 -3.974 -7.145) 8.477 7.944 ( -10.733 3.865 8.474) 14.211 8.129 ( 0.343 0.528 4.252) 4.298 8.154 ( -6.376 -2.340 -6.701) 9.541 8.300 ( -0.463 -2.552 -6.295) 6.809 8.616 ( 7.895 -4.001 4.507) 9.932 8.708 ( 0.580 -1.200 -2.010) 2.412 8.832 ( -8.896 3.177 3.585) 10.104 8.902 ( -7.762 0.690 -2.267) 8.115 9.127 ( -5.136 -3.210 0.906) 6.123 9.174 ( -7.128 1.932 -1.171) 7.478 9.470 ( -8.785 -1.560 -0.469) 8.935 9.489 ( -3.846 -6.026 -2.938) 7.728 9.595 ( -10.352 -7.578 0.487) 12.838 9.626 ( -14.507 -5.901 -0.370) 15.666 9.914 ( -3.486 5.400 5.664) 8.567 10.009 ( -4.579 5.960 0.423) 7.528 10.111 ( -3.109 -2.401 1.153) 4.094 10.196 ( -4.921 -0.448 -1.534) 5.174 10.392 ( -5.273 -0.192 11.466) 12.622 10.534 ( -4.648 -2.879 -2.688) 6.093 10.640 ( -5.840 -3.242 1.276) 6.800 10.861 ( -5.851 5.418 -8.671) 11.781 11.096 ( 5.566 0.346 0.412) 5.592 11.153 ( 5.223 2.778 -3.049) 6.655 11.274 ( -5.483 2.314 1.729) 6.198 11.339 ( -0.234 -6.097 -1.867) 6.381 11.449 ( -0.350 3.055 -1.360) 3.363 11.501 ( -4.998 2.315 -3.730) 6.652 11.624 ( -5.117 -4.040 0.904) 6.582 11.715 ( 0.108 -3.102 -6.521) 7.222 12.045 ( 0.403 0.700 3.095) 3.199 12.059 ( 1.447 0.551 1.880) 2.435 12.278 ( -0.394 -3.190 4.366) 5.421 12.357 ( 1.389 -3.949 0.082) 4.187 12.686 ( -0.748 1.486 3.782) 4.131 12.816 ( -0.349 0.273 -2.083) 2.130 12.839 ( -8.669 7.107 5.387) 12.437 12.966 ( -8.598 2.475 1.886) 9.143 13.186 ( -11.418 2.346 -1.119) 11.710 13.289 ( -9.912 -1.591 -4.460) 10.985 13.485 ( -5.582 2.468 -0.877) 6.166 13.604 ( -7.386 5.808 -8.134) 12.427 13.986 ( -0.316 -5.167 4.826) 7.077 14.084 ( 0.313 -5.105 -3.441) 6.164 14.169 ( -3.205 -5.436 3.153) 7.054 14.261 ( -0.106 -5.023 -4.670) 6.859 14.555 ( 3.246 -0.599 5.125) 6.096 14.698 ( 2.210 -0.274 -7.936) 8.242 15.189 ( 0.324 1.516 9.391) 9.519 15.313 ( 0.115 1.644 -1.645) 2.328 15.442 ( 10.500 -1.875 2.452) 10.945 15.599 ( 9.658 -5.665 -8.893) 14.299 15.782 ( 7.028 2.178 2.514) 7.776 15.836 ( -0.246 2.036 -1.076) 2.316 16.087 ( 6.302 3.596 2.194) 7.580 16.199 ( 2.541 -1.113 -6.622) 7.180 16.450 ( 2.984 6.741 4.743) 8.766 16.553 ( 3.342 4.825 -3.537) 6.853 16.877 ( 0.653 2.227 9.156) 9.445 17.090 ( 0.164 -1.881 -9.515) 9.701 18.568 ( 5.800 -3.925 0.607) 7.029 18.651 ( 3.956 -5.688 -6.425) 9.449 19.886 ( 4.152 -1.486 3.346) 5.536 19.927 ( 4.472 -2.538 -0.165) 5.145 21.314 ( -15.851 5.853 2.168) 17.036 21.366 ( -14.916 3.993 -2.364) 15.621 21.842 ( -11.033 0.366 1.662) 11.163 21.885 ( -10.062 -1.195 -2.118) 10.352 26.279 ( 6.841 0.705 6.050) 9.160 26.346 ( 7.817 -1.025 3.177) 8.499 26.423 ( 9.859 0.136 -2.454) 10.161 26.491 ( 11.613 -0.034 -5.420) 12.816 26.934 ( 9.338 1.115 1.821) 9.579 27.003 ( 9.813 -0.292 -3.997) 10.600 27.383 ( 5.840 1.302 4.677) 7.594 27.498 ( 9.001 -0.785 -5.324) 10.487 27.979 ( 4.921 -1.249 5.540) 7.514 28.004 ( 5.796 -1.074 1.802) 6.164 28.206 ( -1.635 1.046 6.850) 7.119 28.392 ( -2.837 -3.428 -6.095) 7.547 29.125 ( 3.702 -3.898 -1.187) 5.506 29.171 ( 4.350 -2.315 -4.454) 6.642 29.607 ( -2.172 3.710 0.659) 4.349 29.628 ( -2.275 2.656 -1.906) 3.983 30.017 ( 1.540 3.103 7.275) 8.057 30.122 ( 2.838 -1.301 0.275) 3.134 30.353 ( 2.319 -0.818 -0.006) 2.459 30.431 ( 5.048 -1.469 -5.504) 7.612 31.321 ( -1.542 2.342 9.308) 9.721 31.444 ( -0.376 -0.741 -0.177) 0.849 32.620 ( -22.723 5.230 5.198) 23.889 32.817 ( -20.521 -4.894 -11.212) 23.890 ======================= Grid point 179 (64/72) ======================= q-point: ( 0.30 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.028 ( 24.510 1.468 18.325) 30.639 3.370 ( 14.388 -4.319 -9.067) 17.547 3.629 ( 17.212 7.354 15.564) 24.343 3.810 ( 14.834 -10.378 10.650) 21.004 4.054 ( 13.722 -3.781 -15.285) 20.886 4.147 ( 11.827 -11.838 -13.052) 21.222 4.515 ( 11.318 -6.220 2.115) 13.086 4.628 ( 6.657 -1.593 -6.843) 9.679 4.944 ( 8.572 -5.831 1.786) 10.520 5.010 ( 7.246 -3.577 -3.004) 8.621 5.495 ( -10.298 1.717 6.180) 12.132 5.571 ( -5.036 2.682 0.984) 5.790 5.703 ( 10.433 3.701 4.826) 12.076 5.831 ( 9.258 -0.779 -0.459) 9.302 5.882 ( -1.172 3.440 -3.765) 5.233 6.009 ( 7.768 -2.884 -8.639) 11.971 6.391 ( 5.037 6.846 6.021) 10.416 6.432 ( 0.305 4.049 1.469) 4.318 6.644 ( 24.489 1.336 -0.964) 24.544 6.659 ( 10.815 -1.122 -3.258) 11.351 6.899 ( 24.783 0.501 4.799) 25.248 6.942 ( 29.219 3.619 2.233) 29.527 7.142 ( -1.340 7.009 1.829) 7.367 7.188 ( 6.788 5.098 -2.324) 8.801 7.452 ( 3.674 -1.952 7.229) 8.340 7.503 ( 0.360 3.299 3.342) 4.710 7.577 ( -12.047 5.301 -3.464) 13.611 7.755 ( 4.707 3.685 -8.057) 10.033 7.963 ( 3.888 1.823 7.298) 8.468 8.010 ( -4.814 1.127 2.330) 5.466 8.193 ( 1.975 1.178 -0.807) 2.438 8.279 ( -0.125 -1.136 -5.171) 5.296 8.622 ( -3.755 5.475 3.410) 7.464 8.683 ( 0.747 2.500 2.158) 3.386 8.756 ( 0.300 0.342 3.964) 3.990 8.880 ( 4.229 -1.598 -2.556) 5.193 9.066 ( -2.639 -1.937 4.992) 5.969 9.120 ( -3.396 -2.685 -0.352) 4.344 9.256 ( -9.340 -2.460 3.537) 10.286 9.381 ( -4.194 -5.177 -3.305) 7.437 9.475 ( -0.362 -4.601 0.881) 4.698 9.575 ( 0.522 -7.104 -6.341) 9.537 9.759 ( -7.385 2.489 4.230) 8.867 9.862 ( -8.883 -1.928 -3.810) 9.855 10.060 ( -1.084 1.603 4.711) 5.093 10.176 ( -2.115 3.501 -5.343) 6.729 10.281 ( -7.029 0.634 10.862) 12.953 10.457 ( -8.293 -3.552 -1.213) 9.103 10.482 ( -3.159 -0.037 -0.506) 3.200 10.742 ( -4.344 4.324 -11.328) 12.880 11.012 ( -14.076 0.780 4.298) 14.738 11.128 ( -6.722 -1.002 -5.568) 8.786 11.230 ( -2.321 1.872 -4.033) 5.016 11.271 ( -4.182 -2.017 -9.283) 10.379 11.405 ( -6.981 -4.471 2.724) 8.726 11.459 ( -1.961 -2.124 -0.732) 2.982 11.600 ( 4.153 1.847 5.497) 7.133 11.738 ( 4.486 0.268 -6.176) 7.638 12.017 ( -3.316 -0.124 5.438) 6.371 12.093 ( 1.193 -2.954 -1.335) 3.455 12.326 ( 4.811 -1.002 2.876) 5.693 12.363 ( -2.555 -2.432 0.245) 3.536 12.614 ( -4.800 1.155 7.594) 9.057 12.663 ( -7.144 0.545 4.562) 8.494 12.749 ( -3.881 0.204 0.812) 3.970 12.874 ( -2.067 0.152 -0.948) 2.279 12.999 ( -9.269 -0.539 -3.496) 9.921 13.092 ( -9.236 -2.828 -7.451) 12.199 13.340 ( -7.793 6.380 0.201) 10.074 13.467 ( -7.030 2.818 -9.795) 12.382 13.891 ( -12.074 -1.910 3.704) 12.773 13.956 ( -13.015 -5.400 -1.254) 14.147 14.194 ( 4.190 -0.249 2.705) 4.994 14.281 ( 2.872 -0.501 -3.982) 4.935 14.594 ( 0.354 -1.028 3.838) 3.989 14.683 ( -4.038 0.550 -3.679) 5.490 15.160 ( -0.831 -0.842 6.194) 6.306 15.273 ( -1.153 2.523 -3.610) 4.553 15.564 ( 2.142 -1.606 5.781) 6.371 15.687 ( 2.124 -5.389 -3.529) 6.783 15.956 ( 12.371 0.958 4.558) 13.219 16.034 ( 13.041 -0.523 -0.088) 13.052 16.196 ( 4.392 5.949 -0.053) 7.395 16.255 ( 4.383 0.009 -1.442) 4.614 16.476 ( 0.852 6.363 1.457) 6.583 16.571 ( 1.075 4.759 -4.862) 6.887 16.944 ( 2.392 -5.295 6.733) 8.894 17.132 ( 1.484 -11.052 -9.483) 14.638 18.783 ( 17.341 2.157 1.840) 17.571 18.873 ( 19.344 -0.522 -6.149) 20.304 20.036 ( 11.701 -1.718 2.660) 12.122 20.084 ( 11.987 -2.702 -1.373) 12.364 20.929 ( -23.753 7.132 3.361) 25.028 21.002 ( -22.523 4.182 -3.062) 23.111 21.563 ( -17.767 -0.116 2.327) 17.919 21.624 ( -16.980 -2.401 -3.008) 17.411 26.393 ( 4.766 0.163 6.945) 8.425 26.472 ( 5.283 -1.011 3.090) 6.204 26.580 ( 5.723 0.478 0.256) 5.749 26.677 ( 6.887 1.181 -4.883) 8.525 27.112 ( 8.916 -0.886 2.999) 9.449 27.199 ( 10.195 -0.605 -4.157) 11.027 27.495 ( 5.493 3.407 4.156) 7.684 27.651 ( 6.349 -0.305 -8.662) 10.744 28.084 ( 5.254 -1.548 5.273) 7.603 28.117 ( 5.014 -1.031 1.328) 5.289 28.170 ( -1.235 -0.880 2.824) 3.205 28.331 ( -2.929 -1.914 -6.997) 7.823 29.213 ( 5.272 -3.131 0.822) 6.187 29.269 ( 5.560 -1.609 -3.272) 6.649 29.569 ( -1.768 2.584 -0.103) 3.133 29.593 ( -1.562 1.072 -2.041) 2.785 30.053 ( 2.242 3.427 9.798) 10.620 30.172 ( 2.633 -2.075 2.838) 4.392 30.390 ( 1.059 -0.353 0.707) 1.322 30.532 ( 5.146 0.171 -8.655) 10.071 31.301 ( -0.453 0.959 10.415) 10.469 31.453 ( 1.694 -0.942 -1.274) 2.319 32.197 ( -20.214 6.152 5.268) 21.776 32.412 ( -20.627 -4.397 -12.135) 24.332 ======================= Grid point 180 (65/72) ======================= q-point: ( 0.40 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.454 ( 17.368 -2.637 9.749) 20.091 3.622 ( 11.979 -7.346 -4.574) 14.778 3.955 ( 17.387 -2.197 12.496) 21.524 4.147 ( 12.366 8.461 4.856) 15.751 4.227 ( 9.564 -5.838 2.806) 11.551 4.451 ( 16.257 -3.924 -12.371) 20.802 4.665 ( 1.313 -1.656 -1.356) 2.511 4.725 ( 5.066 -3.998 -5.487) 8.471 5.011 ( -1.102 -6.276 2.272) 6.765 5.053 ( -2.743 -3.002 0.616) 4.112 5.339 ( -3.175 -1.284 0.755) 3.507 5.419 ( -7.778 -1.789 -6.631) 10.376 5.661 ( -5.586 0.398 -4.902) 7.443 5.754 ( -3.075 -2.297 -9.313) 10.073 5.995 ( -2.679 -4.722 2.426) 5.946 6.047 ( -4.765 -7.244 -3.601) 9.389 6.441 ( 6.091 2.023 5.288) 8.316 6.536 ( 5.752 -0.847 -1.961) 6.136 6.848 ( -9.219 3.045 2.973) 10.154 6.893 ( -12.065 7.471 -0.511) 14.200 7.023 ( 16.890 6.910 6.515) 19.378 7.159 ( 9.957 1.050 -3.396) 10.572 7.330 ( 6.773 6.704 6.102) 11.316 7.448 ( 5.295 5.300 -0.787) 7.533 7.485 ( 9.619 3.561 2.465) 10.549 7.574 ( 10.369 -1.429 0.231) 10.469 7.762 ( 10.272 2.580 4.963) 11.696 7.833 ( -0.172 0.621 4.565) 4.611 7.976 ( 8.143 3.573 1.952) 9.104 8.055 ( 7.285 -0.339 -1.770) 7.505 8.305 ( 10.218 4.404 3.106) 11.552 8.384 ( 15.633 3.084 -2.126) 16.075 8.515 ( -6.030 2.021 4.162) 7.601 8.680 ( 2.547 -0.548 -3.776) 4.587 8.853 ( 2.285 3.895 4.257) 6.206 8.981 ( -2.954 2.442 -0.825) 3.921 9.035 ( 2.399 -1.158 3.800) 4.641 9.086 ( 3.461 -0.516 4.626) 5.800 9.148 ( -6.135 3.205 0.366) 6.931 9.298 ( -8.837 1.634 -6.388) 11.026 9.448 ( 2.832 2.019 5.015) 6.103 9.510 ( -0.790 0.355 3.365) 3.475 9.695 ( -4.572 -3.830 2.015) 6.295 9.771 ( -3.348 -0.858 -7.488) 8.247 10.024 ( -5.792 2.517 2.058) 6.642 10.092 ( -2.055 -0.636 -1.199) 2.463 10.218 ( 6.509 -0.176 2.392) 6.937 10.357 ( 1.663 -3.875 -1.901) 4.626 10.495 ( -1.609 -0.526 -1.401) 2.197 10.667 ( -5.916 0.396 -6.119) 8.521 10.709 ( -13.760 1.320 3.254) 14.200 10.931 ( -11.742 -1.620 -10.199) 15.637 11.075 ( -12.524 -5.839 2.945) 14.129 11.176 ( -3.314 -0.865 -9.763) 10.346 11.287 ( -5.426 -3.162 -3.546) 7.212 11.391 ( -4.363 -1.165 -9.550) 10.564 11.701 ( 5.677 1.457 10.974) 12.441 11.872 ( 6.162 -0.985 -2.008) 6.555 11.966 ( -1.037 -5.254 5.038) 7.353 12.081 ( -3.369 -5.419 -6.173) 8.878 12.287 ( 0.558 1.779 5.450) 5.760 12.405 ( 2.648 2.472 -2.622) 4.472 12.565 ( -4.491 0.075 6.417) 7.833 12.610 ( 1.473 -2.119 11.689) 11.971 12.699 ( -3.289 -2.243 -3.317) 5.182 12.805 ( -4.309 -3.276 2.165) 5.830 12.871 ( 0.143 -2.358 -6.043) 6.488 12.976 ( -3.744 -1.429 -6.533) 7.664 13.221 ( -3.589 5.895 1.158) 6.998 13.351 ( -4.364 1.198 -8.441) 9.578 13.560 ( -19.300 0.641 0.244) 19.312 13.629 ( -18.466 -2.296 -5.202) 19.322 14.302 ( 6.529 2.728 3.718) 7.994 14.359 ( 4.555 1.533 -1.305) 4.981 14.562 ( -4.524 1.197 2.536) 5.323 14.586 ( -3.834 0.806 0.498) 3.950 15.182 ( 2.752 -1.583 5.548) 6.392 15.337 ( 6.619 -0.551 -7.243) 9.827 15.554 ( -2.690 1.217 6.290) 6.948 15.681 ( -3.306 -2.887 -4.471) 6.265 16.168 ( 7.229 2.362 6.826) 10.219 16.192 ( 5.651 1.288 6.974) 9.068 16.278 ( 3.625 4.372 0.562) 5.707 16.356 ( 3.947 3.578 -4.769) 7.151 16.548 ( 7.386 -0.602 2.203) 7.731 16.661 ( 8.573 -2.771 -6.367) 11.033 16.906 ( -5.892 -5.438 5.397) 9.665 17.082 ( -6.829 -11.490 -9.004) 16.116 19.229 ( 27.792 6.043 4.080) 28.732 19.348 ( 28.494 1.132 -6.466) 29.241 20.308 ( 7.928 -0.313 2.320) 8.266 20.354 ( 7.327 -0.885 -1.047) 7.454 20.460 ( -11.159 4.144 2.311) 12.126 20.528 ( -22.967 3.344 -3.392) 23.455 21.177 ( -21.839 -0.822 2.706) 22.022 21.246 ( -21.824 -3.436 -3.361) 22.347 26.463 ( 2.540 -0.395 7.533) 7.960 26.555 ( 3.527 -0.617 3.566) 5.054 26.635 ( 0.346 0.503 2.174) 2.258 26.753 ( 1.553 1.225 -3.386) 3.921 27.267 ( 6.731 -1.182 3.858) 7.848 27.390 ( 9.569 -1.633 -5.214) 11.019 27.568 ( 1.570 4.224 1.209) 4.666 27.707 ( -1.115 -1.492 -10.065) 10.236 28.140 ( 1.680 -1.187 6.920) 7.219 28.184 ( 1.043 0.114 -0.174) 1.063 28.191 ( 3.044 -0.007 -0.449) 3.077 28.300 ( -0.323 -0.724 -6.682) 6.729 29.313 ( 4.604 -1.538 3.197) 5.813 29.375 ( 5.283 -0.587 -1.464) 5.513 29.534 ( -2.182 0.980 -0.833) 2.533 29.559 ( -1.859 -0.444 -2.878) 3.454 30.103 ( 2.658 1.584 10.714) 11.152 30.229 ( 3.385 -1.222 7.198) 8.048 30.381 ( -1.953 -0.119 0.331) 1.985 30.615 ( 3.123 2.682 -12.348) 13.016 31.305 ( 0.794 -1.192 12.852) 12.932 31.522 ( 5.700 -1.501 -3.177) 6.696 31.870 ( -13.515 4.959 2.588) 14.627 32.058 ( -15.355 -2.652 -11.159) 19.166 ======================= Grid point 181 (66/72) ======================= q-point: (-0.50 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.630 ( 0.000 -5.596 4.891) 7.432 3.768 ( 0.000 -5.161 -7.406) 9.027 4.105 ( -0.000 5.796 14.040) 15.189 4.327 ( 0.000 -2.160 -1.352) 2.548 4.424 ( 0.000 -1.762 17.728) 17.815 4.487 ( -0.000 4.728 3.569) 5.924 4.673 ( 0.000 0.144 -8.314) 8.315 4.755 ( 0.000 -2.036 -4.006) 4.494 5.021 ( 0.000 0.717 -6.875) 6.912 5.100 ( -0.000 -4.565 9.134) 10.212 5.199 ( 0.000 -4.470 -14.573) 15.243 5.327 ( 0.000 -9.958 -9.163) 13.532 5.663 ( 0.000 -2.849 -0.828) 2.967 5.787 ( 0.000 -3.705 -9.537) 10.231 5.884 ( 0.000 -6.609 1.949) 6.891 5.951 ( -0.000 -9.013 -4.390) 10.026 6.574 ( 0.000 -3.564 4.892) 6.052 6.578 ( -0.000 9.327 4.732) 10.458 6.693 ( -0.000 3.711 -4.597) 5.907 6.704 ( 0.000 -5.399 -5.758) 7.893 7.180 ( 0.000 1.412 4.710) 4.917 7.257 ( 0.000 -0.068 -0.616) 0.620 7.452 ( 0.000 4.272 13.331) 13.999 7.574 ( -0.000 2.196 2.673) 3.460 7.588 ( 0.000 7.466 3.680) 8.324 7.672 ( 0.000 7.131 -3.929) 8.142 7.679 ( -0.000 3.309 5.590) 6.496 7.765 ( 0.000 4.923 0.570) 4.956 8.155 ( 0.000 -4.325 6.820) 8.076 8.264 ( 0.000 6.359 13.061) 14.527 8.391 ( 0.000 -4.759 -10.966) 11.954 8.479 ( 0.000 6.928 -4.912) 8.492 8.701 ( -0.000 5.753 5.204) 7.758 8.788 ( 0.000 7.677 5.372) 9.370 8.829 ( 0.000 4.044 0.424) 4.066 8.862 ( -0.000 5.838 -5.327) 7.903 8.939 ( 0.000 5.771 4.478) 7.305 9.103 ( -0.000 8.458 -8.545) 12.023 9.135 ( -0.000 -1.635 4.985) 5.246 9.165 ( 0.000 -5.464 1.551) 5.679 9.496 ( 0.000 1.281 5.550) 5.696 9.552 ( 0.000 1.955 8.221) 8.450 9.605 ( -0.000 -3.059 -2.915) 4.225 9.737 ( 0.000 -1.873 -6.912) 7.161 10.058 ( 0.000 -1.763 3.682) 4.083 10.133 ( 0.000 -3.274 -3.015) 4.451 10.213 ( -0.000 2.886 5.233) 5.976 10.328 ( 0.000 -1.772 -2.358) 2.950 10.508 ( 0.000 -2.315 6.314) 6.725 10.556 ( 0.000 2.732 -5.642) 6.269 10.680 ( 0.000 -3.274 -8.384) 9.000 10.717 ( 0.000 -2.364 -12.608) 12.828 10.927 ( 0.000 -5.212 7.797) 9.379 11.166 ( 0.000 -2.792 -14.720) 14.982 11.211 ( 0.000 -2.346 -2.182) 3.203 11.331 ( 0.000 1.528 -12.088) 12.184 11.787 ( 0.000 -3.831 10.218) 10.913 11.884 ( 0.000 -1.177 9.116) 9.191 11.992 ( 0.000 -5.414 0.399) 5.428 12.017 ( -0.000 -7.574 -9.713) 12.318 12.405 ( 0.000 0.485 6.559) 6.577 12.422 ( -0.000 3.545 2.976) 4.629 12.511 ( -0.000 0.511 -4.205) 4.236 12.525 ( 0.000 1.269 -2.021) 2.386 12.648 ( 0.000 -1.554 10.930) 11.040 12.842 ( 0.000 -4.246 5.147) 6.672 12.905 ( 0.000 -4.943 0.609) 4.980 12.918 ( 0.000 -0.309 -10.016) 10.021 13.250 ( 0.000 1.666 2.768) 3.231 13.261 ( 0.000 4.071 -1.879) 4.484 13.358 ( 0.000 0.864 -10.258) 10.295 13.373 ( -0.000 -0.710 -7.375) 7.409 14.398 ( 0.000 2.649 2.339) 3.533 14.431 ( 0.000 0.503 -0.959) 1.082 14.464 ( 0.000 3.992 6.126) 7.312 14.546 ( 0.000 1.638 -1.475) 2.205 15.223 ( 0.000 -2.450 7.472) 7.863 15.439 ( 0.000 -4.303 -10.547) 11.391 15.510 ( 0.000 2.545 5.321) 5.899 15.614 ( 0.000 1.252 -3.880) 4.077 16.239 ( 0.000 5.755 7.771) 9.670 16.243 ( -0.000 1.252 7.319) 7.426 16.330 ( 0.000 -0.356 0.628) 0.722 16.380 ( 0.000 5.267 -3.270) 6.199 16.696 ( 0.000 -5.179 7.415) 9.044 16.747 ( -0.000 -0.937 2.632) 2.794 16.886 ( -0.000 -8.098 -8.525) 11.758 16.906 ( 0.000 -8.989 -9.604) 13.155 19.729 ( 0.000 5.610 4.496) 7.190 19.856 ( 0.000 1.680 -6.768) 6.973 19.890 ( -0.000 8.543 5.795) 10.323 20.016 ( -0.000 3.245 -5.294) 6.209 20.701 ( 0.000 -2.031 2.950) 3.581 20.781 ( -0.000 -4.209 -3.891) 5.732 20.786 ( 0.000 -0.668 2.440) 2.530 20.839 ( -0.000 -3.003 -2.238) 3.745 26.488 ( 0.000 -0.733 7.761) 7.796 26.608 ( -0.000 1.314 9.898) 9.985 26.615 ( 0.000 -1.194 -3.186) 3.402 26.763 ( 0.000 0.970 -2.828) 2.990 27.340 ( 0.000 -0.630 4.698) 4.740 27.543 ( -0.000 -2.673 -11.964) 12.259 27.544 ( 0.000 3.153 2.964) 4.328 27.662 ( 0.000 -1.353 -7.334) 7.458 28.170 ( 0.000 0.141 5.036) 5.038 28.181 ( 0.000 0.978 1.744) 2.000 28.227 ( 0.000 -0.877 -2.233) 2.399 28.298 ( 0.000 0.617 -6.273) 6.304 29.364 ( 0.000 -0.042 5.212) 5.212 29.459 ( 0.000 1.894 2.904) 3.468 29.481 ( 0.000 -2.024 -4.950) 5.348 29.538 ( 0.000 -1.688 -3.898) 4.247 30.133 ( 0.000 -0.115 10.488) 10.489 30.284 ( 0.000 1.461 17.692) 17.753 30.339 ( 0.000 -1.462 -7.975) 8.108 30.645 ( 0.000 4.046 -14.285) 14.847 31.317 ( 0.000 -2.631 15.125) 15.352 31.661 ( 0.000 -2.818 -15.029) 15.291 31.672 ( -0.000 2.944 9.839) 10.270 31.886 ( 0.000 0.810 -9.190) 9.226 ======================= Grid point 187 (67/72) ======================= q-point: ( 0.00 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.804 ( 0.000 -11.945 12.074) 16.984 2.804 ( 0.000 11.945 12.074) 16.984 2.958 ( 0.000 -29.230 11.919) 31.567 2.958 ( 0.000 29.230 11.919) 31.567 3.414 ( 0.000 -14.726 -2.599) 14.954 3.414 ( 0.000 14.726 -2.599) 14.954 3.636 ( 0.000 -0.763 -20.856) 20.870 3.636 ( 0.000 0.763 -20.856) 20.870 4.428 ( 0.000 -3.427 7.820) 8.538 4.428 ( 0.000 3.427 7.820) 8.538 4.980 ( 0.000 -3.753 -4.302) 5.709 4.980 ( 0.000 3.753 -4.302) 5.709 5.441 ( 0.000 -0.640 0.811) 1.033 5.441 ( 0.000 0.640 0.811) 1.033 5.692 ( 0.000 -9.406 6.813) 11.614 5.692 ( 0.000 9.406 6.813) 11.614 6.397 ( 0.000 -3.420 3.766) 5.087 6.397 ( 0.000 3.420 3.766) 5.087 6.467 ( 0.000 -1.099 6.681) 6.770 6.467 ( 0.000 1.099 6.681) 6.770 6.711 ( 0.000 -11.550 3.260) 12.001 6.711 ( 0.000 11.550 3.260) 12.001 6.992 ( 0.000 -2.161 6.609) 6.953 6.992 ( 0.000 2.161 6.609) 6.953 7.270 ( 0.000 -6.172 -11.331) 12.902 7.270 ( 0.000 6.172 -11.331) 12.902 7.509 ( 0.000 -7.918 -8.755) 11.804 7.509 ( 0.000 7.918 -8.755) 11.804 8.008 ( 0.000 -4.054 1.421) 4.296 8.008 ( 0.000 4.054 1.421) 4.296 8.174 ( 0.000 -7.389 -3.979) 8.393 8.174 ( 0.000 7.389 -3.979) 8.393 8.476 ( 0.000 -2.000 -2.792) 3.434 8.476 ( 0.000 2.000 -2.792) 3.434 9.160 ( 0.000 -1.415 -1.524) 2.080 9.160 ( 0.000 1.415 -1.524) 2.080 9.473 ( 0.000 -1.129 -2.538) 2.778 9.473 ( 0.000 1.129 -2.538) 2.778 9.742 ( 0.000 -4.026 2.734) 4.867 9.742 ( 0.000 4.026 2.734) 4.867 9.929 ( 0.000 -2.082 -0.439) 2.128 9.929 ( 0.000 2.082 -0.439) 2.128 10.182 ( 0.000 -0.583 5.844) 5.873 10.182 ( 0.000 0.583 5.844) 5.873 10.298 ( 0.000 -1.114 4.685) 4.816 10.298 ( 0.000 1.114 4.685) 4.816 10.531 ( 0.000 -2.489 1.773) 3.056 10.531 ( 0.000 2.489 1.773) 3.056 10.779 ( 0.000 -4.843 3.044) 5.721 10.779 ( 0.000 4.843 3.044) 5.721 10.971 ( 0.000 -1.310 -8.969) 9.064 10.971 ( 0.000 1.310 -8.969) 9.064 11.274 ( 0.000 -5.978 0.337) 5.988 11.274 ( 0.000 5.978 0.337) 5.988 11.357 ( 0.000 -1.776 -4.004) 4.380 11.357 ( 0.000 1.776 -4.004) 4.380 11.774 ( 0.000 -2.306 -0.093) 2.308 11.774 ( 0.000 2.306 -0.093) 2.308 12.130 ( 0.000 -2.035 2.784) 3.449 12.130 ( 0.000 2.035 2.784) 3.449 12.272 ( 0.000 -1.334 -0.760) 1.535 12.272 ( 0.000 1.334 -0.760) 1.535 12.704 ( 0.000 -1.692 1.995) 2.616 12.704 ( 0.000 1.692 1.995) 2.616 12.999 ( 0.000 -1.434 -3.268) 3.568 12.999 ( 0.000 1.434 -3.268) 3.568 13.468 ( 0.000 -2.687 5.639) 6.246 13.468 ( 0.000 2.687 5.639) 6.246 13.820 ( 0.000 -0.811 8.275) 8.315 13.820 ( 0.000 0.811 8.275) 8.315 14.111 ( 0.000 -8.302 -6.162) 10.339 14.111 ( 0.000 8.302 -6.162) 10.339 14.175 ( 0.000 -0.270 -6.340) 6.346 14.175 ( 0.000 0.270 -6.340) 6.346 14.488 ( 0.000 -0.397 -2.207) 2.242 14.488 ( 0.000 0.397 -2.207) 2.242 14.991 ( 0.000 -0.744 -2.368) 2.482 14.991 ( 0.000 0.744 -2.368) 2.482 15.465 ( 0.000 -0.411 -0.892) 0.982 15.465 ( 0.000 0.411 -0.892) 0.982 15.686 ( 0.000 -1.176 -4.103) 4.268 15.686 ( 0.000 1.176 -4.103) 4.268 16.011 ( 0.000 -0.063 -0.733) 0.736 16.011 ( 0.000 0.063 -0.733) 0.736 16.495 ( 0.000 -0.202 2.125) 2.135 16.495 ( 0.000 0.202 2.125) 2.135 17.206 ( 0.000 -5.332 6.010) 8.034 17.206 ( 0.000 5.332 6.010) 8.034 18.510 ( 0.000 -4.425 -5.789) 7.286 18.510 ( 0.000 4.425 -5.789) 7.286 19.859 ( 0.000 -0.934 2.817) 2.968 19.859 ( 0.000 0.934 2.817) 2.968 21.652 ( 0.000 -0.036 -0.523) 0.524 21.652 ( 0.000 0.036 -0.523) 0.524 22.019 ( 0.000 -0.167 -0.037) 0.171 22.019 ( 0.000 0.167 -0.037) 0.171 26.100 ( 0.000 -0.000 0.437) 0.437 26.100 ( 0.000 0.000 0.437) 0.437 26.166 ( 0.000 -2.446 -0.878) 2.598 26.166 ( 0.000 2.446 -0.878) 2.598 26.759 ( 0.000 -1.780 -1.039) 2.061 26.759 ( 0.000 1.780 -1.039) 2.061 27.245 ( 0.000 -0.002 0.384) 0.384 27.245 ( 0.000 0.002 0.384) 0.384 27.889 ( 0.000 -0.406 4.961) 4.978 27.889 ( 0.000 0.406 4.961) 4.978 28.332 ( 0.000 -5.495 5.706) 7.921 28.332 ( 0.000 5.495 5.706) 7.921 29.047 ( 0.000 -0.645 -5.663) 5.700 29.047 ( 0.000 0.645 -5.663) 5.700 29.742 ( 0.000 -0.001 -0.313) 0.313 29.742 ( 0.000 0.001 -0.313) 0.313 29.998 ( 0.000 -0.477 0.965) 1.077 29.998 ( 0.000 0.477 0.965) 1.077 30.294 ( 0.000 -0.613 -2.019) 2.110 30.294 ( 0.000 0.613 -2.019) 2.110 31.425 ( 0.000 -2.638 5.648) 6.233 31.425 ( 0.000 2.638 5.648) 6.233 33.213 ( 0.000 -2.700 -4.861) 5.560 33.213 ( 0.000 2.700 -4.861) 5.560 ======================= Grid point 189 (68/72) ======================= q-point: ( 0.10 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.792 ( -3.081 0.000 9.366) 9.860 2.908 ( 10.452 0.000 2.913) 10.850 3.121 ( 9.896 0.000 12.662) 16.070 3.138 ( 20.989 -0.000 17.026) 27.026 3.491 ( 7.212 0.000 1.699) 7.409 3.552 ( 11.165 -0.000 -12.396) 16.683 3.818 ( 21.680 0.000 -15.550) 26.680 3.904 ( 21.930 0.000 -16.840) 27.650 4.441 ( 7.790 0.000 10.052) 12.717 4.511 ( 7.829 0.000 3.727) 8.671 4.989 ( 2.188 0.000 -1.076) 2.438 5.041 ( 5.921 0.000 -5.219) 7.893 5.487 ( 8.477 0.000 7.231) 11.142 5.591 ( 13.764 0.000 -3.166) 14.123 5.763 ( 5.457 -0.000 6.554) 8.529 5.765 ( 7.834 0.000 3.057) 8.410 6.251 ( -10.566 0.000 4.323) 11.416 6.278 ( -9.399 0.000 3.665) 10.089 6.476 ( 0.230 0.000 9.300) 9.303 6.551 ( 1.583 0.000 1.120) 1.939 6.740 ( 2.476 0.000 5.535) 6.064 6.774 ( 3.056 -0.000 -1.078) 3.241 6.980 ( 1.435 0.000 2.372) 2.772 7.015 ( 1.354 0.000 2.359) 2.720 7.209 ( -0.047 0.000 -2.720) 2.721 7.349 ( 3.120 0.000 -8.622) 9.169 7.543 ( 6.876 0.000 -5.307) 8.686 7.583 ( 9.636 0.000 -8.897) 13.115 8.089 ( 4.184 0.000 0.722) 4.245 8.117 ( 0.812 0.000 0.956) 1.254 8.170 ( 4.183 0.000 -3.011) 5.154 8.211 ( 3.627 -0.000 -2.464) 4.385 8.390 ( -1.023 0.000 3.780) 3.916 8.550 ( 4.039 0.000 -9.556) 10.375 9.062 ( -8.390 0.000 -0.021) 8.390 9.107 ( -6.271 0.000 -3.165) 7.024 9.361 ( -10.295 0.000 0.578) 10.311 9.414 ( -7.900 0.000 -4.047) 8.876 9.591 ( -11.744 0.000 1.731) 11.871 9.619 ( -12.805 -0.000 -0.484) 12.814 9.850 ( -10.553 0.000 6.622) 12.458 9.924 ( -11.633 0.000 -0.401) 11.640 10.049 ( -4.013 0.000 2.097) 4.528 10.089 ( -5.872 0.000 -0.708) 5.914 10.160 ( -6.852 0.000 3.816) 7.843 10.223 ( -2.991 0.000 5.177) 5.979 10.483 ( -3.804 0.000 6.804) 7.795 10.565 ( 1.865 0.000 1.484) 2.384 10.738 ( -7.062 0.000 1.695) 7.262 10.904 ( 7.121 -0.000 -0.322) 7.128 10.982 ( 6.381 0.000 -1.883) 6.653 11.020 ( 2.857 0.000 -8.808) 9.259 11.247 ( -0.591 0.000 1.653) 1.755 11.301 ( 2.343 0.000 -1.829) 2.972 11.483 ( 8.997 -0.000 -3.041) 9.497 11.495 ( 8.156 0.000 -7.074) 10.796 11.703 ( -6.834 0.000 0.302) 6.841 11.710 ( -6.093 0.000 -1.569) 6.292 12.084 ( -4.470 0.000 1.961) 4.882 12.087 ( -1.997 0.000 0.883) 2.183 12.260 ( -0.591 0.000 3.215) 3.269 12.311 ( 2.149 0.000 -0.002) 2.149 12.697 ( 0.263 0.000 2.017) 2.034 12.753 ( 3.362 0.000 -2.633) 4.271 12.959 ( 0.394 0.000 6.699) 6.711 13.115 ( 2.967 0.000 -2.237) 3.716 13.402 ( -6.487 0.000 1.409) 6.638 13.416 ( -5.067 0.000 -1.714) 5.349 13.630 ( -10.978 0.000 12.958) 16.983 13.901 ( -1.216 0.000 2.840) 3.089 13.952 ( -9.522 0.000 -10.541) 14.205 14.016 ( -5.693 -0.000 -6.161) 8.389 14.167 ( -0.776 0.000 -0.658) 1.017 14.191 ( -0.397 0.000 -5.025) 5.041 14.479 ( 3.340 0.000 4.842) 5.883 14.606 ( 5.938 0.000 -7.096) 9.253 15.112 ( 9.867 0.000 2.334) 10.139 15.146 ( 12.964 0.000 -1.210) 13.020 15.373 ( -3.233 0.000 0.795) 3.329 15.455 ( -0.636 0.000 -5.948) 5.982 15.735 ( 3.732 0.000 -0.493) 3.764 15.783 ( 7.067 0.000 -4.663) 8.467 16.068 ( 2.861 0.000 1.078) 3.057 16.135 ( 7.248 0.000 -5.185) 8.912 16.430 ( -0.700 0.000 5.004) 5.053 16.494 ( 0.637 0.000 -0.543) 0.837 17.075 ( -9.469 0.000 9.647) 13.517 17.186 ( -4.868 0.000 -0.052) 4.868 18.479 ( -0.945 0.000 -3.488) 3.614 18.521 ( 0.741 0.000 -6.785) 6.825 19.844 ( -0.504 0.000 3.107) 3.148 19.861 ( 0.256 0.000 1.682) 1.701 21.586 ( -6.834 0.000 0.231) 6.838 21.600 ( -6.150 -0.000 -0.961) 6.224 21.987 ( -3.719 0.000 0.258) 3.728 21.997 ( -3.201 -0.000 -0.514) 3.242 26.160 ( 5.814 0.000 2.570) 6.357 26.181 ( 7.292 0.000 2.062) 7.578 26.245 ( 7.751 0.000 -2.434) 8.124 26.264 ( 9.527 0.000 -2.828) 9.938 26.808 ( 5.406 0.000 -0.039) 5.406 26.829 ( 6.705 -0.000 -2.059) 7.014 27.285 ( 4.565 0.000 2.043) 5.001 27.325 ( 7.050 0.000 -1.704) 7.253 27.904 ( 1.864 0.000 5.852) 6.141 27.914 ( 2.643 -0.000 3.532) 4.411 28.281 ( -3.048 0.000 6.889) 7.533 28.362 ( 0.750 0.000 1.932) 2.073 29.046 ( 0.890 0.000 -4.046) 4.143 29.081 ( 2.619 0.000 -5.998) 6.545 29.694 ( -3.107 0.000 0.955) 3.250 29.722 ( -2.931 0.000 -2.019) 3.559 30.007 ( 2.362 -0.000 4.263) 4.873 30.052 ( 3.128 0.000 -0.130) 3.131 30.300 ( 1.317 0.000 -1.127) 1.733 30.331 ( 3.120 0.000 -3.628) 4.785 31.393 ( -2.099 -0.000 7.472) 7.761 31.435 ( 0.010 0.000 3.984) 3.984 33.067 ( -14.321 -0.000 -4.418) 14.987 33.075 ( -13.821 0.000 -5.012) 14.702 ======================= Grid point 191 (69/72) ======================= q-point: ( 0.20 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.837 ( 8.359 0.000 13.116) 15.553 3.063 ( 6.852 0.000 -0.087) 6.853 3.387 ( 16.840 0.000 3.342) 17.169 3.502 ( 16.474 -0.000 12.179) 20.487 3.698 ( 13.526 0.000 4.353) 14.210 3.718 ( 6.946 -0.000 -14.809) 16.357 4.243 ( 18.538 0.000 -5.293) 19.279 4.394 ( 23.819 0.000 -14.269) 27.766 4.697 ( 8.246 -0.000 1.570) 8.394 4.731 ( 14.615 0.000 0.556) 14.626 5.166 ( 21.862 0.000 7.376) 23.073 5.314 ( 23.559 0.000 -4.131) 23.919 5.734 ( 11.133 -0.000 11.032) 15.673 5.803 ( -4.778 0.000 4.879) 6.829 5.944 ( 5.644 0.000 -1.120) 5.754 6.004 ( 19.020 0.000 -1.402) 19.072 6.082 ( 5.137 0.000 2.699) 5.803 6.182 ( 10.192 0.000 -1.893) 10.367 6.471 ( 0.568 0.000 8.906) 8.924 6.574 ( 1.354 -0.000 2.922) 3.220 6.637 ( -6.168 0.000 -2.837) 6.789 6.743 ( -5.828 0.000 -9.188) 10.880 7.053 ( 8.231 -0.000 5.899) 10.127 7.164 ( 7.002 0.000 -4.329) 8.233 7.292 ( 10.075 0.000 11.285) 15.128 7.516 ( 11.024 0.000 -7.235) 13.186 7.712 ( 6.538 0.000 0.306) 6.545 7.804 ( 10.419 -0.000 -7.361) 12.757 7.982 ( -9.627 0.000 6.172) 11.436 8.074 ( -3.086 0.000 -3.919) 4.988 8.172 ( -4.781 0.000 0.228) 4.787 8.287 ( 1.595 0.000 -4.622) 4.890 8.553 ( 12.498 0.000 4.582) 13.312 8.666 ( 6.944 0.000 -4.503) 8.276 8.874 ( -9.170 0.000 1.429) 9.280 8.931 ( -10.531 0.000 -2.340) 10.788 9.099 ( -12.397 0.000 3.899) 12.996 9.202 ( -11.242 0.000 -3.095) 11.660 9.411 ( -5.621 0.000 -2.365) 6.098 9.437 ( -3.811 -0.000 -4.208) 5.678 9.530 ( -17.817 0.000 4.158) 18.296 9.568 ( -17.747 0.000 0.705) 17.761 9.978 ( -9.156 0.000 7.060) 11.562 10.077 ( -3.524 0.000 2.826) 4.517 10.106 ( 0.577 0.000 2.049) 2.128 10.170 ( -0.086 -0.000 -1.665) 1.667 10.406 ( -3.979 0.000 3.655) 5.403 10.507 ( -6.976 0.000 -4.888) 8.519 10.598 ( -6.338 0.000 8.434) 10.550 10.903 ( -4.666 0.000 -7.436) 8.778 11.117 ( 3.662 0.000 -0.610) 3.713 11.162 ( 8.371 0.000 -7.132) 10.998 11.251 ( 0.651 0.000 3.040) 3.109 11.309 ( -3.056 0.000 -0.981) 3.209 11.504 ( -9.250 0.000 1.835) 9.430 11.546 ( -5.379 0.000 -0.419) 5.395 11.596 ( 0.013 0.000 -7.110) 7.110 11.636 ( 2.128 -0.000 -7.764) 8.050 12.045 ( 0.709 0.000 5.151) 5.200 12.079 ( 0.550 0.000 2.075) 2.147 12.247 ( -0.136 0.000 3.035) 3.038 12.321 ( -0.491 0.000 -0.843) 0.975 12.700 ( -0.206 0.000 4.072) 4.077 12.806 ( 0.222 0.000 -3.551) 3.558 12.916 ( -6.840 0.000 6.907) 9.721 12.993 ( -12.264 0.000 6.801) 14.023 13.242 ( -13.426 -0.000 -6.203) 14.790 13.242 ( -9.380 0.000 -3.376) 9.969 13.515 ( -2.758 0.000 1.236) 3.022 13.690 ( -11.733 0.000 -11.101) 16.152 13.937 ( 0.363 0.000 4.773) 4.787 13.962 ( -0.523 -0.000 2.906) 2.953 14.148 ( -0.237 0.000 -0.435) 0.496 14.216 ( 2.863 0.000 -5.913) 6.570 14.549 ( 2.936 0.000 5.033) 5.826 14.692 ( 2.418 0.000 -8.325) 8.669 15.218 ( -1.140 0.000 11.296) 11.353 15.321 ( 2.568 0.000 1.562) 3.006 15.441 ( 9.906 0.000 -2.541) 10.227 15.524 ( 5.251 0.000 -9.025) 10.441 15.805 ( 6.587 0.000 2.286) 6.972 15.853 ( 0.168 0.000 -1.154) 1.167 16.117 ( 6.591 0.000 0.256) 6.596 16.178 ( 0.619 0.000 -4.722) 4.762 16.542 ( 8.445 0.000 3.744) 9.238 16.607 ( 6.371 0.000 -1.095) 6.464 16.904 ( -5.546 0.000 6.758) 8.742 17.049 ( -7.869 0.000 -4.945) 9.294 18.534 ( 8.104 0.000 -1.188) 8.191 18.591 ( 7.965 0.000 -5.766) 9.833 19.871 ( 4.101 0.000 2.668) 4.892 19.900 ( 4.576 0.000 0.263) 4.583 21.378 ( -15.003 0.000 1.010) 15.037 21.401 ( -14.823 -0.000 -0.829) 14.847 21.850 ( -10.868 0.000 0.262) 10.872 21.868 ( -10.636 0.000 -1.085) 10.692 26.287 ( 6.551 0.000 4.746) 8.090 26.336 ( 7.796 0.000 3.669) 8.616 26.425 ( 9.862 0.000 -2.422) 10.155 26.489 ( 12.456 0.000 -4.920) 13.393 26.946 ( 8.195 0.000 1.878) 8.407 26.999 ( 10.195 0.000 -3.141) 10.668 27.398 ( 6.822 0.000 3.125) 7.504 27.488 ( 9.113 0.000 -4.841) 10.319 27.966 ( 4.548 0.000 6.642) 8.050 27.994 ( 5.611 0.000 1.327) 5.766 28.216 ( -3.598 0.000 5.755) 6.787 28.355 ( -1.547 0.000 -2.978) 3.356 29.088 ( 3.661 0.000 -1.371) 3.909 29.151 ( 4.658 0.000 -5.520) 7.222 29.639 ( -2.445 0.000 0.711) 2.546 29.656 ( -3.387 0.000 -1.449) 3.683 30.065 ( 3.253 -0.000 6.116) 6.927 30.096 ( 1.307 0.000 2.282) 2.630 30.340 ( 2.567 0.000 -0.523) 2.620 30.416 ( 5.577 0.000 -6.197) 8.337 31.350 ( -2.246 0.000 9.152) 9.424 31.432 ( -0.131 0.000 2.488) 2.492 32.710 ( -21.411 -0.000 -3.966) 21.775 32.730 ( -20.618 0.000 -5.383) 21.309 ======================= Grid point 193 (70/72) ======================= q-point: ( 0.30 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.110 ( 19.172 0.000 11.540) 22.377 3.226 ( 10.622 0.000 3.428) 11.161 3.728 ( 9.149 0.000 7.424) 11.782 3.765 ( 22.163 -0.000 4.326) 22.581 3.983 ( 15.663 0.000 -8.290) 17.721 3.999 ( 21.812 -0.000 -9.826) 23.923 4.472 ( 6.426 0.000 2.875) 7.040 4.634 ( 3.131 0.000 -8.593) 9.145 4.864 ( 10.792 0.000 1.892) 10.957 4.962 ( 10.126 0.000 -6.070) 11.806 5.537 ( -9.836 0.000 4.790) 10.940 5.541 ( -11.701 -0.000 3.819) 12.309 5.719 ( 19.612 0.000 8.532) 21.387 5.861 ( 6.519 0.000 -6.368) 9.113 5.933 ( -9.803 0.000 -4.261) 10.689 5.998 ( 1.868 0.000 -5.522) 5.829 6.444 ( -1.759 0.000 2.563) 3.108 6.455 ( -1.055 0.000 2.180) 2.422 6.650 ( 24.795 -0.000 -0.407) 24.799 6.659 ( 25.979 0.000 -1.658) 26.032 6.915 ( 26.786 0.000 5.352) 27.315 6.966 ( 33.487 0.000 0.847) 33.498 7.213 ( -3.143 -0.000 2.819) 4.221 7.217 ( 7.432 0.000 1.826) 7.653 7.441 ( 4.386 0.000 5.975) 7.412 7.542 ( -10.948 0.000 -2.896) 11.325 7.691 ( -3.143 0.000 0.983) 3.293 7.798 ( 2.345 -0.000 -2.618) 3.515 7.952 ( -7.950 0.000 -0.129) 7.951 8.036 ( -4.918 -0.000 -4.070) 6.384 8.163 ( 12.182 0.000 3.108) 12.572 8.306 ( 4.108 0.000 -6.120) 7.371 8.656 ( -2.832 -0.000 5.652) 6.321 8.666 ( -6.252 0.000 4.003) 7.424 8.854 ( 6.449 0.000 4.383) 7.798 8.873 ( 5.474 0.000 1.452) 5.663 9.040 ( 5.597 0.000 2.608) 6.175 9.047 ( -6.809 -0.000 1.042) 6.888 9.245 ( -9.270 0.000 1.152) 9.342 9.306 ( -2.559 0.000 1.161) 2.810 9.431 ( 0.147 0.000 -4.568) 4.570 9.473 ( 6.803 0.000 -9.631) 11.791 9.778 ( -9.883 0.000 4.500) 10.859 9.856 ( -14.101 0.000 1.005) 14.137 10.082 ( -3.008 0.000 7.131) 7.739 10.215 ( -0.155 0.000 -1.661) 1.669 10.345 ( -2.906 0.000 -0.578) 2.963 10.361 ( -9.008 -0.000 0.361) 9.015 10.483 ( -3.073 0.000 3.457) 4.625 10.794 ( -5.750 0.000 -11.827) 13.151 11.016 ( -12.625 0.000 3.159) 13.014 11.129 ( -11.310 0.000 -5.540) 12.594 11.218 ( -6.738 0.000 -0.966) 6.807 11.284 ( -0.168 0.000 -10.369) 10.370 11.342 ( -6.135 -0.000 2.597) 6.662 11.438 ( -5.710 0.000 -4.379) 7.196 11.636 ( 4.813 0.000 2.982) 5.662 11.724 ( 7.357 0.000 -4.261) 8.502 12.029 ( -5.750 0.000 3.891) 6.943 12.053 ( -1.142 -0.000 2.063) 2.358 12.319 ( 7.257 0.000 1.656) 7.444 12.333 ( 1.379 -0.000 0.407) 1.438 12.634 ( -6.426 0.000 7.068) 9.553 12.647 ( -12.539 -0.000 1.084) 12.585 12.790 ( -3.451 0.000 -1.350) 3.705 12.849 ( -5.592 0.000 8.903) 10.514 12.998 ( -9.968 0.000 -9.534) 13.794 13.061 ( -8.529 0.000 -4.762) 9.768 13.418 ( -6.438 0.000 -1.673) 6.651 13.487 ( -9.524 0.000 -7.171) 11.922 13.867 ( -10.161 0.000 2.428) 10.447 13.884 ( -10.164 -0.000 1.923) 10.344 14.205 ( 6.135 0.000 1.637) 6.349 14.287 ( 4.690 0.000 -4.200) 6.296 14.579 ( 0.227 0.000 3.531) 3.538 14.682 ( -3.509 0.000 -5.302) 6.358 15.157 ( -2.257 -0.000 8.777) 9.063 15.300 ( -1.538 0.000 -3.037) 3.404 15.577 ( 1.988 0.000 -0.006) 1.988 15.597 ( 4.988 -0.000 -1.428) 5.188 15.963 ( 11.293 -0.000 4.679) 12.224 16.028 ( 12.511 0.000 0.390) 12.517 16.237 ( 5.655 0.000 -1.283) 5.798 16.263 ( 6.645 0.000 -2.359) 7.051 16.590 ( -4.401 0.000 2.882) 5.260 16.621 ( -0.330 -0.000 0.334) 0.470 16.915 ( 2.203 -0.000 -1.335) 2.575 16.956 ( -1.605 0.000 -4.512) 4.789 18.815 ( 20.951 0.000 -0.008) 20.951 18.862 ( 20.378 0.000 -3.826) 20.734 20.020 ( 11.546 -0.000 1.905) 11.702 20.055 ( 11.688 0.000 -0.934) 11.725 21.012 ( -22.788 0.000 1.434) 22.834 21.035 ( -22.895 -0.000 -0.367) 22.898 21.570 ( -17.986 -0.000 0.039) 17.986 21.589 ( -17.956 0.000 -1.440) 18.014 26.394 ( 4.472 0.000 6.041) 7.516 26.462 ( 5.353 0.000 3.229) 6.251 26.584 ( 5.888 0.000 0.727) 5.933 26.689 ( 7.291 0.000 -5.053) 8.870 27.103 ( 8.138 0.000 3.923) 9.035 27.193 ( 9.646 0.000 -3.808) 10.371 27.535 ( 6.892 0.000 1.600) 7.075 27.644 ( 6.000 0.000 -7.705) 9.765 28.063 ( 4.625 0.000 7.863) 9.122 28.109 ( 5.608 0.000 -0.131) 5.609 28.162 ( -0.977 0.000 2.489) 2.674 28.312 ( -2.352 0.000 -6.207) 6.637 29.183 ( 5.841 0.000 1.016) 5.929 29.255 ( 5.939 0.000 -4.484) 7.442 29.598 ( -2.094 0.000 0.098) 2.097 29.599 ( -2.588 -0.000 -0.589) 2.654 30.110 ( 0.454 -0.000 5.894) 5.912 30.131 ( 3.789 0.000 7.122) 8.067 30.382 ( 1.382 0.000 0.597) 1.505 30.534 ( 6.324 0.000 -9.551) 11.455 31.312 ( -1.558 0.000 10.842) 10.954 31.442 ( 1.613 0.000 0.551) 1.704 32.293 ( -20.952 0.000 -3.627) 21.264 32.334 ( -19.485 0.000 -6.264) 20.467 ======================= Grid point 195 (71/72) ======================= q-point: ( 0.40 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.450 ( 11.164 -0.000 5.121) 12.283 3.504 ( 18.923 0.000 1.971) 19.025 3.955 ( 15.156 0.000 11.364) 18.944 4.154 ( 10.773 0.000 7.759) 13.277 4.267 ( 17.561 -0.000 -4.337) 18.089 4.402 ( 13.442 0.000 -5.703) 14.602 4.654 ( 16.326 0.000 -5.707) 17.295 4.695 ( 8.213 0.000 -4.414) 9.324 4.932 ( -13.319 0.000 4.786) 14.152 5.014 ( -2.302 0.000 0.644) 2.391 5.311 ( -6.669 0.000 1.907) 6.936 5.396 ( -3.568 0.000 -7.240) 8.071 5.686 ( -7.312 0.000 -6.934) 10.077 5.717 ( -12.406 -0.000 -11.148) 16.679 5.948 ( -0.404 0.000 1.909) 1.951 5.991 ( -7.061 0.000 -1.274) 7.175 6.458 ( 3.123 0.000 0.360) 3.144 6.494 ( 7.139 -0.000 -3.094) 7.781 6.894 ( -15.922 -0.000 5.611) 16.882 6.956 ( -13.229 0.000 0.888) 13.259 7.142 ( 16.634 0.000 2.121) 16.769 7.156 ( 11.617 0.000 -0.210) 11.618 7.395 ( 10.139 0.000 7.062) 12.356 7.501 ( 4.576 0.000 4.149) 6.177 7.520 ( 5.661 0.000 3.554) 6.684 7.534 ( 9.057 0.000 -2.979) 9.534 7.802 ( 9.477 0.000 4.303) 10.408 7.835 ( 3.577 -0.000 5.889) 6.891 8.018 ( 10.387 0.000 -1.307) 10.469 8.047 ( 13.102 -0.000 -1.964) 13.248 8.395 ( 13.901 0.000 -2.766) 14.173 8.397 ( 8.770 -0.000 1.455) 8.890 8.550 ( -3.782 0.000 3.059) 4.865 8.646 ( 4.959 0.000 -1.425) 5.159 8.901 ( -3.145 0.000 5.252) 6.122 9.006 ( 3.107 0.000 6.529) 7.230 9.016 ( 5.560 0.000 5.051) 7.512 9.082 ( -4.508 0.000 -4.765) 6.560 9.186 ( 0.187 0.000 1.925) 1.934 9.356 ( -9.191 0.000 -8.177) 12.302 9.445 ( 6.932 0.000 5.255) 8.699 9.490 ( 4.782 -0.000 7.206) 8.648 9.642 ( -6.329 0.000 1.350) 6.471 9.752 ( 0.127 0.000 -9.755) 9.756 10.046 ( -0.776 0.000 5.408) 5.464 10.075 ( -10.043 -0.000 3.514) 10.640 10.273 ( 4.276 0.000 1.232) 4.450 10.285 ( -0.798 -0.000 -2.799) 2.911 10.497 ( -0.894 0.000 -2.117) 2.298 10.676 ( -7.464 0.000 -8.940) 11.647 10.730 ( -13.644 0.000 4.225) 14.284 10.905 ( -11.751 -0.000 -9.306) 14.990 11.008 ( -12.412 0.000 3.413) 12.873 11.169 ( -6.289 0.000 -14.704) 15.993 11.248 ( -4.555 0.000 -0.807) 4.626 11.384 ( -2.027 0.000 -11.586) 11.762 11.729 ( 3.269 0.000 10.514) 11.011 11.856 ( 4.589 0.000 0.382) 4.605 11.921 ( -3.909 0.000 2.999) 4.927 12.013 ( -3.267 -0.000 -6.871) 7.608 12.312 ( 0.459 0.000 6.622) 6.638 12.432 ( 1.055 0.000 -2.658) 2.860 12.532 ( 4.251 0.000 5.588) 7.021 12.621 ( 0.016 0.000 4.673) 4.673 12.686 ( -9.242 0.000 7.883) 12.147 12.728 ( 0.067 0.000 -4.976) 4.976 12.880 ( -4.121 0.000 -3.994) 5.739 12.954 ( -2.812 0.000 -6.416) 7.005 13.311 ( -3.543 -0.000 -1.485) 3.842 13.329 ( -6.459 0.000 -2.178) 6.817 13.569 ( -17.628 0.000 -1.811) 17.720 13.602 ( -16.642 0.000 -4.071) 17.132 14.336 ( 6.759 0.000 2.788) 7.311 14.381 ( 4.356 0.000 -0.661) 4.406 14.568 ( -1.018 0.000 2.181) 2.407 14.588 ( -5.300 0.000 1.300) 5.457 15.170 ( 2.606 0.000 5.032) 5.667 15.328 ( 3.962 0.000 -6.994) 8.038 15.583 ( -2.004 0.000 2.564) 3.254 15.640 ( -0.101 0.000 -1.587) 1.590 16.185 ( 9.893 -0.000 5.726) 11.430 16.193 ( 5.354 0.000 5.904) 7.970 16.342 ( 1.367 0.000 0.881) 1.626 16.387 ( 7.012 0.000 -2.113) 7.323 16.555 ( 2.437 0.000 1.435) 2.828 16.639 ( 4.298 0.000 -4.148) 5.973 16.887 ( -5.146 -0.000 -2.110) 5.562 16.910 ( -4.610 0.000 -4.021) 6.117 19.306 ( 28.891 0.000 0.846) 28.903 19.347 ( 28.855 -0.000 -2.407) 28.955 20.299 ( 14.585 -0.000 1.058) 14.624 20.336 ( 14.245 0.000 -1.912) 14.373 20.529 ( -23.870 0.000 1.616) 23.925 20.551 ( -24.447 -0.000 -0.089) 24.448 21.178 ( -22.156 -0.000 -0.006) 22.156 21.198 ( -22.138 0.000 -1.532) 22.191 26.459 ( 2.279 0.000 6.996) 7.358 26.548 ( 3.791 0.000 2.566) 4.578 26.641 ( 0.279 0.000 3.544) 3.555 26.764 ( 1.317 0.000 -3.038) 3.311 27.256 ( 7.161 0.000 3.394) 7.924 27.373 ( 9.161 0.000 -5.095) 10.483 27.628 ( 2.226 0.000 -1.821) 2.876 27.674 ( -3.119 -0.000 -6.288) 7.019 28.129 ( 3.218 0.000 6.405) 7.168 28.183 ( 1.797 0.000 -0.019) 1.797 28.193 ( 2.388 0.000 -0.278) 2.404 28.292 ( 0.547 0.000 -6.804) 6.825 29.297 ( 5.591 0.000 2.954) 6.323 29.370 ( 5.816 0.000 -3.118) 6.599 29.548 ( -2.995 0.000 -0.485) 3.034 29.551 ( -2.832 -0.000 -0.387) 2.859 30.123 ( 0.858 0.000 8.538) 8.581 30.214 ( 4.855 0.000 8.074) 9.422 30.379 ( -1.895 0.000 1.831) 2.635 30.641 ( 4.340 0.000 -13.459) 14.142 31.294 ( -0.355 0.000 13.232) 13.237 31.507 ( 5.437 0.000 -2.706) 6.073 31.931 ( -16.293 0.000 -2.361) 16.463 32.019 ( -12.390 0.000 -7.417) 14.441 ======================= Grid point 197 (72/72) ======================= q-point: (-0.50 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.576 ( 0.000 0.000 4.631) 4.631 3.706 ( 0.000 0.000 -6.725) 6.725 4.200 ( 0.000 0.000 11.202) 11.202 4.227 ( 0.000 -0.000 12.131) 12.131 4.425 ( -0.000 0.000 18.767) 18.767 4.626 ( -0.000 -0.000 -1.140) 1.140 4.646 ( 0.000 0.000 -7.143) 7.143 4.726 ( 0.000 0.000 -1.697) 1.697 5.072 ( 0.000 -0.000 -13.770) 13.770 5.110 ( -19.472 0.000 -8.836) 21.383 5.110 ( 19.472 0.000 -5.439) 20.218 5.130 ( -0.000 -0.000 -3.423) 3.423 5.647 ( 0.000 0.000 -1.378) 1.378 5.756 ( -0.000 0.000 -8.559) 8.559 5.835 ( 0.000 0.000 -2.019) 2.019 5.842 ( -0.000 -0.000 -2.173) 2.173 6.534 ( 0.000 0.000 3.257) 3.257 6.646 ( 0.000 0.000 -5.855) 5.855 6.685 ( 0.000 -0.000 2.612) 2.612 6.720 ( -0.000 0.000 -0.947) 0.947 7.184 ( 0.000 0.000 3.561) 3.561 7.255 ( 0.000 0.000 -0.920) 0.920 7.526 ( 0.000 0.000 7.230) 7.230 7.529 ( 0.000 -0.000 6.289) 6.289 7.680 ( 0.000 0.000 4.801) 4.801 7.742 ( 0.000 0.000 -1.002) 1.002 7.764 ( -0.000 0.000 3.634) 3.634 7.810 ( 0.000 0.000 3.158) 3.158 8.097 ( 0.000 -0.000 8.398) 8.398 8.337 ( 0.000 0.000 -11.120) 11.120 8.343 ( -0.000 0.000 11.196) 11.196 8.571 ( 0.000 0.000 -8.278) 8.278 8.810 ( 0.000 0.000 11.314) 11.314 8.855 ( 0.000 -0.000 -0.061) 0.061 8.869 ( -0.000 0.000 0.052) 0.052 8.961 ( -0.000 -0.000 -0.303) 0.303 8.976 ( 0.000 0.000 4.965) 4.965 9.017 ( 0.000 0.000 9.394) 9.394 9.107 ( -0.000 0.000 -9.275) 9.275 9.201 ( -0.000 0.000 -7.817) 7.817 9.546 ( 0.000 0.000 2.201) 2.201 9.557 ( 0.000 0.000 6.151) 6.151 9.586 ( 0.000 0.000 6.635) 6.635 9.698 ( -0.000 0.000 -1.245) 1.245 10.032 ( 0.000 0.000 4.037) 4.037 10.107 ( 0.000 0.000 -4.650) 4.650 10.255 ( 0.000 -0.000 3.492) 3.492 10.302 ( 0.000 0.000 -0.013) 0.013 10.483 ( 0.000 0.000 5.316) 5.316 10.588 ( 0.000 0.000 -8.309) 8.309 10.641 ( 0.000 0.000 -8.349) 8.349 10.685 ( -0.000 0.000 -11.653) 11.653 10.877 ( 0.000 0.000 8.379) 8.379 11.135 ( 0.000 0.000 -15.739) 15.739 11.186 ( 0.000 0.000 -1.891) 1.891 11.346 ( 0.000 0.000 -15.209) 15.209 11.754 ( 0.000 0.000 8.395) 8.395 11.890 ( 0.000 -0.000 6.005) 6.005 11.921 ( 0.000 0.000 3.282) 3.282 11.929 ( -0.000 -0.000 -6.729) 6.729 12.415 ( 0.000 0.000 5.377) 5.377 12.476 ( -0.000 0.000 0.586) 0.586 12.504 ( -0.000 -0.000 -1.379) 1.379 12.531 ( 0.000 0.000 -3.444) 3.444 12.639 ( 0.000 0.000 12.327) 12.327 12.818 ( 0.000 0.000 0.592) 0.592 12.822 ( 0.000 -0.000 1.880) 1.880 12.913 ( 0.000 0.000 -9.049) 9.049 13.272 ( 0.000 0.000 1.285) 1.285 13.324 ( 0.000 -0.000 -4.138) 4.138 13.349 ( 0.000 0.000 -4.842) 4.842 13.364 ( -0.000 0.000 -5.514) 5.514 14.429 ( 0.000 0.000 0.983) 0.983 14.431 ( 0.000 0.000 0.397) 0.397 14.509 ( 0.000 0.000 5.504) 5.504 14.554 ( 0.000 0.000 0.645) 0.645 15.205 ( 0.000 0.000 4.763) 4.763 15.392 ( 0.000 0.000 -10.363) 10.363 15.538 ( -0.000 0.000 4.915) 4.915 15.629 ( 0.000 0.000 -2.846) 2.846 16.251 ( 0.000 0.000 6.797) 6.797 16.314 ( -0.000 0.000 8.753) 8.753 16.320 ( 0.000 0.000 0.467) 0.467 16.433 ( 0.000 -0.000 1.285) 1.285 16.655 ( 0.000 0.000 0.467) 0.467 16.764 ( -0.000 0.000 -2.354) 2.354 16.781 ( 0.000 -0.000 -3.848) 3.848 16.789 ( 0.000 -0.000 -7.909) 7.909 19.793 ( 0.000 0.000 2.412) 2.412 19.871 ( 0.000 0.000 -4.222) 4.222 20.000 ( -0.000 0.000 2.325) 2.325 20.027 ( -0.000 -0.000 -0.316) 0.316 20.687 ( 0.000 -0.000 0.621) 0.621 20.728 ( 0.000 0.000 -2.797) 2.797 20.789 ( -0.000 -0.000 0.073) 0.073 20.795 ( 0.000 0.000 -0.241) 0.241 26.481 ( 0.000 0.000 7.469) 7.469 26.604 ( -0.000 0.000 -3.026) 3.026 26.621 ( 0.000 0.000 9.862) 9.862 26.772 ( 0.000 0.000 -2.197) 2.197 27.336 ( 0.000 0.000 3.340) 3.340 27.515 ( -0.000 0.000 -10.890) 10.890 27.583 ( 0.000 0.000 0.567) 0.567 27.639 ( 0.000 -0.000 -4.260) 4.260 28.171 ( 0.000 0.000 5.003) 5.003 28.197 ( 0.000 0.000 0.532) 0.532 28.214 ( 0.000 0.000 -1.343) 1.343 28.304 ( 0.000 0.000 -6.625) 6.625 29.365 ( 0.000 0.000 4.729) 4.729 29.460 ( 0.000 0.000 -3.575) 3.575 29.488 ( -0.000 0.000 0.505) 0.505 29.511 ( 0.000 0.000 -1.400) 1.400 30.134 ( 0.000 0.000 9.421) 9.421 30.298 ( -0.000 0.000 18.678) 18.678 30.324 ( 0.000 0.000 -7.750) 7.750 30.685 ( 0.000 0.000 -15.599) 15.599 31.293 ( 0.000 0.000 14.984) 14.984 31.632 ( 0.000 0.000 -14.895) 14.895 31.701 ( -0.000 0.000 8.862) 8.862 31.893 ( 0.000 0.000 -8.235) 8.235 =================== 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 3/36000 10.0 1841.660 2147.540 1007.640 0.000 0.000 0.000 3/36000 20.0 942.028 1390.352 763.451 0.000 0.000 0.000 3/36000 30.0 374.230 451.348 339.336 0.000 0.000 0.000 3/36000 40.0 196.575 196.776 170.241 0.000 0.000 0.000 3/36000 50.0 121.623 106.268 98.791 0.000 0.000 0.000 3/36000 60.0 82.866 65.989 64.011 0.000 0.000 0.000 3/36000 70.0 60.338 45.033 44.933 0.000 0.000 0.000 3/36000 80.0 46.218 32.889 33.493 0.000 0.000 0.000 3/36000 90.0 36.847 25.278 26.148 0.000 0.000 0.000 3/36000 100.0 30.333 20.212 21.170 0.000 0.000 0.000 3/36000 110.0 25.624 16.674 17.643 0.000 0.000 0.000 3/36000 120.0 22.106 14.104 15.052 0.000 0.000 0.000 3/36000 130.0 19.404 12.175 13.089 0.000 0.000 0.000 3/36000 140.0 17.277 10.686 11.561 0.000 0.000 0.000 3/36000 150.0 15.567 9.509 10.345 0.000 0.000 0.000 3/36000 160.0 14.169 8.560 9.359 0.000 0.000 0.000 3/36000 170.0 13.006 7.782 8.545 0.000 0.000 0.000 3/36000 180.0 12.026 7.133 7.863 0.000 0.000 0.000 3/36000 190.0 11.190 6.584 7.284 0.000 0.000 0.000 3/36000 200.0 10.468 6.115 6.787 0.000 0.000 0.000 3/36000 210.0 9.840 5.710 6.356 0.000 0.000 0.000 3/36000 220.0 9.287 5.357 5.979 0.000 0.000 0.000 3/36000 230.0 8.798 5.046 5.646 0.000 0.000 0.000 3/36000 240.0 8.362 4.771 5.351 0.000 0.000 0.000 3/36000 250.0 7.971 4.525 5.086 0.000 0.000 0.000 3/36000 260.0 7.617 4.304 4.848 0.000 0.000 0.000 3/36000 270.0 7.297 4.105 4.633 0.000 0.000 0.000 3/36000 280.0 7.004 3.925 4.437 0.000 0.000 0.000 3/36000 290.0 6.736 3.760 4.258 0.000 0.000 0.000 3/36000 300.0 6.490 3.610 4.094 0.000 0.000 0.000 3/36000 310.0 6.262 3.471 3.944 0.000 0.000 0.000 3/36000 320.0 6.052 3.344 3.804 0.000 0.000 0.000 3/36000 330.0 5.856 3.226 3.675 0.000 0.000 0.000 3/36000 340.0 5.674 3.116 3.555 0.000 0.000 0.000 3/36000 350.0 5.503 3.014 3.443 0.000 0.000 0.000 3/36000 360.0 5.343 2.919 3.339 0.000 0.000 0.000 3/36000 370.0 5.193 2.830 3.241 0.000 0.000 0.000 3/36000 380.0 5.052 2.746 3.149 0.000 0.000 0.000 3/36000 390.0 4.919 2.668 3.062 0.000 0.000 0.000 3/36000 400.0 4.793 2.594 2.981 0.000 0.000 0.000 3/36000 410.0 4.674 2.524 2.904 0.000 0.000 0.000 3/36000 420.0 4.561 2.458 2.831 0.000 0.000 0.000 3/36000 430.0 4.454 2.396 2.762 0.000 0.000 0.000 3/36000 440.0 4.351 2.337 2.696 0.000 0.000 0.000 3/36000 450.0 4.254 2.281 2.634 0.000 0.000 0.000 3/36000 460.0 4.161 2.227 2.574 0.000 0.000 0.000 3/36000 470.0 4.073 2.176 2.517 0.000 0.000 0.000 3/36000 480.0 3.988 2.128 2.463 0.000 0.000 0.000 3/36000 490.0 3.907 2.082 2.412 0.000 0.000 0.000 3/36000 500.0 3.829 2.037 2.362 0.000 0.000 0.000 3/36000 510.0 3.755 1.995 2.315 0.000 0.000 0.000 3/36000 520.0 3.683 1.954 2.269 0.000 0.000 0.000 3/36000 530.0 3.614 1.916 2.226 0.000 0.000 0.000 3/36000 540.0 3.548 1.878 2.184 0.000 0.000 0.000 3/36000 550.0 3.484 1.842 2.144 0.000 0.000 0.000 3/36000 560.0 3.423 1.808 2.105 0.000 0.000 0.000 3/36000 570.0 3.363 1.775 2.067 0.000 0.000 0.000 3/36000 580.0 3.306 1.743 2.031 0.000 0.000 0.000 3/36000 590.0 3.251 1.712 1.997 0.000 0.000 0.000 3/36000 600.0 3.198 1.683 1.963 0.000 0.000 0.000 3/36000 610.0 3.146 1.654 1.931 0.000 0.000 0.000 3/36000 620.0 3.096 1.626 1.900 0.000 0.000 0.000 3/36000 630.0 3.048 1.600 1.869 0.000 0.000 0.000 3/36000 640.0 3.001 1.574 1.840 0.000 0.000 0.000 3/36000 650.0 2.955 1.549 1.812 0.000 0.000 0.000 3/36000 660.0 2.911 1.525 1.784 0.000 0.000 0.000 3/36000 670.0 2.869 1.501 1.757 0.000 0.000 0.000 3/36000 680.0 2.827 1.479 1.732 0.000 0.000 0.000 3/36000 690.0 2.787 1.457 1.707 0.000 0.000 0.000 3/36000 700.0 2.748 1.435 1.682 0.000 0.000 0.000 3/36000 710.0 2.710 1.414 1.659 0.000 0.000 0.000 3/36000 720.0 2.673 1.394 1.636 0.000 0.000 0.000 3/36000 730.0 2.637 1.375 1.613 0.000 0.000 0.000 3/36000 740.0 2.602 1.356 1.591 0.000 0.000 0.000 3/36000 750.0 2.568 1.337 1.570 0.000 0.000 0.000 3/36000 760.0 2.535 1.319 1.550 0.000 0.000 0.000 3/36000 770.0 2.503 1.302 1.530 0.000 0.000 0.000 3/36000 780.0 2.471 1.285 1.510 0.000 0.000 0.000 3/36000 790.0 2.440 1.268 1.491 0.000 0.000 0.000 3/36000 800.0 2.410 1.252 1.473 0.000 0.000 0.000 3/36000 810.0 2.381 1.236 1.455 0.000 0.000 0.000 3/36000 820.0 2.353 1.221 1.437 0.000 0.000 0.000 3/36000 830.0 2.325 1.206 1.420 0.000 0.000 0.000 3/36000 840.0 2.298 1.192 1.403 0.000 0.000 0.000 3/36000 850.0 2.271 1.177 1.387 0.000 0.000 0.000 3/36000 860.0 2.245 1.163 1.370 0.000 0.000 0.000 3/36000 870.0 2.220 1.150 1.355 0.000 0.000 0.000 3/36000 880.0 2.195 1.137 1.340 0.000 0.000 0.000 3/36000 890.0 2.171 1.124 1.325 0.000 0.000 0.000 3/36000 900.0 2.147 1.111 1.310 0.000 0.000 0.000 3/36000 910.0 2.124 1.099 1.296 0.000 0.000 0.000 3/36000 920.0 2.101 1.087 1.282 0.000 0.000 0.000 3/36000 930.0 2.079 1.075 1.268 0.000 0.000 0.000 3/36000 940.0 2.057 1.063 1.255 0.000 0.000 0.000 3/36000 950.0 2.036 1.052 1.242 0.000 0.000 0.000 3/36000 960.0 2.015 1.041 1.229 0.000 0.000 0.000 3/36000 970.0 1.995 1.030 1.216 0.000 0.000 0.000 3/36000 980.0 1.974 1.019 1.204 0.000 0.000 0.000 3/36000 990.0 1.955 1.009 1.192 0.000 0.000 0.000 3/36000 1000.0 1.936 0.999 1.180 0.000 0.000 0.000 3/36000 Thermal conductivity related properties were written into "kappa-m1065.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 14:09:31]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|