----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-09 03:43:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 1 1] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 8 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.885204345031189 -3.353507060000000 0.000000000000000 b 5.885204345031189 3.353507060000000 0.000000000000000 c -3.714265426681640 0.000000000000000 12.265963182308775 Atomic positions (fractional): *1 Ho 0.68833137376850 0.69407883537968 0.54779740366023 164.930 2 Ho 0.69407883537968 0.68833137376850 0.04779740366023 164.930 3 Ho 0.30592116462032 0.31166862623150 0.95220259633977 164.930 4 Ho 0.31166862623150 0.30592116462032 0.45220259633977 164.930 *5 P 0.75094923395580 0.77236679473456 0.83789508322513 30.974 6 P 0.77236679473456 0.75094923395580 0.33789508322513 30.974 *7 P 0.83079632992568 0.14642473701242 0.63320190758986 30.974 8 P 0.85357526298758 0.16920367007432 0.86679809241014 30.974 9 P 0.14642473701242 0.83079632992568 0.13320190758986 30.974 10 P 0.16920367007432 0.85357526298758 0.36679809241014 30.974 11 P 0.22763320526544 0.24905076604420 0.66210491677487 30.974 12 P 0.24905076604420 0.22763320526544 0.16210491677487 30.974 *13 O 0.87175775758128 0.90285589155618 0.60118470091357 15.999 *14 O 0.88137169455057 0.91734285034469 0.84479813455997 15.999 15 O 0.90285589155618 0.87175775758128 0.10118470091357 15.999 16 O 0.91734285034469 0.88137169455057 0.34479813455997 15.999 *17 O 0.68727997529442 0.69926502192147 0.71914842072933 15.999 *18 O 0.92164575217595 0.57403911306351 0.90363311219498 15.999 *19 O 0.54976673368118 0.92100766140017 0.90394091654614 15.999 *20 O 0.66398382453711 0.32350385868896 0.55675935701024 15.999 21 O 0.69926502192147 0.68727997529442 0.21914842072933 15.999 22 O 0.57403911306351 0.92164575217595 0.40363311219498 15.999 23 O 0.92100766140017 0.54976673368118 0.40394091654615 15.999 *24 O 0.74339781023333 0.25660218976666 0.75000000000000 15.999 25 O 0.67649614131104 0.33601617546289 0.94324064298976 15.999 26 O 0.32350385868896 0.66398382453711 0.05675935701024 15.999 27 O 0.25660218976667 0.74339781023333 0.25000000000000 15.999 28 O 0.07899233859983 0.45023326631882 0.59605908345386 15.999 29 O 0.42596088693649 0.07835424782405 0.59636688780502 15.999 30 O 0.30073497807853 0.31272002470558 0.78085157927067 15.999 31 O 0.33601617546289 0.67649614131104 0.44324064298976 15.999 32 O 0.45023326631882 0.07899233859983 0.09605908345385 15.999 33 O 0.07835424782405 0.42596088693649 0.09636688780502 15.999 34 O 0.31272002470558 0.30073497807853 0.28085157927067 15.999 35 O 0.08265714965531 0.11862830544943 0.65520186544003 15.999 36 O 0.09714410844382 0.12824224241872 0.89881529908643 15.999 37 O 0.11862830544943 0.08265714965531 0.15520186544003 15.999 38 O 0.12824224241872 0.09714410844382 0.39881529908643 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 11.770408690062379 0.000000000000000 0.000000000000000 b 0.000000000000000 6.707014120000000 0.000000000000000 c -3.714265426681640 0.000000000000000 12.265963182308775 Atomic positions (fractional): *1 Ho 0.19120510457409 0.50287373080559 0.54779740366023 164.930 > 1 2 Ho 0.19120510457409 0.49712626919441 0.04779740366023 164.930 > 2 3 Ho 0.30879489542591 0.00287373080559 0.95220259633977 164.930 > 3 4 Ho 0.30879489542591 0.99712626919441 0.45220259633977 164.930 > 4 5 Ho 0.69120510457409 0.00287373080559 0.54779740366023 164.930 > 1 6 Ho 0.69120510457409 0.99712626919441 0.04779740366023 164.930 > 2 7 Ho 0.80879489542591 0.50287373080559 0.95220259633977 164.930 > 3 8 Ho 0.80879489542591 0.49712626919441 0.45220259633977 164.930 > 4 *9 P 0.26165801434518 0.51070878038938 0.83789508322513 30.974 > 5 10 P 0.26165801434518 0.48929121961062 0.33789508322513 30.974 > 6 *11 P 0.48861053346905 0.65781420354337 0.63320190758986 30.974 > 7 12 P 0.01138946653095 0.15781420354337 0.86679809241014 30.974 > 8 13 P 0.48861053346905 0.34218579645663 0.13320190758986 30.974 > 9 14 P 0.01138946653095 0.84218579645663 0.36679809241014 30.974 > 10 15 P 0.23834198565482 0.01070878038938 0.66210491677487 30.974 > 11 16 P 0.23834198565482 0.98929121961062 0.16210491677487 30.974 > 12 17 P 0.76165801434518 0.01070878038938 0.83789508322513 30.974 > 5 18 P 0.76165801434518 0.98929121961062 0.33789508322513 30.974 > 6 19 P 0.98861053346905 0.15781420354337 0.63320190758986 30.974 > 7 20 P 0.51138946653095 0.65781420354337 0.86679809241014 30.974 > 8 21 P 0.98861053346905 0.84218579645663 0.13320190758986 30.974 > 9 22 P 0.51138946653095 0.34218579645663 0.36679809241014 30.974 > 10 23 P 0.73834198565482 0.51070878038938 0.66210491677487 30.974 > 11 24 P 0.73834198565482 0.48929121961062 0.16210491677487 30.974 > 12 *25 O 0.38730682456873 0.51554906698745 0.60118470091357 15.999 > 13 *26 O 0.39935727244763 0.51798557789706 0.84479813455997 15.999 > 14 27 O 0.38730682456873 0.48445093301255 0.10118470091357 15.999 > 15 28 O 0.39935727244763 0.48201442210294 0.34479813455997 15.999 > 16 *29 O 0.19327249860794 0.50599252331352 0.71914842072933 15.999 > 17 *30 O 0.24784243261973 0.32619668044378 0.90363311219498 15.999 > 18 *31 O 0.23538719754067 0.68562046385949 0.90394091654614 15.999 > 19 *32 O 0.49374384161303 0.82976001707593 0.55675935701024 15.999 > 20 33 O 0.19327249860794 0.49400747668648 0.21914842072933 15.999 > 21 34 O 0.24784243261973 0.67380331955622 0.40363311219498 15.999 > 22 35 O 0.23538719754067 0.31437953614051 0.40394091654615 15.999 > 23 *36 O 0.00000000000000 0.25660218976666 0.75000000000000 15.999 > 24 37 O 0.00625615838697 0.32976001707593 0.94324064298976 15.999 > 25 38 O 0.49374384161303 0.17023998292407 0.05675935701024 15.999 > 26 39 O 0.00000000000000 0.74339781023333 0.25000000000000 15.999 > 27 40 O 0.26461280245933 0.18562046385949 0.59605908345386 15.999 > 28 41 O 0.25215756738027 0.82619668044378 0.59636688780502 15.999 > 29 42 O 0.30672750139206 0.00599252331352 0.78085157927067 15.999 > 30 43 O 0.00625615838697 0.67023998292407 0.44324064298976 15.999 > 31 44 O 0.26461280245933 0.81437953614051 0.09605908345385 15.999 > 32 45 O 0.25215756738027 0.17380331955622 0.09636688780502 15.999 > 33 46 O 0.30672750139206 0.99400747668648 0.28085157927067 15.999 > 34 47 O 0.10064272755237 0.01798557789706 0.65520186544003 15.999 > 35 48 O 0.11269317543127 0.01554906698745 0.89881529908643 15.999 > 36 49 O 0.10064272755237 0.98201442210294 0.15520186544003 15.999 > 37 50 O 0.11269317543127 0.98445093301255 0.39881529908643 15.999 > 38 51 O 0.88730682456873 0.01554906698745 0.60118470091357 15.999 > 13 52 O 0.89935727244763 0.01798557789706 0.84479813455997 15.999 > 14 53 O 0.88730682456873 0.98445093301255 0.10118470091357 15.999 > 15 54 O 0.89935727244763 0.98201442210294 0.34479813455997 15.999 > 16 55 O 0.69327249860794 0.00599252331352 0.71914842072933 15.999 > 17 56 O 0.74784243261973 0.82619668044378 0.90363311219498 15.999 > 18 57 O 0.73538719754068 0.18562046385949 0.90394091654614 15.999 > 19 58 O 0.99374384161303 0.32976001707593 0.55675935701024 15.999 > 20 59 O 0.69327249860794 0.99400747668648 0.21914842072933 15.999 > 21 60 O 0.74784243261973 0.17380331955622 0.40363311219498 15.999 > 22 61 O 0.73538719754068 0.81437953614051 0.40394091654615 15.999 > 23 62 O 0.50000000000000 0.75660218976667 0.75000000000000 15.999 > 24 63 O 0.50625615838697 0.82976001707593 0.94324064298976 15.999 > 25 64 O 0.99374384161303 0.67023998292407 0.05675935701024 15.999 > 26 65 O 0.50000000000000 0.24339781023334 0.25000000000000 15.999 > 27 66 O 0.76461280245932 0.68562046385949 0.59605908345386 15.999 > 28 67 O 0.75215756738027 0.32619668044378 0.59636688780502 15.999 > 29 68 O 0.80672750139206 0.50599252331352 0.78085157927067 15.999 > 30 69 O 0.50625615838697 0.17023998292407 0.44324064298976 15.999 > 31 70 O 0.76461280245932 0.31437953614051 0.09605908345385 15.999 > 32 71 O 0.75215756738027 0.67380331955622 0.09636688780502 15.999 > 33 72 O 0.80672750139206 0.49400747668648 0.28085157927067 15.999 > 34 73 O 0.60064272755237 0.51798557789706 0.65520186544003 15.999 > 35 74 O 0.61269317543127 0.51554906698745 0.89881529908643 15.999 > 36 75 O 0.60064272755237 0.48201442210294 0.15520186544003 15.999 > 37 76 O 0.61269317543127 0.48445093301255 0.39881529908643 15.999 > 38 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.770408690062379 0.000000000000000 0.000000000000000 b 0.000000000000000 6.707014120000000 0.000000000000000 c -3.714265426681640 0.000000000000000 12.265963182308775 Atomic positions (fractional): *1 Ho 0.19120510457409 0.50287373080559 0.54779740366023 164.930 > 1 2 Ho 0.19120510457409 0.49712626919441 0.04779740366023 164.930 > 2 3 Ho 0.30879489542591 0.00287373080559 0.95220259633977 164.930 > 3 4 Ho 0.30879489542591 0.99712626919441 0.45220259633977 164.930 > 4 5 Ho 0.69120510457409 0.00287373080559 0.54779740366023 164.930 > 1 6 Ho 0.69120510457409 0.99712626919441 0.04779740366023 164.930 > 2 7 Ho 0.80879489542591 0.50287373080559 0.95220259633977 164.930 > 3 8 Ho 0.80879489542591 0.49712626919441 0.45220259633977 164.930 > 4 *9 P 0.26165801434518 0.51070878038938 0.83789508322513 30.974 > 5 10 P 0.26165801434518 0.48929121961062 0.33789508322513 30.974 > 6 *11 P 0.48861053346905 0.65781420354337 0.63320190758986 30.974 > 7 12 P 0.01138946653095 0.15781420354337 0.86679809241014 30.974 > 8 13 P 0.48861053346905 0.34218579645663 0.13320190758986 30.974 > 9 14 P 0.01138946653095 0.84218579645663 0.36679809241014 30.974 > 10 15 P 0.23834198565482 0.01070878038938 0.66210491677487 30.974 > 11 16 P 0.23834198565482 0.98929121961062 0.16210491677487 30.974 > 12 17 P 0.76165801434518 0.01070878038938 0.83789508322513 30.974 > 5 18 P 0.76165801434518 0.98929121961062 0.33789508322513 30.974 > 6 19 P 0.98861053346905 0.15781420354337 0.63320190758986 30.974 > 7 20 P 0.51138946653095 0.65781420354337 0.86679809241014 30.974 > 8 21 P 0.98861053346905 0.84218579645663 0.13320190758986 30.974 > 9 22 P 0.51138946653095 0.34218579645663 0.36679809241014 30.974 > 10 23 P 0.73834198565482 0.51070878038938 0.66210491677487 30.974 > 11 24 P 0.73834198565482 0.48929121961062 0.16210491677487 30.974 > 12 *25 O 0.38730682456873 0.51554906698745 0.60118470091357 15.999 > 13 *26 O 0.39935727244763 0.51798557789706 0.84479813455997 15.999 > 14 27 O 0.38730682456873 0.48445093301255 0.10118470091357 15.999 > 15 28 O 0.39935727244763 0.48201442210294 0.34479813455997 15.999 > 16 *29 O 0.19327249860794 0.50599252331352 0.71914842072933 15.999 > 17 *30 O 0.24784243261973 0.32619668044378 0.90363311219498 15.999 > 18 *31 O 0.23538719754067 0.68562046385949 0.90394091654614 15.999 > 19 *32 O 0.49374384161303 0.82976001707593 0.55675935701024 15.999 > 20 33 O 0.19327249860794 0.49400747668648 0.21914842072933 15.999 > 21 34 O 0.24784243261973 0.67380331955622 0.40363311219498 15.999 > 22 35 O 0.23538719754067 0.31437953614051 0.40394091654615 15.999 > 23 *36 O 0.00000000000000 0.25660218976666 0.75000000000000 15.999 > 24 37 O 0.00625615838697 0.32976001707593 0.94324064298976 15.999 > 25 38 O 0.49374384161303 0.17023998292407 0.05675935701024 15.999 > 26 39 O 0.00000000000000 0.74339781023333 0.25000000000000 15.999 > 27 40 O 0.26461280245933 0.18562046385949 0.59605908345386 15.999 > 28 41 O 0.25215756738027 0.82619668044378 0.59636688780502 15.999 > 29 42 O 0.30672750139206 0.00599252331352 0.78085157927067 15.999 > 30 43 O 0.00625615838697 0.67023998292407 0.44324064298976 15.999 > 31 44 O 0.26461280245933 0.81437953614051 0.09605908345385 15.999 > 32 45 O 0.25215756738027 0.17380331955622 0.09636688780502 15.999 > 33 46 O 0.30672750139206 0.99400747668648 0.28085157927067 15.999 > 34 47 O 0.10064272755237 0.01798557789706 0.65520186544003 15.999 > 35 48 O 0.11269317543127 0.01554906698745 0.89881529908643 15.999 > 36 49 O 0.10064272755237 0.98201442210294 0.15520186544003 15.999 > 37 50 O 0.11269317543127 0.98445093301255 0.39881529908643 15.999 > 38 51 O 0.88730682456873 0.01554906698745 0.60118470091357 15.999 > 13 52 O 0.89935727244763 0.01798557789706 0.84479813455997 15.999 > 14 53 O 0.88730682456873 0.98445093301255 0.10118470091357 15.999 > 15 54 O 0.89935727244763 0.98201442210294 0.34479813455997 15.999 > 16 55 O 0.69327249860794 0.00599252331352 0.71914842072933 15.999 > 17 56 O 0.74784243261973 0.82619668044378 0.90363311219498 15.999 > 18 57 O 0.73538719754068 0.18562046385949 0.90394091654614 15.999 > 19 58 O 0.99374384161303 0.32976001707593 0.55675935701024 15.999 > 20 59 O 0.69327249860794 0.99400747668648 0.21914842072933 15.999 > 21 60 O 0.74784243261973 0.17380331955622 0.40363311219498 15.999 > 22 61 O 0.73538719754068 0.81437953614051 0.40394091654615 15.999 > 23 62 O 0.50000000000000 0.75660218976667 0.75000000000000 15.999 > 24 63 O 0.50625615838697 0.82976001707593 0.94324064298976 15.999 > 25 64 O 0.99374384161303 0.67023998292407 0.05675935701024 15.999 > 26 65 O 0.50000000000000 0.24339781023334 0.25000000000000 15.999 > 27 66 O 0.76461280245932 0.68562046385949 0.59605908345386 15.999 > 28 67 O 0.75215756738027 0.32619668044378 0.59636688780502 15.999 > 29 68 O 0.80672750139206 0.50599252331352 0.78085157927067 15.999 > 30 69 O 0.50625615838697 0.17023998292407 0.44324064298976 15.999 > 31 70 O 0.76461280245932 0.31437953614051 0.09605908345385 15.999 > 32 71 O 0.75215756738027 0.67380331955622 0.09636688780502 15.999 > 33 72 O 0.80672750139206 0.49400747668648 0.28085157927067 15.999 > 34 73 O 0.60064272755237 0.51798557789706 0.65520186544003 15.999 > 35 74 O 0.61269317543127 0.51554906698745 0.89881529908643 15.999 > 36 75 O 0.60064272755237 0.48201442210294 0.15520186544003 15.999 > 37 76 O 0.61269317543127 0.48445093301255 0.39881529908643 15.999 > 38 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.9059263 0.0000000 -0.0563949 0.0000000 2.8429351 0.0000000 -0.0563958 0.0000000 3.0266772 -------------------------- Born effective charges -------------------------- 1 Ho 3.8152940 0.0872847 -0.1401184 0.2042601 3.9530965 0.0096549 -0.2210966 -0.1963249 4.1636950 2 Ho 3.8152940 -0.0872847 -0.1401184 -0.2042601 3.9530965 -0.0096549 -0.2210966 0.1963249 4.1636950 3 Ho 3.8152940 -0.0872847 -0.1401184 -0.2042601 3.9530965 -0.0096549 -0.2210966 0.1963249 4.1636950 4 Ho 3.8152940 0.0872847 -0.1401184 0.2042601 3.9530965 0.0096549 -0.2210966 -0.1963249 4.1636950 5 P 3.5788797 0.2448413 -0.3618970 0.6104895 3.3473697 -0.0331511 -0.0799644 0.0301086 4.1233485 6 P 3.5788797 -0.2448413 -0.3618970 -0.6104895 3.3473697 0.0331511 -0.0799644 -0.0301086 4.1233485 7 P 4.0849746 -0.3018687 0.1786999 -0.0511382 3.1047033 -0.3176097 -0.0156633 0.2902578 3.7951294 8 P 4.0849746 0.3018687 0.1786999 0.0511382 3.1047033 0.3176097 -0.0156633 -0.2902578 3.7951294 9 P 4.0849746 0.3018687 0.1786999 0.0511382 3.1047033 0.3176097 -0.0156633 -0.2902578 3.7951294 10 P 4.0849746 -0.3018687 0.1786999 -0.0511382 3.1047033 -0.3176097 -0.0156633 0.2902578 3.7951294 11 P 3.5788797 -0.2448413 -0.3618970 -0.6104895 3.3473697 0.0331511 -0.0799644 -0.0301086 4.1233485 12 P 3.5788797 0.2448413 -0.3618970 0.6104895 3.3473697 -0.0331511 -0.0799644 0.0301086 4.1233485 13 O -2.3461503 -0.5202990 -0.4052253 -0.4402643 -1.2489734 -0.1701968 -0.4925552 -0.3095429 -1.2431707 14 O -3.2036803 -0.8445638 -0.2714028 -0.8066795 -1.1713172 -0.1527465 -0.0849830 -0.0580465 -1.0263420 15 O -2.3461503 0.5202990 -0.4052253 0.4402643 -1.2489734 0.1701968 -0.4925552 0.3095429 -1.2431707 16 O -3.2036803 0.8445638 -0.2714028 0.8066795 -1.1713172 0.1527465 -0.0849830 0.0580465 -1.0263420 17 O -1.0561311 -0.1222128 0.0875310 -0.1692332 -1.1136151 -0.0717785 0.0458116 -0.0582687 -3.1652059 18 O -1.2625350 -0.2982887 0.3696217 -0.0974872 -2.3676107 0.5802343 0.3298378 0.3172446 -1.7929926 19 O -1.2066819 0.1429192 0.4699483 -0.1549329 -2.3334836 -0.3831806 0.4485823 -0.2638743 -1.7639029 20 O -1.8089851 -0.1106787 -0.1362685 -0.1969742 -1.6951689 0.6129212 -0.1164890 0.6768150 -1.5376067 21 O -1.0561311 0.1222128 0.0875310 0.1692332 -1.1136151 0.0717785 0.0458116 0.0582687 -3.1652059 22 O -1.2625350 0.2982887 0.3696217 0.0974872 -2.3676107 -0.5802343 0.3298378 -0.3172446 -1.7929926 23 O -1.2066819 -0.1429192 0.4699483 0.1549329 -2.3334836 0.3831806 0.4485823 0.2638743 -1.7639029 24 O -1.1899694 0.0000000 0.4182222 -0.0000000 -0.9500013 -0.0000000 0.3730396 0.0000000 -3.1059043 25 O -1.8089851 0.1106787 -0.1362685 0.1969742 -1.6951689 -0.6129212 -0.1164890 -0.6768150 -1.5376067 26 O -1.8089851 0.1106787 -0.1362685 0.1969742 -1.6951689 -0.6129212 -0.1164890 -0.6768150 -1.5376067 27 O -1.1899694 0.0000000 0.4182222 -0.0000000 -0.9500013 -0.0000000 0.3730396 0.0000000 -3.1059043 28 O -1.2066819 -0.1429192 0.4699483 0.1549329 -2.3334836 0.3831806 0.4485823 0.2638743 -1.7639029 29 O -1.2625350 0.2982887 0.3696217 0.0974872 -2.3676107 -0.5802343 0.3298378 -0.3172446 -1.7929926 30 O -1.0561311 0.1222128 0.0875310 0.1692332 -1.1136151 0.0717785 0.0458116 0.0582687 -3.1652059 31 O -1.8089851 -0.1106787 -0.1362685 -0.1969742 -1.6951689 0.6129212 -0.1164890 0.6768150 -1.5376067 32 O -1.2066819 0.1429192 0.4699483 -0.1549329 -2.3334836 -0.3831806 0.4485823 -0.2638743 -1.7639029 33 O -1.2625350 -0.2982887 0.3696217 -0.0974872 -2.3676107 0.5802343 0.3298378 0.3172446 -1.7929926 34 O -1.0561311 -0.1222128 0.0875310 -0.1692332 -1.1136151 -0.0717785 0.0458116 -0.0582687 -3.1652059 35 O -3.2036803 0.8445638 -0.2714028 0.8066795 -1.1713172 0.1527465 -0.0849830 0.0580465 -1.0263420 36 O -2.3461503 0.5202990 -0.4052253 0.4402643 -1.2489734 0.1701968 -0.4925552 0.3095429 -1.2431707 37 O -3.2036803 -0.8445638 -0.2714028 -0.8066795 -1.1713172 -0.1527465 -0.0849830 -0.0580465 -1.0263420 38 O -2.3461503 -0.5202990 -0.4052253 -0.4402643 -1.2489734 -0.1701968 -0.4925552 -0.3095429 -1.2431707 ---------------------------------------------------------------------------- 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: 228/228 Permutation basis: 16341/16341 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3364 Number of blocks in projector: 3364 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: 724 Use submatrix version of eigh solver. (1) Block: 500 / 724 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 724 / 724 (1) 213 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 11 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 720 Use submatrix version of eigh solver. (1) Block: 500 / 720 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 234 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 720 / 720 (1) 203 eigenvectors found. (1) Complementary block size: 35 (1) Compute compressed projector. (1) Use standard solver. (1) 17 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 720 Use submatrix version of eigh solver. (1) Block: 500 / 720 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 234 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 720 / 720 (1) 203 eigenvectors found. (1) Complementary block size: 35 (1) Compute compressed projector. (1) Use standard solver. (1) 17 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 400 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 400 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 400 Use standard eigh solver. Tree of FC basis block matrices: - (3364, 3279), data: False |-- (400, 390), data: True |-- (400, 390), data: True |-- (400, 390), data: True |-- (720, 702), data: False |-- (720, 17), data: (720, 35) @ (35, 17) |-- (220, 203), data: True |-- (500, 482), data: False |-- (500, 16), data: (500, 34) @ (34, 16) |-- (250, 234), data: True |-- (250, 232), data: True |-- (720, 702), data: False |-- (720, 17), data: (720, 35) @ (35, 17) |-- (220, 203), data: True |-- (500, 482), data: False |-- (500, 16), data: (500, 34) @ (34, 16) |-- (250, 234), data: True |-- (250, 232), data: True |-- (724, 705), data: False |-- (724, 11), data: (724, 30) @ (30, 11) |-- (224, 213), data: True |-- (500, 481), data: False |-- (500, 17), data: (500, 36) @ (36, 17) |-- (250, 233), data: True |-- (250, 231), data: True ----- Solver_atoms: 1 -- 76 / 76 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 1200 - Time: 0.748 Solver_block: 200 / 1200 - Time: 0.594 Solver_block: 300 / 1200 - Time: 0.593 Solver_block: 400 / 1200 - Time: 0.595 Solver_block: 500 / 1200 - Time: 0.593 Solver_block: 600 / 1200 - Time: 0.588 Solver_block: 700 / 1200 - Time: 0.591 Solver_block: 800 / 1200 - Time: 0.589 Solver_block: 900 / 1200 - Time: 0.594 Solver_block: 1000 / 1200 - Time: 0.589 Solver_block: 1100 / 1200 - Time: 0.595 Solver_block: 1200 / 1200 - Time: 0.593 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 7.409 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 228/228 Permutation basis: 16341/16341 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3364 Number of blocks in projector: 3364 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: 724 Use submatrix version of eigh solver. (1) Block: 500 / 724 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 724 / 724 (1) 213 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 11 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 720 Use submatrix version of eigh solver. (1) Block: 500 / 720 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 234 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 720 / 720 (1) 203 eigenvectors found. (1) Complementary block size: 35 (1) Compute compressed projector. (1) Use standard solver. (1) 17 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 720 Use submatrix version of eigh solver. (1) Block: 500 / 720 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 234 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 720 / 720 (1) 203 eigenvectors found. (1) Complementary block size: 35 (1) Compute compressed projector. (1) Use standard solver. (1) 17 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 400 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 400 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 400 Use standard eigh solver. Tree of FC basis block matrices: - (3364, 3279), data: False |-- (400, 390), data: True |-- (400, 390), data: True |-- (400, 390), data: True |-- (720, 702), data: False |-- (720, 17), data: (720, 35) @ (35, 17) |-- (220, 203), data: True |-- (500, 482), data: False |-- (500, 16), data: (500, 34) @ (34, 16) |-- (250, 234), data: True |-- (250, 232), data: True |-- (720, 702), data: False |-- (720, 17), data: (720, 35) @ (35, 17) |-- (220, 203), data: True |-- (500, 482), data: False |-- (500, 16), data: (500, 34) @ (34, 16) |-- (250, 234), data: True |-- (250, 232), data: True |-- (724, 705), data: False |-- (724, 11), data: (724, 30) @ (30, 11) |-- (224, 213), data: True |-- (500, 481), data: False |-- (500, 17), data: (500, 36) @ (36, 17) |-- (250, 233), data: True |-- (250, 231), data: True Max drift after symmetrization by symfc projector: -0.00000000 (yy) -0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-09 03:44:01]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 03:44:01]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 1 1] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.885204345031189 -3.353507060000000 0.000000000000000 b 5.885204345031189 3.353507060000000 0.000000000000000 c -3.714265426681640 0.000000000000000 12.265963182308775 Atomic positions (fractional): 1 Ho 0.68833137376850 0.69407883537968 0.54779740366023 164.930 2 Ho 0.69407883537968 0.68833137376850 0.04779740366023 164.930 3 Ho 0.30592116462032 0.31166862623150 0.95220259633977 164.930 4 Ho 0.31166862623150 0.30592116462032 0.45220259633977 164.930 5 P 0.75094923395580 0.77236679473456 0.83789508322513 30.974 6 P 0.77236679473456 0.75094923395580 0.33789508322513 30.974 7 P 0.83079632992568 0.14642473701242 0.63320190758986 30.974 8 P 0.85357526298758 0.16920367007432 0.86679809241014 30.974 9 P 0.14642473701242 0.83079632992568 0.13320190758986 30.974 10 P 0.16920367007432 0.85357526298758 0.36679809241014 30.974 11 P 0.22763320526544 0.24905076604420 0.66210491677487 30.974 12 P 0.24905076604420 0.22763320526544 0.16210491677487 30.974 13 O 0.87175775758128 0.90285589155618 0.60118470091357 15.999 14 O 0.88137169455057 0.91734285034469 0.84479813455997 15.999 15 O 0.90285589155618 0.87175775758128 0.10118470091357 15.999 16 O 0.91734285034469 0.88137169455057 0.34479813455997 15.999 17 O 0.68727997529442 0.69926502192147 0.71914842072933 15.999 18 O 0.92164575217595 0.57403911306351 0.90363311219498 15.999 19 O 0.54976673368118 0.92100766140017 0.90394091654614 15.999 20 O 0.66398382453711 0.32350385868896 0.55675935701024 15.999 21 O 0.69926502192147 0.68727997529442 0.21914842072933 15.999 22 O 0.57403911306351 0.92164575217595 0.40363311219498 15.999 23 O 0.92100766140017 0.54976673368118 0.40394091654615 15.999 24 O 0.74339781023333 0.25660218976666 0.75000000000000 15.999 25 O 0.67649614131104 0.33601617546289 0.94324064298976 15.999 26 O 0.32350385868896 0.66398382453711 0.05675935701024 15.999 27 O 0.25660218976667 0.74339781023333 0.25000000000000 15.999 28 O 0.07899233859983 0.45023326631882 0.59605908345386 15.999 29 O 0.42596088693649 0.07835424782405 0.59636688780502 15.999 30 O 0.30073497807853 0.31272002470558 0.78085157927067 15.999 31 O 0.33601617546289 0.67649614131104 0.44324064298976 15.999 32 O 0.45023326631882 0.07899233859983 0.09605908345385 15.999 33 O 0.07835424782405 0.42596088693649 0.09636688780502 15.999 34 O 0.31272002470558 0.30073497807853 0.28085157927067 15.999 35 O 0.08265714965531 0.11862830544943 0.65520186544003 15.999 36 O 0.09714410844382 0.12824224241872 0.89881529908643 15.999 37 O 0.11862830544943 0.08265714965531 0.15520186544003 15.999 38 O 0.12824224241872 0.09714410844382 0.39881529908643 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.770408690062379 0.000000000000000 0.000000000000000 b 0.000000000000000 6.707014120000000 0.000000000000000 c -3.714265426681640 0.000000000000000 12.265963182308775 Atomic positions (fractional): 1 Ho 0.19120510457409 0.50287373080559 0.54779740366023 164.930 > 1 2 Ho 0.19120510457409 0.49712626919441 0.04779740366023 164.930 > 2 3 Ho 0.30879489542591 0.00287373080559 0.95220259633977 164.930 > 3 4 Ho 0.30879489542591 0.99712626919441 0.45220259633977 164.930 > 4 5 Ho 0.69120510457409 0.00287373080559 0.54779740366023 164.930 > 1 6 Ho 0.69120510457409 0.99712626919441 0.04779740366023 164.930 > 2 7 Ho 0.80879489542591 0.50287373080559 0.95220259633977 164.930 > 3 8 Ho 0.80879489542591 0.49712626919441 0.45220259633977 164.930 > 4 9 P 0.26165801434518 0.51070878038938 0.83789508322513 30.974 > 9 10 P 0.26165801434518 0.48929121961062 0.33789508322513 30.974 > 10 11 P 0.48861053346905 0.65781420354337 0.63320190758986 30.974 > 11 12 P 0.01138946653095 0.15781420354337 0.86679809241014 30.974 > 12 13 P 0.48861053346905 0.34218579645663 0.13320190758986 30.974 > 13 14 P 0.01138946653095 0.84218579645663 0.36679809241014 30.974 > 14 15 P 0.23834198565482 0.01070878038938 0.66210491677487 30.974 > 15 16 P 0.23834198565482 0.98929121961062 0.16210491677487 30.974 > 16 17 P 0.76165801434518 0.01070878038938 0.83789508322513 30.974 > 9 18 P 0.76165801434518 0.98929121961062 0.33789508322513 30.974 > 10 19 P 0.98861053346905 0.15781420354337 0.63320190758986 30.974 > 11 20 P 0.51138946653095 0.65781420354337 0.86679809241014 30.974 > 12 21 P 0.98861053346905 0.84218579645663 0.13320190758986 30.974 > 13 22 P 0.51138946653095 0.34218579645663 0.36679809241014 30.974 > 14 23 P 0.73834198565482 0.51070878038938 0.66210491677487 30.974 > 15 24 P 0.73834198565482 0.48929121961062 0.16210491677487 30.974 > 16 25 O 0.38730682456873 0.51554906698745 0.60118470091357 15.999 > 25 26 O 0.39935727244763 0.51798557789706 0.84479813455997 15.999 > 26 27 O 0.38730682456873 0.48445093301255 0.10118470091357 15.999 > 27 28 O 0.39935727244763 0.48201442210294 0.34479813455997 15.999 > 28 29 O 0.19327249860794 0.50599252331352 0.71914842072933 15.999 > 29 30 O 0.24784243261973 0.32619668044378 0.90363311219498 15.999 > 30 31 O 0.23538719754067 0.68562046385949 0.90394091654614 15.999 > 31 32 O 0.49374384161303 0.82976001707593 0.55675935701024 15.999 > 32 33 O 0.19327249860794 0.49400747668648 0.21914842072933 15.999 > 33 34 O 0.24784243261973 0.67380331955622 0.40363311219498 15.999 > 34 35 O 0.23538719754067 0.31437953614051 0.40394091654615 15.999 > 35 36 O 0.00000000000000 0.25660218976666 0.75000000000000 15.999 > 36 37 O 0.00625615838697 0.32976001707593 0.94324064298976 15.999 > 37 38 O 0.49374384161303 0.17023998292407 0.05675935701024 15.999 > 38 39 O 0.00000000000000 0.74339781023333 0.25000000000000 15.999 > 39 40 O 0.26461280245933 0.18562046385949 0.59605908345386 15.999 > 40 41 O 0.25215756738027 0.82619668044378 0.59636688780502 15.999 > 41 42 O 0.30672750139206 0.00599252331352 0.78085157927067 15.999 > 42 43 O 0.00625615838697 0.67023998292407 0.44324064298976 15.999 > 43 44 O 0.26461280245933 0.81437953614051 0.09605908345385 15.999 > 44 45 O 0.25215756738027 0.17380331955622 0.09636688780502 15.999 > 45 46 O 0.30672750139206 0.99400747668648 0.28085157927067 15.999 > 46 47 O 0.10064272755237 0.01798557789706 0.65520186544003 15.999 > 47 48 O 0.11269317543127 0.01554906698745 0.89881529908643 15.999 > 48 49 O 0.10064272755237 0.98201442210294 0.15520186544003 15.999 > 49 50 O 0.11269317543127 0.98445093301255 0.39881529908643 15.999 > 50 51 O 0.88730682456873 0.01554906698745 0.60118470091357 15.999 > 25 52 O 0.89935727244763 0.01798557789706 0.84479813455997 15.999 > 26 53 O 0.88730682456873 0.98445093301255 0.10118470091357 15.999 > 27 54 O 0.89935727244763 0.98201442210294 0.34479813455997 15.999 > 28 55 O 0.69327249860794 0.00599252331352 0.71914842072933 15.999 > 29 56 O 0.74784243261973 0.82619668044378 0.90363311219498 15.999 > 30 57 O 0.73538719754068 0.18562046385949 0.90394091654614 15.999 > 31 58 O 0.99374384161303 0.32976001707593 0.55675935701024 15.999 > 32 59 O 0.69327249860794 0.99400747668648 0.21914842072933 15.999 > 33 60 O 0.74784243261973 0.17380331955622 0.40363311219498 15.999 > 34 61 O 0.73538719754068 0.81437953614051 0.40394091654615 15.999 > 35 62 O 0.50000000000000 0.75660218976667 0.75000000000000 15.999 > 36 63 O 0.50625615838697 0.82976001707593 0.94324064298976 15.999 > 37 64 O 0.99374384161303 0.67023998292407 0.05675935701024 15.999 > 38 65 O 0.50000000000000 0.24339781023334 0.25000000000000 15.999 > 39 66 O 0.76461280245932 0.68562046385949 0.59605908345386 15.999 > 40 67 O 0.75215756738027 0.32619668044378 0.59636688780502 15.999 > 41 68 O 0.80672750139206 0.50599252331352 0.78085157927067 15.999 > 42 69 O 0.50625615838697 0.17023998292407 0.44324064298976 15.999 > 43 70 O 0.76461280245932 0.31437953614051 0.09605908345385 15.999 > 44 71 O 0.75215756738027 0.67380331955622 0.09636688780502 15.999 > 45 72 O 0.80672750139206 0.49400747668648 0.28085157927067 15.999 > 46 73 O 0.60064272755237 0.51798557789706 0.65520186544003 15.999 > 47 74 O 0.61269317543127 0.51554906698745 0.89881529908643 15.999 > 48 75 O 0.60064272755237 0.48201442210294 0.15520186544003 15.999 > 49 76 O 0.61269317543127 0.48445093301255 0.39881529908643 15.999 > 50 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.9059263 0.0000000 -0.0563949 0.0000000 2.8429351 0.0000000 -0.0563958 0.0000000 3.0266772 -------------------------- Born effective charges -------------------------- 1 Ho 3.8152940 0.0872847 -0.1401184 0.2042601 3.9530965 0.0096549 -0.2210966 -0.1963249 4.1636950 2 Ho 3.8152940 -0.0872847 -0.1401184 -0.2042601 3.9530965 -0.0096549 -0.2210966 0.1963249 4.1636950 3 Ho 3.8152940 -0.0872847 -0.1401184 -0.2042601 3.9530965 -0.0096549 -0.2210966 0.1963249 4.1636950 4 Ho 3.8152940 0.0872847 -0.1401184 0.2042601 3.9530965 0.0096549 -0.2210966 -0.1963249 4.1636950 5 P 3.5788797 0.2448413 -0.3618970 0.6104895 3.3473697 -0.0331511 -0.0799644 0.0301086 4.1233485 6 P 3.5788797 -0.2448413 -0.3618970 -0.6104895 3.3473697 0.0331511 -0.0799644 -0.0301086 4.1233485 7 P 4.0849746 -0.3018687 0.1786999 -0.0511382 3.1047033 -0.3176097 -0.0156633 0.2902578 3.7951294 8 P 4.0849746 0.3018687 0.1786999 0.0511382 3.1047033 0.3176097 -0.0156633 -0.2902578 3.7951294 9 P 4.0849746 0.3018687 0.1786999 0.0511382 3.1047033 0.3176097 -0.0156633 -0.2902578 3.7951294 10 P 4.0849746 -0.3018687 0.1786999 -0.0511382 3.1047033 -0.3176097 -0.0156633 0.2902578 3.7951294 11 P 3.5788797 -0.2448413 -0.3618970 -0.6104895 3.3473697 0.0331511 -0.0799644 -0.0301086 4.1233485 12 P 3.5788797 0.2448413 -0.3618970 0.6104895 3.3473697 -0.0331511 -0.0799644 0.0301086 4.1233485 13 O -2.3461503 -0.5202990 -0.4052253 -0.4402643 -1.2489734 -0.1701968 -0.4925552 -0.3095429 -1.2431707 14 O -3.2036803 -0.8445638 -0.2714028 -0.8066795 -1.1713172 -0.1527465 -0.0849830 -0.0580465 -1.0263420 15 O -2.3461503 0.5202990 -0.4052253 0.4402643 -1.2489734 0.1701968 -0.4925552 0.3095429 -1.2431707 16 O -3.2036803 0.8445638 -0.2714028 0.8066795 -1.1713172 0.1527465 -0.0849830 0.0580465 -1.0263420 17 O -1.0561311 -0.1222128 0.0875310 -0.1692332 -1.1136151 -0.0717785 0.0458116 -0.0582687 -3.1652059 18 O -1.2625350 -0.2982887 0.3696217 -0.0974872 -2.3676107 0.5802343 0.3298378 0.3172446 -1.7929926 19 O -1.2066819 0.1429192 0.4699483 -0.1549329 -2.3334836 -0.3831806 0.4485823 -0.2638743 -1.7639029 20 O -1.8089851 -0.1106787 -0.1362685 -0.1969742 -1.6951689 0.6129212 -0.1164890 0.6768150 -1.5376067 21 O -1.0561311 0.1222128 0.0875310 0.1692332 -1.1136151 0.0717785 0.0458116 0.0582687 -3.1652059 22 O -1.2625350 0.2982887 0.3696217 0.0974872 -2.3676107 -0.5802343 0.3298378 -0.3172446 -1.7929926 23 O -1.2066819 -0.1429192 0.4699483 0.1549329 -2.3334836 0.3831806 0.4485823 0.2638743 -1.7639029 24 O -1.1899694 0.0000000 0.4182222 -0.0000000 -0.9500013 -0.0000000 0.3730396 0.0000000 -3.1059043 25 O -1.8089851 0.1106787 -0.1362685 0.1969742 -1.6951689 -0.6129212 -0.1164890 -0.6768150 -1.5376067 26 O -1.8089851 0.1106787 -0.1362685 0.1969742 -1.6951689 -0.6129212 -0.1164890 -0.6768150 -1.5376067 27 O -1.1899694 0.0000000 0.4182222 -0.0000000 -0.9500013 -0.0000000 0.3730396 0.0000000 -3.1059043 28 O -1.2066819 -0.1429192 0.4699483 0.1549329 -2.3334836 0.3831806 0.4485823 0.2638743 -1.7639029 29 O -1.2625350 0.2982887 0.3696217 0.0974872 -2.3676107 -0.5802343 0.3298378 -0.3172446 -1.7929926 30 O -1.0561311 0.1222128 0.0875310 0.1692332 -1.1136151 0.0717785 0.0458116 0.0582687 -3.1652059 31 O -1.8089851 -0.1106787 -0.1362685 -0.1969742 -1.6951689 0.6129212 -0.1164890 0.6768150 -1.5376067 32 O -1.2066819 0.1429192 0.4699483 -0.1549329 -2.3334836 -0.3831806 0.4485823 -0.2638743 -1.7639029 33 O -1.2625350 -0.2982887 0.3696217 -0.0974872 -2.3676107 0.5802343 0.3298378 0.3172446 -1.7929926 34 O -1.0561311 -0.1222128 0.0875310 -0.1692332 -1.1136151 -0.0717785 0.0458116 -0.0582687 -3.1652059 35 O -3.2036803 0.8445638 -0.2714028 0.8066795 -1.1713172 0.1527465 -0.0849830 0.0580465 -1.0263420 36 O -2.3461503 0.5202990 -0.4052253 0.4402643 -1.2489734 0.1701968 -0.4925552 0.3095429 -1.2431707 37 O -3.2036803 -0.8445638 -0.2714028 -0.8066795 -1.1713172 -0.1527465 -0.0849830 -0.0580465 -1.0263420 38 O -2.3461503 -0.5202990 -0.4052253 -0.4402643 -1.2489734 -0.1701968 -0.4925552 -0.3095429 -1.2431707 ---------------------------------------------------------------------------- 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] [-0.0029 0.0000 0.0096] [ 0.0029 0.0000 -0.0096] Computing fc3[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0029 0.0000 0.0096] [ 0.0029 0.0000 -0.0096] Computing fc3[ 11, 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] [-0.0029 0.0000 0.0096] [ 0.0029 0.0000 -0.0096] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0029 0.0000 0.0096] [ 0.0029 0.0000 -0.0096] Computing fc3[ 26, 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] [-0.0029 0.0000 0.0096] [ 0.0029 0.0000 -0.0096] Computing fc3[ 29, 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] [-0.0029 0.0000 0.0096] [ 0.0029 0.0000 -0.0096] Computing fc3[ 30, 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] [-0.0029 0.0000 0.0096] [ 0.0029 0.0000 -0.0096] Computing fc3[ 31, 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] [-0.0029 0.0000 0.0096] [ 0.0029 0.0000 -0.0096] Computing fc3[ 32, 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] [-0.0029 0.0000 0.0096] [ 0.0029 0.0000 -0.0096] Computing fc3[ 36, 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] [-0.0029 0.0000 0.0096] [ 0.0029 0.0000 -0.0096] 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: -0.00000001 (xy) -0.00000001 (xy) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 03:44:26]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 03:44:27]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 1 1] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.885204345031189 -3.353507060000000 0.000000000000000 b 5.885204345031189 3.353507060000000 0.000000000000000 c -3.714265426681640 0.000000000000000 12.265963182308775 Atomic positions (fractional): 1 Ho 0.68833137376850 0.69407883537968 0.54779740366023 164.930 2 Ho 0.69407883537968 0.68833137376850 0.04779740366023 164.930 3 Ho 0.30592116462032 0.31166862623150 0.95220259633977 164.930 4 Ho 0.31166862623150 0.30592116462032 0.45220259633977 164.930 5 P 0.75094923395580 0.77236679473456 0.83789508322513 30.974 6 P 0.77236679473456 0.75094923395580 0.33789508322513 30.974 7 P 0.83079632992568 0.14642473701242 0.63320190758986 30.974 8 P 0.85357526298758 0.16920367007432 0.86679809241014 30.974 9 P 0.14642473701242 0.83079632992568 0.13320190758986 30.974 10 P 0.16920367007432 0.85357526298758 0.36679809241014 30.974 11 P 0.22763320526544 0.24905076604420 0.66210491677487 30.974 12 P 0.24905076604420 0.22763320526544 0.16210491677487 30.974 13 O 0.87175775758128 0.90285589155618 0.60118470091357 15.999 14 O 0.88137169455057 0.91734285034469 0.84479813455997 15.999 15 O 0.90285589155618 0.87175775758128 0.10118470091357 15.999 16 O 0.91734285034469 0.88137169455057 0.34479813455997 15.999 17 O 0.68727997529442 0.69926502192147 0.71914842072933 15.999 18 O 0.92164575217595 0.57403911306351 0.90363311219498 15.999 19 O 0.54976673368118 0.92100766140017 0.90394091654614 15.999 20 O 0.66398382453711 0.32350385868896 0.55675935701024 15.999 21 O 0.69926502192147 0.68727997529442 0.21914842072933 15.999 22 O 0.57403911306351 0.92164575217595 0.40363311219498 15.999 23 O 0.92100766140017 0.54976673368118 0.40394091654615 15.999 24 O 0.74339781023333 0.25660218976666 0.75000000000000 15.999 25 O 0.67649614131104 0.33601617546289 0.94324064298976 15.999 26 O 0.32350385868896 0.66398382453711 0.05675935701024 15.999 27 O 0.25660218976667 0.74339781023333 0.25000000000000 15.999 28 O 0.07899233859983 0.45023326631882 0.59605908345386 15.999 29 O 0.42596088693649 0.07835424782405 0.59636688780502 15.999 30 O 0.30073497807853 0.31272002470558 0.78085157927067 15.999 31 O 0.33601617546289 0.67649614131104 0.44324064298976 15.999 32 O 0.45023326631882 0.07899233859983 0.09605908345385 15.999 33 O 0.07835424782405 0.42596088693649 0.09636688780502 15.999 34 O 0.31272002470558 0.30073497807853 0.28085157927067 15.999 35 O 0.08265714965531 0.11862830544943 0.65520186544003 15.999 36 O 0.09714410844382 0.12824224241872 0.89881529908643 15.999 37 O 0.11862830544943 0.08265714965531 0.15520186544003 15.999 38 O 0.12824224241872 0.09714410844382 0.39881529908643 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.770408690062379 0.000000000000000 0.000000000000000 b 0.000000000000000 6.707014120000000 0.000000000000000 c -3.714265426681640 0.000000000000000 12.265963182308775 Atomic positions (fractional): 1 Ho 0.19120510457409 0.50287373080559 0.54779740366023 164.930 > 1 2 Ho 0.19120510457409 0.49712626919441 0.04779740366023 164.930 > 2 3 Ho 0.30879489542591 0.00287373080559 0.95220259633977 164.930 > 3 4 Ho 0.30879489542591 0.99712626919441 0.45220259633977 164.930 > 4 5 Ho 0.69120510457409 0.00287373080559 0.54779740366023 164.930 > 1 6 Ho 0.69120510457409 0.99712626919441 0.04779740366023 164.930 > 2 7 Ho 0.80879489542591 0.50287373080559 0.95220259633977 164.930 > 3 8 Ho 0.80879489542591 0.49712626919441 0.45220259633977 164.930 > 4 9 P 0.26165801434518 0.51070878038938 0.83789508322513 30.974 > 9 10 P 0.26165801434518 0.48929121961062 0.33789508322513 30.974 > 10 11 P 0.48861053346905 0.65781420354337 0.63320190758986 30.974 > 11 12 P 0.01138946653095 0.15781420354337 0.86679809241014 30.974 > 12 13 P 0.48861053346905 0.34218579645663 0.13320190758986 30.974 > 13 14 P 0.01138946653095 0.84218579645663 0.36679809241014 30.974 > 14 15 P 0.23834198565482 0.01070878038938 0.66210491677487 30.974 > 15 16 P 0.23834198565482 0.98929121961062 0.16210491677487 30.974 > 16 17 P 0.76165801434518 0.01070878038938 0.83789508322513 30.974 > 9 18 P 0.76165801434518 0.98929121961062 0.33789508322513 30.974 > 10 19 P 0.98861053346905 0.15781420354337 0.63320190758986 30.974 > 11 20 P 0.51138946653095 0.65781420354337 0.86679809241014 30.974 > 12 21 P 0.98861053346905 0.84218579645663 0.13320190758986 30.974 > 13 22 P 0.51138946653095 0.34218579645663 0.36679809241014 30.974 > 14 23 P 0.73834198565482 0.51070878038938 0.66210491677487 30.974 > 15 24 P 0.73834198565482 0.48929121961062 0.16210491677487 30.974 > 16 25 O 0.38730682456873 0.51554906698745 0.60118470091357 15.999 > 25 26 O 0.39935727244763 0.51798557789706 0.84479813455997 15.999 > 26 27 O 0.38730682456873 0.48445093301255 0.10118470091357 15.999 > 27 28 O 0.39935727244763 0.48201442210294 0.34479813455997 15.999 > 28 29 O 0.19327249860794 0.50599252331352 0.71914842072933 15.999 > 29 30 O 0.24784243261973 0.32619668044378 0.90363311219498 15.999 > 30 31 O 0.23538719754067 0.68562046385949 0.90394091654614 15.999 > 31 32 O 0.49374384161303 0.82976001707593 0.55675935701024 15.999 > 32 33 O 0.19327249860794 0.49400747668648 0.21914842072933 15.999 > 33 34 O 0.24784243261973 0.67380331955622 0.40363311219498 15.999 > 34 35 O 0.23538719754067 0.31437953614051 0.40394091654615 15.999 > 35 36 O 0.00000000000000 0.25660218976666 0.75000000000000 15.999 > 36 37 O 0.00625615838697 0.32976001707593 0.94324064298976 15.999 > 37 38 O 0.49374384161303 0.17023998292407 0.05675935701024 15.999 > 38 39 O 0.00000000000000 0.74339781023333 0.25000000000000 15.999 > 39 40 O 0.26461280245933 0.18562046385949 0.59605908345386 15.999 > 40 41 O 0.25215756738027 0.82619668044378 0.59636688780502 15.999 > 41 42 O 0.30672750139206 0.00599252331352 0.78085157927067 15.999 > 42 43 O 0.00625615838697 0.67023998292407 0.44324064298976 15.999 > 43 44 O 0.26461280245933 0.81437953614051 0.09605908345385 15.999 > 44 45 O 0.25215756738027 0.17380331955622 0.09636688780502 15.999 > 45 46 O 0.30672750139206 0.99400747668648 0.28085157927067 15.999 > 46 47 O 0.10064272755237 0.01798557789706 0.65520186544003 15.999 > 47 48 O 0.11269317543127 0.01554906698745 0.89881529908643 15.999 > 48 49 O 0.10064272755237 0.98201442210294 0.15520186544003 15.999 > 49 50 O 0.11269317543127 0.98445093301255 0.39881529908643 15.999 > 50 51 O 0.88730682456873 0.01554906698745 0.60118470091357 15.999 > 25 52 O 0.89935727244763 0.01798557789706 0.84479813455997 15.999 > 26 53 O 0.88730682456873 0.98445093301255 0.10118470091357 15.999 > 27 54 O 0.89935727244763 0.98201442210294 0.34479813455997 15.999 > 28 55 O 0.69327249860794 0.00599252331352 0.71914842072933 15.999 > 29 56 O 0.74784243261973 0.82619668044378 0.90363311219498 15.999 > 30 57 O 0.73538719754068 0.18562046385949 0.90394091654614 15.999 > 31 58 O 0.99374384161303 0.32976001707593 0.55675935701024 15.999 > 32 59 O 0.69327249860794 0.99400747668648 0.21914842072933 15.999 > 33 60 O 0.74784243261973 0.17380331955622 0.40363311219498 15.999 > 34 61 O 0.73538719754068 0.81437953614051 0.40394091654615 15.999 > 35 62 O 0.50000000000000 0.75660218976667 0.75000000000000 15.999 > 36 63 O 0.50625615838697 0.82976001707593 0.94324064298976 15.999 > 37 64 O 0.99374384161303 0.67023998292407 0.05675935701024 15.999 > 38 65 O 0.50000000000000 0.24339781023334 0.25000000000000 15.999 > 39 66 O 0.76461280245932 0.68562046385949 0.59605908345386 15.999 > 40 67 O 0.75215756738027 0.32619668044378 0.59636688780502 15.999 > 41 68 O 0.80672750139206 0.50599252331352 0.78085157927067 15.999 > 42 69 O 0.50625615838697 0.17023998292407 0.44324064298976 15.999 > 43 70 O 0.76461280245932 0.31437953614051 0.09605908345385 15.999 > 44 71 O 0.75215756738027 0.67380331955622 0.09636688780502 15.999 > 45 72 O 0.80672750139206 0.49400747668648 0.28085157927067 15.999 > 46 73 O 0.60064272755237 0.51798557789706 0.65520186544003 15.999 > 47 74 O 0.61269317543127 0.51554906698745 0.89881529908643 15.999 > 48 75 O 0.60064272755237 0.48201442210294 0.15520186544003 15.999 > 49 76 O 0.61269317543127 0.48445093301255 0.39881529908643 15.999 > 50 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.9059263 0.0000000 -0.0563949 0.0000000 2.8429351 0.0000000 -0.0563958 0.0000000 3.0266772 -------------------------- Born effective charges -------------------------- 1 Ho 3.8152940 0.0872847 -0.1401184 0.2042601 3.9530965 0.0096549 -0.2210966 -0.1963249 4.1636950 2 Ho 3.8152940 -0.0872847 -0.1401184 -0.2042601 3.9530965 -0.0096549 -0.2210966 0.1963249 4.1636950 3 Ho 3.8152940 -0.0872847 -0.1401184 -0.2042601 3.9530965 -0.0096549 -0.2210966 0.1963249 4.1636950 4 Ho 3.8152940 0.0872847 -0.1401184 0.2042601 3.9530965 0.0096549 -0.2210966 -0.1963249 4.1636950 5 P 3.5788797 0.2448413 -0.3618970 0.6104895 3.3473697 -0.0331511 -0.0799644 0.0301086 4.1233485 6 P 3.5788797 -0.2448413 -0.3618970 -0.6104895 3.3473697 0.0331511 -0.0799644 -0.0301086 4.1233485 7 P 4.0849746 -0.3018687 0.1786999 -0.0511382 3.1047033 -0.3176097 -0.0156633 0.2902578 3.7951294 8 P 4.0849746 0.3018687 0.1786999 0.0511382 3.1047033 0.3176097 -0.0156633 -0.2902578 3.7951294 9 P 4.0849746 0.3018687 0.1786999 0.0511382 3.1047033 0.3176097 -0.0156633 -0.2902578 3.7951294 10 P 4.0849746 -0.3018687 0.1786999 -0.0511382 3.1047033 -0.3176097 -0.0156633 0.2902578 3.7951294 11 P 3.5788797 -0.2448413 -0.3618970 -0.6104895 3.3473697 0.0331511 -0.0799644 -0.0301086 4.1233485 12 P 3.5788797 0.2448413 -0.3618970 0.6104895 3.3473697 -0.0331511 -0.0799644 0.0301086 4.1233485 13 O -2.3461503 -0.5202990 -0.4052253 -0.4402643 -1.2489734 -0.1701968 -0.4925552 -0.3095429 -1.2431707 14 O -3.2036803 -0.8445638 -0.2714028 -0.8066795 -1.1713172 -0.1527465 -0.0849830 -0.0580465 -1.0263420 15 O -2.3461503 0.5202990 -0.4052253 0.4402643 -1.2489734 0.1701968 -0.4925552 0.3095429 -1.2431707 16 O -3.2036803 0.8445638 -0.2714028 0.8066795 -1.1713172 0.1527465 -0.0849830 0.0580465 -1.0263420 17 O -1.0561311 -0.1222128 0.0875310 -0.1692332 -1.1136151 -0.0717785 0.0458116 -0.0582687 -3.1652059 18 O -1.2625350 -0.2982887 0.3696217 -0.0974872 -2.3676107 0.5802343 0.3298378 0.3172446 -1.7929926 19 O -1.2066819 0.1429192 0.4699483 -0.1549329 -2.3334836 -0.3831806 0.4485823 -0.2638743 -1.7639029 20 O -1.8089851 -0.1106787 -0.1362685 -0.1969742 -1.6951689 0.6129212 -0.1164890 0.6768150 -1.5376067 21 O -1.0561311 0.1222128 0.0875310 0.1692332 -1.1136151 0.0717785 0.0458116 0.0582687 -3.1652059 22 O -1.2625350 0.2982887 0.3696217 0.0974872 -2.3676107 -0.5802343 0.3298378 -0.3172446 -1.7929926 23 O -1.2066819 -0.1429192 0.4699483 0.1549329 -2.3334836 0.3831806 0.4485823 0.2638743 -1.7639029 24 O -1.1899694 0.0000000 0.4182222 -0.0000000 -0.9500013 -0.0000000 0.3730396 0.0000000 -3.1059043 25 O -1.8089851 0.1106787 -0.1362685 0.1969742 -1.6951689 -0.6129212 -0.1164890 -0.6768150 -1.5376067 26 O -1.8089851 0.1106787 -0.1362685 0.1969742 -1.6951689 -0.6129212 -0.1164890 -0.6768150 -1.5376067 27 O -1.1899694 0.0000000 0.4182222 -0.0000000 -0.9500013 -0.0000000 0.3730396 0.0000000 -3.1059043 28 O -1.2066819 -0.1429192 0.4699483 0.1549329 -2.3334836 0.3831806 0.4485823 0.2638743 -1.7639029 29 O -1.2625350 0.2982887 0.3696217 0.0974872 -2.3676107 -0.5802343 0.3298378 -0.3172446 -1.7929926 30 O -1.0561311 0.1222128 0.0875310 0.1692332 -1.1136151 0.0717785 0.0458116 0.0582687 -3.1652059 31 O -1.8089851 -0.1106787 -0.1362685 -0.1969742 -1.6951689 0.6129212 -0.1164890 0.6768150 -1.5376067 32 O -1.2066819 0.1429192 0.4699483 -0.1549329 -2.3334836 -0.3831806 0.4485823 -0.2638743 -1.7639029 33 O -1.2625350 -0.2982887 0.3696217 -0.0974872 -2.3676107 0.5802343 0.3298378 0.3172446 -1.7929926 34 O -1.0561311 -0.1222128 0.0875310 -0.1692332 -1.1136151 -0.0717785 0.0458116 -0.0582687 -3.1652059 35 O -3.2036803 0.8445638 -0.2714028 0.8066795 -1.1713172 0.1527465 -0.0849830 0.0580465 -1.0263420 36 O -2.3461503 0.5202990 -0.4052253 0.4402643 -1.2489734 0.1701968 -0.4925552 0.3095429 -1.2431707 37 O -3.2036803 -0.8445638 -0.2714028 -0.8066795 -1.1713172 -0.1527465 -0.0849830 -0.0580465 -1.0263420 38 O -2.3461503 -0.5202990 -0.4052253 -0.4402643 -1.2489734 -0.1701968 -0.4925552 -0.3095429 -1.2431707 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000001 (xxx) 0.00000001 (xxx) 0.00000001 (xxx) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 9 9 4 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.53, Number of G-points: 305, Lambda: 0.09 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/95) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 95 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 1.876 ( 0.000 0.000 0.000) 0.000 1.957 ( 0.000 0.000 0.000) 0.000 2.390 ( 0.000 0.000 0.000) 0.000 2.714 ( 0.000 0.000 0.000) 0.000 2.927 ( 0.000 0.000 0.000) 0.000 2.964 ( 0.000 0.000 0.000) 0.000 3.210 ( 0.000 0.000 0.000) 0.000 3.288 ( 0.000 0.000 0.000) 0.000 3.390 ( 0.000 0.000 0.000) 0.000 3.689 ( 0.000 0.000 0.000) 0.000 3.729 ( 0.000 0.000 0.000) 0.000 3.807 ( 0.000 0.000 0.000) 0.000 3.980 ( 0.000 0.000 0.000) 0.000 4.008 ( 0.000 0.000 0.000) 0.000 4.100 ( 0.000 0.000 0.000) 0.000 4.216 ( 0.000 0.000 0.000) 0.000 4.376 ( 0.000 0.000 0.000) 0.000 4.398 ( 0.000 0.000 0.000) 0.000 4.566 ( 0.000 0.000 0.000) 0.000 4.591 ( 0.000 0.000 0.000) 0.000 4.738 ( 0.000 0.000 0.000) 0.000 4.798 ( 0.000 0.000 0.000) 0.000 4.940 ( 0.000 0.000 0.000) 0.000 5.025 ( 0.000 0.000 0.000) 0.000 5.249 ( 0.000 0.000 0.000) 0.000 5.313 ( 0.000 0.000 0.000) 0.000 5.721 ( 0.000 0.000 0.000) 0.000 6.033 ( 0.000 0.000 0.000) 0.000 6.165 ( 0.000 0.000 0.000) 0.000 6.234 ( 0.000 0.000 0.000) 0.000 6.623 ( 0.000 0.000 0.000) 0.000 7.374 ( 0.000 0.000 0.000) 0.000 7.461 ( 0.000 0.000 0.000) 0.000 7.486 ( 0.000 0.000 0.000) 0.000 7.511 ( 0.000 0.000 0.000) 0.000 7.823 ( 0.000 0.000 0.000) 0.000 8.027 ( 0.000 0.000 0.000) 0.000 8.423 ( 0.000 0.000 0.000) 0.000 8.442 ( 0.000 0.000 0.000) 0.000 8.470 ( 0.000 0.000 0.000) 0.000 8.738 ( 0.000 0.000 0.000) 0.000 8.897 ( 0.000 0.000 0.000) 0.000 8.917 ( 0.000 0.000 0.000) 0.000 9.570 ( 0.000 0.000 0.000) 0.000 9.765 ( 0.000 0.000 0.000) 0.000 10.035 ( 0.000 0.000 0.000) 0.000 10.086 ( 0.000 0.000 0.000) 0.000 10.140 ( 0.000 0.000 0.000) 0.000 10.408 ( 0.000 0.000 0.000) 0.000 10.788 ( 0.000 0.000 0.000) 0.000 10.816 ( 0.000 0.000 0.000) 0.000 10.944 ( 0.000 0.000 0.000) 0.000 10.984 ( 0.000 0.000 0.000) 0.000 12.125 ( 0.000 0.000 0.000) 0.000 12.180 ( 0.000 0.000 0.000) 0.000 12.915 ( 0.000 0.000 0.000) 0.000 13.030 ( 0.000 0.000 0.000) 0.000 13.053 ( 0.000 0.000 0.000) 0.000 13.272 ( 0.000 0.000 0.000) 0.000 13.505 ( 0.000 0.000 0.000) 0.000 13.601 ( 0.000 0.000 0.000) 0.000 13.613 ( 0.000 0.000 0.000) 0.000 13.958 ( 0.000 0.000 0.000) 0.000 14.265 ( 0.000 0.000 0.000) 0.000 14.321 ( 0.000 0.000 0.000) 0.000 14.599 ( 0.000 0.000 0.000) 0.000 14.840 ( 0.000 0.000 0.000) 0.000 14.899 ( 0.000 0.000 0.000) 0.000 15.114 ( 0.000 0.000 0.000) 0.000 15.300 ( 0.000 0.000 0.000) 0.000 15.420 ( 0.000 0.000 0.000) 0.000 16.664 ( 0.000 0.000 0.000) 0.000 16.669 ( 0.000 0.000 0.000) 0.000 16.707 ( 0.000 0.000 0.000) 0.000 16.741 ( 0.000 0.000 0.000) 0.000 16.957 ( 0.000 0.000 0.000) 0.000 16.998 ( 0.000 0.000 0.000) 0.000 17.004 ( 0.000 0.000 0.000) 0.000 17.199 ( 0.000 0.000 0.000) 0.000 19.597 ( 0.000 0.000 0.000) 0.000 19.701 ( 0.000 0.000 0.000) 0.000 21.502 ( 0.000 0.000 0.000) 0.000 21.600 ( 0.000 0.000 0.000) 0.000 22.979 ( 0.000 0.000 0.000) 0.000 23.239 ( 0.000 0.000 0.000) 0.000 27.693 ( 0.000 0.000 0.000) 0.000 28.165 ( 0.000 0.000 0.000) 0.000 29.172 ( 0.000 0.000 0.000) 0.000 29.400 ( 0.000 0.000 0.000) 0.000 29.783 ( 0.000 0.000 0.000) 0.000 30.005 ( 0.000 0.000 0.000) 0.000 30.748 ( 0.000 0.000 0.000) 0.000 31.012 ( 0.000 0.000 0.000) 0.000 31.144 ( 0.000 0.000 0.000) 0.000 31.178 ( 0.000 0.000 0.000) 0.000 31.811 ( 0.000 0.000 0.000) 0.000 31.864 ( 0.000 0.000 0.000) 0.000 32.039 ( 0.000 0.000 0.000) 0.000 32.190 ( 0.000 0.000 0.000) 0.000 32.197 ( 0.000 0.000 0.000) 0.000 32.236 ( 0.000 0.000 0.000) 0.000 32.254 ( 0.000 0.000 0.000) 0.000 32.389 ( 0.000 0.000 0.000) 0.000 34.314 ( 0.000 0.000 0.000) 0.000 34.454 ( 0.000 0.000 0.000) 0.000 34.741 ( 0.000 0.000 0.000) 0.000 35.390 ( 0.000 0.000 0.000) 0.000 35.658 ( 0.000 0.000 0.000) 0.000 35.811 ( 0.000 0.000 0.000) 0.000 35.875 ( 0.000 0.000 0.000) 0.000 37.771 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/95) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.502 ( 10.692 -22.849 4.039) 25.548 0.597 ( 28.711 -18.271 5.250) 34.434 0.816 ( 20.034 -33.702 4.847) 39.505 1.848 ( -2.657 -1.848 -8.933) 9.502 2.031 ( 2.621 -8.039 -2.379) 8.784 2.483 ( 10.349 -1.040 7.551) 12.853 2.736 ( 5.297 1.134 0.302) 5.426 2.916 ( -0.430 0.937 0.202) 1.051 3.051 ( 2.507 -5.479 -1.414) 6.189 3.163 ( -2.261 3.278 0.369) 4.000 3.321 ( -0.644 2.225 0.500) 2.370 3.439 ( -1.522 -5.486 1.326) 5.846 3.695 ( 2.069 0.993 2.137) 3.136 3.744 ( 1.635 -1.365 -5.663) 6.051 3.792 ( 0.028 0.010 0.237) 0.239 4.013 ( 3.408 0.907 3.587) 5.031 4.030 ( 0.332 -2.731 -0.266) 2.764 4.132 ( 1.948 1.144 -6.107) 6.511 4.223 ( -1.602 -0.057 2.882) 3.298 4.372 ( 2.434 1.115 -0.136) 2.681 4.416 ( 0.034 -1.843 -0.023) 1.844 4.509 ( -1.862 1.442 -0.715) 2.461 4.721 ( 1.495 -8.102 -2.074) 8.496 4.731 ( -3.532 2.480 4.851) 6.493 4.809 ( 5.520 2.808 -3.979) 7.361 5.018 ( 3.666 0.128 -9.477) 10.162 5.093 ( 3.114 -2.222 9.817) 10.536 5.255 ( 2.932 1.488 2.660) 4.229 5.547 ( -1.455 1.751 2.343) 3.267 5.950 ( -4.735 6.118 0.354) 7.744 6.075 ( -11.612 1.408 0.227) 11.699 6.203 ( 0.326 0.566 -2.939) 3.010 6.504 ( -22.432 -10.490 -12.445) 27.715 6.600 ( -3.359 0.491 -1.744) 3.817 7.357 ( -1.213 2.500 -0.723) 2.872 7.398 ( 1.045 3.705 4.504) 5.925 7.517 ( -1.481 -4.004 -16.286) 16.836 7.622 ( -1.065 -4.446 14.157) 14.877 7.834 ( -2.203 -0.328 10.401) 10.637 8.065 ( -13.106 -1.382 0.306) 13.182 8.392 ( -1.372 3.584 -0.773) 3.915 8.424 ( -6.335 -2.009 0.803) 6.694 8.611 ( 4.277 -1.670 1.275) 4.765 8.767 ( 1.148 3.713 5.484) 6.721 8.890 ( 3.157 2.599 0.327) 4.102 8.934 ( -1.404 -2.110 1.535) 2.963 9.524 ( -4.245 5.606 -0.481) 7.048 9.733 ( -2.627 2.713 -1.210) 3.965 10.020 ( -4.738 0.310 2.892) 5.559 10.121 ( 2.152 -0.458 -2.681) 3.468 10.131 ( -0.141 -0.555 -0.945) 1.105 10.440 ( -2.971 -1.519 -0.400) 3.361 10.796 ( 0.392 0.335 -0.224) 0.562 10.888 ( -6.692 -0.739 3.513) 7.594 10.932 ( 7.009 -2.185 4.330) 8.523 11.066 ( 11.158 -1.383 -4.103) 11.969 12.089 ( -2.379 3.095 0.497) 3.935 12.144 ( -3.071 2.548 0.474) 4.018 12.875 ( -1.074 4.075 -1.227) 4.389 12.989 ( -2.470 1.728 -2.157) 3.707 13.053 ( 1.471 1.227 3.369) 3.876 13.266 ( -0.844 -0.000 -1.206) 1.472 13.534 ( -2.074 -2.129 0.154) 2.976 13.617 ( -0.131 -1.326 1.301) 1.862 13.744 ( 14.656 9.311 -13.387) 21.925 14.005 ( 2.652 -1.022 3.371) 4.409 14.295 ( 0.606 -3.198 0.396) 3.279 14.437 ( -0.845 -6.818 -4.099) 8.001 14.818 ( 2.630 1.654 0.211) 3.114 14.917 ( 1.476 -1.487 2.957) 3.624 15.075 ( 20.205 5.356 -0.021) 20.903 15.308 ( 11.459 4.559 0.374) 12.338 15.390 ( 40.524 18.340 -3.618) 44.628 15.450 ( 3.454 -1.116 2.458) 4.384 16.586 ( -3.540 4.865 0.371) 6.028 16.666 ( -0.472 -0.279 0.634) 0.838 16.737 ( 2.630 -0.695 0.369) 2.745 16.903 ( -4.997 -4.038 2.331) 6.835 16.971 ( 3.001 -1.505 -2.571) 4.228 16.993 ( 3.456 0.423 -9.077) 9.722 17.024 ( 0.654 -0.634 2.916) 3.055 17.235 ( -2.046 -1.272 -0.531) 2.467 19.602 ( 0.431 -0.366 0.081) 0.572 19.798 ( -0.284 -2.170 -0.636) 2.279 21.490 ( 0.587 3.502 -1.021) 3.695 21.585 ( -0.319 1.708 0.149) 1.744 23.064 ( -10.098 -0.656 -1.809) 10.280 23.259 ( -1.828 -2.505 -0.611) 3.161 27.748 ( 12.144 3.773 -16.059) 20.484 28.148 ( -0.132 2.498 2.982) 3.892 29.267 ( 9.356 4.132 10.371) 14.565 29.500 ( 2.857 -0.496 0.072) 2.901 29.781 ( -0.205 0.477 1.279) 1.381 29.987 ( -0.199 1.835 -0.336) 1.876 30.781 ( 2.883 -1.488 -1.412) 3.539 31.085 ( 0.117 3.564 0.663) 3.627 31.262 ( -0.854 -6.359 1.145) 6.518 31.548 ( -9.847 -4.378 -5.990) 12.330 31.808 ( -6.509 -4.024 -4.662) 8.961 31.972 ( -5.985 -1.403 -5.197) 8.049 32.103 ( -3.152 -5.022 2.459) 6.419 32.205 ( 0.268 -1.623 -0.752) 1.809 32.239 ( -1.403 -2.289 -2.338) 3.560 32.271 ( 0.288 -1.837 -0.098) 1.862 32.409 ( 1.367 -1.623 -0.135) 2.126 33.327 ( 12.758 7.799 -11.171) 18.665 34.306 ( 0.288 0.384 -0.036) 0.482 34.513 ( -1.575 -7.087 -1.027) 7.333 34.726 ( -5.169 2.383 15.756) 16.752 35.402 ( 3.889 1.034 1.693) 4.366 35.708 ( 5.975 5.569 3.183) 8.766 35.846 ( 5.927 -0.409 -0.284) 5.948 36.897 ( -4.833 9.690 21.337) 23.928 37.669 ( 1.808 12.115 -0.489) 12.259 ======================= Grid point 2 (3/95) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.973 ( 9.221 -21.252 2.606) 23.313 1.163 ( 30.242 -13.922 5.442) 33.734 1.465 ( 8.566 -25.880 1.415) 27.298 1.900 ( 2.642 -7.022 -7.303) 10.470 2.241 ( 5.333 -12.298 -3.144) 13.768 2.616 ( 5.962 -3.595 6.649) 9.627 2.735 ( 1.957 3.018 -2.439) 4.346 2.911 ( 4.814 2.756 0.815) 5.607 3.113 ( -1.443 -0.028 -0.833) 1.666 3.148 ( -1.938 -1.632 0.998) 2.724 3.268 ( 0.438 2.683 5.819) 6.423 3.496 ( -1.304 -2.902 1.261) 3.422 3.717 ( 4.609 0.429 2.903) 5.464 3.756 ( -0.471 -2.277 -2.214) 3.211 3.862 ( 4.070 -4.194 -2.133) 6.221 4.024 ( 1.155 1.884 4.745) 5.234 4.097 ( -0.468 -6.359 -5.371) 8.337 4.148 ( 5.187 -3.675 -8.224) 10.395 4.222 ( -3.084 -0.489 5.027) 5.918 4.382 ( 1.661 1.619 -0.680) 2.417 4.437 ( -3.746 -3.006 0.905) 4.888 4.498 ( 1.575 -0.803 -3.172) 3.632 4.699 ( -3.840 -2.651 3.453) 5.805 4.799 ( 3.777 2.048 -2.432) 4.937 4.838 ( 0.492 -4.659 -2.301) 5.220 5.006 ( 1.209 1.834 -6.533) 6.892 5.194 ( -0.026 -4.736 4.107) 6.269 5.262 ( 3.992 3.188 2.934) 5.892 5.501 ( -0.209 3.713 3.124) 4.857 5.804 ( -8.013 2.681 1.837) 8.647 5.927 ( -11.234 3.287 3.102) 12.109 6.136 ( -4.514 3.856 -4.133) 7.234 6.381 ( -10.130 3.231 -7.046) 12.756 6.548 ( -3.304 1.118 -0.433) 3.515 7.305 ( -0.481 0.763 -3.548) 3.661 7.372 ( 0.385 2.883 5.730) 6.425 7.537 ( -1.011 -4.728 -11.077) 12.086 7.699 ( 2.975 -0.506 1.207) 3.251 7.882 ( -6.814 -2.891 17.316) 18.831 7.947 ( -4.739 0.044 -6.354) 7.927 8.272 ( -3.460 7.254 -1.256) 8.134 8.436 ( -5.905 -5.084 0.959) 7.851 8.653 ( 8.437 5.370 4.664) 11.035 8.736 ( 0.441 1.548 1.050) 1.921 8.880 ( 5.001 3.025 0.073) 5.845 8.950 ( 0.872 0.549 0.905) 1.371 9.378 ( -3.186 6.863 -0.483) 7.582 9.618 ( -4.624 6.186 -1.294) 7.831 9.950 ( -7.349 1.665 2.382) 7.903 10.103 ( -3.361 0.051 -0.315) 3.376 10.156 ( 1.830 0.076 -3.134) 3.630 10.449 ( 0.816 -0.906 0.160) 1.230 10.805 ( 1.109 -0.510 -1.539) 1.964 10.848 ( -6.363 -1.347 3.766) 7.515 11.074 ( 7.319 -4.172 3.950) 9.304 11.199 ( 11.220 -3.110 -4.160) 12.364 11.995 ( -3.666 4.167 0.671) 5.591 12.052 ( -4.402 3.876 -0.356) 5.876 12.773 ( -2.433 4.734 -2.515) 5.887 12.926 ( -3.014 2.816 1.565) 4.412 13.075 ( 3.997 0.474 2.344) 4.658 13.252 ( -0.611 0.221 -2.138) 2.235 13.551 ( 0.366 -0.957 -0.836) 1.322 13.635 ( -1.961 -1.205 2.792) 3.619 13.692 ( 4.458 4.101 -6.303) 8.742 14.017 ( -0.373 1.608 2.937) 3.369 14.367 ( 1.915 -3.431 -0.057) 3.930 14.540 ( 2.009 -3.775 -1.217) 4.446 14.842 ( 0.232 -0.829 -0.834) 1.199 14.989 ( 6.848 -3.760 2.881) 8.326 15.195 ( 7.348 -3.992 -2.306) 8.675 15.381 ( 12.262 0.385 -0.693) 12.288 15.469 ( 21.888 6.727 -3.631) 23.185 15.530 ( 5.163 -2.291 3.710) 6.758 16.487 ( -3.126 3.017 1.549) 4.612 16.665 ( -1.015 -0.143 0.965) 1.408 16.783 ( 2.074 -1.984 -0.069) 2.871 16.897 ( -3.703 -0.523 2.201) 4.339 17.004 ( 4.023 -0.075 -5.723) 6.996 17.034 ( 2.053 -2.766 -5.895) 6.828 17.053 ( -0.184 -2.020 4.361) 4.810 17.227 ( -2.601 -0.340 0.350) 2.646 19.619 ( 1.012 -0.806 0.144) 1.302 19.842 ( 3.200 -1.411 0.189) 3.502 21.409 ( -2.674 4.672 -0.705) 5.429 21.538 ( -1.270 2.965 0.413) 3.252 22.975 ( -7.178 0.564 -0.890) 7.255 23.272 ( -2.749 -1.957 -0.444) 3.404 27.760 ( 4.809 0.620 -6.179) 7.855 28.096 ( -0.693 4.366 3.687) 5.756 29.333 ( 5.208 -0.727 6.042) 8.010 29.550 ( 3.293 -2.330 -2.680) 4.843 29.766 ( -0.588 1.439 1.206) 1.967 29.951 ( 0.361 2.023 -0.717) 2.176 30.841 ( 2.505 -2.822 -1.501) 4.061 31.044 ( 0.263 1.947 1.100) 2.252 31.349 ( -3.371 -5.524 2.378) 6.895 31.530 ( -0.362 -0.777 -0.246) 0.892 31.793 ( -6.257 -3.174 -5.698) 9.038 31.920 ( -1.669 1.750 -3.661) 4.388 32.113 ( -1.566 1.184 3.656) 4.150 32.219 ( -2.128 -0.055 -1.562) 2.640 32.310 ( -2.184 -8.360 -1.306) 8.738 32.318 ( 2.321 -3.012 -1.090) 3.956 32.463 ( 4.272 -1.265 0.645) 4.502 33.273 ( 7.393 7.096 -5.418) 11.592 34.320 ( 1.033 -1.466 0.003) 1.793 34.618 ( -4.112 -5.931 1.553) 7.382 34.687 ( -2.821 -1.354 4.478) 5.462 35.434 ( 6.862 2.288 3.781) 8.162 35.680 ( 2.603 3.296 0.376) 4.216 35.920 ( 6.090 -1.407 -0.643) 6.284 36.671 ( -13.915 11.582 7.749) 19.693 37.463 ( 5.045 14.738 -0.514) 15.586 ======================= Grid point 3 (4/95) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.386 ( 6.762 -18.285 1.486) 19.552 1.607 ( 24.240 -4.353 4.495) 25.034 1.856 ( 2.687 -17.844 -2.034) 18.160 2.048 ( 2.042 -8.563 -4.068) 9.698 2.447 ( 5.050 -5.413 -0.057) 7.403 2.648 ( -4.891 2.708 -4.325) 7.068 2.776 ( -0.775 -0.780 -2.809) 3.017 2.858 ( 3.231 -0.541 5.593) 6.482 3.108 ( 0.490 1.718 2.168) 2.809 3.153 ( 0.436 -2.317 0.288) 2.375 3.308 ( 4.832 -2.383 8.420) 9.996 3.523 ( -2.469 -1.467 2.645) 3.905 3.723 ( -2.017 2.159 -1.214) 3.194 3.808 ( 2.947 -0.195 1.414) 3.274 3.938 ( 0.123 -2.507 -2.458) 3.513 4.054 ( 7.234 -1.581 2.481) 7.809 4.182 ( -3.560 1.742 2.417) 4.642 4.214 ( 2.423 -7.650 -5.675) 9.828 4.309 ( 9.095 -5.694 -12.420) 16.413 4.364 ( 0.953 -3.843 0.668) 4.015 4.472 ( -1.165 -3.339 2.767) 4.491 4.525 ( 2.389 -0.516 -1.416) 2.825 4.732 ( 1.026 2.257 5.606) 6.129 4.805 ( -0.227 -2.549 -0.210) 2.568 4.899 ( -0.724 -5.293 -2.835) 6.048 4.946 ( -2.436 2.646 -2.876) 4.605 5.150 ( -2.047 9.251 -1.473) 9.588 5.285 ( -0.858 -2.929 -0.244) 3.062 5.473 ( 0.466 0.785 3.689) 3.800 5.690 ( -12.238 2.974 2.593) 12.859 5.837 ( -2.029 -0.139 5.711) 6.062 6.002 ( -5.091 3.632 -3.149) 7.002 6.190 ( -4.936 7.784 -6.254) 11.138 6.505 ( -2.168 1.124 0.241) 2.454 7.305 ( 0.187 -1.257 -2.804) 3.079 7.353 ( -0.853 -0.297 3.704) 3.813 7.584 ( 0.589 -4.157 -8.359) 9.354 7.721 ( 2.227 0.351 0.539) 2.318 7.760 ( -7.229 6.339 4.045) 10.431 8.071 ( 0.954 -7.914 1.257) 8.070 8.099 ( -4.387 6.201 2.435) 7.977 8.468 ( -5.864 -5.026 0.105) 7.724 8.607 ( 2.285 7.516 2.822) 8.347 8.744 ( 5.114 1.043 0.075) 5.220 8.888 ( 4.689 1.774 0.802) 5.077 8.942 ( 3.492 2.623 -0.054) 4.368 9.248 ( -2.780 5.075 -0.373) 5.799 9.451 ( -6.036 7.078 -0.169) 9.304 9.856 ( -5.962 2.104 0.466) 6.339 10.066 ( -5.363 -1.185 -0.525) 5.518 10.136 ( 1.729 3.335 -1.102) 3.915 10.471 ( 1.131 -0.163 0.105) 1.147 10.821 ( 1.206 -0.667 -0.912) 1.652 10.841 ( -3.293 -2.063 2.081) 4.409 11.201 ( 5.090 -2.513 2.069) 6.042 11.348 ( 9.058 -3.828 -1.924) 10.021 11.910 ( -1.799 2.866 1.189) 3.587 11.952 ( -3.711 2.586 -1.408) 4.737 12.679 ( -1.975 2.878 -2.195) 4.123 12.845 ( -4.088 3.577 2.420) 5.947 13.106 ( 2.400 0.590 1.492) 2.887 13.243 ( 1.514 0.160 -3.252) 3.590 13.569 ( 1.989 -0.085 -0.321) 2.017 13.636 ( -3.272 -0.823 3.580) 4.919 13.665 ( 1.577 0.807 -3.541) 3.959 13.985 ( -0.646 1.851 1.417) 2.419 14.437 ( 1.761 -2.740 0.079) 3.258 14.581 ( 1.323 -0.375 -0.902) 1.645 14.818 ( -2.985 0.876 -0.524) 3.154 15.135 ( 2.312 -4.443 2.738) 5.708 15.346 ( 9.485 -4.990 -0.880) 10.753 15.496 ( 7.895 -2.358 -2.380) 8.576 15.551 ( 13.439 2.857 -1.822) 13.859 15.634 ( 5.520 -2.742 2.687) 6.724 16.447 ( -1.624 -0.384 2.240) 2.794 16.653 ( -1.224 0.764 0.196) 1.456 16.821 ( -1.083 -0.957 0.770) 1.637 16.891 ( 0.489 -1.203 0.613) 1.436 17.030 ( 2.694 0.421 -1.307) 3.024 17.056 ( 0.402 -1.426 -3.658) 3.947 17.106 ( 0.204 -2.663 -0.512) 2.719 17.202 ( -1.822 0.679 0.578) 2.028 19.648 ( 1.428 -1.100 0.151) 1.809 19.899 ( 3.614 -1.202 0.151) 3.812 21.293 ( -3.733 4.810 -0.576) 6.116 21.473 ( -1.754 2.976 0.504) 3.491 22.914 ( -4.212 -0.020 -0.571) 4.250 23.273 ( -2.295 -1.300 -0.255) 2.650 27.785 ( 2.357 -1.109 -2.597) 3.678 28.018 ( -1.099 4.786 2.546) 5.532 29.415 ( 3.210 -2.263 4.532) 5.997 29.615 ( 2.552 -2.648 -2.119) 4.244 29.725 ( -1.120 2.515 -0.864) 2.886 29.932 ( 1.465 1.062 -0.412) 1.856 30.905 ( 2.031 -2.643 -1.403) 3.616 31.027 ( 0.066 0.903 1.534) 1.782 31.400 ( -4.414 -4.764 2.749) 7.052 31.548 ( 2.187 1.120 1.421) 2.839 31.769 ( -4.174 -2.303 -5.223) 7.072 31.870 ( -0.418 1.658 -2.906) 3.372 32.084 ( -0.465 2.050 3.802) 4.345 32.173 ( -6.282 -0.441 -2.969) 6.962 32.383 ( 1.832 -3.355 -1.271) 4.028 32.430 ( -0.209 -5.914 0.007) 5.918 32.523 ( 5.627 0.021 1.479) 5.818 33.210 ( 4.496 5.560 -3.239) 7.850 34.369 ( 1.563 -2.506 0.307) 2.970 34.592 ( -3.130 2.206 4.534) 5.934 34.787 ( -3.084 -9.978 -3.305) 10.955 35.475 ( 8.817 3.345 5.501) 10.917 35.652 ( 1.872 2.520 -0.359) 3.160 35.986 ( 0.571 -1.974 0.234) 2.068 36.344 ( -11.087 12.514 0.827) 16.739 37.302 ( 4.608 9.906 -0.143) 10.926 ======================= Grid point 4 (5/95) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.677 ( 2.271 -9.502 0.547) 9.785 1.777 ( 7.508 0.991 1.426) 7.706 2.111 ( 2.402 -6.830 -0.457) 7.255 2.176 ( 2.571 -6.307 -2.739) 7.341 2.491 ( -0.435 3.675 -1.311) 3.926 2.576 ( -3.575 0.205 1.110) 3.749 2.612 ( -0.059 5.185 0.040) 5.186 3.054 ( -0.080 1.337 -2.275) 2.640 3.080 ( 2.559 -5.899 1.296) 6.559 3.235 ( 0.991 -8.513 4.704) 9.776 3.417 ( 2.174 1.624 1.764) 3.237 3.514 ( -3.461 0.363 0.135) 3.482 3.648 ( 3.747 1.761 2.858) 5.031 3.764 ( -5.374 3.724 -2.458) 6.985 3.922 ( -1.300 0.719 -1.751) 2.296 4.157 ( 0.515 -0.332 1.660) 1.769 4.216 ( 6.129 -4.315 0.044) 7.496 4.321 ( 4.965 -3.064 -0.182) 5.837 4.371 ( 2.123 -3.030 -3.489) 5.086 4.470 ( -0.102 -0.206 1.011) 1.037 4.504 ( 0.196 3.695 -4.783) 6.048 4.586 ( 1.283 -4.193 1.877) 4.770 4.723 ( 2.041 -1.682 3.302) 4.231 4.858 ( -2.667 -1.730 -3.187) 4.501 4.894 ( -0.536 -0.845 0.248) 1.031 4.978 ( 0.478 3.835 -0.261) 3.873 4.992 ( 1.087 -5.825 -0.470) 5.944 5.213 ( -7.753 8.690 -1.390) 11.728 5.480 ( -2.167 -2.333 2.711) 4.182 5.570 ( -1.436 2.822 1.114) 3.357 5.831 ( -1.371 0.654 -0.304) 1.549 5.961 ( 0.276 -0.600 3.244) 3.311 6.039 ( -1.663 3.697 -4.518) 6.071 6.471 ( -1.197 0.756 0.128) 1.422 7.306 ( 0.081 0.374 0.308) 0.491 7.412 ( 0.043 -5.273 -0.188) 5.276 7.599 ( 0.535 6.648 -1.002) 6.745 7.631 ( -3.055 -2.101 -1.421) 3.971 7.749 ( 1.193 -1.395 1.177) 2.181 7.931 ( -2.238 5.799 -0.669) 6.252 8.275 ( 0.270 -11.036 3.880) 11.702 8.462 ( -1.114 6.414 -1.837) 6.764 8.501 ( -1.110 1.132 0.530) 1.672 8.780 ( 2.871 -0.078 -0.144) 2.876 8.909 ( 1.772 -0.285 0.537) 1.874 8.934 ( 2.336 2.116 0.145) 3.155 9.175 ( 0.065 1.329 -0.530) 1.432 9.297 ( -4.604 4.191 0.517) 6.248 9.788 ( -2.306 0.982 -0.122) 2.510 10.047 ( -3.692 -1.793 -0.276) 4.113 10.092 ( 1.833 3.064 -0.033) 3.571 10.476 ( 0.217 0.181 0.037) 0.285 10.843 ( 2.208 0.055 -0.826) 2.358 10.852 ( -2.416 -1.561 1.117) 3.086 11.262 ( 1.744 -0.606 0.399) 1.889 11.457 ( 3.554 -1.649 -0.208) 3.923 11.875 ( 0.084 0.876 1.224) 1.507 11.898 ( -1.546 0.552 -1.451) 2.191 12.636 ( -0.283 0.546 -1.099) 1.259 12.762 ( -2.703 2.181 1.249) 3.691 13.110 ( 0.340 0.433 0.387) 0.673 13.252 ( 1.331 -0.037 -1.572) 2.060 13.586 ( 1.522 0.198 0.484) 1.609 13.626 ( -2.204 -0.428 1.708) 2.821 13.666 ( 0.663 -0.146 -1.590) 1.729 13.961 ( -0.157 0.721 0.394) 0.836 14.483 ( 0.421 -1.267 0.219) 1.353 14.590 ( 1.014 0.231 -0.558) 1.180 14.778 ( -1.547 0.687 -0.156) 1.699 15.191 ( -0.181 -1.360 0.571) 1.486 15.473 ( 3.751 -1.725 0.658) 4.181 15.571 ( 2.548 -1.113 -1.594) 3.205 15.608 ( 4.528 0.500 -0.163) 4.559 15.723 ( 3.087 -1.610 0.818) 3.576 16.472 ( 0.182 -1.920 1.691) 2.565 16.616 ( -1.088 1.657 -0.848) 2.156 16.811 ( -1.316 -0.002 0.648) 1.467 16.940 ( 2.379 -1.779 0.173) 2.976 17.013 ( -1.485 1.223 -0.325) 1.951 17.081 ( 1.226 -0.723 -1.648) 2.177 17.136 ( -0.161 -1.164 -0.535) 1.291 17.181 ( -0.403 0.620 0.475) 0.878 19.675 ( 0.773 -0.594 0.067) 0.977 19.940 ( 1.569 -0.522 0.023) 1.654 21.201 ( -1.826 2.151 -0.224) 2.830 21.423 ( -0.857 1.290 0.227) 1.565 22.889 ( -1.329 -0.133 -0.206) 1.351 23.273 ( -0.872 -0.478 -0.083) 0.997 27.822 ( 1.047 -1.579 -0.877) 2.088 27.945 ( -0.815 2.944 1.010) 3.217 29.484 ( 1.450 -1.575 2.444) 3.249 29.662 ( 0.875 -1.235 -0.785) 1.705 29.670 ( -0.998 1.718 -1.357) 2.406 29.934 ( 1.040 0.329 -0.132) 1.099 30.951 ( 0.894 -1.248 -0.654) 1.668 31.020 ( -0.078 0.377 0.855) 0.937 31.452 ( -3.690 -5.273 3.008) 7.105 31.518 ( 2.560 4.795 -1.544) 5.651 31.772 ( -1.470 -2.038 -1.648) 3.005 31.842 ( 0.308 0.997 -1.212) 1.600 32.066 ( 1.045 1.436 2.662) 3.200 32.117 ( -4.314 -0.468 -2.335) 4.927 32.444 ( 1.301 -2.071 -0.935) 2.618 32.480 ( -0.677 -0.793 0.435) 1.130 32.577 ( 2.636 -0.632 0.856) 2.843 33.165 ( 1.468 2.210 -1.215) 2.918 34.420 ( 0.997 -1.604 0.226) 1.902 34.547 ( -1.300 1.412 1.518) 2.447 34.891 ( -1.679 -5.184 -2.086) 5.835 35.517 ( 6.080 2.168 3.693) 7.436 35.633 ( 0.945 1.145 -0.228) 1.502 35.950 ( -8.032 0.954 0.327) 8.095 36.159 ( 1.465 3.561 -1.234) 4.043 37.221 ( 1.638 3.424 -0.015) 3.796 ======================= Grid point 10 (6/95) ======================= q-point: ( 0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 95 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.473 ( 22.590 0.000 5.955) 23.362 0.485 ( 20.912 0.000 5.477) 21.618 1.088 ( 51.765 0.000 12.253) 53.195 1.798 ( 2.726 0.000 -10.775) 11.114 1.967 ( 2.374 0.000 -3.232) 4.010 2.646 ( 14.620 0.000 9.473) 17.421 2.832 ( 10.413 0.000 -0.615) 10.431 2.929 ( 0.136 0.000 -0.620) 0.635 3.034 ( -0.290 -0.000 -5.329) 5.337 3.230 ( 2.965 0.000 2.604) 3.946 3.291 ( -0.102 -0.000 1.344) 1.348 3.402 ( 0.301 0.000 3.555) 3.568 3.709 ( 1.074 0.000 1.660) 1.977 3.738 ( 2.783 0.000 -8.142) 8.605 3.785 ( -1.904 -0.000 -0.818) 2.072 4.012 ( -0.196 -0.000 0.716) 0.742 4.055 ( 4.257 0.000 -3.530) 5.530 4.129 ( -8.099 -0.000 4.462) 9.247 4.203 ( -0.623 -0.000 -7.268) 7.295 4.355 ( 1.511 0.000 -0.578) 1.618 4.388 ( -2.090 -0.000 0.047) 2.091 4.530 ( -7.200 -0.000 2.801) 7.726 4.654 ( 6.494 0.000 -3.259) 7.266 4.789 ( -1.006 -0.000 -0.918) 1.362 4.948 ( -0.116 -0.000 -3.198) 3.201 5.073 ( 3.122 0.000 1.078) 3.303 5.233 ( -0.077 -0.000 -2.211) 2.212 5.344 ( 3.427 0.000 -2.069) 4.003 5.588 ( 3.087 0.000 -4.143) 5.166 5.691 ( -3.277 -0.000 3.509) 4.801 5.969 ( -6.057 -0.000 0.195) 6.060 6.018 ( -13.225 -0.000 2.383) 13.438 6.207 ( -3.866 -0.000 -2.145) 4.421 6.543 ( -8.418 -0.000 -0.856) 8.462 7.373 ( -5.163 -0.000 -7.599) 9.187 7.389 ( 0.584 0.000 2.146) 2.224 7.535 ( 2.206 0.000 1.315) 2.568 7.561 ( -0.521 -0.000 14.136) 14.145 7.836 ( -4.812 -0.000 12.266) 13.176 7.946 ( -5.760 -0.000 -0.094) 5.760 8.341 ( -6.074 -0.000 0.628) 6.106 8.427 ( -0.387 -0.000 -0.805) 0.893 8.629 ( 8.558 0.000 4.579) 9.706 8.798 ( -2.114 -0.000 4.291) 4.784 8.930 ( 0.565 0.000 2.288) 2.357 8.939 ( 3.958 0.000 0.449) 3.983 9.518 ( -4.968 -0.000 -0.499) 4.993 9.729 ( -3.367 -0.000 -1.383) 3.640 9.998 ( -4.667 -0.000 3.647) 5.923 10.080 ( -5.826 -0.000 -2.203) 6.229 10.122 ( 1.756 0.000 -3.675) 4.073 10.422 ( 2.211 0.000 -0.206) 2.220 10.797 ( -1.062 -0.000 1.636) 1.951 10.830 ( -5.487 -0.000 2.676) 6.104 11.013 ( 8.226 0.000 4.020) 9.156 11.144 ( 10.656 0.000 -4.072) 11.407 12.086 ( -4.476 -0.000 1.923) 4.872 12.120 ( -6.009 -0.000 0.082) 6.010 12.932 ( 1.697 0.000 -0.064) 1.698 12.954 ( -4.348 -0.000 -3.169) 5.380 13.061 ( -2.498 -0.000 4.350) 5.017 13.245 ( -2.225 -0.000 -2.209) 3.135 13.524 ( 2.376 0.000 -1.402) 2.759 13.619 ( 0.965 0.000 2.475) 2.656 13.871 ( -0.087 -0.000 -14.098) 14.098 14.057 ( 6.362 0.000 7.256) 9.650 14.372 ( 11.548 0.000 -3.124) 11.963 14.398 ( 7.521 0.000 -0.861) 7.570 14.864 ( -1.230 -0.000 -2.209) 2.529 14.893 ( 4.461 0.000 2.474) 5.101 15.128 ( 5.103 0.000 -4.698) 6.936 15.393 ( 9.036 0.000 -1.704) 9.195 15.484 ( 4.902 0.000 4.475) 6.638 16.371 ( -4.940 -0.000 -7.358) 8.863 16.604 ( -7.364 -0.000 4.165) 8.460 16.661 ( 0.266 0.000 -3.727) 3.736 16.733 ( 1.270 0.000 -5.191) 5.344 16.808 ( 0.670 0.000 0.684) 0.957 16.973 ( 0.429 0.000 1.858) 1.907 17.024 ( 10.987 0.000 -31.166) 33.046 17.047 ( 2.374 0.000 -0.265) 2.389 17.172 ( -2.893 -0.000 0.900) 3.029 19.642 ( 5.387 0.000 -2.161) 5.804 19.757 ( 5.468 0.000 1.148) 5.587 21.531 ( -3.340 -0.000 -2.941) 4.450 21.576 ( -2.678 -0.000 0.133) 2.681 22.906 ( -7.331 -0.000 0.703) 7.365 23.204 ( -3.215 -0.000 -1.294) 3.465 27.864 ( 8.638 0.000 -32.909) 34.024 28.173 ( -1.518 -0.000 6.374) 6.552 29.455 ( 7.108 0.000 -4.444) 8.383 29.657 ( -3.406 -0.000 14.326) 14.726 29.795 ( 0.647 0.000 1.408) 1.549 29.979 ( -2.455 -0.000 -0.996) 2.650 30.890 ( 5.564 0.000 -11.756) 13.006 31.015 ( 0.109 0.000 0.558) 0.569 31.149 ( -0.383 -0.000 2.466) 2.496 31.180 ( 0.104 0.000 0.176) 0.204 31.838 ( -2.235 -0.000 -1.332) 2.602 31.849 ( 3.607 0.000 0.393) 3.628 32.071 ( 1.768 0.000 0.484) 1.833 32.163 ( -3.647 -0.000 0.119) 3.649 32.238 ( 2.970 0.000 -0.287) 2.983 32.264 ( 1.195 0.000 0.270) 1.225 32.455 ( 6.090 0.000 -2.427) 6.556 33.436 ( 4.634 0.000 -21.359) 21.856 34.322 ( 1.452 0.000 -1.977) 2.453 34.422 ( -2.558 -0.000 -1.474) 2.953 34.735 ( -10.282 -0.000 23.895) 26.013 35.427 ( 1.092 0.000 4.764) 4.888 35.858 ( -0.171 -0.000 -1.586) 1.595 35.876 ( 8.042 0.000 -4.683) 9.306 37.159 ( -15.856 -0.000 39.870) 42.907 37.703 ( -6.391 -0.000 -1.153) 6.494 ======================= Grid point 11 (7/95) ======================= q-point: ( 0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.816 ( 17.831 -13.043 4.223) 22.492 0.947 ( 12.462 -26.681 2.654) 29.567 1.587 ( 41.613 0.131 10.168) 42.837 1.851 ( 8.158 -3.106 -5.075) 10.097 2.084 ( 5.849 -10.098 -4.561) 12.529 2.724 ( 6.048 5.632 4.836) 9.575 2.842 ( 7.897 5.038 -3.797) 10.108 3.004 ( 3.571 -2.119 0.652) 4.203 3.039 ( -1.541 -4.154 -4.893) 6.601 3.176 ( 4.566 6.216 5.403) 9.417 3.337 ( 2.200 0.869 3.863) 4.530 3.444 ( -0.899 -2.982 5.836) 6.615 3.693 ( -2.562 0.275 -2.433) 3.543 3.764 ( -2.184 -0.474 -0.575) 2.307 3.806 ( 5.685 -5.644 -4.403) 9.142 4.022 ( 1.182 -1.402 -3.811) 4.230 4.066 ( -1.826 1.037 3.360) 3.962 4.096 ( 0.179 -3.622 -6.393) 7.349 4.218 ( 2.861 -1.512 3.931) 5.091 4.361 ( -2.063 -0.744 -0.908) 2.374 4.404 ( -1.797 2.018 -1.012) 2.885 4.476 ( 2.256 -3.810 -0.104) 4.429 4.717 ( 0.072 4.308 -1.696) 4.630 4.789 ( 4.521 -4.990 1.300) 6.858 4.881 ( 2.401 5.038 -2.652) 6.179 5.025 ( 3.232 4.675 -7.480) 9.394 5.143 ( -3.791 -0.199 2.521) 4.557 5.375 ( 6.053 1.607 3.918) 7.387 5.556 ( 0.712 1.846 3.876) 4.352 5.763 ( -12.300 2.210 -0.144) 12.498 5.879 ( -9.342 2.145 3.148) 10.089 6.058 ( -9.953 -9.978 -7.926) 16.169 6.163 ( -9.164 -5.306 -3.900) 11.284 6.467 ( -10.276 -2.466 -0.121) 10.569 7.284 ( -5.643 0.381 -6.695) 8.765 7.427 ( 0.011 -3.182 -3.386) 4.646 7.467 ( 1.215 5.755 3.788) 6.996 7.694 ( 2.904 -5.246 5.709) 8.279 7.833 ( -3.803 -1.174 10.895) 11.599 7.894 ( -5.103 0.514 -0.199) 5.133 8.298 ( -6.473 -0.624 0.677) 6.538 8.365 ( -2.438 3.710 -0.799) 4.511 8.752 ( 6.104 -2.221 1.877) 6.761 8.795 ( 0.428 1.217 3.558) 3.785 8.930 ( 0.002 0.066 2.417) 2.418 8.973 ( 5.569 1.531 1.252) 5.910 9.424 ( -6.071 4.244 -0.840) 7.455 9.655 ( -5.036 3.659 -1.575) 6.421 9.927 ( -6.348 2.657 2.870) 7.456 10.025 ( -8.023 -1.499 -1.613) 8.320 10.148 ( 1.449 -1.854 -3.510) 4.226 10.456 ( 3.655 -0.426 -0.074) 3.681 10.794 ( -2.318 -0.162 1.749) 2.908 10.808 ( -0.854 -0.932 1.479) 1.945 11.124 ( 9.803 -1.534 4.260) 10.798 11.245 ( 10.079 -1.769 -4.327) 11.110 12.015 ( -4.944 2.780 1.156) 5.789 12.048 ( -6.566 1.689 -0.237) 6.784 12.853 ( -0.604 6.318 -2.737) 6.912 12.918 ( -4.500 1.204 1.757) 4.979 13.081 ( -0.881 -2.559 3.536) 4.453 13.220 ( -2.443 -0.897 -3.373) 4.260 13.549 ( 3.057 -0.396 -2.478) 3.955 13.634 ( 0.406 0.370 3.612) 3.654 13.785 ( -0.233 4.287 -7.753) 8.863 14.096 ( 2.293 3.527 6.940) 8.115 14.448 ( 13.694 2.563 0.105) 13.932 14.533 ( 9.480 -3.300 -2.059) 10.247 14.834 ( -0.722 0.819 -3.381) 3.553 14.971 ( 2.561 -3.661 2.918) 5.337 15.214 ( 12.544 -2.122 -5.065) 13.693 15.478 ( 10.773 0.430 -2.342) 11.033 15.563 ( 6.254 -1.313 5.223) 8.253 15.996 ( 11.256 25.845 -3.858) 28.453 16.494 ( -6.044 2.484 1.080) 6.623 16.661 ( -0.574 -0.141 1.608) 1.714 16.788 ( 0.463 -1.025 0.012) 1.125 16.825 ( -1.949 -3.269 -0.692) 3.868 16.994 ( 0.135 -1.930 0.600) 2.026 17.021 ( 5.684 0.446 -12.954) 14.153 17.067 ( 2.682 0.662 -0.223) 2.771 17.172 ( -3.873 -2.194 0.297) 4.461 19.658 ( 6.011 2.464 -0.701) 6.534 19.859 ( 6.351 -2.259 0.547) 6.763 21.443 ( -4.978 3.679 -0.542) 6.214 21.545 ( -4.067 0.585 -0.320) 4.121 22.861 ( -9.931 -2.793 -0.013) 10.317 23.192 ( -4.305 -2.894 -1.454) 5.387 27.817 ( 4.691 2.866 -13.730) 14.789 28.156 ( -2.450 2.309 6.691) 7.490 29.476 ( 7.929 6.342 3.382) 10.701 29.580 ( 4.466 3.025 0.860) 5.462 29.794 ( 0.653 1.082 2.083) 2.436 29.960 ( -2.272 -0.100 -1.183) 2.563 30.852 ( 5.330 1.066 -2.602) 6.026 31.095 ( 0.083 3.303 1.885) 3.804 31.227 ( -3.844 -7.816 -0.173) 8.712 31.310 ( -4.973 -15.819 -4.259) 17.120 31.761 ( 0.076 3.540 0.065) 3.542 31.907 ( -0.326 -0.492 -2.299) 2.374 32.112 ( -0.804 -2.622 -0.407) 2.772 32.123 ( -5.083 -0.283 0.080) 5.091 32.282 ( 5.594 -1.056 1.387) 5.859 32.306 ( 4.288 -1.573 -0.333) 4.579 32.513 ( 6.729 -0.582 -1.655) 6.954 33.383 ( 1.816 3.540 -11.108) 11.799 34.320 ( 1.710 0.218 -1.682) 2.409 34.457 ( -2.867 -6.620 -2.222) 7.549 34.687 ( -7.667 1.606 14.377) 16.372 35.462 ( -1.847 -2.379 5.568) 6.330 35.815 ( 6.226 5.244 -1.221) 8.231 35.958 ( 8.383 -0.552 -4.995) 9.774 36.894 ( -7.436 19.820 18.480) 28.100 37.620 ( -6.467 4.141 -0.246) 7.683 ======================= Grid point 12 (8/95) ======================= q-point: ( 0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.214 ( 13.941 -14.971 2.804) 20.648 1.496 ( 5.614 -26.493 1.542) 27.126 1.898 ( 27.265 2.675 5.040) 27.856 1.986 ( 8.636 -2.208 0.871) 8.956 2.336 ( 7.325 -12.570 -5.751) 15.644 2.663 ( -1.224 3.778 -1.794) 4.357 2.792 ( 4.036 5.709 -3.888) 8.000 3.006 ( 1.896 6.299 0.156) 6.580 3.084 ( 1.282 -3.480 1.162) 3.887 3.167 ( 2.414 2.089 3.753) 4.927 3.368 ( 4.977 0.503 6.543) 8.236 3.474 ( -4.925 -1.458 6.529) 8.307 3.683 ( -2.899 -2.866 -0.176) 4.081 3.770 ( -3.257 -3.481 -1.870) 5.122 3.943 ( 4.715 -1.735 0.938) 5.111 4.059 ( 1.136 -4.301 -8.494) 9.588 4.121 ( 7.079 -5.024 -3.148) 9.234 4.134 ( 0.939 -2.415 0.963) 2.764 4.295 ( 3.253 -1.086 -5.181) 6.213 4.328 ( -2.581 -3.622 2.194) 4.959 4.420 ( 4.078 -1.106 0.284) 4.235 4.555 ( 3.081 0.140 -0.158) 3.088 4.691 ( 1.122 -2.578 2.398) 3.695 4.848 ( 2.321 1.075 -1.928) 3.203 4.878 ( 1.980 1.186 3.186) 3.934 4.946 ( -2.008 1.906 -5.985) 6.594 5.146 ( -4.932 -3.713 -1.522) 6.359 5.359 ( 2.965 8.594 0.462) 9.103 5.497 ( -3.603 2.937 2.467) 5.263 5.649 ( -5.080 1.326 3.432) 6.272 5.798 ( -5.983 -1.464 5.310) 8.132 5.973 ( -8.224 1.586 -3.089) 8.927 6.158 ( -8.048 -2.443 -8.458) 11.928 6.428 ( -9.392 -3.484 0.799) 10.049 7.237 ( -4.401 -3.121 -6.411) 8.379 7.388 ( -0.720 3.532 0.085) 3.606 7.489 ( 0.792 -3.651 -1.815) 4.153 7.762 ( 2.287 1.172 1.814) 3.145 7.807 ( -3.716 3.405 3.094) 5.914 7.934 ( -0.893 -8.397 7.547) 11.325 8.184 ( -4.528 7.091 -1.425) 8.533 8.331 ( -5.325 -3.663 0.572) 6.488 8.751 ( 1.645 6.084 2.214) 6.680 8.811 ( 4.392 1.115 0.511) 4.561 8.948 ( -0.580 -1.336 0.491) 1.537 9.007 ( 6.651 2.451 2.891) 7.655 9.286 ( -5.432 4.759 -1.053) 7.298 9.511 ( -6.200 6.565 -0.164) 9.031 9.830 ( -6.244 2.022 0.230) 6.568 9.973 ( -7.571 -1.978 -0.253) 7.829 10.166 ( 0.138 -0.194 -3.257) 3.266 10.490 ( 2.574 0.416 0.436) 2.643 10.791 ( -1.841 -1.202 3.348) 4.006 10.829 ( 1.930 -0.836 -1.425) 2.540 11.249 ( 8.481 -0.839 3.362) 9.162 11.365 ( 8.542 -3.112 -3.010) 9.577 11.938 ( -2.538 2.155 1.282) 3.567 11.947 ( -5.635 2.553 -1.320) 6.326 12.737 ( 0.325 5.937 -2.004) 6.274 12.844 ( -6.676 1.993 2.556) 7.421 13.109 ( -2.434 -0.976 2.481) 3.610 13.220 ( -0.359 -2.008 -4.287) 4.748 13.579 ( 3.259 -0.606 -3.146) 4.570 13.632 ( -0.798 1.177 5.626) 5.803 13.709 ( 0.786 2.640 -4.632) 5.389 14.054 ( 0.775 4.261 4.208) 6.038 14.524 ( 12.888 3.642 0.674) 13.410 14.637 ( 9.143 1.121 -2.082) 9.444 14.801 ( -1.683 0.669 -2.684) 3.238 15.067 ( -0.002 -5.060 2.692) 5.732 15.382 ( 13.205 -2.870 -1.008) 13.551 15.564 ( 10.426 0.570 -3.045) 10.877 15.664 ( 6.677 -1.452 4.029) 7.933 15.784 ( 7.944 11.765 -1.898) 14.322 16.428 ( -3.655 -0.017 2.020) 4.176 16.661 ( -0.152 0.510 1.876) 1.950 16.794 ( -2.253 -0.699 0.164) 2.365 16.863 ( 0.578 -2.772 -0.529) 2.881 17.026 ( -0.495 -1.421 -2.872) 3.243 17.048 ( 2.281 -1.501 -1.608) 3.169 17.072 ( 0.832 -0.004 -2.049) 2.212 17.174 ( -1.958 -1.495 -0.623) 2.541 19.679 ( 5.558 1.549 -0.071) 5.770 19.940 ( 6.526 0.013 0.511) 6.546 21.321 ( -6.290 4.216 -0.016) 7.573 21.482 ( -4.711 1.561 -0.435) 4.982 22.824 ( -7.710 -3.205 -0.122) 8.350 23.203 ( -3.758 -3.438 -1.054) 5.202 27.794 ( 2.315 0.630 -5.476) 5.979 28.091 ( -2.588 4.337 4.814) 6.977 29.466 ( 4.343 2.626 5.428) 7.431 29.614 ( 4.704 -0.339 -2.666) 5.418 29.774 ( 1.365 3.056 -0.437) 3.376 29.947 ( -0.200 -0.338 -0.400) 0.560 30.896 ( 4.246 -1.060 -1.891) 4.767 31.060 ( 0.511 1.973 1.977) 2.839 31.290 ( -3.615 -4.745 2.046) 6.306 31.478 ( -3.659 -11.099 -2.846) 12.029 31.716 ( 0.406 2.596 -0.712) 2.722 31.875 ( -1.578 1.369 -2.808) 3.500 32.075 ( -6.831 -1.367 -2.279) 7.330 32.121 ( 0.272 0.821 1.873) 2.063 32.374 ( 4.396 -2.475 -0.855) 5.117 32.387 ( 6.239 -2.423 1.311) 6.820 32.580 ( 5.480 -0.297 0.320) 5.498 33.298 ( -0.385 4.279 -6.599) 7.875 34.350 ( 2.412 -1.772 -1.246) 3.242 34.548 ( -3.191 -7.542 -0.962) 8.246 34.634 ( -5.749 -0.110 7.054) 9.101 35.490 ( -6.065 -3.356 5.191) 8.660 35.798 ( 9.715 6.030 0.339) 11.439 36.010 ( 6.855 1.864 -4.602) 8.464 36.555 ( -3.212 18.219 7.441) 19.940 37.457 ( -5.060 8.006 -0.106) 9.472 ======================= Grid point 13 (9/95) ======================= q-point: ( 0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( 11.055 -11.739 3.439) 16.488 1.853 ( 0.307 -9.450 1.475) 9.569 2.067 ( 15.587 2.149 2.964) 16.011 2.099 ( 4.195 -5.830 -1.133) 7.271 2.520 ( 2.054 -2.999 -3.407) 4.982 2.573 ( 3.502 4.386 -7.354) 9.251 2.738 ( 0.861 5.645 -3.176) 6.534 2.991 ( 4.538 -5.103 5.494) 8.765 3.109 ( -2.242 4.754 0.388) 5.270 3.153 ( 1.765 -2.828 2.311) 4.056 3.445 ( 0.841 -1.665 5.261) 5.582 3.458 ( -4.303 -1.150 4.034) 6.009 3.701 ( -1.189 -0.307 -0.962) 1.560 3.751 ( -3.805 1.215 -0.122) 3.996 3.958 ( 3.582 2.842 -1.116) 4.707 4.134 ( -0.916 -4.814 -8.239) 9.586 4.152 ( -0.777 -3.914 2.432) 4.673 4.308 ( 6.632 -3.791 4.014) 8.630 4.354 ( 0.987 -3.624 -4.636) 5.967 4.402 ( -1.288 -4.099 1.599) 4.585 4.495 ( 1.052 -4.818 0.863) 5.006 4.564 ( 4.191 1.756 -3.472) 5.719 4.747 ( -0.886 -1.126 1.007) 1.751 4.816 ( -0.693 3.547 2.135) 4.197 4.892 ( 4.990 -3.498 0.363) 6.105 4.931 ( 1.223 -0.396 -1.152) 1.726 5.091 ( -1.643 4.775 -4.262) 6.608 5.251 ( -2.023 3.973 -1.079) 4.587 5.422 ( -3.933 1.239 4.065) 5.790 5.627 ( 2.646 1.165 -0.829) 3.007 5.802 ( -3.733 -1.569 1.734) 4.405 5.931 ( -2.297 -2.878 2.675) 4.551 6.055 ( -5.386 3.257 -6.314) 8.916 6.402 ( -8.622 -3.373 1.157) 9.330 7.265 ( -2.355 -4.829 -5.030) 7.360 7.348 ( -0.714 -0.558 1.407) 1.673 7.555 ( 0.555 -3.983 -1.939) 4.465 7.704 ( -1.713 5.584 2.179) 6.234 7.767 ( 2.038 1.035 0.031) 2.286 8.011 ( -3.611 7.932 -1.434) 8.833 8.112 ( 0.203 -10.438 6.168) 12.126 8.363 ( -5.530 -5.821 0.351) 8.036 8.638 ( 1.385 9.372 -0.181) 9.475 8.827 ( 3.135 1.141 -0.346) 3.354 8.952 ( 0.490 1.049 -0.194) 1.174 9.008 ( 2.322 4.058 2.370) 5.242 9.180 ( -3.439 2.322 -1.209) 4.322 9.350 ( -3.679 6.052 1.784) 7.304 9.760 ( -4.422 -0.228 -0.762) 4.492 9.956 ( -4.688 -3.067 0.458) 5.621 10.142 ( -0.192 1.472 -3.174) 3.504 10.492 ( 0.577 1.147 1.363) 1.873 10.808 ( -1.748 -1.727 1.414) 2.835 10.866 ( 4.169 -0.472 -0.890) 4.289 11.312 ( 5.463 1.936 1.180) 5.914 11.466 ( 4.067 -1.346 -0.754) 4.350 11.871 ( -3.117 0.653 -2.188) 3.864 11.904 ( -0.639 0.845 1.752) 2.047 12.667 ( 1.951 3.198 -0.952) 3.865 12.757 ( -5.454 1.455 1.668) 5.886 13.093 ( -3.687 -0.673 0.268) 3.758 13.235 ( -1.453 -1.230 -1.805) 2.623 13.612 ( 2.364 0.384 -0.308) 2.415 13.613 ( -0.564 0.590 3.146) 3.250 13.687 ( 1.903 0.651 -3.236) 3.810 14.008 ( 0.613 3.100 2.468) 4.010 14.577 ( 11.625 4.269 0.418) 12.391 14.665 ( 8.008 4.127 -2.061) 9.242 14.772 ( -0.672 0.344 -2.031) 2.166 15.145 ( -0.554 -3.652 2.155) 4.277 15.496 ( 4.281 -0.010 1.759) 4.628 15.627 ( 7.971 1.700 -2.682) 8.580 15.683 ( 1.198 5.388 -0.545) 5.546 15.751 ( 4.490 0.137 1.481) 4.730 16.443 ( 0.196 -2.757 2.056) 3.445 16.642 ( -0.288 2.159 0.873) 2.347 16.785 ( -2.070 -1.261 0.257) 2.438 16.924 ( 2.005 -2.912 -0.580) 3.583 17.006 ( -2.794 0.726 -0.937) 3.035 17.074 ( -0.260 -0.840 -1.306) 1.575 17.093 ( -0.585 -2.350 0.315) 2.442 17.180 ( 0.369 -0.472 -1.906) 1.998 19.703 ( 4.261 1.458 0.067) 4.504 19.981 ( 4.575 1.684 0.213) 4.880 21.206 ( -5.078 2.322 0.393) 5.598 21.417 ( -3.974 0.708 -0.645) 4.087 22.824 ( -4.859 -3.761 0.051) 6.145 23.228 ( -1.991 -3.111 -0.632) 3.747 27.805 ( 1.171 -1.116 -2.163) 2.701 28.002 ( -2.069 4.578 2.513) 5.617 29.491 ( 1.818 -0.064 2.949) 3.465 29.649 ( 1.717 -0.828 -0.823) 2.076 29.724 ( 2.363 4.065 -1.498) 4.935 29.954 ( 0.888 0.455 -0.071) 1.000 30.943 ( 2.807 -0.918 -1.583) 3.351 31.045 ( 0.778 1.407 2.035) 2.593 31.345 ( -2.676 -5.020 2.782) 6.332 31.599 ( 1.073 -4.426 0.087) 4.555 31.667 ( -1.755 0.704 -4.095) 4.510 31.842 ( -1.610 -0.014 -0.949) 1.869 32.028 ( -5.646 -1.318 -3.274) 6.658 32.128 ( 2.778 0.577 3.189) 4.268 32.442 ( 4.318 -1.002 -1.511) 4.683 32.475 ( 3.533 -1.684 0.780) 3.991 32.614 ( 2.301 1.207 1.666) 3.087 33.203 ( -2.235 3.561 -3.962) 5.777 34.404 ( 2.332 -1.981 -1.163) 3.274 34.558 ( -3.347 1.331 4.679) 5.905 34.707 ( -3.183 -10.934 -1.841) 11.536 35.477 ( -11.004 -2.872 3.301) 11.842 35.776 ( 7.489 8.000 1.349) 11.041 36.009 ( 9.034 4.129 -2.421) 10.223 36.313 ( 2.591 12.005 1.648) 12.391 37.282 ( -6.059 6.183 -0.016) 8.657 ======================= Grid point 14 (10/95) ======================= q-point: (-0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.758 ( 3.830 2.146 1.520) 4.646 1.849 ( 0.386 6.754 4.341) 8.038 2.143 ( -0.183 -0.748 -1.297) 1.508 2.243 ( 6.916 -2.404 0.246) 7.326 2.457 ( -2.156 4.276 0.995) 4.891 2.546 ( 0.947 -1.118 -4.716) 4.938 2.680 ( 6.337 4.306 -5.400) 9.374 3.043 ( -0.721 0.267 2.262) 2.389 3.121 ( 1.764 -0.927 -1.573) 2.539 3.279 ( -1.069 -6.538 3.905) 7.690 3.383 ( -2.224 5.799 -2.333) 6.635 3.491 ( 0.906 -4.901 4.241) 6.545 3.611 ( -5.733 3.116 -5.244) 8.371 3.773 ( 3.669 -0.812 4.443) 5.819 3.945 ( 2.181 0.995 0.119) 2.400 4.137 ( -2.434 -0.379 -3.564) 4.333 4.212 ( -3.816 1.049 0.716) 4.022 4.282 ( -7.701 0.005 -1.030) 7.770 4.418 ( 0.588 -1.158 0.891) 1.575 4.458 ( -0.823 -3.759 5.423) 6.650 4.481 ( -1.255 6.915 -0.016) 7.028 4.562 ( -2.037 -3.396 0.365) 3.977 4.747 ( -0.588 1.322 -0.585) 1.561 4.850 ( 1.915 -3.330 -0.434) 3.866 4.888 ( 0.489 1.687 -1.142) 2.095 5.028 ( 1.143 5.082 -2.035) 5.592 5.094 ( 2.890 -5.774 3.768) 7.476 5.165 ( 10.360 0.515 -0.729) 10.398 5.435 ( -0.656 -2.388 -1.204) 2.754 5.628 ( 6.185 1.648 -4.375) 7.753 5.812 ( -1.217 -1.894 1.819) 2.894 5.947 ( -2.863 0.957 -1.901) 3.567 5.990 ( -1.758 -3.549 2.233) 4.547 6.397 ( -6.778 -4.728 0.859) 8.309 7.277 ( -2.148 -1.372 -1.667) 3.046 7.431 ( 1.919 -6.267 -1.401) 6.703 7.557 ( -2.880 4.246 5.102) 7.236 7.667 ( 5.190 -1.777 -5.303) 7.630 7.779 ( 1.157 1.315 1.328) 2.198 7.882 ( -2.443 1.369 0.657) 2.877 8.305 ( 0.528 -10.342 2.534) 10.661 8.409 ( -4.012 -3.497 0.298) 5.331 8.477 ( -0.072 8.515 -1.844) 8.713 8.821 ( 1.507 2.659 -0.702) 3.136 8.907 ( -3.054 3.303 1.220) 4.661 8.942 ( -0.984 4.265 0.196) 4.381 9.134 ( -2.954 -1.635 -1.254) 3.601 9.303 ( 3.791 0.111 2.050) 4.311 9.762 ( -0.735 -3.246 -0.334) 3.345 9.989 ( -1.969 -4.248 0.481) 4.707 10.113 ( 1.420 1.190 -2.792) 3.351 10.480 ( -0.388 0.781 1.470) 1.710 10.816 ( -1.996 -1.104 0.220) 2.292 10.906 ( 5.015 1.046 -0.443) 5.142 11.301 ( 2.122 3.788 0.494) 4.369 11.460 ( -2.788 2.621 -0.434) 3.851 11.851 ( -0.954 -1.015 -2.229) 2.628 11.905 ( 0.143 -0.526 2.124) 2.193 12.649 ( 1.141 0.972 1.335) 2.007 12.738 ( 1.151 -1.800 -0.993) 2.356 13.072 ( -4.099 -1.241 -0.681) 4.337 13.219 ( -4.592 -0.827 1.266) 4.835 13.590 ( -0.447 1.439 3.053) 3.405 13.645 ( 3.618 -0.165 -3.068) 4.747 13.690 ( 1.991 0.586 -1.195) 2.394 13.981 ( 0.562 1.335 1.490) 2.078 14.592 ( 8.219 5.715 -0.545) 10.025 14.659 ( 8.976 4.893 -0.429) 10.232 14.777 ( 1.687 -1.027 -1.518) 2.491 15.184 ( -1.488 -1.293 1.434) 2.437 15.477 ( -3.176 3.098 1.055) 4.560 15.585 ( -5.754 3.984 -0.665) 7.030 15.631 ( 3.899 4.263 -0.687) 5.818 15.740 ( -1.726 3.216 0.474) 3.680 16.495 ( 1.690 -0.025 -0.630) 1.803 16.612 ( 0.008 0.003 2.016) 2.016 16.804 ( 0.567 -1.708 -0.641) 1.911 16.942 ( -2.430 1.362 -0.809) 2.901 16.996 ( 0.296 -1.818 -0.226) 1.855 17.078 ( -1.978 -1.074 2.739) 3.545 17.121 ( -0.151 -1.557 -1.003) 1.858 17.180 ( 0.250 0.286 -1.560) 1.605 19.703 ( 1.888 2.194 0.067) 2.895 19.970 ( 1.441 3.027 0.017) 3.352 21.171 ( -1.407 -1.857 0.654) 2.420 21.392 ( -2.015 -1.540 -0.854) 2.676 22.853 ( -2.322 -3.698 0.296) 4.377 23.261 ( -0.184 -2.169 -0.312) 2.199 27.830 ( 0.232 -0.653 -0.704) 0.988 27.932 ( -1.038 1.816 0.836) 2.252 29.494 ( -0.589 1.255 -1.230) 1.853 29.667 ( -0.036 -0.207 0.302) 0.368 29.699 ( 3.784 2.016 1.160) 4.441 29.936 ( -0.965 1.550 -0.011) 1.825 30.962 ( 0.861 0.453 -1.106) 1.473 31.036 ( 0.897 1.325 1.192) 1.995 31.425 ( -0.763 -5.355 2.556) 5.982 31.573 ( 3.813 5.789 -2.220) 7.278 31.721 ( -2.320 -6.759 -1.607) 7.324 31.826 ( -1.853 0.118 0.984) 2.101 32.012 ( -2.031 -2.635 -3.322) 4.702 32.172 ( 5.096 -0.055 3.345) 6.096 32.468 ( 1.320 0.971 -0.669) 1.770 32.518 ( 3.964 0.353 -0.750) 4.049 32.590 ( -1.412 2.713 1.965) 3.636 33.123 ( -4.544 1.184 -1.645) 4.976 34.434 ( 0.725 0.405 -1.411) 1.637 34.531 ( -1.371 -0.462 1.922) 2.405 34.860 ( -0.509 -8.874 0.135) 8.890 35.386 ( -14.080 -0.312 0.212) 14.085 35.698 ( 4.491 6.597 0.115) 7.981 36.088 ( 17.188 1.438 -2.143) 17.380 36.182 ( 0.592 6.301 2.148) 6.684 37.150 ( -8.693 1.125 0.052) 8.765 ======================= Grid point 15 (11/95) ======================= q-point: (-0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.576 ( -10.706 12.443 -0.792) 16.434 1.671 ( 0.697 18.531 1.295) 18.589 2.021 ( -7.099 9.753 1.727) 12.186 2.236 ( 7.374 6.845 2.125) 10.283 2.474 ( -1.339 2.504 0.768) 2.942 2.639 ( 2.327 -12.026 -4.393) 13.013 2.704 ( 8.071 -0.584 -0.125) 8.093 3.015 ( -2.900 11.447 -2.053) 11.986 3.071 ( 0.294 0.923 3.011) 3.163 3.197 ( -2.072 3.795 -1.846) 4.701 3.296 ( -5.044 3.921 -6.788) 9.322 3.548 ( 1.305 -0.311 -0.130) 1.348 3.669 ( 2.189 -6.124 3.781) 7.523 3.761 ( -5.217 0.521 -1.943) 5.591 3.983 ( 0.876 -1.404 1.503) 2.235 4.034 ( -5.652 5.898 -1.019) 8.232 4.148 ( 1.659 -3.060 -5.562) 6.561 4.263 ( -5.715 1.242 8.321) 10.171 4.353 ( -2.064 4.859 5.114) 7.350 4.440 ( 0.528 -0.105 -0.943) 1.085 4.512 ( -1.395 -0.449 2.780) 3.143 4.537 ( -1.247 4.740 0.790) 4.964 4.649 ( -3.000 1.938 -4.914) 6.075 4.905 ( -1.250 -1.592 2.295) 3.060 4.917 ( 1.478 6.679 -1.850) 7.086 4.965 ( 2.216 -6.267 1.403) 6.794 5.119 ( 7.489 3.701 1.190) 8.438 5.321 ( 1.987 -1.907 2.178) 3.511 5.437 ( -1.567 -0.316 -4.080) 4.382 5.745 ( 13.837 -5.627 -3.790) 15.410 5.816 ( -1.579 -0.030 -3.168) 3.539 5.964 ( 0.775 -4.912 2.000) 5.360 6.092 ( 2.080 -8.067 3.999) 9.241 6.427 ( -6.014 -5.726 0.061) 8.304 7.284 ( -1.077 -1.883 -1.137) 2.450 7.422 ( 0.752 6.224 -0.500) 6.289 7.574 ( -1.909 -5.014 3.002) 6.148 7.720 ( -1.182 3.210 -0.618) 3.476 7.761 ( 8.137 -3.205 -1.524) 8.877 7.970 ( 1.282 -9.012 2.671) 9.487 8.253 ( -0.359 12.323 -2.346) 12.550 8.440 ( -4.537 -7.376 -3.249) 9.249 8.525 ( 3.171 -5.522 1.961) 6.663 8.751 ( 0.335 5.629 0.250) 5.644 8.836 ( -7.761 -1.618 0.799) 7.968 8.866 ( -2.181 2.700 -0.435) 3.498 9.179 ( 0.682 -4.704 -0.511) 4.780 9.400 ( 4.908 -5.345 0.892) 7.311 9.844 ( 2.996 -5.000 -0.233) 5.833 10.041 ( -2.481 -3.833 -0.376) 4.581 10.126 ( 3.997 -0.342 -0.626) 4.060 10.467 ( -1.187 0.412 0.788) 1.483 10.813 ( -1.451 -0.474 0.599) 1.640 10.923 ( 6.216 2.591 -1.532) 6.907 11.233 ( -1.107 5.105 -0.046) 5.224 11.338 ( -8.383 5.021 0.363) 9.778 11.875 ( 1.055 -2.660 -1.345) 3.161 11.939 ( 1.190 -2.354 1.499) 3.034 12.674 ( 2.229 -1.389 2.533) 3.649 12.803 ( 3.018 -3.434 -2.777) 5.349 13.040 ( -6.873 -1.147 -0.743) 7.008 13.206 ( -3.298 -2.073 2.382) 4.566 13.578 ( 1.326 1.108 0.830) 1.917 13.655 ( 0.117 0.739 1.656) 1.817 13.699 ( 4.084 1.285 -3.629) 5.613 13.989 ( 1.818 -0.590 0.610) 2.006 14.548 ( 6.144 6.940 -0.505) 9.283 14.671 ( 10.562 5.367 0.462) 11.857 14.822 ( 2.575 -1.896 -0.701) 3.273 15.141 ( -7.615 2.957 -0.686) 8.198 15.351 ( -8.566 5.299 0.513) 10.085 15.435 ( -10.166 4.025 0.355) 10.940 15.555 ( -0.476 6.721 1.908) 7.003 15.640 ( -4.168 4.237 -1.605) 6.156 16.471 ( 0.887 2.041 -1.563) 2.719 16.651 ( 1.396 -1.549 1.225) 2.418 16.836 ( 1.286 -0.470 -1.077) 1.742 16.894 ( -1.536 0.762 -0.618) 1.823 17.001 ( -2.520 -0.246 0.423) 2.567 17.090 ( 0.668 0.880 3.591) 3.757 17.132 ( -0.520 0.295 0.075) 0.603 17.181 ( -0.003 -1.872 -1.775) 2.579 19.672 ( 0.260 2.394 0.087) 2.409 19.916 ( -0.845 3.438 -0.102) 3.541 21.236 ( 1.378 -5.114 0.653) 5.337 21.422 ( -0.370 -3.484 -0.847) 3.604 22.903 ( 0.084 -3.586 0.468) 3.617 23.291 ( 0.944 -0.983 -0.102) 1.366 27.804 ( -1.139 2.391 0.614) 2.718 27.950 ( 0.244 -3.463 -0.679) 3.538 29.436 ( -1.391 3.515 -2.614) 4.596 29.648 ( -0.910 2.261 0.925) 2.607 29.725 ( 3.189 -0.088 1.222) 3.416 29.903 ( -2.228 -0.037 0.365) 2.258 30.938 ( -0.524 2.239 0.052) 2.300 31.026 ( 0.601 0.815 -0.197) 1.032 31.489 ( -0.092 -0.609 -0.367) 0.717 31.526 ( 3.786 2.806 -1.437) 4.927 31.788 ( -0.362 -2.918 0.766) 3.039 31.831 ( -1.634 -3.134 2.106) 4.114 32.052 ( 1.872 -2.833 -2.719) 4.350 32.224 ( 3.604 0.499 2.187) 4.245 32.435 ( -0.322 3.196 0.455) 3.244 32.484 ( -5.448 3.131 -1.192) 6.396 32.578 ( 9.662 3.057 2.083) 10.346 33.069 ( -8.977 -2.864 -0.335) 9.429 34.399 ( -0.726 2.605 -0.922) 2.857 34.560 ( 0.832 -2.698 -0.870) 2.955 34.943 ( 2.565 2.438 3.018) 4.651 35.277 ( -12.490 -4.191 -2.917) 13.493 35.663 ( 3.355 2.440 -0.213) 4.153 36.031 ( -2.759 6.294 -2.199) 7.215 36.347 ( 20.268 -6.799 1.800) 21.454 37.085 ( -12.544 -5.350 0.112) 13.638 ======================= Grid point 16 (12/95) ======================= q-point: (-0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.184 ( -13.953 18.859 -1.582) 23.513 1.303 ( -1.893 23.606 -0.982) 23.703 1.775 ( -5.054 14.364 1.351) 15.287 2.131 ( 5.965 16.324 5.278) 18.164 2.363 ( -3.395 6.678 -2.304) 7.838 2.708 ( -2.634 8.793 -1.772) 9.348 2.754 ( 2.292 8.173 0.310) 8.494 2.843 ( -0.025 -5.450 0.149) 5.452 3.053 ( -3.508 -0.857 -1.592) 3.946 3.152 ( 2.752 -3.983 -0.694) 4.891 3.256 ( 0.413 -0.263 -3.024) 3.063 3.554 ( 1.348 2.273 2.415) 3.580 3.638 ( -5.835 0.255 -2.825) 6.488 3.788 ( -0.001 -1.267 0.095) 1.271 3.911 ( -1.679 5.280 0.240) 5.546 3.985 ( -0.464 0.042 -1.919) 1.975 4.173 ( -3.582 3.826 5.060) 7.285 4.211 ( -0.791 -1.050 0.312) 1.352 4.271 ( 0.344 7.028 0.949) 7.100 4.389 ( 0.511 4.565 0.927) 4.686 4.492 ( 4.812 -0.434 -2.561) 5.469 4.524 ( -0.245 0.509 5.552) 5.580 4.645 ( -4.349 -5.167 -5.021) 8.416 4.834 ( 2.489 4.809 -1.781) 5.700 4.907 ( -2.021 -0.971 5.367) 5.816 5.017 ( 2.809 5.972 0.553) 6.622 5.157 ( -1.159 -5.598 -0.378) 5.729 5.299 ( 0.689 6.315 0.205) 6.355 5.427 ( -1.207 -3.151 -2.497) 4.198 5.813 ( 1.299 -1.600 -2.613) 3.328 5.958 ( 11.618 -5.101 -2.270) 12.890 6.075 ( -1.329 -6.181 3.111) 7.046 6.314 ( 5.134 -11.857 2.843) 13.230 6.479 ( -3.767 -6.581 -0.281) 7.588 7.308 ( -0.522 -1.666 1.493) 2.298 7.342 ( 0.303 2.844 -2.547) 3.829 7.609 ( -0.196 0.130 4.178) 4.184 7.675 ( -1.912 0.555 -0.474) 2.047 7.916 ( 9.135 -5.787 -5.236) 12.014 8.040 ( -2.545 9.960 2.627) 10.611 8.167 ( 3.226 -9.706 1.291) 10.310 8.470 ( -7.136 -4.090 -4.263) 9.264 8.586 ( 6.309 4.592 -0.325) 7.810 8.715 ( -0.030 -0.959 1.329) 1.639 8.809 ( -3.259 0.128 -0.207) 3.268 8.847 ( -5.195 -6.928 -0.015) 8.660 9.279 ( 0.761 -6.460 -0.228) 6.509 9.549 ( 3.187 -7.053 0.689) 7.770 9.964 ( 5.221 -4.513 -1.269) 7.017 10.064 ( -3.330 -2.529 -0.112) 4.184 10.169 ( 2.102 0.025 1.369) 2.509 10.451 ( -0.723 0.075 -0.084) 0.731 10.810 ( -0.521 0.127 1.082) 1.207 10.943 ( 8.389 2.292 -2.847) 9.150 11.113 ( -2.468 6.932 -1.977) 7.619 11.164 ( -10.767 4.668 3.163) 12.154 11.947 ( 1.806 -4.330 -0.500) 4.718 12.014 ( 1.740 -4.299 0.548) 4.670 12.745 ( 2.684 -3.206 2.345) 4.794 12.878 ( 1.835 -3.702 -2.674) 4.922 12.990 ( -7.149 -1.910 -0.262) 7.404 13.234 ( -0.558 -2.230 1.249) 2.616 13.584 ( 3.424 0.827 -1.431) 3.802 13.642 ( -2.853 0.378 5.075) 5.834 13.691 ( 2.501 2.274 -3.194) 4.651 14.028 ( 3.140 -0.577 -0.356) 3.212 14.486 ( 5.963 7.404 -0.389) 9.515 14.673 ( 10.498 7.008 1.882) 12.761 14.854 ( -1.343 0.955 -0.216) 1.662 14.950 ( -11.642 4.481 -1.773) 12.600 15.124 ( -17.651 5.745 -1.364) 18.612 15.332 ( -1.151 2.812 2.083) 3.684 15.428 ( -3.157 6.801 1.928) 7.742 15.533 ( -2.950 3.613 -1.971) 5.063 16.465 ( 0.932 -0.908 -0.958) 1.615 16.676 ( 0.906 -0.021 -0.133) 0.916 16.810 ( -0.880 2.477 0.095) 2.631 16.908 ( 1.674 -1.314 -1.542) 2.628 16.981 ( -2.341 -0.132 1.610) 2.845 17.073 ( -0.008 2.080 1.937) 2.843 17.098 ( -0.421 3.009 -0.229) 3.047 17.224 ( 0.718 -2.340 -0.470) 2.492 19.638 ( -0.025 1.784 0.068) 1.786 19.854 ( -1.059 2.614 -0.145) 2.824 21.345 ( 1.300 -5.558 0.421) 5.723 21.483 ( 0.087 -3.961 -0.506) 3.994 22.976 ( 1.715 -3.919 0.446) 4.301 23.308 ( 1.060 0.184 0.016) 1.076 27.755 ( -1.503 2.074 1.265) 2.857 28.018 ( 0.182 -4.488 -1.097) 4.624 29.346 ( -1.546 4.660 -2.118) 5.347 29.589 ( -1.051 3.685 1.144) 3.999 29.756 ( 1.391 -0.669 -0.251) 1.564 29.907 ( -1.166 -2.146 0.490) 2.491 30.885 ( -0.674 3.435 0.581) 3.548 31.022 ( 0.052 -0.258 -0.536) 0.597 31.463 ( 3.053 4.595 -1.007) 5.608 31.508 ( -1.429 0.144 -1.172) 1.854 31.844 ( 1.140 -2.717 2.487) 3.856 31.893 ( 0.126 -3.904 1.638) 4.236 32.112 ( 3.852 -1.721 -1.737) 4.563 32.228 ( 0.047 1.108 0.464) 1.202 32.356 ( -4.658 4.356 1.033) 6.460 32.379 ( -2.299 3.099 -0.960) 3.976 32.614 ( 12.474 7.596 2.346) 14.792 33.062 ( -10.592 -8.237 0.036) 13.418 34.346 ( -0.495 2.511 -0.402) 2.590 34.620 ( 1.599 -3.410 -2.212) 4.368 34.845 ( 1.277 10.535 1.720) 10.751 35.280 ( -6.511 -6.326 -1.616) 9.221 35.666 ( 2.244 0.653 -0.322) 2.360 35.902 ( -4.870 3.745 -0.875) 6.206 36.684 ( 20.662 -7.295 -1.146) 21.941 37.108 ( -15.057 -14.765 0.663) 21.098 ======================= Grid point 17 (13/95) ======================= q-point: (-0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 95 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.751 ( 0.000 22.207 -0.000) 22.207 0.882 ( 0.000 25.245 -0.000) 25.245 1.367 ( 0.000 33.008 -0.000) 33.008 1.940 ( 0.000 7.602 -0.000) 7.602 2.183 ( 0.000 11.316 -0.000) 11.316 2.511 ( 0.000 8.486 -0.000) 8.486 2.708 ( 0.000 0.929 -0.000) 0.929 2.885 ( -0.000 -3.004 0.000) 3.004 3.125 ( -0.000 -4.171 0.000) 4.171 3.162 ( 0.000 5.770 -0.000) 5.770 3.273 ( -0.000 -2.515 0.000) 2.515 3.522 ( 0.000 3.186 -0.000) 3.186 3.624 ( -0.000 -3.418 0.000) 3.418 3.788 ( 0.000 0.430 -0.000) 0.430 3.810 ( 0.000 5.380 -0.000) 5.380 3.978 ( -0.000 -0.349 0.000) 0.349 4.111 ( 0.000 4.783 -0.000) 4.783 4.150 ( 0.000 4.289 -0.000) 4.289 4.219 ( -0.000 -0.557 0.000) 0.557 4.350 ( 0.000 0.871 -0.000) 0.871 4.471 ( 0.000 3.496 -0.000) 3.496 4.532 ( 0.000 1.648 -0.000) 1.648 4.713 ( -0.000 -5.486 0.000) 5.486 4.786 ( 0.000 2.732 -0.000) 2.732 4.881 ( 0.000 9.137 -0.000) 9.137 4.965 ( -0.000 -3.922 0.000) 3.922 5.169 ( 0.000 7.952 -0.000) 7.952 5.212 ( -0.000 -1.902 0.000) 1.902 5.495 ( -0.000 -4.722 0.000) 4.722 5.872 ( -0.000 -4.776 0.000) 4.776 6.101 ( -0.000 -3.549 0.000) 3.549 6.143 ( -0.000 -4.300 0.000) 4.300 6.540 ( -0.000 -10.207 0.000) 10.207 6.563 ( -0.000 -4.820 0.000) 4.820 7.323 ( -0.000 -1.536 0.000) 1.536 7.342 ( -0.000 -1.782 0.000) 1.782 7.606 ( 0.000 1.606 -0.000) 1.606 7.648 ( 0.000 1.753 -0.000) 1.753 7.877 ( 0.000 6.221 -0.000) 6.221 8.083 ( -0.000 -6.625 0.000) 6.625 8.335 ( -0.000 -6.243 0.000) 6.243 8.450 ( -0.000 -1.028 0.000) 1.028 8.558 ( 0.000 0.734 -0.000) 0.734 8.733 ( -0.000 -0.452 0.000) 0.452 8.814 ( -0.000 -3.295 0.000) 3.295 8.927 ( -0.000 -3.653 0.000) 3.653 9.408 ( -0.000 -8.550 0.000) 8.550 9.678 ( -0.000 -6.029 0.000) 6.029 10.052 ( 0.000 0.108 -0.000) 0.108 10.077 ( -0.000 -3.816 0.000) 3.816 10.156 ( 0.000 2.316 -0.000) 2.316 10.458 ( -0.000 -0.799 0.000) 0.799 10.803 ( 0.000 0.613 -0.000) 0.613 10.962 ( 0.000 7.247 -0.000) 7.247 10.983 ( 0.000 0.383 -0.000) 0.383 11.025 ( 0.000 4.332 -0.000) 4.332 12.033 ( -0.000 -4.576 0.000) 4.576 12.099 ( -0.000 -4.331 0.000) 4.331 12.826 ( -0.000 -3.965 0.000) 3.965 12.947 ( -0.000 -4.086 0.000) 4.086 12.994 ( -0.000 -2.803 0.000) 2.803 13.262 ( -0.000 -1.128 0.000) 1.128 13.608 ( -0.000 -0.164 0.000) 0.164 13.609 ( 0.000 1.097 -0.000) 1.097 13.656 ( 0.000 2.608 -0.000) 2.608 14.033 ( 0.000 2.218 -0.000) 2.218 14.392 ( 0.000 6.999 -0.000) 6.999 14.660 ( 0.000 5.866 -0.000) 5.866 14.737 ( 0.000 7.579 -0.000) 7.579 14.793 ( 0.000 0.968 -0.000) 0.968 14.986 ( 0.000 1.680 -0.000) 1.680 15.295 ( 0.000 6.041 -0.000) 6.041 15.305 ( 0.000 1.032 -0.000) 1.032 15.464 ( 0.000 2.545 -0.000) 2.545 16.514 ( -0.000 -4.365 0.000) 4.365 16.674 ( 0.000 0.484 -0.000) 0.484 16.761 ( 0.000 2.725 -0.000) 2.725 16.935 ( -0.000 -1.050 0.000) 1.050 16.978 ( -0.000 -0.583 0.000) 0.583 17.026 ( 0.000 5.031 -0.000) 5.031 17.042 ( 0.000 1.830 -0.000) 1.830 17.252 ( -0.000 -0.378 0.000) 0.378 19.614 ( 0.000 1.078 -0.000) 1.078 19.817 ( 0.000 1.178 -0.000) 1.178 21.433 ( -0.000 -4.095 0.000) 4.095 21.544 ( -0.000 -3.179 0.000) 3.179 23.058 ( -0.000 -4.271 0.000) 4.271 23.301 ( 0.000 1.411 -0.000) 1.411 27.718 ( 0.000 1.515 -0.000) 1.515 28.089 ( -0.000 -4.013 0.000) 4.013 29.254 ( 0.000 4.459 -0.000) 4.459 29.526 ( 0.000 3.131 -0.000) 3.131 29.771 ( -0.000 -0.617 0.000) 0.617 29.946 ( -0.000 -2.788 0.000) 2.788 30.821 ( 0.000 3.679 -0.000) 3.679 31.038 ( -0.000 -1.871 0.000) 1.871 31.376 ( 0.000 6.731 -0.000) 6.731 31.527 ( -0.000 -3.189 0.000) 3.189 31.883 ( 0.000 0.045 -0.000) 0.045 31.963 ( -0.000 -3.690 0.000) 3.690 32.161 ( -0.000 -1.258 0.000) 1.258 32.211 ( 0.000 0.540 -0.000) 0.540 32.256 ( 0.000 3.595 -0.000) 3.595 32.316 ( 0.000 3.186 -0.000) 3.186 32.545 ( 0.000 8.198 -0.000) 8.198 33.149 ( -0.000 -7.914 0.000) 7.914 34.311 ( 0.000 1.248 -0.000) 1.248 34.672 ( 0.000 10.483 -0.000) 10.483 34.682 ( -0.000 -3.187 0.000) 3.187 35.330 ( -0.000 -3.733 0.000) 3.733 35.668 ( 0.000 0.477 -0.000) 0.477 35.830 ( 0.000 1.571 -0.000) 1.571 36.852 ( -0.000 -2.235 0.000) 2.235 37.356 ( -0.000 -21.160 0.000) 21.160 ======================= Grid point 20 (14/95) ======================= q-point: ( 0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 95 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.844 ( 14.683 0.000 3.982) 15.213 0.906 ( 20.101 0.000 3.148) 20.346 1.914 ( 10.762 0.000 -1.672) 10.891 1.977 ( 16.613 0.000 4.057) 17.101 2.089 ( 29.307 0.000 3.427) 29.507 2.876 ( -0.312 -0.000 3.127) 3.142 2.911 ( -1.021 -0.000 -5.133) 5.234 2.978 ( -2.516 -0.000 -2.627) 3.637 3.000 ( 14.603 0.000 -0.009) 14.603 3.314 ( 2.002 0.000 1.916) 2.771 3.370 ( 4.996 0.000 4.918) 7.011 3.435 ( -0.709 -0.000 7.732) 7.765 3.662 ( -4.123 -0.000 -6.510) 7.706 3.703 ( -2.275 -0.000 -8.807) 9.096 3.784 ( 0.221 0.000 2.806) 2.814 4.028 ( -0.476 -0.000 -10.068) 10.079 4.032 ( 3.432 0.000 -1.166) 3.624 4.080 ( 2.042 0.000 8.538) 8.779 4.209 ( -0.702 -0.000 1.113) 1.316 4.353 ( -2.317 -0.000 -4.078) 4.690 4.444 ( 2.690 0.000 1.713) 3.189 4.493 ( 10.636 0.000 1.643) 10.763 4.754 ( -2.220 -0.000 1.003) 2.436 4.759 ( 7.342 0.000 -7.081) 10.200 4.891 ( -4.907 -0.000 -0.082) 4.908 5.078 ( -3.117 -0.000 1.586) 3.497 5.238 ( 1.922 0.000 -2.985) 3.551 5.361 ( 0.342 0.000 -7.052) 7.061 5.609 ( 0.474 0.000 -1.119) 1.215 5.679 ( -3.088 -0.000 4.664) 5.594 5.780 ( -9.099 -0.000 3.671) 9.812 5.849 ( -5.535 -0.000 -0.758) 5.587 6.076 ( -8.092 -0.000 -0.926) 8.145 6.307 ( -15.415 -0.000 -0.054) 15.415 7.180 ( -9.329 -0.000 -9.445) 13.275 7.412 ( 0.742 0.000 1.092) 1.320 7.575 ( 1.789 0.000 -0.338) 1.821 7.648 ( 0.990 0.000 11.704) 11.746 7.829 ( -1.205 -0.000 5.018) 5.161 7.859 ( -4.463 -0.000 2.146) 4.952 8.235 ( -5.306 -0.000 1.507) 5.516 8.379 ( -2.967 -0.000 -2.511) 3.887 8.767 ( 3.380 0.000 1.225) 3.595 8.821 ( 3.294 0.000 0.875) 3.408 8.959 ( 0.540 0.000 3.796) 3.834 9.047 ( 6.243 0.000 3.051) 6.949 9.396 ( -6.812 -0.000 -1.218) 6.920 9.625 ( -6.601 -0.000 -1.637) 6.801 9.910 ( -9.501 -0.000 -3.479) 10.118 9.920 ( -5.863 -0.000 5.493) 8.034 10.126 ( 0.652 0.000 -4.277) 4.327 10.502 ( 5.961 0.000 -0.339) 5.971 10.782 ( -1.442 -0.000 2.664) 3.029 10.793 ( -0.359 -0.000 0.516) 0.629 11.222 ( 10.716 0.000 4.316) 11.552 11.311 ( 9.567 0.000 -4.410) 10.534 11.990 ( -6.721 -0.000 -1.059) 6.803 11.995 ( -5.784 -0.000 1.534) 5.984 12.857 ( -4.748 -0.000 -0.230) 4.754 12.967 ( 1.250 0.000 1.038) 1.625 13.010 ( -4.549 -0.000 2.452) 5.167 13.172 ( -3.114 -0.000 -4.387) 5.380 13.579 ( 4.979 0.000 -3.487) 6.078 13.657 ( 1.205 0.000 3.380) 3.588 13.775 ( -3.386 -0.000 -5.591) 6.536 14.155 ( -3.061 -0.000 10.367) 10.810 14.615 ( 15.295 0.000 1.435) 15.362 14.620 ( 15.236 0.000 -3.483) 15.629 14.826 ( -0.138 -0.000 -5.104) 5.106 14.961 ( 0.911 0.000 1.532) 1.782 15.335 ( 18.521 0.000 -4.719) 19.112 15.582 ( 11.523 0.000 -2.343) 11.759 15.631 ( 6.962 0.000 5.563) 8.912 16.210 ( -9.113 -0.000 -0.179) 9.115 16.462 ( -9.120 -0.000 2.943) 9.583 16.638 ( -1.227 -0.000 -1.373) 1.842 16.734 ( 1.137 0.000 -2.316) 2.580 16.826 ( 1.084 0.000 -0.326) 1.132 16.972 ( -1.942 -0.000 1.585) 2.507 17.042 ( 3.875 0.000 -10.901) 11.569 17.105 ( 4.700 0.000 -4.953) 6.828 17.113 ( -3.664 -0.000 1.186) 3.851 19.772 ( 9.930 0.000 -3.828) 10.642 19.908 ( 8.872 0.000 2.540) 9.229 21.413 ( -8.201 -0.000 0.301) 8.206 21.496 ( -5.676 -0.000 -0.587) 5.706 22.747 ( -8.816 -0.000 0.804) 8.853 23.113 ( -4.952 -0.000 -2.104) 5.380 27.831 ( 1.764 0.000 -12.588) 12.711 28.164 ( -4.049 -0.000 8.227) 9.169 29.603 ( 10.830 0.000 -5.259) 12.039 29.687 ( 0.042 0.000 7.118) 7.118 29.814 ( 0.205 0.000 1.773) 1.785 29.903 ( -4.334 -0.000 -2.582) 5.044 30.952 ( 6.574 0.000 -6.380) 9.161 31.022 ( 0.334 0.000 0.567) 0.658 31.152 ( -1.265 -0.000 3.907) 4.107 31.184 ( 0.236 0.000 0.136) 0.272 31.770 ( -3.801 -0.000 -1.368) 4.040 31.930 ( 3.893 0.000 0.382) 3.912 32.064 ( -6.695 -0.000 -0.052) 6.696 32.096 ( 1.815 0.000 -0.894) 2.023 32.316 ( 4.366 0.000 1.159) 4.517 32.362 ( 8.375 0.000 0.070) 8.375 32.559 ( 5.986 0.000 -1.933) 6.291 33.378 ( -1.510 -0.000 -9.988) 10.102 34.346 ( 2.796 0.000 -3.523) 4.498 34.358 ( -2.834 -0.000 -1.732) 3.322 34.664 ( -8.488 -0.000 14.268) 16.602 35.408 ( -6.771 -0.000 4.564) 8.166 35.918 ( 7.745 0.000 -0.383) 7.754 36.042 ( 12.541 0.000 -7.270) 14.496 37.059 ( -12.306 -0.000 18.644) 22.339 37.547 ( -8.339 -0.000 -2.171) 8.617 ======================= Grid point 21 (15/95) ======================= q-point: ( 0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.165 ( 11.421 -18.080 -0.812) 21.401 1.171 ( 14.544 -10.560 5.866) 18.906 1.990 ( 6.867 -0.077 1.592) 7.049 2.144 ( 7.223 -8.269 -1.799) 11.125 2.383 ( 27.648 4.815 7.004) 28.925 2.745 ( 0.299 6.888 -3.461) 7.715 2.916 ( -2.091 3.245 -1.960) 4.329 2.962 ( -2.217 -1.958 -4.775) 5.617 3.136 ( 11.204 0.006 3.599) 11.768 3.301 ( 4.344 5.098 3.464) 7.540 3.412 ( -0.872 -0.421 2.714) 2.882 3.446 ( -1.132 0.156 8.255) 8.334 3.610 ( -3.468 -0.811 -2.768) 4.510 3.669 ( -4.211 -3.235 -2.844) 6.024 3.860 ( -0.719 -7.431 -0.752) 7.503 4.008 ( -1.458 -2.684 -10.822) 11.245 4.066 ( 3.147 -0.436 -2.749) 4.201 4.193 ( 9.927 -2.883 6.013) 11.959 4.249 ( 0.944 -3.820 3.121) 5.022 4.291 ( 0.400 1.952 -6.454) 6.754 4.503 ( 8.455 0.637 1.351) 8.586 4.582 ( 4.209 0.300 0.438) 4.242 4.710 ( 0.438 1.978 0.263) 2.043 4.834 ( -4.046 -1.430 -0.049) 4.292 4.884 ( 4.378 -4.600 -1.712) 6.577 5.031 ( -3.267 7.599 0.436) 8.283 5.075 ( 2.834 3.722 -4.090) 6.214 5.439 ( -5.097 -0.514 -2.603) 5.746 5.542 ( 1.117 2.913 3.845) 4.951 5.651 ( -1.226 -0.062 1.466) 1.912 5.742 ( -6.880 2.422 2.443) 7.692 5.868 ( -5.907 -4.998 -2.786) 8.224 5.988 ( -7.103 -2.669 -3.084) 8.191 6.233 ( -13.735 -6.592 0.910) 15.262 7.091 ( -8.585 -3.299 -8.474) 12.506 7.421 ( 0.737 0.392 -1.890) 2.066 7.512 ( 0.356 4.650 4.222) 6.290 7.778 ( 1.849 -5.654 5.435) 8.058 7.812 ( -4.720 0.845 6.450) 8.038 7.836 ( -1.377 -1.632 1.325) 2.512 8.200 ( -3.904 -0.045 0.811) 3.988 8.304 ( -2.180 4.279 -2.466) 5.398 8.815 ( 0.384 -2.057 -1.477) 2.562 8.852 ( 5.379 1.220 0.325) 5.526 8.951 ( 0.001 2.310 3.663) 4.330 9.106 ( 4.845 1.145 4.607) 6.783 9.301 ( -4.949 3.261 -1.981) 6.249 9.527 ( -7.441 3.057 -0.777) 8.082 9.794 ( -8.375 1.681 -2.706) 8.960 9.889 ( -5.494 -0.841 4.786) 7.334 10.129 ( -1.101 -1.507 -4.779) 5.131 10.541 ( 4.400 1.598 -0.001) 4.682 10.778 ( -0.948 0.153 2.495) 2.673 10.819 ( 2.026 -2.320 -0.172) 3.085 11.339 ( 9.968 -0.306 3.983) 10.739 11.399 ( 9.009 -1.421 -3.980) 9.951 11.915 ( -6.092 1.284 -1.558) 6.418 11.937 ( -4.609 0.765 1.529) 4.916 12.802 ( -4.746 1.314 0.780) 4.986 12.866 ( -1.063 6.916 1.261) 7.109 13.047 ( -4.667 -2.863 2.046) 5.845 13.156 ( -1.126 -2.639 -5.561) 6.257 13.615 ( 6.025 0.629 -4.341) 7.452 13.669 ( 1.051 1.072 3.652) 3.949 13.719 ( -2.603 1.258 -2.827) 4.044 14.116 ( -4.726 2.457 8.149) 9.736 14.716 ( 12.416 2.896 -0.250) 12.752 14.764 ( 11.546 0.721 0.222) 11.571 14.808 ( 4.598 1.653 -6.161) 7.863 15.002 ( 0.494 -3.637 1.956) 4.159 15.499 ( 16.410 0.356 -2.268) 16.570 15.672 ( 10.641 1.082 -2.602) 11.008 15.725 ( 7.711 -1.082 4.412) 8.950 16.011 ( -4.349 11.565 -0.003) 12.355 16.384 ( -6.057 -0.356 1.958) 6.376 16.654 ( -1.788 -2.277 2.117) 3.587 16.750 ( -1.076 -1.087 -1.468) 2.120 16.835 ( 1.315 -0.648 -1.199) 1.894 16.975 ( -2.349 -2.302 0.520) 3.330 17.046 ( 1.251 -0.171 -2.377) 2.692 17.074 ( -2.357 0.726 -1.747) 3.022 17.144 ( 3.186 -1.104 -4.374) 5.522 19.810 ( 10.469 4.692 -2.207) 11.683 20.014 ( 8.548 -0.444 1.767) 8.739 21.307 ( -9.241 2.539 1.034) 9.639 21.435 ( -6.744 0.005 -1.231) 6.855 22.696 ( -7.480 -2.752 0.580) 7.991 23.094 ( -4.591 -3.717 -1.879) 6.199 27.804 ( 0.738 0.697 -6.824) 6.899 28.128 ( -4.190 2.036 6.425) 7.936 29.603 ( 2.806 7.393 3.383) 8.601 29.678 ( 6.198 2.283 -2.096) 6.930 29.824 ( 1.708 0.367 -0.041) 1.747 29.903 ( -2.189 -3.466 -0.931) 4.204 30.945 ( 5.663 1.895 -1.862) 6.255 31.109 ( 0.114 2.555 2.647) 3.681 31.166 ( -0.564 -8.731 -2.780) 9.181 31.255 ( -1.940 -7.496 0.955) 7.802 31.738 ( -2.287 -0.552 -0.265) 2.368 31.912 ( 0.366 4.559 -1.028) 4.688 32.001 ( -5.407 -0.368 -0.906) 5.495 32.128 ( 1.442 -0.959 0.393) 1.776 32.385 ( 6.142 -1.571 1.450) 6.503 32.439 ( 7.654 -0.303 -1.828) 7.875 32.617 ( 4.552 -0.791 0.662) 4.668 33.310 ( -3.475 2.038 -7.163) 8.218 34.344 ( 1.451 -1.373 -2.271) 3.025 34.403 ( -0.541 -4.861 -2.867) 5.669 34.616 ( -7.167 0.935 10.816) 13.009 35.366 ( -9.287 -2.612 3.066) 10.123 35.975 ( 9.993 3.378 1.158) 10.611 36.126 ( 12.530 2.048 -7.146) 14.569 36.842 ( -6.961 15.473 11.479) 20.485 37.461 ( -9.190 1.621 -1.062) 9.392 ======================= Grid point 22 (16/95) ======================= q-point: ( 0.44 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.500 ( 13.975 -12.253 1.550) 18.650 1.583 ( 2.275 -20.411 3.096) 20.770 2.063 ( 3.293 -2.405 2.421) 4.742 2.311 ( 7.116 -0.873 -3.162) 7.836 2.453 ( 5.020 3.558 0.176) 6.156 2.718 ( 13.155 2.611 -3.560) 13.876 2.839 ( 3.889 5.987 -0.090) 7.140 2.934 ( -6.349 -1.684 -3.336) 7.367 3.177 ( 0.188 4.508 1.848) 4.876 3.256 ( 7.558 6.116 3.135) 10.215 3.377 ( -6.174 -1.038 5.731) 8.487 3.483 ( 1.875 -0.255 5.175) 5.510 3.625 ( -3.366 -2.873 -2.695) 5.181 3.712 ( -1.255 -4.821 2.666) 5.650 3.954 ( -3.972 -7.650 -0.223) 8.622 4.038 ( 1.095 -1.999 -6.923) 7.288 4.088 ( 1.188 -1.964 -4.197) 4.784 4.242 ( -1.501 -1.666 -4.879) 5.370 4.332 ( 0.202 -3.519 3.696) 5.107 4.395 ( 11.890 -0.934 5.068) 12.958 4.497 ( -2.162 2.916 -3.557) 5.082 4.620 ( 6.183 -0.837 -1.507) 6.419 4.695 ( -1.932 -0.732 -0.745) 2.197 4.856 ( -0.831 -0.927 4.239) 4.417 4.921 ( 4.823 1.239 0.857) 5.053 4.979 ( 4.634 2.423 1.671) 5.490 5.060 ( -0.048 -1.481 -7.828) 7.967 5.313 ( -4.533 4.513 0.012) 6.397 5.492 ( 1.111 6.536 3.703) 7.594 5.648 ( -0.041 -0.170 -2.399) 2.406 5.724 ( -2.493 -4.166 2.550) 5.484 5.855 ( -4.010 -2.804 2.028) 5.297 5.986 ( -5.627 -2.615 -6.193) 8.767 6.224 ( -12.079 -6.042 1.728) 13.616 7.096 ( -5.124 -7.817 -6.830) 11.577 7.378 ( -0.101 3.654 -0.286) 3.667 7.510 ( 0.657 -2.254 1.782) 2.947 7.754 ( -4.131 2.507 5.768) 7.525 7.801 ( 1.074 1.280 -3.309) 3.707 7.968 ( -0.126 -9.428 7.162) 11.841 8.122 ( -0.655 7.546 -1.598) 7.741 8.241 ( -4.316 -2.012 -0.072) 4.762 8.793 ( 2.306 5.950 -1.244) 6.501 8.885 ( 4.646 1.619 -0.673) 4.966 8.926 ( -2.159 -1.002 0.959) 2.566 9.088 ( -2.351 3.866 3.548) 5.750 9.214 ( -0.936 4.511 -0.978) 4.710 9.408 ( -3.432 3.524 0.926) 5.006 9.694 ( -7.204 -0.074 -2.871) 7.756 9.888 ( -2.146 -1.928 4.769) 5.574 10.117 ( -2.467 -0.952 -5.221) 5.852 10.535 ( 1.485 2.398 1.257) 3.088 10.774 ( -1.684 -0.634 0.979) 2.049 10.893 ( 5.365 -1.958 -0.215) 5.715 11.417 ( 7.572 2.257 1.587) 8.059 11.491 ( 6.204 -0.844 -1.681) 6.483 11.838 ( -4.633 0.674 -1.860) 5.038 11.900 ( -3.221 -0.077 1.753) 3.668 12.729 ( -6.148 1.804 2.563) 6.901 12.773 ( 4.391 5.180 -0.955) 6.858 13.029 ( -5.457 -1.418 -0.298) 5.646 13.175 ( -3.075 -2.310 -2.642) 4.666 13.649 ( 6.469 0.772 -4.887) 8.144 13.656 ( -1.649 2.402 8.977) 9.438 13.690 ( 1.437 -0.213 -5.678) 5.861 14.050 ( -4.431 2.319 5.303) 7.289 14.755 ( 3.620 1.529 -0.825) 4.016 14.782 ( 7.892 3.592 -2.596) 9.051 14.852 ( 13.480 4.816 -2.957) 14.617 15.086 ( 0.422 -4.074 3.386) 5.314 15.582 ( 7.534 3.345 0.784) 8.281 15.729 ( 7.841 1.914 -2.875) 8.568 15.803 ( -0.286 7.753 1.858) 7.977 15.816 ( 4.175 2.285 0.630) 4.800 16.389 ( -1.442 -3.842 1.885) 4.516 16.676 ( 0.109 0.288 2.372) 2.391 16.737 ( -2.735 -1.017 -0.812) 3.028 16.878 ( 0.983 -3.429 -1.301) 3.797 16.981 ( -2.945 -0.530 -0.137) 2.995 17.034 ( -2.810 -0.370 -1.049) 3.022 17.069 ( -0.042 -1.528 0.771) 1.712 17.175 ( 2.635 -0.604 -4.016) 4.841 19.815 ( 8.399 5.008 -0.889) 9.819 20.073 ( 6.429 2.463 0.970) 6.952 21.183 ( -8.105 2.048 1.190) 8.445 21.370 ( -5.975 -0.195 -1.425) 6.146 22.699 ( -5.401 -4.655 0.423) 7.143 23.131 ( -2.843 -5.226 -1.206) 6.070 27.793 ( 0.354 -0.440 -2.939) 2.993 28.058 ( -3.067 3.754 3.546) 6.006 29.538 ( 0.944 3.389 2.162) 4.129 29.675 ( 2.537 1.888 -1.067) 3.338 29.817 ( 3.342 3.077 -0.509) 4.571 29.950 ( 0.739 -2.018 -0.459) 2.198 30.971 ( 4.320 0.636 -1.192) 4.526 31.086 ( 0.972 1.724 2.103) 2.888 31.253 ( -1.224 -4.594 1.294) 4.927 31.397 ( -2.935 -11.320 -2.501) 11.959 31.744 ( 1.340 0.360 1.234) 1.857 31.820 ( -2.935 2.884 -1.885) 4.526 31.959 ( -3.856 0.003 -2.163) 4.421 32.159 ( 2.544 -0.763 1.852) 3.238 32.468 ( 5.192 -0.859 0.795) 5.323 32.503 ( 5.967 -0.339 -3.085) 6.726 32.655 ( 1.544 0.735 2.689) 3.187 33.213 ( -4.360 2.839 -4.761) 7.053 34.393 ( 3.284 -2.024 -2.698) 4.707 34.496 ( -1.395 -8.571 -1.623) 8.834 34.565 ( -5.709 0.758 7.383) 9.364 35.326 ( -10.639 -2.712 1.713) 11.112 35.979 ( 7.144 7.283 1.189) 10.271 36.178 ( 13.637 3.488 -4.589) 14.805 36.573 ( -0.244 14.859 5.738) 15.930 37.303 ( -10.153 5.619 -0.471) 11.614 ======================= Grid point 23 (17/95) ======================= q-point: ( 0.56 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.812 ( 9.466 -7.523 -0.222) 12.093 1.846 ( 0.354 -9.133 7.038) 11.536 2.121 ( -1.158 -1.357 -2.624) 3.173 2.290 ( 9.529 4.405 3.080) 10.941 2.488 ( -1.878 -3.641 -7.148) 8.239 2.673 ( 3.886 15.603 0.284) 16.082 2.778 ( 3.020 3.700 -8.371) 9.638 2.955 ( -2.407 -6.144 2.311) 6.992 3.143 ( 0.187 -1.967 4.269) 4.704 3.241 ( 5.192 3.132 0.925) 6.134 3.416 ( 0.714 -4.899 3.986) 6.356 3.467 ( -1.336 4.158 2.480) 5.022 3.579 ( -5.006 0.948 -4.988) 7.130 3.799 ( 1.616 -2.385 4.772) 5.574 3.998 ( -0.502 3.756 0.142) 3.792 4.059 ( -1.977 -6.300 -3.305) 7.384 4.153 ( -0.541 -5.483 -0.832) 5.572 4.216 ( -4.426 1.516 -2.432) 5.273 4.360 ( -5.073 -1.809 1.149) 5.507 4.420 ( -3.760 0.092 2.549) 4.544 4.496 ( 4.143 -2.374 0.887) 4.857 4.647 ( 4.343 6.724 0.548) 8.023 4.720 ( -0.452 -2.267 -3.461) 4.161 4.827 ( -0.240 -0.149 1.286) 1.317 4.957 ( 1.637 1.864 0.321) 2.502 5.025 ( 3.665 -2.221 1.819) 4.655 5.059 ( 1.708 -0.409 -5.156) 5.447 5.276 ( 6.380 0.355 1.638) 6.596 5.459 ( 4.316 1.820 0.492) 4.710 5.645 ( -0.864 -1.378 -2.599) 3.066 5.775 ( 0.995 -2.054 0.580) 2.355 5.902 ( -2.202 -4.999 2.840) 6.156 5.929 ( -4.420 1.032 -3.532) 5.751 6.218 ( -10.983 -6.051 1.656) 12.648 7.187 ( -2.250 -7.279 -4.207) 8.704 7.349 ( 0.074 -1.800 0.697) 1.932 7.583 ( 2.067 -3.305 1.687) 4.248 7.681 ( -1.422 3.214 -0.576) 3.561 7.795 ( 0.607 -0.618 0.906) 1.254 7.963 ( -0.660 9.337 -1.179) 9.434 8.150 ( 0.834 -9.786 3.548) 10.443 8.263 ( -5.103 -5.784 0.638) 7.740 8.663 ( 1.516 10.934 -1.196) 11.103 8.873 ( 2.002 2.782 -0.430) 3.454 8.941 ( -1.097 0.763 -0.060) 1.337 9.005 ( -1.698 3.286 0.851) 3.796 9.092 ( -4.832 3.721 -0.516) 6.121 9.370 ( 2.737 2.340 2.096) 4.167 9.666 ( -4.266 -4.369 -1.904) 6.396 9.934 ( 0.907 -2.351 3.870) 4.618 10.097 ( -1.741 -1.397 -4.992) 5.468 10.507 ( 0.004 2.203 1.742) 2.808 10.774 ( -2.015 -1.353 -0.048) 2.428 10.969 ( 6.088 -0.325 -0.036) 6.097 11.414 ( 4.158 5.244 1.076) 6.778 11.496 ( 0.323 3.750 -1.450) 4.033 11.806 ( -2.453 -1.553 -1.975) 3.511 11.889 ( -2.110 -1.102 2.044) 3.138 12.668 ( -2.528 0.755 2.318) 3.512 12.769 ( 7.032 1.931 -1.674) 7.482 13.003 ( -4.452 -1.290 -1.132) 4.772 13.150 ( -6.921 -1.244 0.478) 7.049 13.625 ( -0.985 1.671 5.050) 5.410 13.684 ( 4.263 0.864 -3.637) 5.670 13.707 ( 4.533 -0.330 -3.070) 5.484 13.990 ( -4.638 1.044 3.361) 5.822 14.758 ( 1.620 0.162 -0.296) 1.655 14.785 ( 9.184 5.216 -3.027) 10.987 14.883 ( 13.791 5.906 -1.626) 15.090 15.139 ( -2.932 -2.125 3.280) 4.886 15.545 ( 1.247 6.134 1.072) 6.351 15.629 ( -5.127 7.560 -0.334) 9.140 15.740 ( 4.411 3.716 -2.983) 6.493 15.808 ( 1.096 5.030 2.543) 5.742 16.478 ( 2.304 -4.869 0.789) 5.444 16.635 ( -1.632 3.275 1.305) 3.884 16.762 ( -0.358 -3.312 -0.269) 3.342 16.937 ( -1.377 0.229 -0.717) 1.569 16.955 ( -0.359 -2.936 -0.323) 2.975 17.020 ( -3.231 -1.649 0.026) 3.628 17.102 ( 0.128 -1.789 1.228) 2.174 17.185 ( 1.089 0.483 -2.644) 2.900 19.791 ( 4.316 5.086 -0.256) 6.675 20.059 ( 3.205 4.674 0.341) 5.677 21.119 ( -4.160 -1.438 0.938) 4.501 21.334 ( -3.549 -1.690 -1.119) 4.087 22.745 ( -3.268 -5.540 0.334) 6.441 23.196 ( -0.961 -4.775 -0.574) 4.904 27.808 ( 0.227 -1.553 -1.092) 1.912 27.976 ( -1.674 4.035 1.433) 4.597 29.508 ( -0.322 1.429 -0.244) 1.485 29.669 ( 0.690 0.453 -0.145) 0.838 29.798 ( 4.848 3.635 1.255) 6.188 29.952 ( -1.167 1.410 -0.739) 1.974 30.987 ( 2.288 1.144 -0.958) 2.732 31.075 ( 1.027 1.632 1.442) 2.408 31.337 ( 0.119 -5.816 2.385) 6.287 31.535 ( -3.627 -9.359 -3.165) 10.525 31.705 ( 3.324 4.865 -0.444) 5.909 31.807 ( -1.461 -1.256 1.606) 2.508 31.927 ( -3.271 -2.413 -3.270) 5.217 32.221 ( 4.789 -1.482 2.705) 5.696 32.503 ( 2.389 1.093 0.026) 2.627 32.542 ( 3.172 -0.070 -3.982) 5.091 32.635 ( -0.577 2.642 3.564) 4.474 33.114 ( -4.307 3.064 -2.386) 5.799 34.440 ( 2.744 -0.779 -3.122) 4.229 34.518 ( -3.663 0.596 4.713) 5.999 34.666 ( -0.538 -12.286 -0.213) 12.300 35.259 ( -10.386 -0.730 0.433) 10.421 35.881 ( 3.651 9.543 0.285) 10.221 36.268 ( 16.310 1.440 -2.680) 16.591 36.370 ( 1.566 12.641 3.278) 13.152 37.103 ( -11.671 5.186 -0.155) 12.772 ======================= Grid point 24 (18/95) ======================= q-point: (-0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.753 ( -1.914 12.902 -0.364) 13.048 1.946 ( 4.282 7.993 4.761) 10.241 2.121 ( -1.070 6.101 0.191) 6.197 2.370 ( 0.834 -10.741 -2.265) 11.008 2.424 ( 2.459 9.511 0.442) 9.834 2.545 ( 1.387 0.148 -1.084) 1.767 2.734 ( 1.337 -2.235 -4.846) 5.501 3.064 ( 1.891 -3.512 2.854) 4.904 3.123 ( -0.735 2.294 -2.675) 3.600 3.227 ( -3.780 5.657 1.708) 7.014 3.365 ( 0.905 7.579 -1.202) 7.727 3.524 ( -1.312 -2.360 -1.996) 3.358 3.583 ( 3.572 -8.799 3.754) 10.212 3.786 ( -2.372 6.633 0.208) 7.047 3.938 ( -2.574 -1.228 1.071) 3.046 4.082 ( -1.827 2.023 2.104) 3.443 4.109 ( -1.404 0.766 -6.181) 6.385 4.237 ( -0.736 -1.783 3.711) 4.183 4.384 ( -0.399 -5.205 -4.130) 6.657 4.408 ( -4.318 -1.143 4.902) 6.632 4.522 ( 1.576 7.619 1.547) 7.933 4.581 ( 1.808 -0.917 2.945) 3.575 4.693 ( -2.491 3.299 -4.053) 5.789 4.881 ( 1.034 -4.030 0.263) 4.168 4.892 ( -0.036 2.309 0.148) 2.314 5.020 ( 0.328 4.297 -1.857) 4.693 5.178 ( 2.270 -8.943 3.168) 9.755 5.323 ( 3.579 4.494 -1.520) 5.942 5.475 ( 5.426 2.935 -0.474) 6.187 5.680 ( -2.903 -6.188 -2.367) 7.233 5.829 ( 5.154 -1.612 -1.270) 5.547 5.899 ( -0.737 -2.439 -0.119) 2.551 6.003 ( 2.447 -6.641 2.722) 7.583 6.231 ( -10.072 -7.297 0.297) 12.441 7.235 ( -1.013 -2.482 -1.047) 2.878 7.451 ( 0.847 -7.704 -0.907) 7.804 7.549 ( -0.675 6.793 2.178) 7.165 7.727 ( 2.564 -6.143 -2.340) 7.056 7.801 ( 0.511 6.706 -0.196) 6.728 7.868 ( 0.138 -4.685 2.330) 5.234 8.274 ( -2.869 -5.890 -1.823) 6.800 8.388 ( 0.377 -10.834 3.496) 11.390 8.471 ( 0.252 11.888 -1.907) 12.043 8.811 ( -3.049 5.191 0.659) 6.056 8.854 ( -0.112 4.932 -0.835) 5.003 8.920 ( -1.043 5.094 0.320) 5.209 9.103 ( -0.105 -4.840 -0.613) 4.880 9.383 ( 2.380 -0.899 1.274) 2.846 9.743 ( -0.711 -7.614 -0.707) 7.680 9.984 ( 0.217 -1.737 1.313) 2.188 10.119 ( 0.804 -2.950 -2.287) 3.818 10.475 ( -0.653 1.620 1.027) 2.026 10.782 ( -1.221 -1.514 -0.039) 1.945 11.013 ( 5.145 1.248 -0.338) 5.305 11.333 ( -0.401 6.831 1.595) 7.026 11.381 ( -2.696 7.279 -1.608) 7.927 11.827 ( -0.488 -3.053 -1.188) 3.312 11.909 ( -0.485 -2.070 1.270) 2.476 12.670 ( 0.034 -1.319 1.787) 2.221 12.817 ( 7.538 0.228 -2.440) 7.926 12.959 ( -7.241 0.208 -0.021) 7.244 13.132 ( -3.749 -3.447 1.238) 5.241 13.610 ( 0.375 1.037 1.878) 2.178 13.681 ( 0.583 1.291 -0.208) 1.432 13.746 ( 4.787 0.990 -3.127) 5.803 13.964 ( -2.795 -1.947 1.714) 3.813 14.755 ( 9.083 7.425 -0.421) 11.739 14.791 ( 1.298 -1.665 -1.201) 2.429 14.907 ( 12.376 5.971 -0.901) 13.771 15.102 ( -8.459 1.648 2.023) 8.852 15.393 ( -6.695 9.637 -0.650) 11.752 15.469 ( -2.114 6.253 0.852) 6.655 15.677 ( -0.201 5.124 -2.139) 5.557 15.702 ( -0.405 7.993 1.868) 8.218 16.524 ( 1.638 3.221 -1.095) 3.776 16.618 ( -0.788 -3.692 1.800) 4.182 16.817 ( 0.815 -2.766 -0.629) 2.951 16.895 ( -1.381 1.494 -0.342) 2.063 16.981 ( -1.194 -0.141 -0.110) 1.207 17.065 ( -0.625 -5.189 1.692) 5.494 17.130 ( 1.081 -0.438 0.133) 1.174 17.165 ( -0.794 1.178 -1.447) 2.028 19.734 ( 1.018 4.378 0.014) 4.495 19.991 ( 0.623 5.413 0.031) 5.449 21.156 ( -0.540 -4.987 0.457) 5.037 21.354 ( -1.110 -3.426 -0.599) 3.651 22.818 ( -1.183 -5.613 0.228) 5.741 23.260 ( 0.051 -3.297 -0.176) 3.302 27.827 ( -0.088 0.106 -0.259) 0.294 27.920 ( -0.459 0.798 0.311) 0.972 29.473 ( -0.429 2.328 -1.050) 2.589 29.666 ( -0.183 0.473 0.217) 0.552 29.794 ( 4.586 3.188 1.424) 5.764 29.894 ( -3.147 1.793 -0.479) 3.654 30.970 ( 0.433 1.955 -0.481) 2.059 31.057 ( 0.552 1.780 0.512) 1.933 31.443 ( 0.889 -4.567 1.189) 4.803 31.589 ( -0.941 -0.988 -1.249) 1.850 31.716 ( 2.649 -2.708 -1.438) 4.052 31.789 ( -2.669 0.209 1.679) 3.160 31.981 ( -0.119 -5.782 -1.540) 5.985 32.285 ( 4.155 0.884 1.950) 4.674 32.483 ( 0.674 2.827 -1.138) 3.121 32.506 ( -3.166 3.512 -0.389) 4.745 32.653 ( 4.951 -3.160 1.453) 6.051 33.006 ( -5.409 4.412 -0.998) 7.051 34.434 ( 0.186 2.201 -1.053) 2.447 34.520 ( -0.611 -2.203 1.063) 2.521 34.881 ( 1.865 -12.214 0.729) 12.377 35.157 ( -8.013 2.379 -0.646) 8.384 35.773 ( 2.564 6.587 0.060) 7.068 36.165 ( -0.294 12.164 -0.822) 12.195 36.446 ( 16.073 -4.090 0.903) 16.610 36.926 ( -12.846 1.929 -0.039) 12.991 ======================= Grid point 25 (19/95) ======================= q-point: (-0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 95 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.455 ( 0.000 19.648 -0.000) 19.648 1.689 ( 0.000 22.474 -0.000) 22.474 1.943 ( 0.000 10.744 -0.000) 10.744 2.378 ( 0.000 0.607 -0.000) 0.607 2.432 ( 0.000 10.746 -0.000) 10.746 2.645 ( -0.000 -15.785 0.000) 15.785 2.797 ( 0.000 1.287 -0.000) 1.287 2.977 ( 0.000 12.334 -0.000) 12.334 3.095 ( 0.000 0.010 -0.000) 0.010 3.149 ( 0.000 8.697 -0.000) 8.697 3.215 ( -0.000 -0.319 0.000) 0.319 3.580 ( -0.000 -2.836 0.000) 2.836 3.641 ( 0.000 5.990 -0.000) 5.990 3.733 ( -0.000 -5.458 0.000) 5.458 3.948 ( 0.000 0.374 -0.000) 0.374 4.019 ( 0.000 3.117 -0.000) 3.117 4.151 ( -0.000 -4.739 0.000) 4.739 4.224 ( 0.000 3.016 -0.000) 3.016 4.345 ( 0.000 3.537 -0.000) 3.537 4.483 ( -0.000 -4.354 0.000) 4.354 4.490 ( 0.000 0.651 -0.000) 0.651 4.563 ( 0.000 2.000 -0.000) 2.000 4.564 ( 0.000 6.923 -0.000) 6.923 4.882 ( -0.000 -0.381 0.000) 0.381 4.934 ( 0.000 5.690 -0.000) 5.690 5.007 ( -0.000 -9.357 0.000) 9.357 5.191 ( 0.000 9.602 -0.000) 9.602 5.341 ( -0.000 -6.364 0.000) 6.364 5.417 ( 0.000 6.043 -0.000) 6.043 5.758 ( -0.000 -4.565 0.000) 4.565 5.933 ( -0.000 -6.872 0.000) 6.872 5.962 ( -0.000 -4.191 0.000) 4.191 6.168 ( -0.000 -9.375 0.000) 9.375 6.306 ( -0.000 -9.131 0.000) 9.131 7.269 ( -0.000 -2.438 0.000) 2.438 7.428 ( 0.000 6.799 -0.000) 6.799 7.566 ( -0.000 -5.107 0.000) 5.107 7.705 ( 0.000 4.096 -0.000) 4.096 7.844 ( -0.000 -6.295 0.000) 6.295 8.010 ( -0.000 -10.209 0.000) 10.209 8.233 ( 0.000 12.342 -0.000) 12.342 8.361 ( -0.000 -4.246 0.000) 4.246 8.603 ( -0.000 -11.166 0.000) 11.166 8.714 ( 0.000 2.629 -0.000) 2.629 8.767 ( 0.000 5.470 -0.000) 5.470 8.839 ( 0.000 3.815 -0.000) 3.815 9.187 ( -0.000 -5.237 0.000) 5.237 9.455 ( -0.000 -5.695 0.000) 5.695 9.875 ( -0.000 -7.905 0.000) 7.905 10.013 ( -0.000 -1.902 0.000) 1.902 10.169 ( -0.000 -1.944 0.000) 1.944 10.451 ( 0.000 0.794 -0.000) 0.794 10.800 ( -0.000 -1.065 0.000) 1.065 11.019 ( 0.000 1.502 -0.000) 1.502 11.208 ( 0.000 6.825 -0.000) 6.825 11.230 ( 0.000 8.394 -0.000) 8.394 11.884 ( -0.000 -4.006 0.000) 4.006 11.955 ( -0.000 -3.465 0.000) 3.465 12.710 ( -0.000 -2.797 0.000) 2.797 12.866 ( 0.000 0.293 -0.000) 0.293 12.907 ( -0.000 -2.097 0.000) 2.097 13.183 ( -0.000 -3.619 0.000) 3.619 13.606 ( 0.000 0.286 -0.000) 0.286 13.657 ( 0.000 1.676 -0.000) 1.676 13.735 ( 0.000 2.053 -0.000) 2.053 14.007 ( -0.000 -3.247 0.000) 3.247 14.674 ( 0.000 8.806 -0.000) 8.806 14.831 ( -0.000 -1.685 0.000) 1.685 14.879 ( 0.000 6.598 -0.000) 6.598 14.972 ( 0.000 5.779 -0.000) 5.779 15.162 ( 0.000 10.826 -0.000) 10.826 15.382 ( 0.000 3.698 -0.000) 3.698 15.559 ( 0.000 8.984 -0.000) 8.984 15.585 ( 0.000 4.714 -0.000) 4.714 16.477 ( 0.000 2.076 -0.000) 2.076 16.669 ( -0.000 -1.700 0.000) 1.700 16.839 ( 0.000 1.112 -0.000) 1.112 16.885 ( -0.000 -1.537 0.000) 1.537 16.972 ( 0.000 0.149 -0.000) 0.149 17.115 ( 0.000 2.528 -0.000) 2.528 17.125 ( -0.000 -0.042 0.000) 0.042 17.169 ( -0.000 -3.775 0.000) 3.775 19.677 ( 0.000 2.928 -0.000) 2.928 19.908 ( 0.000 4.464 -0.000) 4.464 21.253 ( -0.000 -6.167 0.000) 6.167 21.414 ( -0.000 -4.201 0.000) 4.201 22.904 ( -0.000 -5.187 0.000) 5.187 23.301 ( -0.000 -1.574 0.000) 1.574 27.794 ( 0.000 2.789 -0.000) 2.789 27.949 ( -0.000 -3.542 0.000) 3.542 29.414 ( 0.000 4.226 -0.000) 4.226 29.642 ( 0.000 2.572 -0.000) 2.572 29.771 ( 0.000 1.788 -0.000) 1.788 29.873 ( -0.000 -1.043 0.000) 1.043 30.934 ( 0.000 2.577 -0.000) 2.577 31.032 ( 0.000 1.347 -0.000) 1.347 31.486 ( -0.000 -0.687 0.000) 0.687 31.565 ( 0.000 3.850 -0.000) 3.850 31.783 ( -0.000 -4.410 0.000) 4.410 31.819 ( -0.000 -4.475 0.000) 4.475 32.073 ( -0.000 -4.803 0.000) 4.803 32.270 ( 0.000 2.906 -0.000) 2.906 32.405 ( 0.000 4.899 -0.000) 4.899 32.434 ( 0.000 3.765 -0.000) 3.765 32.822 ( -0.000 -10.224 0.000) 10.224 32.848 ( 0.000 8.748 -0.000) 8.748 34.389 ( 0.000 2.828 -0.000) 2.828 34.566 ( -0.000 -3.263 0.000) 3.263 35.016 ( 0.000 8.138 -0.000) 8.138 35.101 ( -0.000 -10.855 0.000) 10.855 35.710 ( 0.000 2.977 -0.000) 2.977 35.979 ( 0.000 8.724 -0.000) 8.724 36.708 ( -0.000 -13.962 0.000) 13.962 36.811 ( 0.000 0.718 -0.000) 0.718 ======================= Grid point 30 (20/95) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 95 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.094 ( 9.621 0.000 2.787) 10.016 1.251 ( 15.006 0.000 -0.019) 15.006 2.081 ( 4.495 0.000 4.432) 6.313 2.084 ( 3.651 0.000 -2.273) 4.301 2.686 ( 17.179 0.000 9.166) 19.472 2.812 ( -0.976 -0.000 -12.098) 12.137 2.846 ( -0.983 -0.000 1.017) 1.414 2.963 ( 0.425 0.000 2.815) 2.847 3.253 ( 4.519 0.000 3.204) 5.540 3.376 ( 1.768 0.000 2.000) 2.670 3.433 ( 6.525 0.000 1.421) 6.678 3.455 ( -1.527 -0.000 8.587) 8.722 3.578 ( -0.701 -0.000 -5.773) 5.815 3.582 ( -4.709 -0.000 -3.584) 5.918 3.782 ( -0.690 -0.000 1.005) 1.219 3.913 ( -6.470 -0.000 -9.925) 11.847 4.078 ( 1.580 0.000 -2.787) 3.204 4.234 ( 2.301 0.000 -3.129) 3.884 4.286 ( 10.110 0.000 5.077) 11.313 4.334 ( 8.151 0.000 -0.957) 8.207 4.573 ( 5.487 0.000 1.110) 5.598 4.608 ( -2.733 -0.000 -2.370) 3.618 4.750 ( 1.270 0.000 3.142) 3.389 4.791 ( -0.766 -0.000 4.551) 4.615 4.864 ( 6.525 0.000 -8.062) 10.372 5.045 ( -1.026 -0.000 3.431) 3.581 5.247 ( 0.505 0.000 -4.161) 4.192 5.310 ( -2.530 -0.000 -1.148) 2.778 5.559 ( -3.761 -0.000 -0.436) 3.786 5.609 ( 0.564 0.000 0.182) 0.592 5.757 ( -4.302 -0.000 -0.930) 4.401 5.793 ( 1.516 0.000 1.790) 2.346 5.928 ( -6.514 -0.000 0.561) 6.538 6.006 ( -15.075 -0.000 0.355) 15.079 6.952 ( -8.904 -0.000 -6.704) 11.146 7.423 ( -0.098 -0.000 0.118) 0.154 7.596 ( 0.549 0.000 -0.356) 0.654 7.710 ( -0.943 -0.000 9.345) 9.392 7.783 ( -4.877 -0.000 2.043) 5.288 7.830 ( -1.224 -0.000 2.442) 2.732 8.172 ( -2.040 -0.000 0.862) 2.214 8.331 ( 0.345 0.000 -3.441) 3.458 8.786 ( -0.119 -0.000 -2.281) 2.285 8.928 ( 7.538 0.000 0.028) 7.538 8.988 ( 0.262 0.000 3.509) 3.518 9.156 ( -0.448 -0.000 5.723) 5.741 9.289 ( -0.440 -0.000 -3.420) 3.449 9.471 ( -8.725 -0.000 -0.576) 8.744 9.720 ( -8.033 -0.000 -2.192) 8.327 9.853 ( -4.569 -0.000 6.057) 7.588 10.087 ( -1.711 -0.000 -5.536) 5.794 10.601 ( 3.325 0.000 0.141) 3.328 10.788 ( -0.272 -0.000 0.090) 0.287 10.809 ( 3.202 0.000 1.647) 3.601 11.443 ( 9.691 0.000 3.921) 10.454 11.464 ( 9.593 0.000 -4.331) 10.525 11.870 ( -5.143 -0.000 -1.499) 5.357 11.891 ( -6.233 -0.000 1.567) 6.427 12.768 ( -5.527 -0.000 2.735) 6.167 12.939 ( -3.077 -0.000 -0.333) 3.095 12.963 ( -3.207 -0.000 1.929) 3.742 13.108 ( 0.307 0.000 -5.616) 5.624 13.672 ( 7.567 0.000 -5.498) 9.353 13.688 ( 1.640 0.000 -9.394) 9.536 13.709 ( -2.757 -0.000 10.361) 10.722 14.096 ( -7.938 -0.000 9.329) 12.249 14.769 ( 0.236 0.000 -2.761) 2.771 14.899 ( 12.125 0.000 -4.471) 12.923 14.917 ( 13.819 0.000 1.951) 13.956 14.974 ( 0.228 0.000 0.969) 0.995 15.656 ( 15.114 0.000 -3.177) 15.445 15.782 ( 10.554 0.000 -1.744) 10.697 15.790 ( 6.615 0.000 3.435) 7.454 16.047 ( -8.098 -0.000 1.851) 8.307 16.321 ( -6.604 -0.000 2.409) 7.030 16.599 ( -2.373 -0.000 0.088) 2.375 16.749 ( 1.128 0.000 0.087) 1.131 16.847 ( 1.655 0.000 -1.652) 2.338 16.924 ( -3.690 -0.000 2.197) 4.294 17.044 ( 0.285 0.000 -2.250) 2.268 17.049 ( -3.448 -0.000 -0.402) 3.471 17.159 ( 3.987 0.000 -5.456) 6.757 19.961 ( 11.928 0.000 -4.279) 12.673 20.098 ( 8.675 0.000 3.352) 9.300 21.235 ( -10.795 -0.000 1.882) 10.958 21.363 ( -7.161 -0.000 -1.688) 7.357 22.613 ( -5.492 -0.000 0.712) 5.538 23.010 ( -4.287 -0.000 -1.973) 4.720 27.793 ( -0.199 -0.000 -5.280) 5.283 28.121 ( -4.366 -0.000 5.918) 7.355 29.734 ( 1.218 0.000 4.042) 4.222 29.764 ( 4.715 0.000 -0.309) 4.725 29.810 ( 0.071 0.000 -6.486) 6.486 29.821 ( -0.473 -0.000 1.628) 1.696 31.032 ( 0.345 0.000 0.158) 0.380 31.062 ( 7.783 0.000 -3.841) 8.680 31.150 ( -1.186 -0.000 3.905) 4.082 31.190 ( 0.258 0.000 0.100) 0.277 31.695 ( -3.031 -0.000 -1.099) 3.224 31.912 ( -7.982 -0.000 -0.144) 7.983 31.989 ( 1.457 0.000 -0.211) 1.472 32.137 ( 2.500 0.000 0.021) 2.500 32.447 ( 7.960 0.000 2.408) 8.316 32.495 ( 6.361 0.000 -4.782) 7.958 32.655 ( 3.553 0.000 3.114) 4.725 33.265 ( -5.292 -0.000 -6.001) 8.001 34.309 ( -1.367 -0.000 -1.021) 1.706 34.385 ( 3.720 0.000 -4.462) 5.809 34.586 ( -6.898 -0.000 9.893) 12.060 35.269 ( -8.196 -0.000 1.575) 8.346 36.102 ( 9.741 0.000 1.830) 9.911 36.247 ( 13.329 0.000 -7.936) 15.513 36.917 ( -11.611 -0.000 11.677) 16.467 37.386 ( -6.899 -0.000 -2.373) 7.296 ======================= Grid point 31 (21/95) ======================= q-point: ( 0.44 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.315 ( 4.871 -15.007 1.934) 15.896 1.445 ( 10.924 -8.236 -0.380) 13.686 2.087 ( 2.121 0.260 4.507) 4.988 2.197 ( 0.703 -7.278 -3.501) 8.107 2.662 ( 0.275 7.880 1.389) 8.006 2.824 ( -1.634 0.280 -6.988) 7.182 2.878 ( 11.293 1.146 3.545) 11.892 2.955 ( 1.195 2.282 1.740) 3.108 3.269 ( -1.129 1.373 3.430) 3.863 3.377 ( 2.005 2.002 0.224) 2.842 3.392 ( 1.305 7.033 -0.312) 7.160 3.493 ( 0.934 -1.286 5.803) 6.017 3.577 ( 0.152 -1.118 -2.527) 2.768 3.612 ( -0.999 -4.533 3.879) 6.049 3.807 ( -3.340 -4.046 -1.417) 5.434 3.901 ( -1.917 -8.105 -6.712) 10.696 4.076 ( -1.383 -0.528 -3.962) 4.230 4.245 ( 3.569 0.476 -4.612) 5.851 4.346 ( 3.652 1.331 3.319) 5.111 4.453 ( 2.962 -1.010 -2.703) 4.135 4.528 ( 1.049 2.036 0.908) 2.464 4.630 ( 3.366 -0.981 0.162) 3.509 4.734 ( 1.186 3.526 0.693) 3.784 4.845 ( 2.115 -1.922 6.073) 6.712 4.960 ( 6.042 -3.387 -1.210) 7.031 5.023 ( 1.771 0.929 -1.956) 2.797 5.137 ( 4.802 6.970 -2.229) 8.752 5.296 ( -7.192 0.268 1.549) 7.362 5.575 ( -6.790 0.284 -2.760) 7.335 5.627 ( 1.901 4.026 1.433) 4.678 5.661 ( 1.717 -3.858 -0.339) 4.236 5.810 ( -2.388 0.677 2.296) 3.381 5.872 ( -3.173 -3.632 -3.139) 5.754 6.002 ( -10.147 -7.829 1.217) 12.874 6.908 ( -5.957 -5.607 -4.666) 9.418 7.424 ( 0.328 0.317 -0.991) 1.091 7.522 ( -1.078 4.475 2.388) 5.186 7.746 ( -4.059 0.039 2.371) 4.701 7.806 ( -0.733 -1.492 0.309) 1.691 7.836 ( -0.621 -6.550 5.152) 8.356 8.160 ( -1.053 0.099 0.518) 1.177 8.279 ( 0.916 5.840 -2.514) 6.424 8.799 ( -0.200 -2.486 -2.990) 3.894 8.963 ( -0.330 3.545 2.108) 4.137 8.984 ( 8.000 3.071 0.351) 8.576 9.117 ( -4.374 2.457 2.801) 5.745 9.277 ( -0.095 3.426 -0.516) 3.466 9.392 ( -4.446 -0.756 -0.333) 4.522 9.631 ( -6.543 1.496 -1.814) 6.953 9.855 ( -1.875 -2.381 6.142) 6.849 10.058 ( -2.611 -0.688 -5.682) 6.291 10.597 ( 1.326 2.572 0.784) 2.998 10.767 ( -0.856 1.169 0.230) 1.467 10.893 ( 4.644 -3.680 0.341) 5.935 11.526 ( 7.814 1.403 1.752) 8.130 11.548 ( 8.594 -0.185 -2.648) 8.995 11.803 ( -5.159 1.219 -0.518) 5.326 11.850 ( -5.585 -1.195 1.097) 5.815 12.713 ( -4.728 1.379 2.544) 5.543 12.879 ( 1.314 3.198 -0.046) 3.457 12.953 ( -4.540 -1.554 -0.460) 4.820 13.112 ( -1.013 -0.956 -3.177) 3.469 13.667 ( -1.144 0.457 -2.055) 2.396 13.707 ( 1.738 1.208 1.080) 2.376 13.728 ( 7.216 0.688 -2.889) 7.804 14.035 ( -7.908 1.053 7.441) 10.909 14.757 ( -0.273 0.224 -2.295) 2.322 14.937 ( 7.582 3.406 -1.005) 8.372 14.999 ( 7.372 0.771 -4.880) 8.874 15.057 ( 4.991 -2.171 5.261) 7.570 15.729 ( 8.376 3.882 -1.337) 9.328 15.818 ( 5.195 2.525 -1.518) 5.972 15.888 ( 6.109 -0.021 0.161) 6.111 15.921 ( -3.621 6.635 3.039) 8.147 16.309 ( -2.545 -3.469 1.570) 4.580 16.618 ( -2.251 -4.203 0.605) 4.806 16.746 ( 0.416 1.862 0.398) 1.949 16.848 ( 0.455 -0.346 -0.785) 0.972 16.932 ( -2.103 -2.537 1.906) 3.807 17.008 ( -3.003 0.654 -1.740) 3.532 17.045 ( -0.407 -0.845 -0.392) 1.016 17.182 ( 2.701 -0.448 -3.632) 4.548 20.000 ( 9.861 6.007 -2.350) 11.783 20.173 ( 6.452 1.391 1.907) 6.870 21.130 ( -9.251 1.142 1.781) 9.490 21.299 ( -5.896 -0.618 -1.678) 6.161 22.594 ( -3.626 -2.610 0.535) 4.499 23.012 ( -2.798 -4.705 -1.340) 5.636 27.780 ( -0.263 -0.191 -2.717) 2.737 28.084 ( -3.118 1.715 3.551) 5.027 29.631 ( -0.529 6.710 0.810) 6.780 29.749 ( 1.932 4.434 -0.630) 4.877 29.842 ( 0.089 -3.057 0.672) 3.132 29.910 ( 3.171 -3.812 -1.600) 5.210 31.023 ( 2.670 0.996 -0.324) 2.868 31.129 ( 0.452 1.711 2.105) 2.750 31.178 ( 2.934 -4.834 -1.755) 5.921 31.230 ( -0.952 -4.957 0.224) 5.053 31.694 ( -1.751 -2.955 -0.343) 3.452 31.829 ( -6.272 1.186 -0.390) 6.395 31.970 ( 0.654 3.034 -0.671) 3.176 32.168 ( 1.972 -0.947 0.750) 2.313 32.526 ( 6.280 0.385 1.319) 6.429 32.538 ( 5.344 -0.505 -4.537) 7.029 32.688 ( 1.380 0.505 4.013) 4.273 33.187 ( -5.419 1.172 -4.244) 6.982 34.340 ( -0.194 -4.954 -0.721) 5.010 34.417 ( 3.318 -1.108 -4.237) 5.495 34.547 ( -5.646 0.557 7.646) 9.521 35.213 ( -6.824 -1.197 0.706) 6.964 36.151 ( 6.747 4.858 1.275) 8.412 36.332 ( 12.694 1.583 -6.256) 14.240 36.765 ( -7.004 8.565 8.142) 13.738 37.290 ( -7.245 3.747 -1.482) 8.290 ======================= Grid point 32 (22/95) ======================= q-point: ( 0.56 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.616 ( 0.617 -16.121 0.523) 16.141 1.713 ( 6.178 -13.786 1.093) 15.146 2.118 ( 0.965 0.542 3.221) 3.406 2.323 ( -0.379 -9.721 -5.509) 11.180 2.540 ( 6.277 10.616 3.184) 12.737 2.736 ( -9.151 1.963 -6.214) 11.235 2.924 ( 3.277 5.486 0.664) 6.425 2.980 ( 9.069 0.773 1.587) 9.239 3.157 ( -2.902 6.844 3.194) 8.091 3.303 ( -1.350 0.309 -0.131) 1.391 3.410 ( 3.289 1.169 0.777) 3.576 3.503 ( -1.212 1.115 1.948) 2.550 3.559 ( -0.685 1.822 -1.580) 2.507 3.726 ( -0.287 -8.199 2.732) 8.647 3.890 ( -1.327 -8.612 -0.690) 8.741 4.014 ( -0.909 -3.079 2.014) 3.790 4.058 ( -1.098 -3.630 -6.265) 7.323 4.250 ( 3.860 2.673 -1.998) 5.103 4.333 ( -2.566 2.561 3.463) 5.013 4.379 ( -4.552 0.694 -2.981) 5.485 4.558 ( 3.101 3.463 3.392) 5.755 4.666 ( 0.746 -0.234 -2.708) 2.818 4.715 ( 2.607 -2.673 -1.050) 3.878 4.893 ( 1.923 0.291 4.295) 4.715 4.956 ( -1.062 5.285 -1.420) 5.574 5.065 ( 3.144 -0.215 -4.428) 5.435 5.112 ( 3.451 3.603 2.651) 5.650 5.291 ( 3.732 -4.611 1.051) 6.024 5.465 ( -6.030 -0.222 -1.381) 6.190 5.643 ( 2.536 1.509 1.834) 3.474 5.747 ( 2.143 -4.756 -3.300) 6.172 5.811 ( -2.288 -2.890 3.516) 5.094 5.881 ( -2.638 -1.111 -2.736) 3.960 6.036 ( -7.158 -5.596 1.223) 9.168 6.998 ( -1.975 -10.276 -2.600) 10.782 7.377 ( -0.044 3.944 0.103) 3.945 7.529 ( 0.516 -4.267 0.801) 4.372 7.710 ( -2.264 1.683 1.795) 3.344 7.791 ( -0.163 0.422 -1.141) 1.228 8.001 ( 0.194 -10.235 3.129) 10.704 8.123 ( 0.546 7.625 -0.351) 7.653 8.178 ( -1.745 1.275 -0.652) 2.257 8.827 ( 2.994 3.795 -3.322) 5.865 8.876 ( -3.673 1.007 2.311) 4.455 8.993 ( 5.936 4.215 0.029) 7.280 9.044 ( -1.390 3.289 0.386) 3.592 9.146 ( -5.907 6.603 0.864) 8.901 9.411 ( 1.578 -0.526 -0.007) 1.663 9.566 ( -3.963 -1.355 -1.160) 4.346 9.926 ( 1.956 -3.385 6.155) 7.292 10.028 ( -3.113 -1.073 -5.947) 6.798 10.559 ( 0.455 3.149 0.878) 3.301 10.745 ( -1.124 0.003 -0.189) 1.140 10.991 ( 3.534 -2.811 0.111) 4.517 11.537 ( 3.241 4.602 1.413) 5.803 11.582 ( 4.809 3.886 -2.509) 6.672 11.752 ( -3.630 -0.961 -0.059) 3.755 11.838 ( -3.126 -2.386 0.903) 4.035 12.665 ( -1.770 0.946 1.388) 2.440 12.861 ( 2.930 1.754 -0.214) 3.421 12.954 ( 0.380 -1.875 -0.981) 2.150 13.074 ( -5.858 1.027 -0.665) 5.984 13.644 ( -1.162 0.796 1.724) 2.226 13.705 ( 1.185 0.633 -0.960) 1.651 13.778 ( 7.948 1.035 -3.664) 8.813 13.959 ( -7.197 1.228 4.549) 8.603 14.751 ( 0.033 -0.317 -1.065) 1.112 14.947 ( 7.246 3.862 -1.085) 8.283 15.029 ( 3.795 0.208 -3.992) 5.512 15.110 ( 0.486 0.775 4.875) 4.960 15.691 ( 3.648 7.150 -0.023) 8.027 15.726 ( -2.910 8.298 -0.026) 8.794 15.825 ( 1.853 4.073 -1.037) 4.593 15.914 ( 2.686 3.715 1.342) 4.777 16.390 ( 0.272 -6.646 0.724) 6.691 16.681 ( -0.475 -3.048 1.055) 3.260 16.696 ( -1.018 2.240 -0.508) 2.512 16.882 ( 0.112 -3.633 -0.437) 3.661 16.943 ( -1.012 0.673 1.307) 1.785 16.979 ( -1.666 -0.888 -1.606) 2.479 17.066 ( -0.406 -2.186 0.539) 2.288 17.197 ( 1.190 0.137 -1.712) 2.089 19.945 ( 4.525 7.968 -0.662) 9.187 20.171 ( 2.884 4.552 0.578) 5.419 21.060 ( -4.395 -0.663 0.888) 4.532 21.271 ( -2.894 -1.621 -0.898) 3.436 22.631 ( -1.890 -4.806 0.263) 5.171 23.089 ( -0.991 -6.444 -0.533) 6.542 27.783 ( -0.079 -1.056 -0.874) 1.373 28.028 ( -1.334 3.266 1.237) 3.739 29.543 ( -0.336 3.535 0.055) 3.551 29.700 ( 0.709 2.579 -0.298) 2.692 29.877 ( 2.013 0.169 1.397) 2.456 29.956 ( 0.277 0.241 -1.326) 1.376 31.029 ( 1.778 1.275 -0.279) 2.206 31.114 ( 0.702 1.597 0.933) 1.978 31.254 ( 0.134 -4.632 1.302) 4.813 31.347 ( -0.829 -8.853 -1.985) 9.111 31.741 ( -2.237 -2.399 -0.090) 3.281 31.779 ( 0.144 -1.167 0.544) 1.295 31.907 ( -0.817 3.911 -1.326) 4.210 32.218 ( 1.891 -2.849 1.105) 3.593 32.552 ( 2.671 1.367 -0.337) 3.019 32.567 ( 2.490 1.195 -2.556) 3.763 32.681 ( -0.108 2.041 2.825) 3.487 33.114 ( -3.061 1.642 -1.826) 3.924 34.439 ( 3.135 -2.876 -3.365) 5.424 34.478 ( 0.113 -8.114 -0.778) 8.152 34.507 ( -4.142 0.849 5.312) 6.789 35.177 ( -4.583 -0.691 0.161) 4.638 36.070 ( 2.263 9.502 0.153) 9.769 36.410 ( 10.772 0.814 -3.420) 11.331 36.585 ( -1.965 10.498 4.507) 11.593 37.118 ( -6.999 7.755 -0.623) 10.465 ======================= Grid point 33 (23/95) ======================= q-point: (-0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 95 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.818 ( -0.000 -5.948 0.000) 5.948 2.004 ( -0.000 -16.144 0.000) 16.144 2.072 ( 0.000 5.005 -0.000) 5.005 2.373 ( 0.000 8.698 -0.000) 8.698 2.512 ( -0.000 -5.418 0.000) 5.418 2.637 ( 0.000 0.169 -0.000) 0.169 2.721 ( 0.000 16.347 -0.000) 16.347 3.029 ( -0.000 -1.036 0.000) 1.036 3.131 ( -0.000 -1.461 0.000) 1.461 3.303 ( 0.000 2.736 -0.000) 2.736 3.436 ( -0.000 -5.005 0.000) 5.005 3.488 ( 0.000 5.494 -0.000) 5.494 3.501 ( -0.000 -1.946 0.000) 1.946 3.823 ( -0.000 -2.372 0.000) 2.372 3.969 ( 0.000 4.739 -0.000) 4.739 4.039 ( -0.000 -6.767 0.000) 6.767 4.114 ( -0.000 -0.755 0.000) 0.755 4.236 ( 0.000 1.428 -0.000) 1.428 4.268 ( -0.000 -2.355 0.000) 2.355 4.374 ( -0.000 -1.453 0.000) 1.453 4.553 ( -0.000 -1.795 0.000) 1.795 4.669 ( 0.000 0.756 -0.000) 0.756 4.738 ( 0.000 11.134 -0.000) 11.134 4.812 ( -0.000 -5.117 0.000) 5.117 4.976 ( 0.000 2.514 -0.000) 2.514 5.054 ( -0.000 -2.440 0.000) 2.440 5.067 ( 0.000 1.615 -0.000) 1.615 5.409 ( 0.000 1.790 -0.000) 1.790 5.490 ( -0.000 -10.266 0.000) 10.266 5.596 ( 0.000 4.830 -0.000) 4.830 5.844 ( -0.000 -0.497 0.000) 0.497 5.848 ( -0.000 -2.749 0.000) 2.749 5.902 ( -0.000 -7.480 0.000) 7.480 6.074 ( -0.000 -4.394 0.000) 4.394 7.151 ( -0.000 -7.940 0.000) 7.940 7.353 ( -0.000 -2.345 0.000) 2.345 7.628 ( -0.000 -6.229 0.000) 6.229 7.649 ( 0.000 4.726 -0.000) 4.726 7.803 ( -0.000 -2.429 0.000) 2.429 7.957 ( 0.000 10.543 -0.000) 10.543 8.188 ( -0.000 -2.923 0.000) 2.923 8.192 ( -0.000 -11.797 0.000) 11.797 8.674 ( 0.000 11.631 -0.000) 11.631 8.895 ( 0.000 0.233 -0.000) 0.233 8.920 ( 0.000 7.607 -0.000) 7.607 9.007 ( 0.000 5.868 -0.000) 5.868 9.027 ( -0.000 -2.605 0.000) 2.605 9.408 ( 0.000 1.495 -0.000) 1.495 9.613 ( -0.000 -6.318 0.000) 6.318 9.983 ( 0.000 0.361 -0.000) 0.361 10.044 ( -0.000 -5.051 0.000) 5.051 10.512 ( 0.000 2.772 -0.000) 2.772 10.751 ( -0.000 -1.304 0.000) 1.304 11.041 ( -0.000 -0.898 0.000) 0.898 11.451 ( 0.000 7.043 -0.000) 7.043 11.499 ( 0.000 7.293 -0.000) 7.293 11.771 ( -0.000 -2.772 0.000) 2.772 11.870 ( -0.000 -2.471 0.000) 2.471 12.656 ( -0.000 -0.369 0.000) 0.369 12.867 ( -0.000 -0.224 0.000) 0.224 12.959 ( 0.000 4.525 -0.000) 4.525 13.040 ( -0.000 -4.578 0.000) 4.578 13.629 ( 0.000 0.824 -0.000) 0.824 13.699 ( 0.000 0.688 -0.000) 0.688 13.798 ( 0.000 1.704 -0.000) 1.704 13.916 ( -0.000 -0.849 0.000) 0.849 14.764 ( -0.000 -1.368 0.000) 1.368 14.911 ( 0.000 5.404 -0.000) 5.404 15.054 ( -0.000 -0.880 0.000) 0.880 15.069 ( 0.000 4.371 -0.000) 4.371 15.539 ( 0.000 10.848 -0.000) 10.848 15.587 ( 0.000 7.975 -0.000) 7.975 15.754 ( 0.000 4.995 -0.000) 4.995 15.836 ( 0.000 6.924 -0.000) 6.924 16.514 ( -0.000 -7.151 0.000) 7.151 16.609 ( 0.000 5.030 -0.000) 5.030 16.760 ( -0.000 -4.277 0.000) 4.277 16.916 ( 0.000 1.663 -0.000) 1.663 16.957 ( -0.000 -4.192 0.000) 4.192 16.985 ( -0.000 -1.712 0.000) 1.712 17.107 ( -0.000 -2.415 0.000) 2.415 17.187 ( 0.000 1.365 -0.000) 1.365 19.835 ( 0.000 6.984 -0.000) 6.984 20.093 ( 0.000 6.032 -0.000) 6.032 21.079 ( -0.000 -3.525 0.000) 3.525 21.294 ( -0.000 -2.766 0.000) 2.766 22.714 ( -0.000 -5.943 0.000) 5.943 23.186 ( -0.000 -5.427 0.000) 5.427 27.806 ( -0.000 -1.742 0.000) 1.742 27.963 ( 0.000 3.764 -0.000) 3.764 29.501 ( 0.000 1.750 -0.000) 1.750 29.675 ( 0.000 0.938 -0.000) 0.938 29.886 ( 0.000 0.996 -0.000) 0.996 29.905 ( 0.000 4.334 -0.000) 4.334 31.007 ( 0.000 2.079 -0.000) 2.079 31.090 ( 0.000 1.777 -0.000) 1.777 31.356 ( -0.000 -6.506 0.000) 6.506 31.480 ( -0.000 -8.110 0.000) 8.110 31.729 ( 0.000 0.679 -0.000) 0.679 31.822 ( 0.000 4.355 -0.000) 4.355 31.870 ( -0.000 -6.403 0.000) 6.403 32.291 ( -0.000 -3.416 0.000) 3.416 32.527 ( 0.000 2.478 -0.000) 2.478 32.539 ( 0.000 2.544 -0.000) 2.544 32.652 ( 0.000 1.192 -0.000) 1.192 33.057 ( 0.000 3.522 -0.000) 3.522 34.468 ( 0.000 1.760 -0.000) 1.760 34.484 ( -0.000 -1.777 0.000) 1.777 34.666 ( -0.000 -13.156 0.000) 13.156 35.152 ( 0.000 0.915 -0.000) 0.915 35.917 ( 0.000 9.329 -0.000) 9.329 36.385 ( 0.000 13.207 -0.000) 13.207 36.475 ( -0.000 -1.894 0.000) 1.894 36.943 ( 0.000 7.340 -0.000) 7.340 ======================= Grid point 40 (24/95) ======================= q-point: ( 0.44 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 95 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.230 ( 3.495 0.000 0.915) 3.613 1.451 ( 5.894 0.000 -0.933) 5.967 2.112 ( 0.745 0.000 -1.047) 1.285 2.131 ( -0.275 -0.000 2.650) 2.664 2.672 ( -3.226 -0.000 -2.107) 3.853 2.848 ( -0.275 -0.000 0.945) 0.984 2.976 ( 5.649 0.000 -1.075) 5.751 2.994 ( 1.839 0.000 3.583) 4.028 3.268 ( 1.033 0.000 -1.054) 1.476 3.368 ( -1.973 -0.000 1.587) 2.532 3.494 ( 0.192 0.000 3.849) 3.854 3.520 ( -0.207 -0.000 0.116) 0.237 3.540 ( -0.990 -0.000 -0.902) 1.339 3.642 ( 7.999 0.000 5.624) 9.779 3.723 ( -6.201 -0.000 -6.780) 9.188 3.777 ( -0.348 -0.000 -2.184) 2.211 4.039 ( -2.498 -0.000 -3.274) 4.118 4.268 ( 2.620 0.000 -2.776) 3.817 4.357 ( -2.141 -0.000 -2.384) 3.204 4.518 ( -1.617 -0.000 0.491) 1.690 4.552 ( 9.278 0.000 2.887) 9.716 4.653 ( 3.406 0.000 -0.596) 3.458 4.782 ( -1.579 -0.000 2.278) 2.772 4.870 ( 2.021 0.000 4.090) 4.562 4.988 ( 10.702 0.000 -7.205) 12.901 5.039 ( -0.284 -0.000 5.084) 5.092 5.217 ( -0.554 -0.000 -2.763) 2.818 5.218 ( -8.304 -0.000 0.976) 8.361 5.569 ( 2.539 0.000 -0.618) 2.613 5.642 ( 1.262 0.000 1.334) 1.837 5.663 ( -3.118 -0.000 -1.556) 3.485 5.799 ( -6.223 -0.000 0.182) 6.226 5.801 ( 0.327 0.000 -0.997) 1.049 5.856 ( -2.224 -0.000 0.975) 2.429 6.799 ( -3.886 -0.000 -2.144) 4.438 7.413 ( -0.570 -0.000 -0.081) 0.576 7.596 ( -0.121 -0.000 -0.129) 0.177 7.715 ( -2.530 -0.000 0.811) 2.657 7.722 ( -1.101 -0.000 3.180) 3.365 7.823 ( -0.382 -0.000 1.119) 1.182 8.159 ( -0.117 -0.000 0.137) 0.181 8.338 ( 1.087 0.000 -1.561) 1.902 8.766 ( -0.327 -0.000 -1.532) 1.567 8.999 ( 0.097 0.000 1.044) 1.049 9.102 ( 9.822 0.000 -0.019) 9.822 9.105 ( -3.148 -0.000 1.278) 3.398 9.295 ( -9.792 -0.000 0.421) 9.801 9.337 ( 3.052 0.000 -0.521) 3.096 9.599 ( -3.663 -0.000 -0.420) 3.687 9.821 ( -1.738 -0.000 3.498) 3.906 10.021 ( -1.502 -0.000 -3.560) 3.864 10.629 ( 0.209 0.000 0.479) 0.522 10.786 ( -0.000 -0.000 0.057) 0.057 10.886 ( 2.853 0.000 0.161) 2.858 11.612 ( 5.672 0.000 2.133) 6.060 11.623 ( 9.433 0.000 -3.670) 10.122 11.771 ( -7.916 -0.000 2.580) 8.325 11.778 ( -3.585 -0.000 -1.211) 3.784 12.693 ( -2.966 -0.000 1.646) 3.392 12.900 ( -0.799 -0.000 -0.570) 0.982 12.901 ( -2.441 -0.000 0.051) 2.441 13.107 ( 0.882 0.000 -1.686) 1.903 13.659 ( -0.146 -0.000 -2.210) 2.215 13.735 ( 0.034 0.000 2.958) 2.958 13.788 ( 6.968 0.000 -5.226) 8.710 13.991 ( -7.021 -0.000 6.435) 9.524 14.751 ( -0.229 -0.000 -1.383) 1.402 14.982 ( 0.327 0.000 -0.092) 0.340 15.055 ( 5.019 0.000 -1.445) 5.223 15.116 ( 5.384 0.000 1.243) 5.526 15.816 ( 3.978 0.000 -1.956) 4.433 15.890 ( 2.362 0.000 -1.699) 2.910 15.930 ( 4.222 0.000 0.088) 4.223 15.952 ( -2.789 -0.000 3.850) 4.754 16.263 ( -0.713 -0.000 0.704) 1.002 16.560 ( -1.369 -0.000 0.056) 1.370 16.770 ( 0.494 0.000 0.339) 0.599 16.864 ( 0.762 0.000 -0.681) 1.022 16.885 ( -1.452 -0.000 2.758) 3.117 16.983 ( -2.288 -0.000 -1.839) 2.935 17.034 ( -0.243 -0.000 -0.447) 0.508 17.189 ( 1.446 0.000 -1.937) 2.417 20.133 ( 6.718 0.000 -2.241) 7.082 20.240 ( 3.912 0.000 1.796) 4.304 21.067 ( -6.358 -0.000 1.380) 6.506 21.242 ( -3.652 -0.000 -1.151) 3.829 22.550 ( -1.650 -0.000 0.319) 1.680 22.944 ( -1.651 -0.000 -0.810) 1.839 27.769 ( -0.262 -0.000 -1.466) 1.489 28.082 ( -1.843 -0.000 2.052) 2.758 29.721 ( -1.890 -0.000 -0.756) 2.036 29.769 ( 0.750 0.000 1.147) 1.370 29.818 ( -0.424 -0.000 0.888) 0.984 29.886 ( 3.575 0.000 -1.968) 4.081 31.036 ( 0.094 0.000 -0.033) 0.100 31.152 ( -0.391 -0.000 1.738) 1.781 31.175 ( 4.450 0.000 -1.328) 4.644 31.195 ( 0.249 0.000 0.030) 0.251 31.651 ( -1.092 -0.000 -0.434) 1.175 31.777 ( -4.779 -0.000 -0.140) 4.781 32.005 ( 0.352 0.000 -0.132) 0.376 32.176 ( 1.182 0.000 0.338) 1.229 32.549 ( 2.325 0.000 -3.636) 4.316 32.603 ( 5.450 0.000 1.807) 5.742 32.715 ( 0.780 0.000 2.758) 2.867 33.136 ( -4.309 -0.000 -2.714) 5.092 34.293 ( -0.139 -0.000 -0.234) 0.272 34.430 ( 3.198 0.000 -3.859) 5.012 34.522 ( -4.187 -0.000 5.511) 6.921 35.158 ( -3.344 -0.000 0.228) 3.352 36.255 ( 4.441 0.000 1.180) 4.596 36.429 ( 8.680 0.000 -5.476) 10.263 36.773 ( -7.868 -0.000 6.306) 10.083 37.277 ( -2.984 -0.000 -1.159) 3.201 ======================= Grid point 41 (25/95) ======================= q-point: ( 0.56 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 95 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.367 ( -0.000 -13.046 0.000) 13.046 1.551 ( -0.000 -8.504 0.000) 8.504 2.136 ( -0.000 -0.151 0.000) 0.151 2.168 ( -0.000 -6.333 0.000) 6.333 2.658 ( -0.000 -0.345 0.000) 0.345 2.773 ( 0.000 8.071 -0.000) 8.071 2.974 ( 0.000 1.220 -0.000) 1.220 3.031 ( -0.000 -0.606 0.000) 0.606 3.237 ( 0.000 3.373 -0.000) 3.373 3.386 ( 0.000 3.931 -0.000) 3.931 3.416 ( 0.000 2.941 -0.000) 2.941 3.557 ( 0.000 4.806 -0.000) 4.806 3.558 ( -0.000 -1.879 0.000) 1.879 3.585 ( -0.000 -6.643 0.000) 6.643 3.786 ( -0.000 -3.183 0.000) 3.183 3.879 ( -0.000 -11.118 0.000) 11.118 4.020 ( -0.000 -0.048 0.000) 0.048 4.277 ( -0.000 -0.194 0.000) 0.194 4.343 ( -0.000 -0.305 0.000) 0.305 4.440 ( 0.000 6.884 -0.000) 6.884 4.621 ( -0.000 -0.149 0.000) 0.149 4.683 ( -0.000 -0.926 0.000) 0.926 4.721 ( 0.000 4.552 -0.000) 4.552 4.878 ( -0.000 -0.123 0.000) 0.123 5.035 ( -0.000 -0.788 0.000) 0.788 5.081 ( 0.000 1.877 -0.000) 1.877 5.159 ( -0.000 -0.670 0.000) 0.670 5.233 ( -0.000 -3.053 0.000) 3.053 5.467 ( 0.000 6.574 -0.000) 6.574 5.670 ( -0.000 -2.109 0.000) 2.109 5.685 ( -0.000 -0.727 0.000) 0.727 5.777 ( -0.000 -1.150 0.000) 1.150 5.835 ( -0.000 -2.646 0.000) 2.646 5.905 ( -0.000 -6.061 0.000) 6.061 6.835 ( -0.000 -6.733 0.000) 6.733 7.424 ( -0.000 -0.535 0.000) 0.535 7.515 ( 0.000 4.614 -0.000) 4.614 7.709 ( -0.000 -0.355 0.000) 0.355 7.797 ( -0.000 -1.002 0.000) 1.002 7.847 ( -0.000 -7.328 0.000) 7.328 8.153 ( 0.000 0.491 -0.000) 0.491 8.285 ( 0.000 6.409 -0.000) 6.409 8.787 ( -0.000 -2.920 0.000) 2.920 8.962 ( 0.000 4.771 -0.000) 4.771 9.076 ( 0.000 1.895 -0.000) 1.895 9.128 ( 0.000 5.088 -0.000) 5.088 9.187 ( 0.000 3.481 -0.000) 3.481 9.387 ( -0.000 -2.909 0.000) 2.909 9.555 ( 0.000 2.067 -0.000) 2.067 9.865 ( -0.000 -4.846 0.000) 4.846 10.005 ( 0.000 0.441 -0.000) 0.441 10.611 ( 0.000 2.261 -0.000) 2.261 10.758 ( 0.000 2.041 -0.000) 2.041 10.946 ( -0.000 -4.094 0.000) 4.094 11.623 ( 0.000 2.830 -0.000) 2.830 11.674 ( 0.000 2.816 -0.000) 2.816 11.708 ( -0.000 -0.855 0.000) 0.855 11.777 ( -0.000 -2.365 0.000) 2.365 12.673 ( 0.000 0.844 -0.000) 0.844 12.883 ( 0.000 0.662 -0.000) 0.662 12.916 ( -0.000 -2.295 0.000) 2.295 13.090 ( 0.000 2.302 -0.000) 2.302 13.650 ( 0.000 0.483 -0.000) 0.483 13.726 ( 0.000 1.174 -0.000) 1.174 13.823 ( -0.000 -0.294 0.000) 0.294 13.949 ( 0.000 1.491 -0.000) 1.491 14.747 ( 0.000 0.041 -0.000) 0.041 14.997 ( -0.000 -1.461 0.000) 1.461 15.050 ( 0.000 2.908 -0.000) 2.908 15.144 ( 0.000 0.294 -0.000) 0.294 15.800 ( 0.000 3.720 -0.000) 3.720 15.841 ( 0.000 6.168 -0.000) 6.168 15.898 ( 0.000 3.633 -0.000) 3.633 15.965 ( 0.000 0.460 -0.000) 0.460 16.297 ( -0.000 -4.147 0.000) 4.147 16.595 ( -0.000 -4.489 0.000) 4.489 16.752 ( 0.000 2.610 -0.000) 2.610 16.847 ( -0.000 -0.232 0.000) 0.232 16.929 ( -0.000 -3.056 0.000) 3.056 16.960 ( 0.000 0.878 -0.000) 0.878 17.039 ( -0.000 -0.863 0.000) 0.863 17.198 ( -0.000 -0.374 0.000) 0.374 20.099 ( 0.000 6.837 -0.000) 6.837 20.246 ( 0.000 2.234 -0.000) 2.234 21.034 ( 0.000 0.202 -0.000) 0.202 21.232 ( -0.000 -1.053 0.000) 1.053 22.562 ( -0.000 -2.422 0.000) 2.422 22.981 ( -0.000 -5.159 0.000) 5.159 27.769 ( -0.000 -0.433 0.000) 0.433 28.063 ( 0.000 1.568 -0.000) 1.568 29.623 ( 0.000 6.121 -0.000) 6.121 29.762 ( 0.000 4.293 -0.000) 4.293 29.846 ( -0.000 -4.276 0.000) 4.276 29.943 ( -0.000 -2.607 0.000) 2.607 31.044 ( -0.000 -0.402 0.000) 0.402 31.142 ( 0.000 1.128 -0.000) 1.128 31.203 ( -0.000 -1.689 0.000) 1.689 31.233 ( -0.000 -4.302 0.000) 4.302 31.674 ( -0.000 -3.241 0.000) 3.241 31.758 ( -0.000 -0.549 0.000) 0.549 31.975 ( 0.000 3.545 -0.000) 3.545 32.192 ( -0.000 -1.253 0.000) 1.253 32.561 ( -0.000 -0.586 0.000) 0.586 32.617 ( 0.000 1.882 -0.000) 1.882 32.713 ( 0.000 1.158 -0.000) 1.158 33.108 ( 0.000 0.308 -0.000) 0.308 34.337 ( -0.000 -5.372 0.000) 5.372 34.447 ( -0.000 -0.721 0.000) 0.721 34.505 ( 0.000 0.516 -0.000) 0.516 35.147 ( -0.000 -0.480 0.000) 0.480 36.221 ( 0.000 6.544 -0.000) 6.544 36.465 ( 0.000 0.124 -0.000) 0.124 36.700 ( 0.000 4.973 -0.000) 4.973 37.209 ( 0.000 5.949 -0.000) 5.949 ======================= Grid point 83 (26/95) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.597 ( 12.844 0.000 28.707) 31.449 0.618 ( -3.097 -0.000 30.141) 30.299 1.283 ( -14.137 -0.000 57.790) 59.494 1.627 ( -11.866 -0.000 -19.757) 23.046 1.736 ( 2.687 0.000 -18.874) 19.065 2.593 ( 12.352 0.000 14.253) 18.861 2.651 ( 0.292 0.000 -5.865) 5.872 2.976 ( -3.267 -0.000 1.522) 3.604 3.044 ( -3.833 -0.000 7.488) 8.412 3.286 ( -1.871 -0.000 6.163) 6.441 3.310 ( -6.496 -0.000 0.247) 6.501 3.457 ( -1.456 -0.000 2.831) 3.184 3.607 ( 3.801 0.000 -15.293) 15.758 3.650 ( -3.990 -0.000 1.854) 4.400 3.665 ( 6.076 0.000 -12.770) 14.142 3.852 ( 4.950 0.000 -3.979) 6.351 3.990 ( -3.752 -0.000 -4.083) 5.546 4.099 ( 6.567 0.000 4.112) 7.748 4.200 ( 4.034 0.000 -4.810) 6.277 4.340 ( -1.420 -0.000 -4.280) 4.509 4.498 ( -3.047 -0.000 6.912) 7.554 4.571 ( -2.510 -0.000 -1.476) 2.912 4.622 ( 1.671 0.000 -4.875) 5.153 4.781 ( 8.652 0.000 -2.318) 8.957 4.800 ( 1.121 0.000 -9.530) 9.595 4.878 ( 2.750 0.000 -9.186) 9.589 5.072 ( -12.996 -0.000 13.740) 18.912 5.330 ( 4.077 0.000 6.975) 8.079 5.426 ( -0.133 -0.000 3.072) 3.075 5.641 ( 4.048 0.000 -6.549) 7.699 6.059 ( 0.257 0.000 2.142) 2.157 6.131 ( 2.417 0.000 -1.714) 2.963 6.315 ( -3.914 -0.000 6.328) 7.441 6.579 ( 0.408 0.000 -4.277) 4.297 7.375 ( 6.269 0.000 0.085) 6.269 7.402 ( -6.466 -0.000 -2.160) 6.817 7.563 ( 0.003 0.000 3.953) 3.953 7.707 ( -0.216 -0.000 -2.577) 2.586 8.066 ( -2.518 -0.000 3.978) 4.708 8.339 ( 0.693 0.000 -7.020) 7.054 8.497 ( -5.387 -0.000 6.128) 8.160 8.577 ( 6.686 0.000 7.531) 10.071 8.682 ( -7.447 -0.000 0.815) 7.491 8.856 ( 5.132 0.000 -5.948) 7.856 8.946 ( -0.714 -0.000 5.137) 5.186 9.226 ( 4.393 0.000 -4.077) 5.993 9.584 ( -0.873 -0.000 1.440) 1.684 9.716 ( 0.825 0.000 -4.158) 4.239 10.016 ( 1.528 0.000 -0.160) 1.536 10.111 ( -1.245 -0.000 -2.687) 2.962 10.173 ( -5.420 -0.000 5.070) 7.422 10.373 ( 0.902 0.000 -3.341) 3.461 10.774 ( -2.550 -0.000 -0.658) 2.633 10.866 ( 7.709 0.000 -4.591) 8.972 10.902 ( 8.711 0.000 4.376) 9.749 11.011 ( -7.973 -0.000 0.181) 7.975 12.148 ( 1.785 0.000 1.949) 2.643 12.209 ( 0.043 0.000 -0.596) 0.597 12.913 ( -0.875 -0.000 -0.080) 0.879 12.956 ( -0.433 -0.000 -3.007) 3.038 13.162 ( 0.608 0.000 6.307) 6.336 13.429 ( 5.744 0.000 -5.949) 8.269 13.538 ( -2.328 -0.000 2.891) 3.712 13.622 ( 7.325 0.000 0.501) 7.342 13.880 ( -55.907 -0.000 1.057) 55.917 13.943 ( 8.601 0.000 -1.382) 8.712 14.271 ( 0.465 0.000 0.604) 0.763 14.311 ( -0.992 -0.000 -0.915) 1.350 14.719 ( 22.344 0.000 0.713) 22.356 14.802 ( 1.429 0.000 -2.911) 3.243 15.121 ( -2.435 -0.000 2.446) 3.451 15.168 ( -2.715 -0.000 3.848) 4.709 15.285 ( -3.333 -0.000 -0.928) 3.460 15.394 ( 6.241 0.000 -2.551) 6.742 16.617 ( 3.864 0.000 -2.117) 4.406 16.640 ( -2.789 -0.000 -2.046) 3.459 16.742 ( 2.170 0.000 2.514) 3.321 16.797 ( -6.362 -0.000 2.501) 6.836 16.943 ( 3.086 0.000 -0.601) 3.144 16.989 ( 0.438 0.000 -0.961) 1.056 17.238 ( 0.551 0.000 3.574) 3.616 17.428 ( -15.455 -0.000 -3.866) 15.931 19.615 ( -1.741 -0.000 1.618) 2.376 19.688 ( 1.433 0.000 -1.212) 1.877 21.517 ( -1.799 -0.000 1.067) 2.092 21.583 ( 0.791 0.000 -1.514) 1.708 23.019 ( -0.236 -0.000 3.696) 3.704 23.203 ( 0.143 0.000 -3.420) 3.423 28.130 ( -45.306 -0.000 0.695) 45.312 28.160 ( 8.398 0.000 -0.472) 8.411 29.427 ( -6.377 -0.000 2.553) 6.869 29.590 ( 22.015 0.000 -4.279) 22.427 29.827 ( 0.178 0.000 3.479) 3.483 29.976 ( 0.013 0.000 -2.707) 2.707 30.842 ( -13.705 -0.000 4.176) 14.327 31.018 ( 1.717 0.000 -0.302) 1.744 31.104 ( 2.669 0.000 -2.672) 3.777 31.158 ( 0.535 0.000 -2.270) 2.332 31.833 ( -0.013 -0.000 1.841) 1.841 31.880 ( -2.171 -0.000 0.795) 2.312 32.050 ( 1.681 0.000 1.494) 2.249 32.174 ( 0.379 0.000 -2.385) 2.415 32.248 ( -1.811 -0.000 0.898) 2.021 32.255 ( 0.108 0.000 0.282) 0.302 32.330 ( 26.301 0.000 0.632) 26.308 32.376 ( -3.096 -0.000 -1.187) 3.316 34.328 ( 0.647 0.000 1.409) 1.551 34.426 ( -0.834 -0.000 -2.455) 2.593 35.425 ( 4.624 0.000 3.155) 5.598 35.549 ( -18.934 -0.000 -1.514) 18.995 35.812 ( 2.767 0.000 0.360) 2.790 35.861 ( -1.330 -0.000 -1.289) 1.852 37.725 ( 21.313 0.000 0.774) 21.327 37.764 ( -1.463 -0.000 -0.713) 1.627 ======================= Grid point 84 (27/95) ======================= q-point: ( 0.11 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.892 ( 9.314 -16.748 21.158) 28.547 0.987 ( 21.578 -10.078 23.405) 33.391 1.442 ( -4.455 -10.152 42.930) 44.338 1.549 ( 1.076 -4.778 -18.313) 18.957 1.809 ( 4.629 -11.284 -13.057) 17.868 2.651 ( 3.778 0.785 -4.203) 5.706 2.736 ( 9.296 2.638 10.476) 14.252 2.928 ( -0.278 1.635 -0.160) 1.666 3.105 ( -0.732 -5.974 6.283) 8.701 3.259 ( -4.097 -0.598 3.289) 5.288 3.332 ( 1.608 -3.227 -0.475) 3.637 3.471 ( 2.503 0.835 2.332) 3.522 3.537 ( 2.345 1.933 -14.248) 14.569 3.681 ( 0.278 -3.134 -5.140) 6.027 3.722 ( 3.741 -2.375 -0.266) 4.439 3.894 ( 1.196 -1.742 -3.697) 4.258 3.990 ( -1.503 -4.977 -5.807) 7.794 4.126 ( 3.223 3.491 1.515) 4.987 4.268 ( 2.277 -3.366 -1.150) 4.224 4.311 ( 0.005 -1.019 -5.027) 5.129 4.469 ( -1.976 1.471 3.364) 4.169 4.535 ( -3.473 2.940 1.488) 4.787 4.608 ( -1.111 -2.791 -5.881) 6.604 4.746 ( 1.879 1.590 -2.309) 3.375 4.818 ( 4.085 0.159 -5.173) 6.594 4.930 ( -0.675 -1.444 6.123) 6.327 5.099 ( -1.157 -5.703 -5.896) 8.284 5.369 ( 3.897 2.501 6.764) 8.197 5.495 ( 3.287 -1.932 -3.429) 5.128 5.759 ( 1.669 -9.710 -14.725) 17.717 6.000 ( -4.830 3.562 2.491) 6.498 6.113 ( -3.595 0.870 -2.090) 4.248 6.288 ( -6.868 -0.029 4.663) 8.301 6.553 ( -1.733 0.470 -3.801) 4.203 7.314 ( -5.433 1.912 -2.512) 6.284 7.442 ( 4.942 -0.164 0.877) 5.022 7.530 ( -1.260 3.863 4.372) 5.969 7.685 ( -0.289 1.015 -2.679) 2.880 8.018 ( -3.253 2.620 5.890) 7.220 8.273 ( -2.443 4.445 -4.258) 6.622 8.464 ( -7.050 -0.298 7.448) 10.260 8.553 ( -13.601 2.135 9.219) 16.569 8.690 ( 5.070 -1.790 4.707) 7.146 8.892 ( 2.891 -1.238 -5.557) 6.385 8.920 ( 0.927 4.990 4.832) 7.007 8.963 ( -7.393 12.104 6.301) 15.520 9.525 ( -3.749 5.211 1.011) 6.499 9.658 ( -1.295 3.712 -4.885) 6.270 10.043 ( 0.976 -0.547 -0.283) 1.154 10.099 ( -3.361 -1.256 -2.610) 4.437 10.149 ( -5.152 -0.833 5.088) 7.289 10.387 ( 1.404 -1.256 -3.538) 4.008 10.778 ( 1.098 -0.084 -1.352) 1.744 10.918 ( -3.267 -2.962 -1.617) 4.696 10.981 ( 7.013 0.239 -1.860) 7.259 11.020 ( 8.680 -2.471 3.279) 9.602 12.119 ( -3.222 3.732 1.674) 5.207 12.149 ( -3.621 3.232 -0.364) 4.867 12.834 ( -5.632 3.925 -0.833) 6.915 12.932 ( -0.206 0.572 -2.197) 2.280 13.169 ( -0.590 1.229 6.160) 6.309 13.379 ( -4.379 4.565 0.773) 6.373 13.531 ( 0.578 -0.854 -1.145) 1.541 13.575 ( -7.904 -1.129 3.712) 8.805 13.724 ( 2.379 -1.050 3.586) 4.430 14.056 ( 8.386 0.285 1.712) 8.563 14.305 ( -0.836 -3.216 0.379) 3.344 14.388 ( 5.093 -6.766 -0.579) 8.489 14.827 ( 6.850 -0.391 0.013) 6.861 14.894 ( 2.010 -2.848 -4.006) 5.310 15.094 ( 13.411 4.394 1.973) 14.250 15.247 ( 12.811 1.469 -2.316) 13.102 15.279 ( 6.359 1.341 -3.465) 7.365 15.475 ( 7.867 -1.738 -0.267) 8.061 16.580 ( -3.228 2.083 -0.438) 3.867 16.661 ( 2.756 -1.724 -2.790) 4.284 16.748 ( -1.493 -0.396 1.593) 2.219 16.781 ( -2.536 -1.714 -0.226) 3.069 16.971 ( 1.724 -0.622 -0.584) 1.924 16.994 ( 1.742 0.224 0.353) 1.791 17.212 ( -8.739 3.509 6.242) 11.298 17.262 ( -2.934 0.121 2.712) 3.997 19.611 ( 0.987 0.063 1.301) 1.635 19.741 ( 3.905 -2.127 -3.194) 5.475 21.489 ( -1.412 2.331 0.958) 2.889 21.568 ( -0.111 1.524 -1.482) 2.129 23.038 ( -5.643 -1.854 1.411) 6.105 23.189 ( -2.001 -1.992 -4.349) 5.185 27.819 ( -13.480 2.177 9.703) 16.751 28.205 ( 6.935 4.323 2.592) 8.573 29.395 ( -0.764 -0.905 1.632) 2.016 29.577 ( 6.192 9.120 3.968) 11.716 29.805 ( 1.476 1.428 1.963) 2.841 29.946 ( -0.103 2.118 -3.545) 4.131 30.796 ( -1.452 -1.940 2.875) 3.760 31.039 ( 3.169 3.013 -4.220) 6.077 31.279 ( 1.463 -9.141 0.896) 9.301 31.343 ( -9.811 -21.138 -9.694) 25.240 31.776 ( 0.697 4.155 2.962) 5.150 31.890 ( -1.635 0.523 -3.157) 3.593 32.136 ( -1.033 -7.258 0.310) 7.338 32.169 ( -1.844 -1.689 -1.986) 3.193 32.224 ( -0.613 0.426 0.409) 0.851 32.263 ( 0.597 -0.404 -0.269) 0.770 32.388 ( 2.744 -2.154 -1.354) 3.742 32.680 ( 27.904 -7.093 -16.400) 33.135 34.337 ( -0.310 -0.699 2.806) 2.908 34.458 ( -1.744 -5.778 -3.781) 7.122 35.298 ( -18.216 8.353 10.280) 22.523 35.481 ( 7.348 1.661 5.003) 9.043 35.775 ( -2.989 4.350 1.975) 5.635 35.851 ( 3.216 -1.357 0.578) 3.538 37.365 ( -10.489 30.725 12.189) 34.678 37.644 ( 4.042 13.891 -1.594) 14.555 ======================= Grid point 85 (28/95) ======================= q-point: ( 0.22 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.355 ( 23.751 -8.785 12.774) 28.363 1.368 ( 0.767 -19.279 21.588) 28.953 1.687 ( -0.474 -14.670 3.804) 15.162 1.713 ( 15.851 -4.421 1.875) 16.563 2.094 ( 3.852 -17.874 -3.534) 18.623 2.651 ( -0.357 2.631 -5.515) 6.121 2.735 ( -1.152 -0.971 4.166) 4.430 2.950 ( 6.195 2.176 3.997) 7.687 3.180 ( -2.583 -1.830 3.724) 4.887 3.222 ( -2.402 1.822 5.417) 6.199 3.399 ( 2.815 -0.249 2.604) 3.842 3.518 ( 5.972 -0.708 -0.865) 6.076 3.576 ( 9.070 -7.456 -16.799) 20.496 3.754 ( -0.071 -6.262 -2.067) 6.595 3.762 ( 2.165 1.483 1.211) 2.890 3.935 ( -1.610 -6.401 -3.306) 7.382 4.036 ( -0.779 -2.136 -2.101) 3.095 4.110 ( 4.109 2.571 1.163) 4.985 4.261 ( -3.286 -0.610 -2.420) 4.126 4.348 ( -0.431 0.216 -3.251) 3.287 4.472 ( -3.715 -2.519 1.764) 4.823 4.486 ( 3.386 -0.735 1.893) 3.948 4.674 ( 1.309 -7.098 -4.459) 8.484 4.761 ( 0.172 -1.501 0.291) 1.538 4.827 ( 2.266 0.313 -4.949) 5.452 4.961 ( -0.608 0.124 7.834) 7.859 5.155 ( -0.998 -4.640 -6.716) 8.223 5.321 ( 2.404 9.082 1.032) 9.451 5.516 ( 1.833 0.470 -0.389) 1.932 5.811 ( -3.651 -1.094 -5.979) 7.091 5.915 ( -4.596 0.668 -5.955) 7.551 6.041 ( -4.974 1.190 0.157) 5.117 6.183 ( -9.785 3.898 -0.422) 10.541 6.523 ( -1.048 0.505 -1.974) 2.291 7.247 ( -4.010 -0.678 -2.064) 4.561 7.418 ( -1.489 3.684 -0.394) 3.993 7.517 ( 2.019 0.338 5.296) 5.678 7.664 ( 1.571 0.860 -4.058) 4.435 7.965 ( -4.046 2.706 5.301) 7.197 8.162 ( -2.294 4.112 0.518) 4.738 8.373 ( -11.973 2.272 12.487) 17.448 8.483 ( -7.988 -3.239 4.078) 9.535 8.751 ( 3.039 1.399 2.396) 4.115 8.782 ( 0.660 8.528 3.253) 9.151 8.889 ( 4.887 3.346 1.053) 6.016 8.908 ( 4.322 1.515 -4.484) 6.409 9.394 ( -4.303 5.952 2.179) 7.661 9.551 ( -2.131 5.250 -4.379) 7.161 9.976 ( -7.527 2.760 -1.046) 8.085 10.104 ( -2.446 -0.296 0.698) 2.560 10.128 ( -2.386 -0.817 1.240) 2.810 10.423 ( 2.707 -1.372 -2.040) 3.657 10.780 ( 0.714 0.002 -1.356) 1.532 10.911 ( -5.335 -2.094 2.019) 6.077 11.079 ( 10.219 -1.582 -4.302) 11.200 11.183 ( 9.691 -4.983 3.515) 11.450 12.011 ( -4.222 4.201 0.487) 5.976 12.041 ( -4.956 4.585 -0.355) 6.761 12.716 ( -3.715 4.064 -1.767) 5.783 12.915 ( -0.173 1.186 -1.562) 1.969 13.157 ( 1.385 2.367 4.802) 5.530 13.269 ( -4.940 3.445 0.237) 6.027 13.532 ( -1.670 -1.424 -0.893) 2.370 13.590 ( 1.199 -1.559 1.090) 2.249 13.771 ( 0.676 -1.134 5.013) 5.184 14.062 ( 1.126 3.521 1.330) 3.929 14.367 ( 1.874 -3.371 0.139) 3.860 14.536 ( 2.268 -3.998 0.846) 4.674 14.854 ( -3.816 -0.378 1.601) 4.156 15.044 ( 17.603 -6.374 2.148) 18.844 15.143 ( -2.222 -2.990 -1.970) 4.214 15.336 ( 9.159 -0.668 -2.893) 9.628 15.373 ( 23.470 3.819 -4.355) 24.174 15.584 ( 7.798 -1.969 1.149) 8.124 16.524 ( -3.319 0.718 1.914) 3.898 16.698 ( 0.999 -0.400 -0.021) 1.076 16.761 ( -2.090 -3.273 -6.323) 7.420 16.793 ( 1.691 -1.287 1.496) 2.599 16.993 ( 1.085 -0.888 -2.074) 2.503 17.005 ( 1.075 0.822 2.179) 2.565 17.139 ( -4.212 -0.199 3.725) 5.626 17.243 ( -2.773 0.440 1.513) 3.190 19.634 ( 1.640 -0.658 1.523) 2.332 19.802 ( 5.321 -1.175 -3.614) 6.539 21.413 ( -3.142 4.376 1.157) 5.510 21.523 ( -1.133 2.692 -1.709) 3.384 22.991 ( -6.888 -0.238 2.761) 7.425 23.200 ( -1.970 -2.697 -5.388) 6.340 27.771 ( -2.674 -0.888 5.087) 5.815 28.158 ( 3.069 7.474 2.037) 8.332 29.448 ( 2.652 -3.278 1.421) 4.450 29.532 ( 2.051 2.267 2.824) 4.161 29.778 ( -0.664 3.238 0.165) 3.310 29.913 ( 2.219 1.241 -2.499) 3.565 30.841 ( 0.215 -2.988 1.460) 3.333 31.028 ( 2.571 0.612 -2.122) 3.389 31.409 ( -4.929 -7.162 2.082) 8.940 31.514 ( -3.248 -11.253 -1.716) 11.837 31.720 ( -0.578 4.115 1.119) 4.304 31.843 ( 0.196 2.161 -3.511) 4.128 32.155 ( -5.383 -0.952 -2.294) 5.928 32.165 ( -4.526 -1.684 -0.388) 4.845 32.287 ( 1.930 -1.768 -1.515) 3.025 32.307 ( 4.764 -5.038 0.657) 6.964 32.471 ( 5.669 -2.587 0.445) 6.247 32.916 ( 15.996 -2.588 -16.693) 23.265 34.373 ( -0.833 -3.056 5.036) 5.949 34.544 ( -2.239 -8.228 -5.635) 10.221 35.041 ( -12.699 8.698 14.207) 20.947 35.535 ( 9.888 3.580 4.870) 11.590 35.699 ( -0.819 3.268 1.140) 3.556 35.927 ( 2.907 -3.715 1.408) 4.923 36.798 ( -16.079 24.667 2.344) 29.538 37.442 ( 6.599 14.608 -1.049) 16.064 ======================= Grid point 86 (29/95) ======================= q-point: ( 0.33 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.644 ( 6.616 -8.412 15.476) 18.816 1.795 ( 13.298 -12.624 10.462) 21.111 1.883 ( 6.862 -2.705 6.538) 9.857 1.966 ( 5.386 -13.046 -2.386) 14.314 2.359 ( 1.897 -10.865 -6.264) 12.684 2.539 ( -7.500 1.783 -6.236) 9.916 2.765 ( -4.282 -1.259 3.838) 5.886 2.978 ( 3.738 -0.504 4.729) 6.049 3.158 ( -0.868 2.632 2.178) 3.525 3.237 ( 0.580 -2.513 5.667) 6.226 3.423 ( 2.029 0.215 -0.283) 2.060 3.603 ( 5.827 -2.244 1.340) 6.387 3.672 ( -3.107 1.683 -8.001) 8.746 3.766 ( 8.849 -0.293 -6.732) 11.122 3.810 ( -4.033 -1.054 -0.048) 4.169 4.042 ( 1.215 -3.420 -4.873) 6.076 4.115 ( 5.745 -8.957 -0.893) 10.678 4.158 ( 2.133 -2.773 3.079) 4.661 4.223 ( 4.983 0.301 -0.976) 5.087 4.358 ( 1.590 -3.868 -1.791) 4.549 4.516 ( -0.917 -3.420 2.515) 4.343 4.565 ( 3.581 -2.600 3.620) 5.717 4.754 ( 0.025 0.787 -3.543) 3.630 4.818 ( 0.578 -4.027 -2.055) 4.558 4.835 ( -0.737 -4.263 -3.341) 5.466 4.939 ( -1.088 3.848 7.355) 8.371 5.112 ( -3.820 7.078 -2.851) 8.533 5.241 ( 1.255 -0.919 -2.125) 2.634 5.510 ( -0.851 0.752 -2.672) 2.903 5.700 ( -12.704 3.278 -1.515) 13.208 5.852 ( 0.197 2.143 -3.739) 4.314 6.004 ( -3.127 2.449 -6.903) 7.964 6.022 ( -3.734 2.060 4.671) 6.325 6.499 ( -0.741 1.125 -0.760) 1.546 7.247 ( -2.684 -3.295 -2.826) 5.103 7.368 ( -0.103 0.457 -0.255) 0.533 7.539 ( 0.711 0.001 2.800) 2.888 7.664 ( 0.843 -0.491 -3.690) 3.817 7.855 ( -3.759 6.572 3.188) 8.215 8.081 ( -2.513 4.995 1.641) 5.827 8.325 ( -6.356 -3.889 11.626) 13.809 8.491 ( -6.000 -4.374 1.983) 7.685 8.632 ( -0.670 9.023 -0.436) 9.058 8.752 ( 3.835 3.340 -0.191) 5.089 8.901 ( 3.782 1.102 -0.942) 4.051 8.922 ( 7.313 2.118 0.176) 7.615 9.263 ( -4.662 5.157 1.592) 7.132 9.427 ( -2.998 5.610 -1.685) 6.580 9.856 ( -6.370 2.590 -0.692) 6.911 10.066 ( -6.005 -1.049 0.852) 6.155 10.116 ( -0.133 1.828 -0.684) 1.957 10.457 ( 2.492 0.018 -1.097) 2.723 10.796 ( 1.546 -1.304 -1.078) 2.292 10.904 ( -3.591 -1.178 2.838) 4.726 11.177 ( 7.279 -1.319 -3.632) 8.241 11.362 ( 8.012 -4.634 2.567) 9.605 11.916 ( -3.491 2.897 -1.669) 4.834 11.935 ( -2.588 2.737 1.100) 3.924 12.627 ( -1.931 2.545 -1.932) 3.733 12.865 ( -2.787 2.820 -0.350) 3.980 13.143 ( 1.141 2.338 2.075) 3.328 13.188 ( -1.077 1.743 -2.369) 3.132 13.556 ( 0.671 -1.975 -0.588) 2.167 13.633 ( 1.245 -1.669 2.163) 3.003 13.792 ( -2.468 -0.040 6.962) 7.387 14.009 ( -0.439 2.759 0.800) 2.906 14.441 ( 1.988 -2.906 0.247) 3.530 14.578 ( -0.111 -0.697 0.567) 0.906 14.820 ( -4.079 0.145 1.379) 4.308 15.136 ( -0.164 -0.557 -3.542) 3.589 15.356 ( 15.499 -6.586 2.642) 17.046 15.425 ( 5.827 -2.442 -3.226) 7.094 15.513 ( 14.665 0.914 -1.873) 14.812 15.687 ( 6.077 -2.057 1.752) 6.650 16.510 ( -2.597 -1.361 3.511) 4.575 16.686 ( -0.782 1.852 0.932) 2.216 16.761 ( -1.934 -1.466 -5.564) 6.070 16.870 ( 3.907 -3.202 0.200) 5.056 17.003 ( 0.027 -0.323 -3.127) 3.144 17.014 ( 2.316 -0.063 1.236) 2.625 17.131 ( -1.767 -0.588 1.957) 2.701 17.211 ( -2.788 0.250 0.341) 2.820 19.669 ( 1.641 -0.976 1.935) 2.718 19.859 ( 4.890 -1.032 -3.636) 6.181 21.306 ( -3.659 4.638 1.743) 6.159 21.455 ( -1.858 2.796 -2.108) 3.964 22.952 ( -4.867 -0.570 4.171) 6.435 23.207 ( -1.147 -1.866 -5.537) 5.955 27.793 ( -0.406 -1.837 2.793) 3.367 28.051 ( 0.479 7.044 0.373) 7.070 29.521 ( 1.220 0.109 4.286) 4.458 29.558 ( 2.146 -3.955 -3.439) 5.663 29.711 ( -0.962 2.905 0.418) 3.088 29.922 ( 3.003 0.748 -0.493) 3.134 30.900 ( 0.527 -3.057 0.797) 3.203 31.040 ( 1.595 0.318 -0.327) 1.659 31.464 ( -5.494 -5.621 1.774) 8.057 31.608 ( 0.059 4.726 3.829) 6.083 31.668 ( -3.098 -6.617 -2.580) 7.749 31.817 ( 1.994 1.287 -1.656) 2.894 32.091 ( -6.577 -0.047 -3.917) 7.655 32.151 ( -1.769 0.360 2.186) 2.835 32.348 ( 2.634 -3.127 -1.780) 4.460 32.415 ( 2.732 -3.419 -1.200) 4.538 32.562 ( 5.577 -0.996 1.944) 5.989 33.008 ( 8.391 -0.506 -11.310) 14.092 34.444 ( -1.388 -4.300 6.763) 8.133 34.648 ( -1.972 -7.622 -4.995) 9.324 34.859 ( -7.130 5.399 10.803) 14.025 35.564 ( 9.512 5.747 1.728) 11.247 35.655 ( 1.860 2.950 0.869) 3.594 36.018 ( -2.717 -5.073 3.000) 6.490 36.294 ( -9.984 18.450 -5.702) 21.740 37.294 ( 4.934 9.586 -0.477) 10.792 ======================= Grid point 87 (30/95) ======================= q-point: ( 0.44 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.832 ( 2.943 -3.130 10.734) 11.562 1.939 ( 2.717 3.130 13.247) 13.880 2.097 ( 4.608 -8.139 1.297) 9.442 2.153 ( 1.902 -6.386 -0.168) 6.665 2.401 ( -0.886 0.823 -7.312) 7.411 2.510 ( -2.889 -5.336 -8.987) 10.844 2.714 ( -7.096 2.207 10.643) 12.980 3.043 ( 3.180 0.426 2.392) 4.001 3.147 ( -1.504 -3.772 3.688) 5.485 3.342 ( 1.502 -6.564 3.699) 7.682 3.364 ( -1.096 8.862 -3.718) 9.673 3.566 ( -2.650 1.824 -5.905) 6.724 3.680 ( -0.372 4.681 1.641) 4.974 3.730 ( -0.036 -0.099 2.276) 2.278 3.796 ( 2.692 -0.179 -4.752) 5.464 4.075 ( 1.081 -2.417 -8.629) 9.026 4.223 ( 1.173 -4.340 -1.181) 4.648 4.296 ( 6.956 -3.141 -0.398) 7.642 4.382 ( 7.180 -3.452 3.575) 8.732 4.473 ( 4.180 -5.166 0.991) 6.719 4.543 ( -0.648 2.006 6.489) 6.823 4.623 ( 0.573 0.663 1.896) 2.089 4.726 ( 0.497 -0.112 -6.496) 6.515 4.811 ( -0.489 -2.697 -5.186) 5.866 4.843 ( -2.634 2.200 4.031) 5.295 4.979 ( -0.981 -4.126 0.027) 4.241 5.012 ( 3.673 -1.110 0.792) 3.918 5.196 ( -5.819 6.178 -0.528) 8.503 5.465 ( -0.705 2.122 -4.628) 5.140 5.538 ( -8.935 -0.213 -2.266) 9.220 5.835 ( 1.747 0.782 1.430) 2.389 5.909 ( 0.202 2.598 -5.143) 5.766 6.033 ( -0.229 -1.212 1.010) 1.594 6.470 ( -0.254 1.215 -0.184) 1.255 7.258 ( -0.877 -0.934 -3.898) 4.103 7.409 ( 1.157 -4.004 0.330) 4.180 7.544 ( 1.102 1.994 0.486) 2.329 7.657 ( -3.158 -1.491 -0.280) 3.504 7.755 ( 0.917 3.292 -0.666) 3.482 7.981 ( -2.888 3.186 3.447) 5.511 8.407 ( -2.676 -6.522 6.256) 9.425 8.467 ( -0.637 9.511 2.827) 9.943 8.518 ( -2.820 -2.225 1.026) 3.735 8.741 ( 2.499 0.528 -3.341) 4.206 8.924 ( 3.603 0.431 0.610) 3.679 8.946 ( 1.754 1.503 1.290) 2.646 9.173 ( -1.131 1.652 0.270) 2.020 9.309 ( -2.799 4.253 0.449) 5.111 9.784 ( -2.199 0.796 -0.394) 2.372 10.048 ( -4.474 -2.841 -0.342) 5.311 10.072 ( 0.322 2.640 -0.804) 2.779 10.464 ( 1.767 0.908 -0.904) 2.183 10.840 ( 1.547 -1.828 0.438) 2.435 10.890 ( -2.478 0.459 2.050) 3.249 11.231 ( 3.089 -0.192 -2.770) 4.153 11.475 ( 2.739 -1.663 1.525) 3.549 11.854 ( -2.213 0.512 -1.769) 2.879 11.907 ( 0.782 0.590 1.019) 1.414 12.590 ( 0.408 0.299 -2.337) 2.391 12.789 ( -2.583 2.413 0.869) 3.639 13.115 ( -0.622 1.043 0.020) 1.215 13.179 ( 2.609 -0.028 -3.469) 4.341 13.591 ( 1.018 -1.050 -0.128) 1.468 13.677 ( 0.667 -1.572 2.342) 2.899 13.764 ( -4.743 1.426 8.043) 9.446 13.979 ( 0.255 1.224 1.161) 1.706 14.488 ( 0.270 -1.021 0.253) 1.086 14.588 ( 0.283 -0.855 0.118) 0.908 14.790 ( -3.513 -0.486 2.477) 4.326 15.131 ( 2.532 0.853 -6.280) 6.825 15.482 ( 3.014 -0.334 -0.615) 3.094 15.537 ( 4.859 -2.660 0.033) 5.540 15.595 ( 4.337 -0.289 -0.989) 4.458 15.765 ( 2.368 -0.926 2.162) 3.337 16.517 ( -2.509 0.132 2.644) 3.647 16.659 ( 0.723 0.627 3.136) 3.279 16.742 ( -0.570 0.341 -5.148) 5.190 16.951 ( 2.346 -2.503 0.954) 3.560 16.988 ( -1.242 0.456 -2.229) 2.592 17.052 ( 3.208 -0.699 -1.306) 3.533 17.134 ( -0.430 -0.899 0.542) 1.134 17.188 ( -2.001 0.029 0.057) 2.002 19.699 ( 0.413 -0.440 2.184) 2.266 19.900 ( 2.618 -0.529 -3.586) 4.471 21.225 ( -1.582 2.120 2.338) 3.530 21.397 ( -1.156 1.162 -2.515) 3.002 22.940 ( -2.314 -0.382 4.908) 5.440 23.210 ( 0.475 -0.814 -5.550) 5.629 27.834 ( -0.075 -2.342 1.717) 2.905 27.954 ( -0.230 4.402 -0.249) 4.415 29.503 ( -1.714 1.660 -0.733) 2.496 29.626 ( 1.493 -1.973 -2.064) 3.222 29.697 ( 0.958 -0.466 3.389) 3.553 29.934 ( 1.494 0.382 0.013) 1.542 30.948 ( -0.214 -2.112 0.342) 2.150 31.038 ( 0.655 1.258 0.557) 1.524 31.505 ( 0.533 4.730 0.641) 4.803 31.513 ( -3.711 -2.972 1.282) 4.924 31.756 ( -1.968 -5.466 1.087) 5.910 31.826 ( 2.686 0.071 -0.270) 2.700 32.023 ( -4.502 0.262 -3.732) 5.854 32.141 ( 1.349 0.992 1.919) 2.547 32.413 ( 1.627 -2.454 -1.667) 3.384 32.461 ( 0.833 -0.576 -1.694) 1.974 32.605 ( 2.138 0.993 1.381) 2.732 33.050 ( 3.567 -1.336 -7.376) 8.302 34.510 ( -2.774 -2.633 7.420) 8.348 34.650 ( -3.095 2.950 4.427) 6.155 34.865 ( 0.472 -6.139 1.557) 6.351 35.506 ( 3.906 8.740 -5.183) 10.886 35.638 ( 1.778 1.609 0.765) 2.517 35.938 ( -9.808 1.770 -1.399) 10.064 36.139 ( 4.290 0.438 -0.101) 4.314 37.216 ( 1.784 3.369 -0.308) 3.824 ======================= Grid point 88 (31/95) ======================= q-point: (-0.44 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.838 ( -8.867 2.282 7.556) 11.872 1.876 ( -3.188 10.243 16.324) 19.533 2.112 ( -1.073 4.792 0.523) 4.939 2.227 ( -3.094 2.110 1.159) 3.920 2.382 ( 0.582 -0.389 -10.593) 10.616 2.542 ( -0.770 -6.298 -6.320) 8.955 2.724 ( 0.711 -6.387 12.644) 14.183 3.071 ( -1.449 7.083 2.223) 7.564 3.119 ( 0.128 7.667 2.813) 8.168 3.212 ( -1.120 -1.016 2.148) 2.627 3.308 ( -6.264 7.732 -7.837) 12.667 3.551 ( -0.744 1.606 -0.578) 1.862 3.641 ( 3.310 -3.859 5.478) 7.474 3.761 ( 1.467 -0.093 -6.639) 6.799 3.847 ( 3.158 -3.622 -3.270) 5.813 4.112 ( 1.335 -1.770 -2.097) 3.052 4.225 ( -8.144 5.403 2.240) 10.027 4.303 ( -1.283 -4.298 -6.252) 7.695 4.424 ( -1.122 4.144 2.566) 5.001 4.472 ( -0.589 2.652 1.847) 3.285 4.567 ( -1.287 4.188 1.162) 4.532 4.631 ( 1.036 -4.330 5.316) 6.934 4.706 ( -0.236 3.016 -0.057) 3.025 4.800 ( -1.528 1.855 -5.172) 5.703 4.893 ( 5.638 -0.041 0.190) 5.642 4.962 ( -2.538 -6.142 -1.372) 6.786 5.021 ( 0.042 6.609 -0.257) 6.614 5.234 ( 9.243 -8.299 -0.449) 12.430 5.412 ( 1.922 2.953 -1.809) 3.961 5.507 ( -2.186 -2.310 -3.595) 4.800 5.821 ( -1.135 2.659 -0.869) 3.019 5.918 ( 3.961 -3.055 -0.472) 5.024 6.069 ( 1.780 -3.113 -2.054) 4.133 6.467 ( 1.414 -0.303 -0.127) 1.451 7.248 ( 0.184 0.061 -3.815) 3.820 7.441 ( -1.897 2.086 2.122) 3.528 7.538 ( 5.114 -1.030 -2.040) 5.602 7.697 ( -1.125 -3.876 -0.007) 4.036 7.726 ( -0.251 0.407 -0.398) 0.622 7.978 ( 1.198 -3.054 2.061) 3.874 8.326 ( -0.659 7.774 7.776) 11.015 8.499 ( -1.751 -5.303 0.837) 5.647 8.520 ( 1.132 1.510 2.606) 3.218 8.756 ( -1.746 -2.305 -2.282) 3.683 8.906 ( -2.272 1.792 0.455) 2.929 8.942 ( -1.137 0.273 1.213) 1.685 9.183 ( -0.504 -3.177 -0.002) 3.216 9.296 ( 5.191 -2.127 0.484) 5.631 9.786 ( 2.455 -0.731 -0.525) 2.615 10.050 ( 1.300 0.268 -1.005) 1.665 10.080 ( -0.705 -3.876 -0.002) 3.940 10.462 ( 1.039 0.642 -1.025) 1.594 10.845 ( -0.644 3.019 0.388) 3.111 10.879 ( -0.858 -1.272 2.171) 2.659 11.221 ( -1.336 1.537 -2.708) 3.388 11.480 ( -3.411 0.930 1.486) 3.835 11.844 ( -0.054 -1.153 -1.366) 1.788 11.922 ( 1.891 -0.503 0.597) 2.045 12.609 ( 2.580 -1.643 -2.792) 4.141 12.766 ( 0.940 -0.470 1.365) 1.723 13.101 ( -0.682 0.013 -0.369) 0.775 13.208 ( 2.385 -1.710 -3.787) 4.791 13.597 ( 0.106 1.077 -0.078) 1.085 13.690 ( -2.691 1.025 4.663) 5.481 13.743 ( -2.313 -1.986 6.059) 6.782 13.971 ( 0.686 0.939 1.367) 1.795 14.481 ( -0.573 1.474 0.088) 1.584 14.609 ( -0.780 -1.298 0.631) 1.641 14.794 ( -1.317 -2.013 2.674) 3.597 15.113 ( 3.069 2.515 -6.706) 7.792 15.464 ( -2.384 2.789 -0.382) 3.689 15.571 ( -2.204 -0.021 -0.678) 2.306 15.602 ( -4.842 -1.602 -0.826) 5.167 15.750 ( -4.435 2.439 2.412) 5.606 16.471 ( -1.226 2.822 2.050) 3.697 16.679 ( -0.066 1.005 3.318) 3.468 16.735 ( 3.262 -1.106 -4.372) 5.566 16.943 ( -2.802 1.430 -0.061) 3.146 17.008 ( 0.857 -1.410 -0.547) 1.738 17.069 ( 0.811 0.084 -2.775) 2.892 17.161 ( 1.753 -0.535 1.347) 2.275 17.174 ( -1.133 -0.784 -0.304) 1.411 19.697 ( -1.563 0.770 2.141) 2.760 19.899 ( -0.580 0.530 -3.546) 3.632 21.233 ( 1.870 -2.029 2.587) 3.783 21.389 ( 0.632 -1.471 -2.760) 3.191 22.946 ( 0.212 0.196 4.990) 4.998 23.211 ( 2.341 0.337 -5.658) 6.132 27.867 ( -1.470 -1.238 3.157) 3.696 27.917 ( 0.952 -0.505 -1.666) 1.985 29.448 ( -2.093 2.454 -0.342) 3.243 29.638 ( 0.783 0.714 -2.005) 2.268 29.733 ( -0.064 -1.604 3.041) 3.438 29.936 ( -1.104 -0.387 -0.089) 1.173 30.965 ( -1.210 -0.801 0.352) 1.494 31.015 ( 0.101 2.096 0.512) 2.160 31.426 ( 3.368 5.688 0.785) 6.657 31.546 ( -3.191 -2.782 0.610) 4.277 31.813 ( 0.638 -1.817 2.137) 2.876 31.862 ( 0.622 -2.413 0.180) 2.498 31.988 ( -0.474 -0.296 -3.500) 3.544 32.162 ( 5.194 0.742 1.160) 5.374 32.439 ( 0.970 0.616 -2.864) 3.086 32.444 ( -1.069 1.452 -0.795) 1.970 32.580 ( -2.776 1.781 1.059) 3.464 33.077 ( -0.474 -2.368 -7.589) 7.964 34.479 ( -3.679 3.871 5.110) 7.391 34.644 ( 0.444 -1.590 7.637) 7.814 34.938 ( 2.541 2.531 3.431) 4.963 35.389 ( -3.629 0.114 -7.553) 8.380 35.644 ( -1.904 -2.078 0.684) 2.900 35.932 ( 4.850 -2.579 -1.167) 5.616 36.170 ( 0.759 -1.411 -0.235) 1.619 37.217 ( -1.451 -3.355 -0.308) 3.669 ======================= Grid point 89 (32/95) ======================= q-point: (-0.33 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.605 ( -23.097 9.993 4.526) 25.570 1.634 ( -11.025 15.615 18.363) 26.506 1.972 ( -3.304 11.728 8.943) 15.115 2.098 ( -0.214 8.225 0.351) 8.235 2.338 ( -3.802 0.903 -9.780) 10.532 2.680 ( 4.234 -3.805 -0.475) 5.712 2.749 ( -5.275 12.817 -2.125) 14.022 2.925 ( -0.506 -3.931 9.900) 10.664 3.085 ( -1.686 -0.014 -5.138) 5.407 3.158 ( -3.050 -0.912 3.240) 4.542 3.224 ( 0.485 0.800 2.044) 2.248 3.533 ( 3.579 2.353 1.428) 4.515 3.701 ( 2.090 1.795 -2.074) 3.448 3.728 ( -3.081 -0.167 -7.535) 8.142 3.892 ( -2.053 -0.409 -4.250) 4.737 4.039 ( -7.961 3.298 0.965) 8.671 4.130 ( -0.703 4.381 2.188) 4.947 4.306 ( -1.398 3.345 -1.364) 3.874 4.359 ( -0.437 4.514 -0.156) 4.538 4.380 ( 1.002 0.914 -5.537) 5.701 4.505 ( -4.448 4.300 3.531) 7.123 4.571 ( -4.521 2.776 3.635) 6.431 4.701 ( -2.722 -0.788 1.990) 3.463 4.764 ( 2.333 -1.173 -3.256) 4.174 4.911 ( 6.238 4.100 -1.367) 7.589 4.990 ( 3.689 -1.110 -0.243) 3.860 5.128 ( -1.900 -10.295 -1.913) 10.642 5.256 ( 0.919 7.164 -1.259) 7.331 5.406 ( -2.799 -1.188 -3.290) 4.480 5.627 ( 15.118 -3.515 -2.211) 15.678 5.792 ( 1.995 -0.997 2.097) 3.061 6.032 ( 5.327 -4.359 -1.841) 7.125 6.160 ( 5.162 -4.750 -5.732) 9.060 6.493 ( 1.531 -0.886 -0.741) 1.918 7.246 ( 0.582 -0.888 -4.022) 4.159 7.409 ( 0.002 1.048 5.495) 5.594 7.570 ( 0.925 -0.249 -7.361) 7.423 7.712 ( -3.019 -0.418 -1.904) 3.593 7.772 ( 4.391 -2.658 5.381) 7.437 8.092 ( 4.426 -5.427 2.389) 7.399 8.267 ( 0.226 1.858 12.404) 12.544 8.492 ( 4.215 4.869 3.191) 7.187 8.570 ( -2.869 -5.330 -0.253) 6.058 8.760 ( -4.451 -1.657 1.753) 5.062 8.868 ( -3.373 -0.971 -1.040) 3.660 8.918 ( -2.176 -0.090 -1.808) 2.830 9.270 ( 1.487 -5.989 1.431) 6.334 9.435 ( 7.020 -6.309 -1.437) 9.547 9.839 ( 5.541 -1.046 -1.046) 5.735 10.075 ( 1.793 -1.299 0.278) 2.231 10.156 ( 1.932 -3.981 0.334) 4.438 10.449 ( -0.569 1.043 -1.481) 1.899 10.789 ( 1.282 3.132 -1.339) 3.639 10.884 ( -1.564 0.249 3.333) 3.690 11.138 ( -5.045 3.679 -2.970) 6.915 11.397 ( -8.254 2.627 1.866) 8.860 11.888 ( 2.835 -3.022 -0.717) 4.205 11.968 ( 3.262 -2.240 0.102) 3.958 12.674 ( 4.218 -3.122 -2.756) 5.928 12.817 ( 2.507 -2.661 0.709) 3.724 13.093 ( -1.474 -0.240 0.510) 1.578 13.256 ( 1.440 -2.857 -2.335) 3.961 13.566 ( 0.093 2.048 -0.467) 2.103 13.650 ( -2.686 1.870 4.160) 5.293 13.801 ( -2.158 -4.986 6.515) 8.483 13.966 ( 1.536 1.283 0.307) 2.025 14.437 ( -1.192 2.813 0.071) 3.055 14.609 ( -1.556 0.290 1.218) 1.997 14.842 ( 0.605 -2.808 2.602) 3.876 15.056 ( -0.626 4.172 -4.655) 6.282 15.358 ( -7.310 3.808 0.139) 8.244 15.494 ( -9.387 1.767 -1.320) 9.643 15.550 ( -11.894 -1.554 -2.929) 12.348 15.639 ( -8.048 3.424 3.005) 9.248 16.441 ( 1.462 1.208 2.122) 2.846 16.657 ( 1.459 1.823 -1.145) 2.600 16.783 ( 2.838 -0.749 -0.524) 2.982 16.890 ( -2.139 1.736 0.453) 2.792 17.007 ( -2.145 0.071 -2.954) 3.651 17.056 ( -0.461 1.115 -1.429) 1.870 17.178 ( 1.621 -0.714 0.997) 2.033 17.202 ( 0.368 -1.282 1.867) 2.294 19.664 ( -2.477 1.225 1.851) 3.326 19.856 ( -2.824 1.259 -3.590) 4.738 21.326 ( 3.414 -4.560 2.414) 6.187 21.436 ( 1.949 -3.297 -2.776) 4.730 22.968 ( 2.927 0.450 4.363) 5.273 23.211 ( 3.950 1.379 -5.874) 7.212 27.889 ( -2.564 -3.128 5.771) 7.047 27.960 ( 1.115 -3.318 -2.431) 4.262 29.378 ( -2.590 3.545 1.345) 4.591 29.620 ( 0.156 1.135 -1.602) 1.970 29.756 ( -1.990 -1.339 1.946) 3.089 29.928 ( -1.845 -0.786 -0.930) 2.211 30.952 ( -2.779 1.182 2.713) 4.060 30.984 ( 0.857 1.175 -2.317) 2.735 31.377 ( 4.662 5.460 0.638) 7.208 31.552 ( -2.471 -1.392 1.721) 3.317 31.847 ( 2.894 0.424 1.433) 3.257 31.912 ( -0.417 -3.457 -0.096) 3.483 32.001 ( 3.410 -0.394 -2.921) 4.507 32.211 ( 5.999 0.568 0.560) 6.052 32.377 ( 0.369 4.832 -2.657) 5.526 32.409 ( 0.548 3.405 -1.475) 3.751 32.514 ( -7.617 0.358 1.240) 7.726 33.056 ( -5.169 -0.988 -13.168) 14.181 34.393 ( -1.989 4.076 3.337) 5.630 34.695 ( 4.258 2.956 4.151) 6.641 34.887 ( 0.121 2.160 9.559) 9.800 35.395 ( -4.228 -4.823 -0.373) 6.425 35.667 ( -3.989 -3.501 0.891) 5.382 36.006 ( -4.689 -2.532 2.336) 5.819 36.276 ( 14.281 -6.467 -5.261) 16.536 37.298 ( -4.182 -9.743 -0.467) 10.613 ======================= Grid point 90 (33/95) ======================= q-point: (-0.22 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.165 ( -27.395 14.338 6.947) 31.691 1.271 ( -13.673 19.884 17.036) 29.539 1.706 ( -12.769 15.932 22.473) 30.363 1.956 ( -2.050 8.041 -0.309) 8.304 2.154 ( -6.094 12.385 -8.904) 16.425 2.520 ( -1.812 3.498 -2.608) 4.725 2.796 ( -9.608 0.485 5.144) 10.909 2.846 ( -0.146 -3.270 -4.010) 5.176 3.189 ( -1.990 -1.000 5.047) 5.516 3.213 ( 1.608 0.806 4.722) 5.053 3.246 ( 5.584 -7.895 1.400) 9.771 3.503 ( 1.690 4.987 1.114) 5.383 3.640 ( -2.302 2.032 -5.949) 6.695 3.688 ( -0.128 0.340 -9.226) 9.233 3.823 ( -3.669 3.672 -0.813) 5.254 3.934 ( -0.970 4.060 -3.860) 5.685 4.041 ( 0.289 4.103 -0.088) 4.114 4.206 ( -0.356 6.172 -1.972) 6.489 4.250 ( -3.327 2.886 -1.352) 4.608 4.381 ( -2.665 2.356 -1.159) 3.741 4.457 ( 0.380 -3.725 0.522) 3.780 4.543 ( 1.141 1.690 1.177) 2.355 4.665 ( -0.762 2.139 1.122) 2.533 4.838 ( 0.175 -2.616 -0.221) 2.631 4.871 ( 2.342 2.779 -1.753) 4.035 5.009 ( -2.710 4.344 -7.702) 9.249 5.141 ( 2.616 2.051 2.215) 3.994 5.224 ( -2.931 -4.164 3.497) 6.177 5.408 ( -0.150 -1.781 -4.952) 5.265 5.802 ( 10.489 -3.995 0.694) 11.245 5.911 ( 9.473 -3.654 1.808) 10.313 6.083 ( 2.575 1.939 -13.807) 14.178 6.275 ( 8.041 -1.959 -1.532) 8.416 6.521 ( 2.296 -1.083 -2.431) 3.515 7.270 ( 1.003 -2.424 -3.436) 4.323 7.432 ( 0.136 -1.247 6.880) 6.993 7.540 ( -2.248 0.395 -6.889) 7.258 7.684 ( -1.548 -0.732 -1.446) 2.241 7.885 ( 4.111 -3.477 7.698) 9.394 8.237 ( 6.605 -4.091 7.397) 10.727 8.328 ( 3.176 -2.692 8.485) 9.452 8.471 ( 4.043 3.426 7.638) 9.296 8.635 ( -3.057 -5.802 2.009) 6.859 8.743 ( -2.200 0.242 3.302) 3.975 8.872 ( -3.691 -3.707 -0.862) 5.301 8.895 ( 0.141 1.054 -3.681) 3.831 9.401 ( 1.905 -7.098 1.578) 7.517 9.593 ( 5.086 -5.895 -3.509) 8.540 9.911 ( 6.702 -0.928 -0.993) 6.839 10.111 ( 1.141 -0.744 0.438) 1.431 10.224 ( 0.984 -1.199 2.501) 2.943 10.408 ( -1.056 1.530 -3.151) 3.658 10.775 ( 4.840 1.270 -2.601) 5.640 10.865 ( -1.045 1.538 3.904) 4.325 11.003 ( -6.979 4.272 -2.454) 8.542 11.261 ( -10.728 3.116 1.304) 11.247 11.988 ( 4.889 -4.213 0.134) 6.455 12.055 ( 4.319 -3.511 -0.055) 5.566 12.767 ( 4.599 -3.760 -2.611) 6.489 12.886 ( 1.615 -2.970 -1.000) 3.525 13.095 ( -0.729 -0.980 4.106) 4.284 13.309 ( 0.728 -2.555 0.089) 2.658 13.545 ( 1.325 0.882 -1.180) 1.982 13.604 ( -1.480 2.056 1.941) 3.191 13.898 ( -4.887 -8.002 6.520) 11.420 13.958 ( 2.349 1.761 0.031) 2.936 14.367 ( -1.784 3.760 0.040) 4.162 14.575 ( -0.149 3.307 1.423) 3.603 14.891 ( -1.247 -1.353 2.427) 3.046 14.940 ( -7.434 3.459 0.096) 8.200 15.206 ( -15.603 1.424 -1.726) 15.763 15.354 ( -13.377 0.219 -2.334) 13.581 15.433 ( -6.933 1.341 -5.856) 9.174 15.522 ( -12.044 0.712 2.451) 12.312 16.477 ( 3.677 -1.964 1.098) 4.311 16.646 ( 2.401 1.353 -1.533) 3.153 16.781 ( -1.353 1.700 -0.049) 2.174 16.875 ( 2.192 0.301 1.267) 2.550 16.959 ( -3.095 1.167 -4.623) 5.685 17.018 ( -1.294 1.756 -0.080) 2.183 17.218 ( 2.930 0.287 -0.393) 2.970 17.239 ( -2.224 -4.819 6.508) 8.398 19.629 ( -2.373 0.603 1.542) 2.894 19.795 ( -2.830 1.311 -3.781) 4.901 21.437 ( 2.123 -4.333 1.828) 5.160 21.506 ( 2.026 -3.350 -2.450) 4.618 23.012 ( 5.438 0.344 2.663) 6.065 23.205 ( 4.692 2.294 -5.891) 7.873 27.969 ( -1.768 -6.991 4.834) 8.682 28.034 ( -3.182 -7.646 2.837) 8.754 29.294 ( -2.140 4.106 2.873) 5.450 29.591 ( -2.763 0.994 0.583) 2.994 29.757 ( -1.373 -0.690 1.166) 1.929 29.933 ( -0.473 -1.828 -2.433) 3.080 30.896 ( -3.747 2.292 3.499) 5.616 30.982 ( 1.474 -0.592 -4.258) 4.545 31.321 ( 4.095 6.676 -0.269) 7.836 31.574 ( -0.537 -2.159 3.903) 4.493 31.853 ( 3.872 2.993 -1.777) 5.207 31.965 ( -1.092 -3.748 -1.463) 4.169 32.039 ( 6.817 1.009 -1.212) 6.997 32.240 ( -1.307 0.019 0.906) 1.590 32.288 ( 7.564 8.102 -4.674) 12.029 32.347 ( 2.414 4.971 0.042) 5.527 32.429 ( -10.586 -0.155 -1.166) 10.651 32.896 ( -11.838 6.069 -22.496) 26.135 34.335 ( -0.420 2.481 2.620) 3.633 34.609 ( 3.214 9.104 -3.187) 10.167 35.034 ( 4.454 -10.727 20.737) 23.768 35.440 ( -3.052 -4.030 6.473) 8.213 35.683 ( -4.631 -2.971 0.468) 5.522 35.955 ( -10.161 -0.417 2.476) 10.467 36.581 ( 19.457 -10.089 1.139) 21.947 37.458 ( -4.377 -14.509 -0.884) 15.180 ======================= Grid point 91 (34/95) ======================= q-point: (-0.11 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.720 ( -22.850 12.132 16.450) 30.658 0.839 ( -11.614 21.667 19.297) 31.253 1.399 ( -17.748 13.000 47.393) 52.250 1.798 ( -7.042 3.045 -12.197) 14.409 1.874 ( -5.682 8.894 -15.099) 18.422 2.497 ( 3.649 1.458 6.347) 7.465 2.691 ( -6.253 0.342 -1.920) 6.550 2.936 ( -0.910 -5.293 1.414) 5.553 3.123 ( -4.078 5.402 7.246) 9.916 3.272 ( 0.741 -2.878 7.231) 7.818 3.350 ( -0.462 1.016 -0.145) 1.125 3.458 ( -0.749 -0.372 4.200) 4.282 3.594 ( 0.238 -0.640 -11.465) 11.485 3.658 ( 4.041 0.893 -12.871) 13.520 3.737 ( -3.109 2.805 -1.479) 4.441 3.854 ( 3.496 4.196 -5.017) 7.417 4.014 ( 0.807 1.256 2.475) 2.891 4.136 ( -4.872 2.060 -6.171) 8.128 4.176 ( 3.223 1.438 -3.027) 4.649 4.341 ( -0.405 -0.145 -1.955) 2.002 4.518 ( -4.040 -0.657 5.713) 7.028 4.542 ( 2.626 -3.215 -1.481) 4.407 4.636 ( 0.629 1.894 -2.149) 2.932 4.765 ( -1.427 5.641 1.722) 6.068 4.856 ( -2.457 3.208 -11.605) 12.289 4.901 ( 0.797 -0.562 -1.917) 2.151 5.157 ( -4.674 -0.026 7.286) 8.657 5.275 ( 0.771 -1.601 5.918) 6.179 5.431 ( 4.432 -0.191 -5.186) 6.824 5.843 ( 2.057 14.841 -18.334) 23.678 5.989 ( 3.746 -2.815 2.006) 5.097 6.068 ( 8.828 -1.621 -1.590) 9.116 6.328 ( 0.952 0.988 4.146) 4.368 6.561 ( 3.379 -1.195 -4.022) 5.387 7.318 ( 3.470 -1.483 -2.170) 4.353 7.456 ( -4.558 -0.955 -0.370) 4.672 7.521 ( -0.538 -2.251 3.593) 4.273 7.699 ( 0.811 -1.332 -2.687) 3.107 8.008 ( 1.506 -5.052 6.493) 8.364 8.321 ( 0.654 -2.288 -4.837) 5.391 8.490 ( 2.641 -4.491 11.258) 12.406 8.502 ( 5.523 1.438 8.076) 9.889 8.709 ( -1.659 -2.464 -0.508) 3.013 8.802 ( 15.543 -2.001 10.799) 19.032 8.882 ( 1.161 -4.683 2.623) 5.492 8.913 ( -2.212 -4.039 2.688) 5.332 9.537 ( 2.255 -5.519 0.922) 6.033 9.686 ( 1.934 -2.725 -4.975) 5.993 9.984 ( 5.211 -0.700 -0.339) 5.269 10.121 ( 0.888 0.307 -0.805) 1.237 10.215 ( -3.025 1.398 4.406) 5.524 10.385 ( 1.780 0.710 -4.654) 5.033 10.811 ( 6.690 0.448 -3.448) 7.540 10.849 ( -0.017 1.024 4.643) 4.754 10.866 ( -5.338 3.739 -1.521) 6.692 11.116 ( -10.753 1.879 0.444) 10.925 12.093 ( 4.114 -2.510 0.851) 4.894 12.153 ( 3.756 -3.206 0.618) 4.977 12.861 ( 4.097 -2.970 -0.839) 5.129 12.936 ( 1.262 -2.236 -3.305) 4.185 13.133 ( 1.140 -0.559 6.766) 6.884 13.363 ( 2.160 -2.718 0.510) 3.509 13.546 ( -1.362 -0.389 1.364) 1.966 13.579 ( 3.035 1.584 -0.246) 3.432 13.924 ( 2.272 1.851 -4.386) 5.275 14.035 ( -14.726 -14.546 7.809) 22.123 14.291 ( -0.095 3.599 0.071) 3.601 14.511 ( 2.305 7.004 -0.309) 7.380 14.762 ( -23.580 3.652 -5.576) 24.504 14.840 ( -4.843 1.988 0.381) 5.249 15.082 ( -15.669 -7.955 1.819) 17.667 15.251 ( -7.343 -0.163 -2.852) 7.879 15.364 ( -4.543 0.688 -2.945) 5.457 15.396 ( -6.694 2.310 -0.218) 7.085 16.564 ( 4.502 -2.764 -0.983) 5.374 16.646 ( 1.615 0.377 -1.228) 2.063 16.738 ( -1.459 1.135 0.758) 1.998 16.868 ( -3.282 2.466 1.408) 4.340 16.921 ( 2.438 0.199 -2.118) 3.236 16.989 ( -1.001 0.052 -0.305) 1.048 17.228 ( 1.856 1.057 1.946) 2.890 17.366 ( -5.669 -12.618 4.830) 14.652 19.613 ( -2.355 -0.854 1.761) 3.062 19.738 ( -1.200 2.276 -4.024) 4.776 21.508 ( -0.709 -2.765 0.846) 2.977 21.561 ( 1.515 -1.831 -1.844) 3.008 23.048 ( 4.880 3.125 -0.229) 5.800 23.195 ( 4.083 1.494 -4.043) 5.938 28.072 ( 6.223 -2.574 -3.561) 7.618 28.220 ( -25.853 -26.576 9.237) 38.210 29.269 ( 7.261 -0.037 9.666) 12.089 29.532 ( -4.697 2.084 1.791) 5.441 29.773 ( 0.362 -1.680 1.775) 2.471 29.960 ( 0.492 -2.018 -2.815) 3.499 30.843 ( -5.084 -0.404 4.293) 6.666 31.010 ( 2.706 -2.310 -5.726) 6.741 31.233 ( 2.669 7.189 -1.329) 7.783 31.568 ( 1.361 12.318 -7.974) 14.737 31.799 ( -0.446 2.548 -4.803) 5.456 31.984 ( -3.895 -0.896 -6.179) 7.359 32.099 ( 14.876 4.516 2.304) 15.716 32.141 ( 1.568 10.091 -7.548) 12.698 32.259 ( 1.977 1.762 -0.538) 2.702 32.290 ( -6.283 3.641 -7.060) 10.128 32.301 ( -2.937 2.952 3.103) 5.193 32.518 ( -14.851 10.414 -7.732) 19.718 34.318 ( 0.593 0.575 1.850) 2.026 34.488 ( 0.918 6.122 -2.899) 6.836 35.335 ( 6.260 -7.155 4.263) 10.419 35.585 ( -4.850 -16.542 12.365) 21.215 35.680 ( 1.433 0.095 2.700) 3.058 35.874 ( -7.289 0.040 1.722) 7.489 37.036 ( 24.392 -21.486 24.229) 40.542 37.663 ( -1.643 -12.356 -0.909) 12.498 ======================= Grid point 93 (35/95) ======================= q-point: ( 0.11 0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.838 ( 6.588 0.000 23.593) 24.496 1.223 ( 11.298 0.000 33.389) 35.249 1.532 ( 14.280 0.000 -14.556) 20.391 1.550 ( 23.229 0.000 28.319) 36.628 1.736 ( 8.295 0.000 -8.604) 11.952 2.722 ( 10.432 0.000 -6.563) 12.324 2.894 ( -4.558 -0.000 -4.152) 6.166 2.912 ( 8.182 0.000 11.102) 13.791 3.082 ( 0.009 0.000 7.811) 7.811 3.209 ( 1.103 0.000 -7.589) 7.669 3.329 ( 4.446 0.000 5.354) 6.959 3.522 ( 3.707 0.000 5.141) 6.339 3.539 ( -0.139 -0.000 -19.799) 19.800 3.632 ( -1.322 -0.000 6.265) 6.403 3.737 ( 6.058 0.000 -4.429) 7.505 3.883 ( -3.144 -0.000 -8.316) 8.891 3.905 ( 2.502 0.000 -3.263) 4.112 4.191 ( -5.236 -0.000 -3.848) 6.498 4.222 ( 1.622 0.000 2.790) 3.228 4.287 ( 6.215 0.000 -5.939) 8.597 4.471 ( -3.554 -0.000 6.120) 7.077 4.545 ( 2.001 0.000 -5.405) 5.764 4.558 ( -6.916 -0.000 -1.524) 7.081 4.810 ( 3.632 0.000 -7.512) 8.344 4.907 ( -5.775 -0.000 13.953) 15.101 4.922 ( 6.334 0.000 -9.078) 11.069 4.989 ( 10.231 0.000 -13.320) 16.796 5.409 ( -3.357 -0.000 1.298) 3.599 5.470 ( 6.293 0.000 3.337) 7.123 5.699 ( 4.513 0.000 -3.053) 5.449 5.991 ( -7.688 -0.000 1.451) 7.824 6.033 ( -10.296 -0.000 -1.551) 10.412 6.242 ( -7.733 -0.000 6.256) 9.947 6.495 ( -6.973 -0.000 -3.815) 7.949 7.247 ( -8.190 -0.000 -3.953) 9.095 7.499 ( 3.696 0.000 4.077) 5.503 7.573 ( -0.358 -0.000 2.441) 2.468 7.687 ( 1.346 0.000 -1.486) 2.005 8.023 ( -4.191 -0.000 7.032) 8.186 8.268 ( -9.040 -0.000 -0.171) 9.042 8.410 ( -7.409 -0.000 5.590) 9.281 8.440 ( -15.756 -0.000 9.331) 18.312 8.731 ( 4.519 0.000 3.770) 5.885 8.851 ( -3.675 -0.000 -3.081) 4.796 8.986 ( -5.328 -0.000 3.973) 6.646 8.990 ( 2.490 0.000 4.273) 4.946 9.527 ( -5.742 -0.000 1.503) 5.935 9.660 ( -3.135 -0.000 -4.308) 5.328 10.016 ( -6.714 -0.000 -3.666) 7.650 10.059 ( 2.475 0.000 0.166) 2.481 10.115 ( -4.831 -0.000 5.329) 7.192 10.387 ( 3.016 0.000 -3.070) 4.303 10.794 ( 1.854 0.000 -1.874) 2.636 10.853 ( -3.530 -0.000 -0.387) 3.551 11.061 ( 9.960 0.000 -3.719) 10.631 11.094 ( 9.501 0.000 4.048) 10.327 12.112 ( -7.378 -0.000 -1.128) 7.463 12.123 ( -5.174 -0.000 1.312) 5.338 12.842 ( -0.663 -0.000 -2.943) 3.017 12.892 ( -3.377 -0.000 -2.391) 4.137 13.169 ( -3.597 -0.000 5.658) 6.705 13.335 ( -10.093 -0.000 1.643) 10.226 13.520 ( -0.603 -0.000 0.551) 0.816 13.565 ( 3.851 0.000 -0.838) 3.941 13.781 ( 4.598 0.000 0.787) 4.665 14.218 ( 14.135 0.000 8.620) 16.556 14.336 ( 7.742 0.000 -0.412) 7.753 14.357 ( 6.701 0.000 -2.814) 7.268 14.841 ( -3.635 -0.000 0.261) 3.645 14.931 ( 14.652 0.000 -1.240) 14.704 15.079 ( -6.013 -0.000 2.671) 6.580 15.361 ( 9.231 0.000 -1.526) 9.356 15.541 ( 9.035 0.000 0.808) 9.072 15.631 ( 40.426 0.000 -27.310) 48.786 16.544 ( -5.378 -0.000 -1.999) 5.737 16.639 ( -3.778 -0.000 -2.199) 4.371 16.698 ( -1.684 -0.000 3.000) 3.440 16.801 ( 2.447 0.000 1.603) 2.925 16.986 ( 1.296 0.000 -0.256) 1.321 17.000 ( 0.515 0.000 -0.830) 0.976 17.159 ( -11.247 -0.000 5.031) 12.321 17.237 ( -3.358 -0.000 5.458) 6.408 19.639 ( 3.081 0.000 1.155) 3.290 19.767 ( 7.276 0.000 -0.208) 7.279 21.501 ( -1.729 -0.000 0.256) 1.748 21.563 ( -2.348 -0.000 -1.203) 2.638 22.955 ( -8.208 -0.000 3.850) 9.066 23.122 ( -4.477 -0.000 -5.078) 6.770 27.761 ( -5.673 -0.000 7.271) 9.222 28.318 ( 3.804 0.000 8.176) 9.017 29.381 ( 2.722 0.000 -3.015) 4.062 29.758 ( 2.574 0.000 -1.138) 2.814 29.840 ( 0.575 0.000 2.765) 2.824 29.932 ( -2.912 -0.000 -3.414) 4.487 30.787 ( 1.918 0.000 1.067) 2.195 31.038 ( 0.088 0.000 1.800) 1.802 31.155 ( 3.362 0.000 -1.574) 3.712 31.158 ( 0.791 0.000 -2.116) 2.259 31.846 ( -2.733 -0.000 1.522) 3.128 31.880 ( 3.343 0.000 2.369) 4.097 32.057 ( -1.203 -0.000 -1.413) 1.856 32.126 ( -2.980 -0.000 -3.207) 4.378 32.252 ( 4.365 0.000 1.319) 4.560 32.268 ( 1.610 0.000 0.167) 1.619 32.406 ( 5.917 0.000 -2.248) 6.330 32.832 ( 24.186 0.000 -17.988) 30.142 34.337 ( -0.673 -0.000 1.980) 2.091 34.376 ( -2.430 -0.000 -2.662) 3.604 35.225 ( -17.458 -0.000 11.131) 20.705 35.551 ( 2.367 0.000 7.016) 7.404 35.807 ( -0.383 -0.000 -3.325) 3.347 35.840 ( 2.878 0.000 0.181) 2.884 37.634 ( -17.867 -0.000 7.769) 19.483 37.642 ( -8.675 -0.000 -5.327) 10.181 ======================= Grid point 94 (36/95) ======================= q-point: ( 0.22 0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.128 ( 6.512 -17.171 17.512) 25.375 1.418 ( 0.831 -7.331 31.409) 32.264 1.667 ( 20.949 -0.750 -7.766) 22.355 1.838 ( 17.018 -8.072 -14.094) 23.525 1.982 ( 23.385 -2.717 22.387) 32.488 2.718 ( -0.562 7.257 -6.132) 9.518 2.790 ( 5.677 5.134 -1.600) 7.820 3.018 ( -0.012 -2.750 3.129) 4.166 3.132 ( 0.189 -3.409 9.563) 10.154 3.232 ( 3.028 0.489 -2.012) 3.668 3.424 ( 3.299 -1.275 -0.268) 3.547 3.494 ( 5.235 -4.803 -19.483) 20.737 3.570 ( 3.658 -0.074 5.703) 6.775 3.659 ( -1.211 -3.066 5.158) 6.121 3.800 ( 2.829 -1.515 -0.584) 3.262 3.825 ( -2.475 -0.825 -8.812) 9.190 3.968 ( 1.350 -4.304 -3.951) 5.996 4.139 ( -0.520 0.217 -1.717) 1.807 4.262 ( 2.624 -1.966 1.372) 3.554 4.338 ( 5.433 0.548 -5.355) 7.648 4.413 ( -9.915 2.080 3.516) 10.724 4.523 ( 4.088 -1.143 1.112) 4.388 4.571 ( 1.729 -3.440 -6.402) 7.470 4.794 ( 2.765 1.194 -3.894) 4.923 4.887 ( 5.268 5.535 -3.724) 8.501 4.943 ( -2.891 -4.426 10.707) 11.941 5.064 ( 2.234 -1.497 -8.500) 8.915 5.431 ( -0.260 -0.767 -2.510) 2.638 5.530 ( 3.557 0.091 -0.566) 3.603 5.748 ( 0.006 -1.975 -2.622) 3.282 5.847 ( -8.985 2.368 -2.521) 9.628 5.973 ( -8.335 -1.972 0.061) 8.565 6.141 ( -11.129 3.153 3.714) 12.148 6.441 ( -8.400 -3.694 -2.246) 9.448 7.165 ( -7.850 -1.066 -2.876) 8.428 7.486 ( -1.574 4.711 3.335) 5.983 7.561 ( 0.845 1.105 4.332) 4.550 7.705 ( 4.941 1.572 -2.995) 5.988 7.990 ( -3.793 1.621 8.366) 9.328 8.160 ( -9.857 0.117 6.532) 11.826 8.320 ( -9.662 2.164 3.673) 10.561 8.377 ( -7.870 -1.944 4.517) 9.280 8.783 ( 2.508 -0.944 0.757) 2.785 8.827 ( -3.855 -0.758 -2.053) 4.433 8.946 ( 1.910 3.016 -0.740) 3.646 9.013 ( 6.073 2.344 1.779) 6.748 9.433 ( -6.818 4.057 2.100) 8.207 9.587 ( -3.424 3.078 -4.028) 6.117 9.921 ( -8.910 1.228 -2.907) 9.452 10.074 ( -5.511 0.847 6.000) 8.191 10.098 ( 0.716 -1.920 -1.174) 2.361 10.425 ( 4.214 -1.126 -2.672) 5.115 10.793 ( 1.101 0.607 -1.174) 1.720 10.850 ( -1.869 -1.711 1.278) 2.838 11.149 ( 9.914 -0.541 -3.972) 10.694 11.223 ( 10.171 -2.631 4.218) 11.321 12.017 ( -6.577 2.275 -1.050) 7.038 12.048 ( -6.138 2.564 0.308) 6.659 12.767 ( -0.249 5.342 -3.581) 6.436 12.894 ( -1.368 -1.339 -2.313) 3.003 13.159 ( -4.275 -1.648 4.450) 6.387 13.238 ( -8.585 1.145 0.394) 8.670 13.516 ( 0.550 0.069 -0.841) 1.007 13.600 ( 2.992 -0.342 -0.271) 3.024 13.810 ( 2.503 0.700 3.380) 4.264 14.207 ( 4.456 8.547 3.079) 10.119 14.441 ( 13.612 1.767 -0.776) 13.748 14.512 ( 7.676 -5.084 0.858) 9.247 14.811 ( -4.061 -0.507 1.152) 4.251 15.057 ( -3.974 -2.328 1.431) 4.823 15.138 ( 20.529 -4.397 2.464) 21.138 15.437 ( 10.979 1.754 -1.699) 11.247 15.640 ( 8.791 -0.765 1.558) 8.961 15.748 ( 25.094 12.025 -14.855) 31.543 16.489 ( -4.759 -0.046 -1.175) 4.902 16.637 ( -3.685 -5.356 -6.108) 8.921 16.714 ( 1.302 -0.242 2.573) 2.894 16.817 ( 2.093 0.476 1.639) 2.700 16.989 ( 1.036 -0.251 -1.619) 1.938 17.011 ( -1.456 -0.642 1.952) 2.519 17.098 ( -4.175 -0.828 2.550) 4.962 17.214 ( -5.026 -0.015 4.133) 6.507 19.670 ( 4.537 0.956 1.694) 4.937 19.851 ( 8.724 -0.140 -1.272) 8.817 21.447 ( -4.038 3.122 1.034) 5.208 21.522 ( -4.127 0.858 -1.678) 4.537 22.897 ( -9.552 -1.884 3.435) 10.324 23.097 ( -3.972 -3.617 -6.207) 8.209 27.754 ( -0.923 -0.558 4.067) 4.208 28.302 ( -1.139 5.810 7.418) 9.491 29.434 ( 6.866 -1.660 -3.951) 8.093 29.663 ( 1.003 8.230 3.149) 8.869 29.832 ( -0.191 2.682 1.274) 2.975 29.922 ( -0.005 -1.313 -2.053) 2.437 30.824 ( 3.234 -1.068 0.351) 3.424 31.075 ( 2.628 2.693 -2.641) 4.598 31.180 ( -3.759 -11.600 -2.296) 12.409 31.309 ( -0.591 -9.676 2.174) 9.934 31.808 ( -1.590 2.117 4.190) 4.957 31.869 ( 1.292 3.852 -1.480) 4.324 32.056 ( -3.569 -0.851 -3.205) 4.872 32.117 ( -1.503 -2.810 -1.431) 3.494 32.294 ( 3.423 -0.373 -0.530) 3.484 32.315 ( 5.753 -1.485 1.090) 6.041 32.497 ( 8.522 -2.392 0.412) 8.861 32.981 ( 14.520 -1.117 -17.129) 22.483 34.338 ( -1.099 -1.343 2.585) 3.113 34.398 ( -2.095 -5.119 -3.095) 6.338 35.062 ( -14.363 4.676 13.037) 19.953 35.567 ( -5.885 -2.218 3.086) 7.006 35.810 ( 8.859 3.143 1.033) 9.457 35.897 ( 4.335 -1.826 -0.746) 4.762 37.144 ( -12.343 27.645 3.006) 30.424 37.599 ( -7.423 3.118 -1.317) 8.158 ======================= Grid point 95 (37/95) ======================= q-point: ( 0.33 0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.513 ( 2.660 -15.453 17.243) 23.306 1.687 ( 3.031 -15.041 15.029) 21.478 1.889 ( 18.688 -4.003 -3.430) 19.417 2.111 ( 15.254 -9.801 -10.981) 21.198 2.195 ( 12.379 4.382 14.504) 19.566 2.555 ( -3.025 6.563 -4.528) 8.528 2.758 ( 2.496 3.143 -0.338) 4.028 3.033 ( -1.605 0.106 1.495) 2.196 3.211 ( 3.083 -0.038 6.683) 7.360 3.230 ( 1.047 2.090 3.045) 3.839 3.434 ( 1.796 -1.679 -5.745) 6.249 3.554 ( -3.948 -2.018 -7.119) 8.387 3.669 ( 7.929 -1.881 -3.692) 8.946 3.741 ( -1.674 -4.362 8.012) 9.275 3.818 ( 2.112 -0.123 -4.663) 5.121 3.901 ( 0.813 -11.184 -6.566) 12.994 4.014 ( 1.582 -2.413 0.580) 2.943 4.190 ( 5.819 -1.812 -0.409) 6.108 4.252 ( -1.480 -0.569 0.274) 1.609 4.356 ( 5.806 0.399 -3.906) 7.009 4.423 ( -1.256 -5.182 3.461) 6.357 4.578 ( 5.284 -1.484 -0.975) 5.575 4.679 ( 0.387 -6.563 -1.573) 6.760 4.805 ( 3.598 1.887 -1.325) 4.273 4.827 ( 1.030 1.576 -3.223) 3.733 5.009 ( -0.279 -0.232 8.381) 8.389 5.061 ( -4.306 -1.253 -5.400) 7.019 5.346 ( 0.591 7.536 -1.061) 7.633 5.518 ( 0.033 2.907 -3.051) 4.214 5.655 ( -7.791 3.523 -2.167) 8.821 5.840 ( -1.687 -2.473 -1.754) 3.470 5.943 ( -4.497 -2.210 -2.081) 5.425 5.999 ( -8.859 1.043 0.477) 8.933 6.429 ( -8.006 -4.053 -0.637) 8.997 7.135 ( -5.577 -4.021 -1.619) 7.064 7.401 ( -0.936 3.751 2.528) 4.619 7.557 ( -0.522 0.841 2.536) 2.722 7.695 ( 3.238 3.003 -3.253) 5.485 7.940 ( -1.797 4.143 6.236) 7.699 8.115 ( -3.763 2.006 -0.004) 4.264 8.225 ( -9.167 -2.443 9.984) 13.772 8.365 ( -6.691 -3.780 3.137) 8.301 8.747 ( -0.893 5.236 -2.595) 5.912 8.818 ( 1.660 0.777 -0.150) 1.839 8.923 ( 1.272 0.883 -2.447) 2.896 9.042 ( 7.838 2.792 -0.547) 8.339 9.295 ( -7.108 4.846 2.137) 8.864 9.479 ( -3.703 4.644 -2.369) 6.395 9.808 ( -8.531 0.912 -2.102) 8.833 10.024 ( -4.569 0.977 5.048) 6.878 10.111 ( -1.659 -0.463 -1.926) 2.584 10.473 ( 3.378 -0.673 -1.679) 3.832 10.804 ( 2.626 -0.103 -1.350) 2.955 10.865 ( -1.774 -1.463 3.231) 3.966 11.235 ( 8.703 -0.181 -3.851) 9.519 11.379 ( 8.413 -3.508 3.427) 9.738 11.910 ( -6.088 2.621 -1.729) 6.850 11.962 ( -2.370 2.302 0.731) 3.384 12.672 ( 0.663 4.752 -3.003) 5.660 12.863 ( -3.966 1.623 -0.737) 4.348 13.149 ( -6.310 0.718 0.092) 6.351 13.163 ( -2.867 -1.807 -0.179) 3.394 13.533 ( 1.489 -1.258 -1.017) 2.199 13.634 ( 2.011 -0.953 1.253) 2.554 13.824 ( 0.377 1.309 6.590) 6.729 14.112 ( 2.900 7.041 1.086) 7.692 14.521 ( 12.683 3.047 -0.803) 13.069 14.608 ( 5.874 0.665 -0.192) 5.915 14.785 ( -3.565 -0.219 1.542) 3.891 15.081 ( -0.731 -3.103 -1.952) 3.738 15.419 ( 15.475 -4.847 5.422) 17.098 15.504 ( 11.203 2.013 -2.580) 11.671 15.702 ( 10.582 6.226 -4.099) 12.944 15.745 ( 8.145 1.781 1.617) 8.493 16.463 ( -3.298 -1.745 1.320) 3.958 16.671 ( -0.619 -2.977 -9.683) 10.150 16.731 ( 0.359 0.376 4.492) 4.522 16.858 ( 2.138 -2.397 1.482) 3.537 16.989 ( -0.540 -0.119 -2.388) 2.451 17.024 ( 1.419 -0.977 0.900) 1.944 17.104 ( -1.570 -1.375 1.926) 2.840 17.170 ( -5.554 -0.287 1.157) 5.680 19.704 ( 4.739 0.999 2.377) 5.394 19.915 ( 8.243 1.365 -2.765) 8.801 21.342 ( -5.484 4.155 2.001) 7.165 21.451 ( -5.172 1.464 -2.332) 5.859 22.868 ( -7.712 -3.228 4.307) 9.405 23.117 ( -2.760 -4.495 -6.370) 8.270 27.775 ( 0.017 -1.139 2.640) 2.875 28.176 ( -2.756 7.859 3.003) 8.854 29.523 ( 6.278 -2.413 -3.382) 7.528 29.576 ( 0.044 4.052 1.639) 4.371 29.775 ( 0.843 3.973 1.190) 4.232 29.948 ( 1.716 -0.639 0.335) 1.861 30.879 ( 3.272 -1.498 0.262) 3.608 31.066 ( 2.364 0.863 -1.059) 2.731 31.300 ( -4.118 -8.292 -2.077) 9.488 31.465 ( -3.859 -10.449 3.128) 11.569 31.747 ( 1.595 7.052 2.536) 7.662 31.827 ( -1.255 -0.375 -0.861) 1.568 32.010 ( -5.119 -0.225 -3.322) 6.107 32.143 ( 0.028 -1.131 0.205) 1.150 32.345 ( 5.002 -1.239 -1.381) 5.335 32.401 ( 4.401 -2.403 -0.240) 5.020 32.612 ( 7.184 -1.061 2.570) 7.704 33.043 ( 6.831 0.190 -12.719) 14.439 34.382 ( -0.922 -3.667 4.119) 5.592 34.479 ( -1.363 -7.970 -4.251) 9.135 34.898 ( -10.422 4.887 11.972) 16.608 35.537 ( -9.743 -2.846 -1.493) 10.259 35.857 ( 12.803 4.977 3.734) 14.235 35.954 ( 2.005 -0.393 0.804) 2.196 36.615 ( -2.636 25.575 -2.607) 25.843 37.441 ( -5.251 7.332 -1.103) 9.085 ======================= Grid point 96 (38/95) ======================= q-point: ( 0.44 0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.790 ( 2.216 -10.207 13.286) 16.900 1.980 ( 2.584 -9.364 9.674) 13.709 2.088 ( 8.947 -3.761 0.544) 9.721 2.176 ( 6.320 7.475 4.858) 10.928 2.355 ( 4.130 -9.071 -11.375) 15.124 2.462 ( 7.470 5.186 -1.815) 9.273 2.722 ( -2.331 3.275 4.960) 6.385 3.056 ( -0.665 -4.555 1.308) 4.785 3.154 ( 1.091 5.720 2.603) 6.379 3.273 ( 0.457 -3.003 6.262) 6.960 3.440 ( 0.471 3.644 -4.994) 6.200 3.502 ( -5.720 -2.202 -8.072) 10.136 3.719 ( -6.153 2.504 6.609) 9.370 3.754 ( 5.413 0.211 -0.398) 5.432 3.845 ( 3.910 0.008 -3.213) 5.061 3.987 ( 0.609 -4.551 -10.957) 11.880 4.137 ( -0.510 -6.499 2.991) 7.173 4.279 ( 2.281 -4.587 -1.542) 5.349 4.381 ( 3.622 -4.348 -0.680) 5.699 4.428 ( 6.588 -5.155 1.420) 8.485 4.528 ( 1.887 -7.591 3.825) 8.707 4.613 ( -2.053 1.727 4.792) 5.492 4.692 ( -2.393 0.633 -3.152) 4.008 4.804 ( -0.207 2.168 -6.612) 6.962 4.871 ( 6.657 -3.614 -0.689) 7.606 4.968 ( 0.205 5.349 6.235) 8.218 5.016 ( -2.926 -1.694 -3.656) 4.980 5.274 ( 2.486 5.234 2.853) 6.458 5.440 ( -3.974 2.117 -3.536) 5.726 5.532 ( -0.097 3.274 -5.213) 6.157 5.839 ( -2.037 -0.894 1.804) 2.864 5.919 ( -1.959 0.711 -5.336) 5.729 5.977 ( -3.426 -3.366 0.994) 4.904 6.413 ( -7.723 -3.209 -0.121) 8.364 7.180 ( -2.044 -5.539 -1.987) 6.229 7.372 ( -0.603 -0.358 1.868) 1.995 7.556 ( 0.711 -1.059 -0.383) 1.332 7.655 ( -0.086 2.761 -1.383) 3.089 7.860 ( 1.589 6.488 2.098) 7.002 8.004 ( -5.284 3.915 1.598) 6.768 8.288 ( -4.202 -6.727 8.742) 11.804 8.395 ( -5.606 -5.901 2.128) 8.413 8.625 ( 0.299 8.383 -0.442) 8.400 8.799 ( 2.591 2.995 -2.744) 4.818 8.934 ( 0.898 -1.311 -0.616) 1.705 9.035 ( 3.242 5.102 -0.378) 6.056 9.172 ( -5.843 2.579 0.513) 6.407 9.365 ( -1.893 4.440 -0.621) 4.867 9.739 ( -5.427 -1.548 -1.307) 5.792 9.997 ( -1.713 -0.028 3.944) 4.300 10.080 ( -2.373 0.450 -2.621) 3.564 10.491 ( 1.549 0.749 -1.246) 2.125 10.830 ( 0.848 -1.027 0.164) 1.342 10.889 ( 1.173 -0.550 2.760) 3.048 11.283 ( 6.077 1.789 -3.237) 7.114 11.485 ( 3.157 -0.946 1.975) 3.842 11.830 ( -3.421 0.637 -1.454) 3.771 11.930 ( 0.164 0.788 0.684) 1.056 12.616 ( 2.541 2.626 -2.802) 4.604 12.786 ( -4.625 1.583 0.644) 4.931 13.092 ( -5.227 -0.365 -0.373) 5.253 13.166 ( -1.164 -1.379 -3.102) 3.589 13.571 ( 1.273 -1.751 -0.697) 2.275 13.673 ( 1.333 -1.093 1.754) 2.460 13.802 ( -1.957 3.028 8.824) 9.533 14.051 ( 3.184 4.133 1.193) 5.352 14.575 ( 10.662 3.880 -0.494) 11.357 14.630 ( 6.116 2.391 -0.983) 6.640 14.761 ( -2.689 -0.010 1.923) 3.306 15.122 ( 1.819 -1.885 -4.265) 5.005 15.539 ( 6.431 1.909 -0.072) 6.708 15.578 ( 6.022 0.938 0.849) 6.154 15.661 ( 2.315 4.596 -1.365) 5.324 15.803 ( 4.438 0.692 2.356) 5.072 16.490 ( -0.913 -2.460 2.647) 3.727 16.672 ( 0.871 -0.522 -5.270) 5.367 16.734 ( -0.341 0.470 2.305) 2.378 16.927 ( 1.266 -3.205 1.120) 3.623 16.974 ( -1.179 0.343 -2.031) 2.374 17.064 ( 2.981 -0.686 -1.733) 3.516 17.098 ( -3.871 -0.994 1.873) 4.414 17.152 ( -2.133 -1.823 -0.480) 2.847 19.733 ( 3.560 1.471 2.682) 4.694 19.944 ( 5.889 2.273 -3.559) 7.247 21.240 ( -4.671 2.381 2.635) 5.868 21.378 ( -4.330 0.532 -2.784) 5.176 22.880 ( -5.382 -3.791 5.226) 8.405 23.153 ( -0.715 -3.875 -6.137) 7.293 27.806 ( 0.115 -1.666 1.855) 2.496 28.036 ( -2.200 6.332 0.406) 6.716 29.521 ( -1.087 2.401 -0.739) 2.737 29.604 ( 3.634 -2.363 -2.530) 5.019 29.743 ( 2.832 2.659 2.923) 4.862 29.962 ( 0.867 0.928 0.565) 1.390 30.930 ( 2.333 -1.095 0.238) 2.589 31.070 ( 1.532 1.084 0.138) 1.882 31.385 ( -2.500 -6.545 -0.413) 7.019 31.589 ( -4.848 -7.640 0.496) 9.062 31.651 ( 2.549 5.737 2.391) 6.718 31.840 ( 0.428 -0.997 1.294) 1.689 31.958 ( -4.842 -0.814 -3.238) 5.881 32.166 ( 2.378 -0.564 0.475) 2.490 32.407 ( 4.181 -1.035 -1.532) 4.572 32.462 ( 2.639 -0.956 -1.410) 3.141 32.662 ( 3.153 1.896 2.193) 4.283 33.047 ( 2.031 0.438 -8.080) 8.343 34.452 ( -1.292 -4.036 5.288) 6.776 34.602 ( -0.392 -7.552 -3.098) 8.172 34.789 ( -6.551 0.849 9.694) 11.731 35.462 ( -12.770 -1.484 -4.609) 13.657 35.853 ( 5.115 10.783 5.232) 13.032 35.953 ( 8.086 2.403 -2.653) 8.843 36.302 ( 6.434 12.809 -2.549) 14.559 37.273 ( -6.177 5.668 -0.703) 8.413 ======================= Grid point 97 (39/95) ======================= q-point: (-0.44 0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.872 ( -5.170 5.021 7.627) 10.493 2.069 ( 3.024 4.267 15.171) 16.047 2.123 ( -1.269 0.268 -0.580) 1.421 2.247 ( 6.803 -0.429 -0.544) 6.838 2.409 ( 3.062 -1.794 -6.564) 7.462 2.479 ( 6.235 3.825 -4.652) 8.669 2.672 ( -2.944 -2.646 9.520) 10.311 3.115 ( -1.763 -5.674 1.572) 6.146 3.137 ( 1.640 3.117 5.286) 6.352 3.319 ( -0.775 6.397 -4.312) 7.753 3.356 ( -3.977 5.862 3.474) 7.889 3.463 ( 0.352 -6.807 -7.414) 10.071 3.649 ( -3.040 0.214 9.152) 9.646 3.776 ( 3.545 1.247 -7.465) 8.357 3.858 ( 3.269 1.861 -2.250) 4.383 4.047 ( 0.582 -4.929 -7.984) 9.401 4.204 ( -9.924 1.890 -2.398) 10.383 4.239 ( -0.988 -0.358 1.801) 2.085 4.433 ( -4.495 -3.390 -0.095) 5.631 4.511 ( 1.739 3.874 2.755) 5.062 4.576 ( -4.871 -1.040 2.777) 5.703 4.629 ( 2.392 0.035 4.700) 5.274 4.718 ( -1.552 -2.019 -0.542) 2.604 4.769 ( -0.407 -2.534 -5.835) 6.375 4.862 ( 2.984 1.416 -1.188) 3.510 4.982 ( 1.483 2.048 -2.362) 3.460 5.152 ( 9.693 -5.588 0.260) 11.192 5.191 ( 4.954 2.660 2.291) 6.072 5.383 ( -2.357 -0.073 -2.937) 3.767 5.544 ( 8.315 0.185 -1.208) 8.404 5.833 ( -3.775 1.421 -0.119) 4.035 5.885 ( 0.119 -2.259 -2.579) 3.431 6.012 ( -0.957 -3.641 -0.961) 3.886 6.401 ( -6.966 -4.087 -0.550) 8.095 7.227 ( -0.278 -1.806 -2.256) 2.903 7.410 ( -0.582 -3.609 -0.533) 3.694 7.594 ( 2.022 2.771 1.089) 3.599 7.631 ( 1.641 -4.305 -0.275) 4.615 7.773 ( 1.340 5.414 -1.354) 5.739 7.944 ( -2.518 -1.006 3.081) 4.104 8.375 ( -4.321 -6.011 4.525) 8.677 8.456 ( -2.353 -1.288 -0.293) 2.698 8.496 ( -0.122 3.642 6.348) 7.319 8.767 ( 2.541 2.521 -3.979) 5.352 8.928 ( -3.258 3.202 0.355) 4.582 8.959 ( -1.821 3.688 1.254) 4.300 9.113 ( -2.953 -2.477 -0.416) 3.877 9.328 ( 3.220 0.494 -0.102) 3.259 9.755 ( -0.854 -4.092 -0.447) 4.204 10.004 ( -0.843 -0.761 0.753) 1.363 10.072 ( 1.341 -1.706 -0.282) 2.188 10.478 ( 0.113 1.046 -1.511) 1.842 10.847 ( -2.014 -1.023 2.405) 3.299 10.907 ( 3.687 1.856 0.311) 4.139 11.269 ( 2.965 4.007 -2.857) 5.745 11.475 ( -3.341 2.182 1.468) 4.252 11.815 ( -0.789 -1.420 -1.013) 1.915 11.933 ( 0.605 -0.258 0.519) 0.837 12.618 ( 4.613 0.260 -3.145) 5.589 12.751 ( -2.070 -0.942 1.610) 2.787 13.058 ( -5.057 -1.430 -0.401) 5.271 13.170 ( -1.337 -1.958 -4.071) 4.710 13.603 ( 1.331 -0.645 -0.900) 1.731 13.699 ( 0.182 -0.484 1.188) 1.296 13.756 ( -1.550 3.004 9.847) 10.411 14.032 ( 2.713 2.465 2.707) 4.557 14.579 ( 6.537 5.003 -0.602) 8.254 14.658 ( 9.201 3.210 -0.004) 9.745 14.761 ( -0.467 -1.586 1.368) 2.146 15.139 ( 1.417 0.394 -5.680) 5.867 15.510 ( -2.285 4.667 1.946) 5.548 15.562 ( -3.569 3.116 -1.871) 5.094 15.594 ( 0.967 3.363 -1.465) 3.793 15.782 ( -1.989 4.193 2.256) 5.161 16.508 ( 0.279 1.125 2.204) 2.490 16.695 ( -0.134 -0.908 4.353) 4.449 16.732 ( 2.684 -0.669 -4.793) 5.534 16.937 ( -2.527 1.190 0.222) 2.802 16.984 ( 0.027 -1.752 -0.804) 1.928 17.061 ( -1.191 -0.668 -4.185) 4.402 17.123 ( 0.032 -2.293 1.276) 2.624 17.167 ( -0.267 -1.165 0.323) 1.239 19.730 ( 1.257 2.520 2.545) 3.796 19.928 ( 2.494 3.139 -3.758) 5.495 21.210 ( -1.711 -1.702 2.757) 3.664 21.349 ( -1.844 -1.708 -2.910) 3.845 22.916 ( -3.309 -3.510 5.534) 7.341 23.193 ( 1.283 -2.606 -5.960) 6.630 27.839 ( -0.274 -1.663 1.428) 2.209 27.940 ( -1.055 3.118 -0.205) 3.298 29.474 ( -0.583 2.153 -0.211) 2.240 29.647 ( 1.513 -0.577 -1.864) 2.469 29.747 ( 2.355 1.245 2.488) 3.645 29.936 ( -1.430 1.693 -0.082) 2.217 30.956 ( 0.857 -0.098 0.491) 0.992 31.056 ( 0.750 1.978 0.463) 2.166 31.467 ( -0.717 -4.663 0.425) 4.737 31.560 ( 3.158 5.105 0.970) 6.081 31.704 ( -3.401 -6.877 0.824) 7.716 31.850 ( -0.819 0.188 1.068) 1.359 31.957 ( -0.354 -3.175 -1.591) 3.569 32.213 ( 5.004 -0.521 0.266) 5.038 32.441 ( 1.917 0.030 -1.816) 2.640 32.474 ( 1.444 0.960 -2.618) 3.140 32.628 ( 0.119 4.231 1.344) 4.441 33.023 ( -2.104 0.188 -5.989) 6.350 34.501 ( -2.200 -0.518 6.748) 7.116 34.638 ( -1.396 -0.677 5.565) 5.777 34.869 ( -0.946 -9.882 2.139) 10.154 35.309 ( -13.246 2.236 -7.311) 15.294 35.723 ( 4.455 8.444 2.033) 9.761 36.003 ( 9.924 2.659 -4.543) 11.233 36.237 ( 7.908 4.033 1.913) 9.080 37.145 ( -8.806 0.857 -0.499) 8.862 ======================= Grid point 98 (40/95) ======================= q-point: (-0.33 0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.644 ( -12.821 13.556 6.160) 19.649 1.902 ( -4.024 16.587 14.103) 22.140 2.035 ( -7.817 7.322 2.804) 11.072 2.271 ( 6.996 2.889 0.608) 7.594 2.389 ( 3.745 8.588 -5.829) 11.034 2.556 ( 4.315 -10.262 -3.739) 11.744 2.854 ( 4.488 -8.921 10.969) 14.834 3.038 ( -2.985 11.952 5.469) 13.479 3.110 ( -5.043 10.507 -4.630) 12.541 3.184 ( 0.919 6.719 3.019) 7.424 3.219 ( -0.112 -4.023 2.412) 4.692 3.548 ( 0.679 -2.690 -2.348) 3.635 3.700 ( -2.708 4.935 -2.594) 6.198 3.736 ( -0.130 -4.238 3.182) 5.301 3.840 ( 1.838 1.399 -12.672) 12.881 4.011 ( -6.830 1.167 2.162) 7.259 4.119 ( -3.999 -3.234 -2.896) 5.903 4.303 ( 2.847 -3.380 -3.897) 5.892 4.383 ( -2.289 7.660 0.756) 8.031 4.426 ( -4.372 -0.787 -2.011) 4.876 4.540 ( -1.823 2.398 1.526) 3.377 4.615 ( -3.238 4.824 4.497) 7.347 4.670 ( -2.716 0.525 4.477) 5.263 4.785 ( 1.556 2.073 -6.342) 6.852 4.935 ( 0.788 -7.916 -3.570) 8.720 5.000 ( 3.143 -1.498 2.884) 4.520 5.090 ( 6.355 7.921 -3.318) 10.684 5.344 ( -2.539 -2.896 -0.422) 3.875 5.376 ( 4.265 3.818 -1.051) 5.820 5.694 ( 14.489 -6.172 -0.492) 15.757 5.787 ( 0.094 -0.329 1.080) 1.133 5.957 ( 0.505 -5.814 -3.790) 6.959 6.093 ( 2.965 -6.027 -1.903) 6.982 6.410 ( -7.090 -5.224 -1.393) 8.916 7.239 ( 0.903 -0.382 -2.035) 2.259 7.427 ( -0.653 0.213 -0.121) 0.697 7.575 ( 0.038 1.300 -0.458) 1.379 7.683 ( -0.123 1.236 -2.150) 2.483 7.778 ( 5.153 -3.836 1.607) 6.622 8.012 ( 0.696 -7.111 1.455) 7.291 8.360 ( -0.794 5.906 8.131) 10.081 8.444 ( -4.277 -6.211 3.713) 8.406 8.564 ( 2.592 -2.207 1.793) 3.847 8.736 ( 0.959 1.933 -1.685) 2.738 8.838 ( -7.607 -0.247 -0.470) 7.626 8.867 ( -4.036 3.163 0.541) 5.156 9.189 ( 1.329 -5.465 1.297) 5.772 9.396 ( 4.006 -4.366 -1.282) 6.062 9.842 ( 3.432 -4.431 0.098) 5.605 10.017 ( -1.576 -2.634 -1.002) 3.229 10.149 ( 4.493 -2.891 2.023) 5.712 10.452 ( -1.433 0.962 -1.916) 2.579 10.840 ( -0.875 0.486 1.464) 1.774 10.902 ( 3.185 2.580 -0.259) 4.107 11.192 ( 0.565 6.166 -2.604) 6.717 11.374 ( -8.295 3.651 1.934) 9.267 11.856 ( 1.767 -3.247 -0.403) 3.719 11.956 ( 0.826 -1.876 0.039) 2.050 12.672 ( 6.097 -1.500 -3.278) 7.083 12.775 ( -1.680 -2.959 1.353) 3.662 13.035 ( -5.805 -1.933 0.699) 6.158 13.193 ( -1.050 -3.660 -3.286) 5.030 13.602 ( 0.791 1.589 -0.551) 1.859 13.694 ( 0.166 1.817 1.335) 2.261 13.758 ( 0.383 -0.703 8.922) 8.958 14.031 ( 2.643 1.763 2.773) 4.217 14.543 ( 6.040 6.191 -0.029) 8.649 14.686 ( 9.577 4.229 0.904) 10.508 14.809 ( 1.419 -2.889 0.797) 3.315 15.087 ( -3.428 3.559 -4.802) 6.890 15.354 ( -12.622 6.306 -0.047) 14.110 15.430 ( -7.790 4.051 -0.746) 8.812 15.533 ( 0.578 4.680 -2.755) 5.461 15.660 ( -5.797 5.918 2.260) 8.587 16.488 ( 0.969 2.176 3.326) 4.091 16.693 ( 0.287 1.093 1.450) 1.838 16.790 ( 3.675 -1.931 -2.103) 4.654 16.895 ( -2.078 1.045 0.764) 2.448 16.976 ( -2.560 0.059 -2.923) 3.886 17.052 ( -0.306 -0.005 -3.814) 3.826 17.169 ( 0.492 -2.259 0.375) 2.342 17.184 ( -0.291 -1.050 2.015) 2.291 19.694 ( -0.324 2.905 2.056) 3.574 19.871 ( 0.026 3.509 -3.870) 5.224 21.272 ( 0.487 -4.927 2.530) 5.560 21.381 ( 0.538 -3.679 -2.745) 4.621 22.964 ( -1.364 -3.079 5.102) 6.113 23.226 ( 2.604 -1.179 -5.829) 6.492 27.849 ( -2.259 -0.294 3.350) 4.051 27.925 ( 0.968 -1.589 -1.687) 2.511 29.431 ( -0.126 3.220 2.173) 3.887 29.643 ( 0.337 1.351 -1.479) 2.031 29.749 ( 0.998 0.926 1.053) 1.721 29.895 ( -2.749 0.135 -1.156) 2.985 30.954 ( -0.510 0.779 1.302) 1.601 31.023 ( 0.482 2.549 -0.148) 2.598 31.507 ( 1.356 0.874 2.297) 2.807 31.530 ( 3.046 2.612 1.517) 4.290 31.779 ( -3.087 -6.033 -2.085) 7.091 31.853 ( -1.288 -2.087 0.097) 2.455 32.027 ( 4.185 -2.648 0.520) 4.979 32.257 ( 2.911 0.787 0.741) 3.105 32.421 ( -1.534 2.075 -0.972) 2.757 32.456 ( 0.129 1.547 -3.918) 4.214 32.564 ( 5.668 5.064 -1.002) 7.667 32.954 ( -7.541 0.645 -7.787) 10.859 34.459 ( -1.808 4.082 6.227) 7.662 34.713 ( 0.541 -5.406 11.542) 12.756 34.957 ( -0.370 3.166 -2.115) 3.825 35.192 ( -9.939 -7.411 -3.706) 12.940 35.678 ( 4.198 3.195 1.599) 5.513 35.980 ( -1.726 3.174 -2.330) 4.299 36.357 ( 19.080 -2.976 -0.793) 19.327 37.081 ( -12.589 -5.600 -0.450) 13.786 ======================= Grid point 99 (41/95) ======================= q-point: (-0.22 0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.264 ( -12.423 18.240 8.739) 23.736 1.591 ( -5.212 20.654 18.360) 28.122 1.810 ( -10.367 8.774 2.284) 13.772 2.166 ( -2.700 16.895 -2.484) 17.288 2.289 ( 4.007 5.978 -0.225) 7.201 2.670 ( 1.079 8.109 -5.484) 9.849 2.769 ( 1.146 4.544 4.064) 6.203 2.874 ( -2.295 6.327 5.145) 8.472 3.112 ( 0.295 -4.014 5.188) 6.566 3.186 ( 2.450 -5.956 2.983) 7.097 3.271 ( 2.640 -0.180 3.091) 4.069 3.551 ( -5.443 3.539 -3.369) 7.314 3.591 ( 0.878 -1.177 -4.015) 4.275 3.758 ( 5.158 5.221 -7.884) 10.771 3.806 ( -2.701 -1.147 0.560) 2.988 3.975 ( -0.635 1.527 -1.971) 2.574 4.077 ( -3.762 1.234 -2.528) 4.697 4.235 ( -5.414 4.673 -0.253) 7.156 4.348 ( -0.638 3.532 -4.745) 5.950 4.398 ( 3.415 -0.786 -5.066) 6.160 4.426 ( -3.029 5.614 6.285) 8.955 4.619 ( 2.728 -2.286 2.202) 4.185 4.642 ( -2.461 2.182 2.747) 4.285 4.764 ( 0.130 -2.038 -3.077) 3.693 4.992 ( 1.420 6.744 -4.115) 8.027 5.012 ( -3.142 1.702 1.858) 4.027 5.089 ( 2.219 -7.560 -1.751) 8.071 5.269 ( -0.090 5.700 -2.392) 6.182 5.381 ( 3.306 -0.934 -0.144) 3.438 5.844 ( 5.305 -1.651 2.424) 6.061 5.912 ( 7.096 -6.058 -1.847) 9.511 6.034 ( 0.906 -3.868 -7.767) 8.724 6.250 ( 4.746 -7.236 -1.942) 8.869 6.439 ( -4.542 -6.251 -3.039) 8.303 7.249 ( 1.380 -0.404 -1.441) 2.036 7.432 ( -0.882 -1.409 3.851) 4.194 7.526 ( -0.865 2.793 -5.539) 6.263 7.658 ( -0.872 0.046 -1.505) 1.740 7.897 ( 5.144 -2.670 3.349) 6.693 8.162 ( -0.651 -8.972 -1.105) 9.064 8.342 ( -0.058 -1.396 14.324) 14.392 8.514 ( -2.039 -3.193 8.012) 8.862 8.597 ( 4.628 1.757 1.842) 5.282 8.727 ( -1.393 -0.963 -0.393) 1.739 8.800 ( -2.717 0.493 -0.708) 2.851 8.821 ( -5.121 -5.566 -2.148) 7.863 9.301 ( 0.751 -6.237 2.291) 6.687 9.517 ( 2.499 -6.398 -3.665) 7.785 9.948 ( 6.316 -2.422 -0.125) 6.766 10.055 ( -2.563 -4.231 -0.082) 4.947 10.230 ( 1.602 -1.172 3.394) 3.931 10.410 ( -1.154 1.059 -3.238) 3.597 10.837 ( 0.473 0.151 0.525) 0.723 10.886 ( 3.834 2.632 -1.566) 4.907 11.077 ( 1.317 7.431 -0.919) 7.603 11.222 ( -10.661 4.130 1.687) 11.557 11.948 ( 2.806 -4.856 0.510) 5.631 12.016 ( 1.046 -4.168 -0.357) 4.312 12.754 ( 5.304 -2.504 -2.489) 6.371 12.812 ( -3.048 -4.092 -1.063) 5.212 13.036 ( -3.789 -3.577 4.424) 6.836 13.247 ( -0.555 -4.313 -1.777) 4.697 13.578 ( 0.731 1.949 0.692) 2.194 13.660 ( 0.824 2.550 -0.522) 2.730 13.803 ( -1.922 -1.439 9.478) 9.778 14.037 ( 3.484 1.778 0.560) 3.952 14.489 ( 6.416 7.641 0.596) 9.995 14.699 ( 8.554 5.206 -0.281) 10.017 14.865 ( -0.611 -1.709 2.905) 3.425 14.929 ( -9.146 6.394 -0.153) 11.160 15.083 ( -17.102 6.588 -2.449) 18.490 15.304 ( -4.740 2.807 -4.478) 7.100 15.451 ( 0.294 5.043 -0.417) 5.069 15.513 ( -5.048 5.207 0.775) 7.294 16.490 ( 1.515 0.006 3.632) 3.935 16.684 ( 1.352 1.250 -0.022) 1.842 16.806 ( -0.089 1.832 -0.515) 1.905 16.897 ( 2.472 -0.909 0.944) 2.798 16.930 ( -3.046 0.782 -4.922) 5.841 17.029 ( -0.952 1.007 -2.015) 2.446 17.188 ( -1.880 -1.203 3.319) 4.000 17.224 ( 1.211 -1.788 0.345) 2.187 19.649 ( -0.630 2.353 1.362) 2.791 19.804 ( -0.032 2.833 -4.176) 5.046 21.372 ( 0.064 -5.344 2.025) 5.715 21.453 ( 1.589 -4.198 -2.246) 5.020 23.020 ( -0.092 -2.882 3.749) 4.730 23.245 ( 2.867 0.203 -5.576) 6.274 27.847 ( -5.040 -2.083 6.386) 8.398 27.978 ( 2.551 -3.283 -2.834) 5.032 29.376 ( 0.599 4.405 4.729) 6.490 29.602 ( -1.686 2.515 -0.448) 3.061 29.751 ( 0.914 -0.017 0.288) 0.958 29.882 ( -1.563 -1.839 -2.750) 3.659 30.920 ( -2.201 2.644 2.518) 4.264 30.994 ( 1.452 1.299 -1.966) 2.768 31.480 ( 4.430 6.553 2.602) 8.326 31.540 ( -0.558 -1.699 4.059) 4.435 31.831 ( -2.629 -4.173 -3.807) 6.230 31.881 ( -1.415 -2.589 -3.236) 4.379 32.114 ( 6.230 -1.373 1.778) 6.623 32.244 ( -0.862 1.548 1.011) 2.040 32.352 ( -4.186 2.612 -1.165) 5.070 32.383 ( -2.689 3.847 0.334) 4.706 32.578 ( 16.162 6.291 -6.471) 18.511 32.804 ( -11.766 2.720 -14.138) 18.594 34.396 ( -0.605 3.901 5.515) 6.782 34.784 ( 2.452 9.639 -5.249) 11.246 34.914 ( -2.986 -10.762 18.119) 21.284 35.273 ( -5.972 -8.556 1.236) 10.506 35.690 ( 3.749 0.948 2.763) 4.753 35.892 ( -5.323 2.017 -0.160) 5.694 36.653 ( 23.331 -7.162 -1.319) 24.441 37.103 ( -15.425 -14.452 -1.032) 21.163 ======================= Grid point 100 (42/95) ======================= q-point: (-0.11 0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.942 ( 3.165 16.560 16.312) 23.459 1.241 ( -1.472 23.698 18.848) 30.315 1.592 ( -6.584 9.979 13.595) 18.104 1.802 ( -9.816 15.438 -4.604) 18.865 2.071 ( 0.908 18.357 -5.183) 19.096 2.606 ( 8.620 1.093 -1.427) 8.805 2.689 ( -3.208 4.741 7.670) 9.571 2.885 ( 1.727 -2.533 1.061) 3.244 3.191 ( -1.311 0.924 6.007) 6.217 3.242 ( -1.015 -2.711 2.483) 3.814 3.333 ( 2.250 -1.066 2.050) 3.225 3.470 ( -0.967 1.398 -3.802) 4.165 3.567 ( 0.857 2.270 -9.500) 9.805 3.703 ( 4.788 3.370 -5.839) 8.269 3.769 ( -2.025 2.648 1.907) 3.841 3.941 ( 2.858 3.688 -4.345) 6.375 4.041 ( 0.260 0.257 0.874) 0.948 4.121 ( -4.264 1.924 -4.795) 6.699 4.283 ( 5.271 5.284 1.150) 7.552 4.334 ( -1.633 1.340 0.061) 2.113 4.454 ( -0.690 -2.305 -0.958) 2.590 4.571 ( -3.748 2.846 1.709) 5.007 4.658 ( 2.368 0.537 -3.483) 4.246 4.799 ( -1.183 -0.535 -6.092) 6.229 4.846 ( -4.172 6.398 0.312) 7.644 4.941 ( 0.030 2.165 1.205) 2.478 5.176 ( 1.585 1.806 -3.751) 4.454 5.259 ( 1.279 -4.464 6.851) 8.276 5.445 ( 5.272 -1.850 -1.842) 5.883 5.901 ( 0.437 -0.340 -7.788) 7.808 5.986 ( -0.165 -0.718 -6.983) 7.021 6.083 ( 2.946 -2.761 -1.933) 4.477 6.330 ( -3.395 -1.774 -0.430) 3.854 6.519 ( 1.604 -4.725 -4.087) 6.450 7.285 ( 0.498 -3.102 0.023) 3.142 7.452 ( -0.176 2.852 -3.603) 4.598 7.471 ( -1.658 -3.007 4.263) 5.474 7.667 ( 0.348 -1.688 -2.213) 2.805 7.973 ( 0.947 -1.949 5.315) 5.739 8.242 ( -3.781 -4.967 -5.344) 8.218 8.465 ( -3.835 -4.938 16.434) 17.583 8.573 ( 0.821 -0.338 9.009) 9.052 8.624 ( 0.589 -3.571 5.927) 6.945 8.762 ( 0.549 -5.042 3.045) 5.916 8.818 ( 0.247 -4.804 0.412) 4.828 8.875 ( 1.848 -2.714 -5.024) 6.002 9.424 ( -0.431 -7.529 1.872) 7.770 9.612 ( -0.345 -5.167 -5.638) 7.655 10.026 ( 4.509 -0.287 -0.192) 4.523 10.100 ( -1.362 -3.243 -0.276) 3.528 10.212 ( -5.267 1.630 4.638) 7.205 10.398 ( 2.181 0.325 -4.492) 5.004 10.810 ( -4.275 0.980 0.556) 4.421 10.907 ( 9.827 1.742 -4.556) 10.971 10.997 ( 5.874 6.009 2.834) 8.868 11.061 ( -9.762 3.401 0.961) 10.382 12.053 ( 0.446 -5.050 1.531) 5.296 12.097 ( -0.480 -4.884 -0.342) 4.919 12.814 ( -3.704 -4.147 -0.288) 5.568 12.874 ( 3.819 -3.806 -3.603) 6.485 13.104 ( -0.710 -4.295 7.092) 8.322 13.311 ( -0.439 -4.375 0.104) 4.398 13.552 ( 0.171 1.911 0.544) 1.994 13.629 ( -0.486 1.322 -1.230) 1.870 13.793 ( -8.966 0.588 9.605) 13.152 14.032 ( 3.452 2.488 -0.981) 4.367 14.409 ( 2.742 7.463 1.750) 8.141 14.565 ( -13.159 8.735 -5.734) 16.803 14.792 ( 7.325 5.142 2.258) 9.230 14.866 ( 8.356 2.513 5.124) 10.118 14.950 ( -3.301 -0.359 -0.713) 3.396 15.241 ( 0.436 -0.105 -5.816) 5.833 15.331 ( -7.109 4.995 3.068) 9.214 15.452 ( 5.134 2.884 -1.461) 6.068 16.537 ( 0.962 -2.753 2.486) 3.831 16.675 ( 1.571 1.408 -1.108) 2.383 16.763 ( -0.321 2.279 0.450) 2.345 16.862 ( -3.471 1.846 -4.609) 6.058 16.948 ( 3.430 -0.820 0.945) 3.651 16.995 ( -0.578 1.402 -0.794) 1.712 17.203 ( -4.902 -2.768 6.037) 8.254 17.256 ( 0.675 -0.851 0.461) 1.180 19.616 ( -0.223 1.340 0.878) 1.618 19.760 ( 1.629 1.884 -4.522) 5.163 21.449 ( -1.332 -3.955 1.427) 4.410 21.525 ( 1.303 -3.288 -1.652) 3.904 23.066 ( -1.422 -1.920 1.529) 2.836 23.236 ( 1.517 1.642 -5.024) 5.499 27.852 ( -10.467 -4.128 9.201) 14.535 28.069 ( 5.162 -4.382 -1.987) 7.057 29.355 ( 3.717 1.673 7.898) 8.888 29.534 ( -2.754 2.360 0.120) 3.628 29.769 ( 1.309 -0.810 0.465) 1.608 29.908 ( 0.131 -2.918 -3.534) 4.585 30.852 ( -2.531 3.196 2.785) 4.937 30.997 ( 2.320 -0.412 -3.403) 4.139 31.398 ( 2.754 8.189 2.634) 9.032 31.581 ( -1.693 -1.292 3.651) 4.227 31.805 ( -4.763 2.224 -7.732) 9.350 31.892 ( -2.857 -3.102 -5.853) 7.214 32.186 ( 2.715 -0.375 1.708) 3.230 32.219 ( 0.197 0.935 1.007) 1.389 32.255 ( -2.473 3.673 -0.754) 4.491 32.307 ( -0.354 3.938 -0.930) 4.062 32.515 ( -9.020 7.503 -3.293) 12.186 32.644 ( 19.545 9.221 -20.968) 30.111 34.354 ( -0.059 2.450 4.368) 5.008 34.609 ( -0.551 9.087 -5.605) 10.691 35.179 ( -7.182 -16.360 21.045) 27.606 35.353 ( 0.680 -4.672 1.740) 5.032 35.726 ( 0.640 -1.282 5.636) 5.815 35.837 ( 0.451 1.260 0.399) 1.396 36.967 ( 7.523 -12.556 10.048) 17.754 37.314 ( -2.481 -21.752 -4.256) 22.303 ======================= Grid point 103 (43/95) ======================= q-point: ( 0.22 0.22 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.093 ( 7.156 0.000 18.280) 19.631 1.429 ( -1.996 -0.000 28.239) 28.309 1.830 ( 11.683 0.000 -10.620) 15.788 1.873 ( 22.120 0.000 -2.380) 22.247 2.329 ( 29.781 0.000 17.626) 34.606 2.792 ( -3.053 -0.000 -2.689) 4.069 2.878 ( 3.902 0.000 -2.441) 4.603 3.045 ( 9.168 0.000 -1.943) 9.371 3.067 ( -4.373 -0.000 7.542) 8.718 3.275 ( 8.371 0.000 -8.214) 11.728 3.391 ( -3.428 -0.000 -12.142) 12.617 3.457 ( 4.124 0.000 -0.698) 4.182 3.607 ( -0.093 -0.000 8.744) 8.745 3.654 ( -1.264 -0.000 7.564) 7.669 3.761 ( -1.649 -0.000 -5.910) 6.135 3.797 ( 0.816 0.000 -10.097) 10.130 3.954 ( 5.465 0.000 -3.721) 6.612 4.165 ( 5.366 0.000 -1.192) 5.497 4.247 ( 2.634 0.000 2.782) 3.831 4.330 ( -13.353 -0.000 3.065) 13.700 4.428 ( 9.504 0.000 -8.385) 12.674 4.530 ( 3.480 0.000 3.773) 5.133 4.565 ( 4.240 0.000 -8.472) 9.474 4.817 ( 1.590 0.000 -5.097) 5.340 4.865 ( -3.404 -0.000 7.641) 8.365 5.004 ( 6.470 0.000 -5.076) 8.224 5.125 ( 6.687 0.000 -3.665) 7.625 5.333 ( -3.490 -0.000 0.040) 3.491 5.578 ( 3.357 0.000 1.302) 3.601 5.727 ( -3.821 -0.000 -0.275) 3.831 5.827 ( -5.935 -0.000 -2.138) 6.308 5.836 ( -7.510 -0.000 -0.530) 7.529 6.088 ( -11.330 -0.000 4.071) 12.039 6.275 ( -13.683 -0.000 -2.908) 13.989 7.069 ( -8.372 -0.000 -0.750) 8.406 7.525 ( -2.326 -0.000 4.726) 5.268 7.590 ( 0.726 0.000 1.852) 1.989 7.769 ( 5.431 0.000 -0.221) 5.435 7.982 ( -5.684 -0.000 8.928) 10.584 8.049 ( -13.280 -0.000 9.900) 16.564 8.283 ( -5.047 -0.000 -3.905) 6.382 8.296 ( -7.009 -0.000 4.099) 8.119 8.763 ( -0.851 -0.000 -1.749) 1.945 8.823 ( 2.875 0.000 -1.098) 3.078 8.982 ( 1.008 0.000 -1.618) 1.906 9.087 ( 6.126 0.000 -1.178) 6.238 9.403 ( -8.175 -0.000 2.814) 8.646 9.561 ( -4.804 -0.000 -3.730) 6.082 9.843 ( -8.590 -0.000 -2.842) 9.048 10.036 ( -5.807 -0.000 2.490) 6.319 10.094 ( -0.473 -0.000 4.241) 4.268 10.456 ( 5.954 0.000 -3.819) 7.074 10.806 ( 0.269 0.000 -0.112) 0.292 10.830 ( 0.270 0.000 1.735) 1.756 11.221 ( 9.242 0.000 -4.104) 10.112 11.313 ( 10.551 0.000 4.364) 11.418 11.963 ( -7.063 -0.000 -1.488) 7.218 12.012 ( -5.922 -0.000 0.226) 5.927 12.834 ( -1.376 -0.000 -1.553) 2.075 12.855 ( 4.142 0.000 -6.761) 7.928 13.094 ( -7.487 -0.000 5.270) 9.156 13.161 ( -8.832 -0.000 -0.842) 8.872 13.525 ( 1.779 0.000 -1.917) 2.615 13.617 ( 1.051 0.000 0.359) 1.110 13.843 ( 1.626 0.000 3.617) 3.965 14.321 ( -2.945 -0.000 3.655) 4.693 14.554 ( 15.127 0.000 -2.685) 15.363 14.616 ( 15.725 0.000 0.612) 15.737 14.773 ( -3.427 -0.000 0.824) 3.525 15.014 ( -1.449 -0.000 1.205) 1.885 15.310 ( 20.934 0.000 4.840) 21.486 15.561 ( 11.377 0.000 0.312) 11.381 15.720 ( 8.318 0.000 2.592) 8.712 16.022 ( 14.261 0.000 -16.653) 21.925 16.459 ( 0.849 0.000 -6.751) 6.805 16.500 ( -8.075 -0.000 0.739) 8.108 16.738 ( 2.199 0.000 2.569) 3.382 16.829 ( -1.087 -0.000 0.665) 1.275 16.988 ( -0.883 -0.000 0.403) 0.971 16.999 ( 1.314 0.000 0.280) 1.343 17.061 ( -2.276 -0.000 0.220) 2.287 17.177 ( -6.092 -0.000 4.978) 7.867 19.743 ( 7.330 0.000 0.672) 7.360 19.946 ( 10.743 0.000 1.132) 10.802 21.431 ( -6.188 -0.000 1.427) 6.350 21.471 ( -6.558 -0.000 -1.707) 6.777 22.798 ( -9.539 -0.000 3.988) 10.339 23.004 ( -3.943 -0.000 -7.109) 8.129 27.757 ( 0.049 0.000 2.825) 2.825 28.338 ( -6.564 -0.000 8.442) 10.694 29.501 ( 11.075 0.000 -4.830) 12.083 29.769 ( -0.767 -0.000 2.081) 2.218 29.838 ( -4.261 -0.000 -3.121) 5.282 29.880 ( 1.239 0.000 3.109) 3.347 30.863 ( 6.125 0.000 -1.693) 6.355 31.047 ( -0.234 -0.000 1.940) 1.954 31.162 ( 0.886 0.000 -2.104) 2.283 31.193 ( 1.128 0.000 0.095) 1.132 31.779 ( -5.011 -0.000 2.086) 5.428 31.959 ( 2.639 0.000 2.020) 3.323 32.025 ( -5.400 -0.000 -2.969) 6.162 32.061 ( 3.043 0.000 -2.245) 3.781 32.337 ( 5.786 0.000 0.798) 5.841 32.348 ( 4.311 0.000 -1.525) 4.573 32.573 ( 10.359 0.000 3.522) 10.942 33.043 ( 9.794 0.000 -15.756) 18.552 34.320 ( -1.883 -0.000 -1.730) 2.557 34.332 ( -0.574 -0.000 1.197) 1.328 35.001 ( -14.161 -0.000 13.261) 19.400 35.454 ( -11.279 -0.000 -1.240) 11.347 35.941 ( 11.617 0.000 3.520) 12.138 35.950 ( 9.071 0.000 -2.191) 9.332 37.355 ( -16.408 -0.000 9.559) 18.989 37.427 ( -8.193 -0.000 -10.289) 13.153 ======================= Grid point 104 (44/95) ======================= q-point: ( 0.33 0.22 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.333 ( 4.757 -13.962 14.620) 20.768 1.551 ( -0.035 -7.965 18.396) 20.046 1.964 ( 9.898 -6.230 -5.720) 13.019 2.066 ( 15.267 -0.952 0.570) 15.308 2.555 ( 18.524 5.711 9.667) 21.661 2.650 ( -1.245 9.550 -1.284) 9.716 2.910 ( 6.233 5.585 -1.887) 8.579 2.964 ( -4.448 -0.819 3.018) 5.437 3.212 ( 3.772 -5.681 1.415) 6.964 3.324 ( -2.459 1.258 -11.220) 11.555 3.357 ( 7.857 0.283 -0.907) 7.914 3.519 ( 0.240 -0.964 -2.177) 2.393 3.646 ( 0.784 -5.856 4.133) 7.210 3.690 ( 0.497 -4.008 4.445) 6.006 3.751 ( 0.658 -3.135 -8.071) 8.683 3.801 ( -1.555 -0.597 0.144) 1.672 4.010 ( 2.997 -2.072 -2.232) 4.273 4.202 ( -4.030 0.641 -0.916) 4.183 4.241 ( 6.798 -1.164 -1.573) 7.074 4.335 ( 3.071 -3.802 4.623) 6.728 4.431 ( 2.354 2.855 -10.297) 10.942 4.603 ( 3.500 -3.110 -3.963) 6.134 4.619 ( 7.785 -1.794 0.645) 8.015 4.816 ( 2.457 -0.326 -0.236) 2.490 4.896 ( -1.492 -1.127 -0.091) 1.873 4.999 ( 4.545 5.348 -1.486) 7.174 5.082 ( 0.285 2.705 4.395) 5.169 5.388 ( -0.812 -1.309 -2.627) 3.045 5.596 ( 2.545 2.695 0.393) 3.728 5.631 ( -6.821 1.787 -0.599) 7.076 5.757 ( -3.366 -1.434 -1.902) 4.123 5.852 ( -3.335 -3.570 -0.886) 4.965 5.932 ( -10.838 3.095 0.227) 11.274 6.226 ( -12.611 -7.711 -1.121) 14.824 7.018 ( -6.739 -2.669 1.894) 7.492 7.474 ( -1.622 4.299 3.744) 5.927 7.575 ( -1.041 1.855 1.591) 2.656 7.776 ( 1.922 3.642 -2.051) 4.601 7.955 ( -5.896 -1.188 9.185) 10.979 8.026 ( -7.604 -5.676 6.197) 11.333 8.197 ( -2.627 3.653 -1.679) 4.803 8.267 ( -5.700 -1.683 2.247) 6.354 8.755 ( -1.584 -0.577 -4.110) 4.443 8.850 ( 5.075 1.025 -0.653) 5.219 8.964 ( 0.841 2.285 -2.201) 3.282 9.135 ( 6.802 0.661 -4.130) 7.985 9.302 ( -8.376 3.613 3.700) 9.843 9.485 ( -5.267 2.058 -2.766) 6.295 9.741 ( -8.011 1.564 -1.992) 8.401 10.000 ( -5.216 -1.273 2.656) 5.990 10.089 ( -2.064 0.724 3.578) 4.193 10.500 ( 4.996 0.120 -3.586) 6.151 10.813 ( 0.074 -0.444 0.252) 0.516 10.851 ( 1.616 -0.911 2.744) 3.312 11.302 ( 9.151 -0.439 -4.163) 10.063 11.433 ( 9.017 -1.252 3.833) 9.877 11.882 ( -5.929 1.572 -1.418) 6.295 11.956 ( -4.266 0.496 0.344) 4.309 12.768 ( 2.387 5.132 -3.566) 6.690 12.861 ( -1.440 2.039 -1.651) 2.993 13.071 ( -6.092 -3.743 1.338) 7.274 13.081 ( -7.230 -0.301 -1.439) 7.378 13.542 ( 3.273 -0.040 -2.579) 4.167 13.630 ( -0.241 -1.137 1.309) 1.750 13.864 ( 0.938 0.747 5.688) 5.813 14.241 ( -2.414 5.553 2.860) 6.696 14.680 ( 12.603 1.370 -2.893) 13.003 14.716 ( 8.499 2.328 -1.673) 8.970 14.764 ( 1.349 -0.477 1.218) 1.879 15.040 ( 2.561 -2.079 0.174) 3.303 15.527 ( 15.687 -1.811 5.723) 16.797 15.646 ( 10.726 2.293 0.000) 10.969 15.800 ( 6.507 0.160 2.162) 6.859 15.955 ( 4.711 10.443 -5.270) 12.610 16.409 ( -3.631 -0.587 0.284) 3.689 16.563 ( 1.281 -6.426 -8.850) 11.011 16.761 ( 1.298 0.552 3.783) 4.037 16.826 ( -1.639 -1.748 0.903) 2.561 16.978 ( -0.842 0.065 -0.087) 0.849 17.031 ( 3.824 -0.867 -1.959) 4.383 17.063 ( -1.430 -1.973 0.794) 2.563 17.121 ( -6.864 0.716 3.072) 7.554 19.802 ( 8.356 2.206 1.300) 8.739 20.033 ( 10.121 2.209 -0.030) 10.359 21.344 ( -7.907 2.668 2.343) 8.668 21.396 ( -7.544 0.207 -2.379) 7.913 22.750 ( -7.948 -2.823 4.657) 9.635 22.990 ( -2.827 -4.397 -7.223) 8.915 27.769 ( 0.108 -0.533 2.394) 2.455 28.246 ( -7.269 4.456 4.370) 9.581 29.578 ( 9.077 1.132 -5.226) 10.535 29.665 ( -1.369 6.774 0.994) 6.982 29.828 ( 0.399 0.148 0.930) 1.022 29.931 ( 0.137 -2.676 2.422) 3.612 30.916 ( 6.341 0.401 -0.790) 6.403 31.104 ( 1.645 -0.318 -1.417) 2.194 31.136 ( -0.352 -4.900 -0.797) 4.977 31.292 ( -2.246 -7.432 1.969) 8.010 31.757 ( -4.172 -2.159 2.042) 5.122 31.893 ( -0.898 6.065 -1.533) 6.320 31.978 ( -2.157 1.169 -0.152) 2.458 32.119 ( 2.121 -2.308 -1.166) 3.344 32.382 ( 5.186 -0.351 -2.151) 5.625 32.417 ( 6.349 -1.243 0.585) 6.496 32.682 ( 7.538 -0.335 5.283) 9.211 33.066 ( 4.403 0.364 -12.622) 13.373 34.329 ( -0.644 -2.904 0.506) 3.017 34.360 ( -0.454 -3.701 -1.133) 3.897 34.890 ( -11.635 2.495 12.169) 17.020 35.365 ( -11.718 -2.864 -3.791) 12.645 36.026 ( 9.959 1.430 -2.715) 10.421 36.046 ( 11.180 2.241 5.687) 12.742 36.978 ( -6.329 21.427 -0.039) 22.342 37.406 ( -10.658 -1.596 -3.033) 11.195 ======================= Grid point 105 (45/95) ======================= q-point: ( 0.44 0.22 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.642 ( 1.969 -13.645 10.824) 17.528 1.796 ( 1.451 -14.851 10.128) 18.034 2.156 ( 7.651 -6.234 1.084) 9.928 2.176 ( 3.370 -2.093 -2.121) 4.499 2.456 ( 5.433 12.732 0.577) 13.855 2.630 ( 8.150 2.516 -0.469) 8.543 2.874 ( 8.815 7.789 5.537) 13.001 2.966 ( -3.937 -2.402 1.476) 4.843 3.226 ( -1.813 3.955 -4.405) 6.191 3.323 ( 3.763 -1.492 2.147) 4.582 3.370 ( -2.932 0.171 -2.128) 3.627 3.487 ( 2.238 1.564 -4.528) 5.288 3.706 ( -7.449 1.528 6.805) 10.204 3.784 ( -1.769 -5.282 -3.896) 6.797 3.812 ( 4.996 -1.207 1.931) 5.490 3.867 ( 2.319 -10.040 -7.905) 12.987 4.057 ( -0.337 -2.668 2.740) 3.839 4.213 ( 1.935 -3.660 0.567) 4.179 4.339 ( -1.171 -0.626 -7.750) 7.863 4.401 ( 3.187 -4.586 -2.977) 6.329 4.447 ( 6.052 -4.829 1.856) 7.962 4.650 ( -1.133 -1.848 -2.424) 3.253 4.680 ( 2.339 3.976 5.264) 7.000 4.863 ( 3.496 3.443 -1.174) 5.045 4.907 ( 5.467 -2.509 -1.414) 6.180 4.940 ( 1.935 0.423 -5.630) 5.968 5.065 ( -0.148 2.929 5.887) 6.577 5.362 ( -0.122 1.563 4.729) 4.982 5.484 ( -1.316 6.909 -5.074) 8.673 5.578 ( 1.622 2.429 -2.598) 3.910 5.766 ( -6.316 -3.759 1.262) 7.457 5.861 ( -2.032 -2.571 -4.694) 5.725 5.892 ( -2.715 -3.202 1.048) 4.327 6.233 ( -11.626 -6.686 -0.568) 13.424 7.053 ( -3.079 -6.348 2.861) 7.614 7.402 ( -0.842 3.856 2.656) 4.758 7.544 ( -0.745 -0.169 -1.113) 1.350 7.701 ( -1.378 3.748 -2.186) 4.552 7.941 ( -3.493 0.847 7.573) 8.383 8.051 ( -0.315 3.519 -3.401) 4.904 8.153 ( -4.465 -5.029 7.695) 10.220 8.262 ( -5.769 -3.630 2.494) 7.258 8.722 ( 1.039 2.841 -4.422) 5.358 8.867 ( 3.600 2.638 -1.983) 4.884 8.929 ( 0.802 1.053 -0.233) 1.344 9.149 ( 3.699 4.567 -2.542) 6.403 9.164 ( -6.986 3.573 0.805) 7.888 9.391 ( -3.742 2.299 -2.213) 4.917 9.654 ( -6.207 -0.574 -0.831) 6.289 9.999 ( -2.266 -2.161 2.164) 3.806 10.053 ( -2.540 1.770 2.469) 3.959 10.515 ( 2.043 1.051 -2.821) 3.638 10.814 ( -1.723 -0.546 2.124) 2.789 10.911 ( 4.634 -1.390 1.624) 5.103 11.369 ( 8.216 1.337 -3.958) 9.217 11.521 ( 4.539 0.275 2.632) 5.254 11.808 ( -3.616 1.109 -0.863) 3.879 11.922 ( -3.015 -0.463 0.336) 3.069 12.711 ( 5.544 4.713 -3.945) 8.277 12.779 ( -4.443 2.802 1.543) 5.475 13.019 ( -7.005 -0.875 -0.397) 7.070 13.092 ( -3.290 -3.398 -3.599) 5.943 13.573 ( 3.945 -0.399 -2.387) 4.628 13.656 ( -0.914 -1.925 1.589) 2.658 13.862 ( -0.337 2.305 8.520) 8.833 14.143 ( -1.685 4.476 2.759) 5.522 14.705 ( 2.759 1.320 -2.500) 3.950 14.757 ( 8.297 3.062 0.876) 8.887 14.793 ( 8.782 2.508 -2.534) 9.479 15.108 ( 4.311 -1.561 -1.601) 4.856 15.640 ( 5.315 2.606 4.680) 7.546 15.690 ( 8.644 3.283 -1.154) 9.318 15.774 ( 0.022 7.916 -2.153) 8.204 15.882 ( 5.188 2.464 2.700) 6.347 16.431 ( -1.311 -4.112 2.315) 4.897 16.631 ( 1.865 -3.252 -8.369) 9.170 16.759 ( -0.960 1.450 4.845) 5.148 16.868 ( -0.628 -4.063 0.631) 4.160 16.971 ( -0.291 0.399 -0.559) 0.746 17.047 ( -6.425 0.665 0.997) 6.536 17.082 ( 3.680 -1.699 -3.038) 5.066 17.094 ( -0.732 -2.121 1.156) 2.524 19.833 ( 6.951 3.660 2.429) 8.223 20.059 ( 7.705 4.360 -2.244) 9.133 21.229 ( -7.728 2.353 2.930) 8.593 21.320 ( -6.168 -0.301 -2.946) 6.842 22.763 ( -6.217 -4.805 5.702) 9.708 23.042 ( -0.851 -5.956 -6.875) 9.136 27.790 ( 0.101 -1.057 2.252) 2.490 28.107 ( -4.957 5.590 0.663) 7.500 29.560 ( -0.838 3.811 -1.161) 4.071 29.619 ( 4.527 0.665 -2.296) 5.120 29.832 ( 3.966 2.454 1.687) 4.959 29.968 ( -0.510 -0.939 1.658) 1.972 30.961 ( 4.812 0.595 0.088) 4.850 31.103 ( 1.845 1.058 -0.488) 2.182 31.250 ( 0.023 -7.658 -1.692) 7.843 31.396 ( -5.109 -8.556 2.773) 10.344 31.782 ( -1.008 4.278 -1.535) 4.656 31.788 ( -0.977 -2.858 2.401) 3.859 31.928 ( -2.151 2.338 -0.140) 3.180 32.166 ( 2.369 -1.832 -1.327) 3.276 32.433 ( 4.570 -0.685 -2.469) 5.240 32.486 ( 5.299 0.208 0.644) 5.342 32.733 ( 2.787 1.906 4.191) 5.382 33.050 ( 1.028 0.772 -8.480) 8.577 34.388 ( -0.264 -3.849 2.222) 4.452 34.451 ( 0.455 -8.074 -2.519) 8.470 34.783 ( -8.687 2.520 11.035) 14.269 35.289 ( -11.522 -2.449 -5.313) 12.922 36.036 ( 4.373 6.459 2.916) 8.327 36.121 ( 13.096 3.293 0.075) 13.504 36.619 ( 3.252 18.389 -1.799) 18.761 37.269 ( -11.037 3.966 -2.087) 11.912 ======================= Grid point 106 (46/95) ======================= q-point: ( 0.56 0.22 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.856 ( -1.421 -6.368 5.820) 8.743 2.053 ( 1.728 -10.246 4.160) 11.193 2.171 ( -1.095 2.116 8.035) 8.381 2.334 ( 0.833 -0.160 -5.551) 5.616 2.361 ( 12.244 -0.287 3.446) 12.723 2.645 ( 3.035 1.598 -1.058) 3.590 2.772 ( 4.358 15.233 7.504) 17.531 2.977 ( -4.020 -4.164 0.620) 5.821 3.214 ( 1.887 -1.436 0.346) 2.396 3.322 ( -1.233 -2.542 -5.275) 5.984 3.358 ( 0.587 1.829 2.429) 3.097 3.468 ( 1.343 3.802 -0.494) 4.062 3.619 ( -7.414 -0.464 6.142) 9.639 3.839 ( 4.459 2.243 -2.975) 5.811 3.848 ( 0.341 -3.528 -8.293) 9.019 3.968 ( 2.533 -2.901 -8.487) 9.320 4.124 ( -5.773 -3.206 2.357) 7.012 4.239 ( -1.374 1.359 3.509) 4.006 4.316 ( -4.879 -3.508 -4.142) 7.299 4.478 ( -5.178 -4.328 4.212) 7.955 4.567 ( 2.158 -0.842 0.207) 2.325 4.649 ( 0.756 -1.475 -1.151) 2.018 4.704 ( 5.777 -1.448 3.793) 7.061 4.746 ( -0.654 4.930 -6.238) 7.978 4.945 ( 1.239 4.159 -2.654) 5.086 4.997 ( 1.006 -1.145 -0.723) 1.687 5.105 ( 8.650 -4.553 5.307) 11.123 5.348 ( 3.370 3.871 4.028) 6.524 5.386 ( 1.961 1.702 -6.513) 7.012 5.608 ( 6.615 -0.627 0.250) 6.649 5.772 ( -4.274 -3.460 -1.208) 5.630 5.850 ( -2.373 0.005 -3.657) 4.359 5.935 ( -1.092 -4.003 0.593) 4.192 6.221 ( -11.638 -5.645 -1.282) 12.999 7.164 ( 0.625 -6.037 1.836) 6.341 7.359 ( -1.298 -0.319 0.640) 1.482 7.582 ( 2.883 -3.453 -2.358) 5.079 7.639 ( -1.453 1.342 0.015) 1.978 7.903 ( 0.534 4.834 3.149) 5.794 7.935 ( -1.998 5.276 0.110) 5.643 8.250 ( -4.174 -6.415 5.835) 9.624 8.302 ( -5.494 -7.768 2.341) 9.798 8.645 ( 1.984 7.493 -0.103) 7.752 8.827 ( 2.494 3.050 -3.798) 5.472 8.944 ( -0.137 0.876 0.259) 0.924 9.026 ( -3.891 5.260 0.923) 6.607 9.076 ( -2.108 2.882 -0.756) 3.650 9.350 ( 0.561 0.323 -3.812) 3.866 9.656 ( -2.498 -4.715 0.947) 5.419 10.002 ( -3.281 -0.074 -2.345) 4.033 10.051 ( 2.766 -1.754 5.406) 6.321 10.490 ( -0.429 1.583 -3.048) 3.461 10.817 ( -2.163 -1.014 3.773) 4.466 10.972 ( 4.984 0.325 -0.142) 4.997 11.380 ( 6.364 4.565 -3.182) 8.454 11.506 ( -1.659 3.890 1.619) 4.529 11.782 ( -1.220 -1.001 -0.310) 1.608 11.913 ( -2.566 -1.348 0.189) 2.904 12.696 ( 7.294 3.058 -3.590) 8.686 12.726 ( -2.117 0.359 1.994) 2.931 12.978 ( -5.468 -1.506 -0.839) 5.734 13.093 ( -4.222 -2.630 -4.227) 6.528 13.612 ( 3.950 -0.428 -2.186) 4.535 13.675 ( -2.146 -1.443 1.022) 2.781 13.839 ( 0.515 3.236 10.194) 10.707 14.080 ( -2.821 1.915 4.146) 5.368 14.710 ( 4.053 0.973 -2.435) 4.828 14.769 ( 5.996 3.063 0.861) 6.788 14.835 ( 11.399 3.631 -2.517) 12.225 15.140 ( 1.325 0.483 -3.111) 3.415 15.584 ( -2.273 6.897 2.236) 7.599 15.623 ( -3.178 7.352 0.071) 8.010 15.690 ( 6.058 4.586 -1.882) 7.828 15.857 ( -0.107 5.119 1.889) 5.457 16.507 ( 1.060 -3.415 2.267) 4.234 16.673 ( 0.732 -1.787 -2.415) 3.092 16.735 ( -0.953 0.220 1.899) 2.136 16.938 ( -0.826 -1.513 1.053) 2.020 16.946 ( -0.759 -0.828 -0.378) 1.186 16.995 ( -3.805 -0.974 -3.066) 4.983 17.123 ( 0.185 -1.273 0.697) 1.463 17.132 ( 1.933 -1.617 -1.451) 2.908 19.820 ( 3.355 4.770 2.958) 6.539 20.024 ( 4.331 5.501 -3.524) 7.838 21.163 ( -4.855 -1.076 2.995) 5.805 21.285 ( -2.864 -1.955 -3.182) 4.706 22.816 ( -4.649 -5.438 6.282) 9.521 23.119 ( 1.063 -5.263 -6.523) 8.449 27.818 ( 0.133 -1.384 1.859) 2.321 27.987 ( -2.527 4.375 -0.587) 5.086 29.506 ( 0.047 2.139 0.207) 2.150 29.642 ( 1.581 -0.563 -2.044) 2.645 29.829 ( 4.639 3.368 1.246) 5.866 29.950 ( -2.552 1.795 0.459) 3.153 30.983 ( 2.679 1.113 0.589) 2.960 31.093 ( 0.624 1.567 0.033) 1.687 31.377 ( 1.696 -6.726 0.111) 6.938 31.491 ( -5.412 -8.253 0.461) 9.880 31.712 ( 2.077 3.688 0.914) 4.330 31.862 ( -1.440 2.627 2.080) 3.647 31.870 ( -0.659 -5.658 -0.346) 5.707 32.228 ( 3.598 -2.761 -2.592) 5.224 32.464 ( 3.028 0.656 -2.454) 3.952 32.505 ( 2.317 1.989 0.086) 3.055 32.704 ( 0.164 3.698 2.979) 4.752 33.012 ( -0.913 1.776 -5.879) 6.209 34.460 ( -0.674 -4.048 4.303) 5.946 34.597 ( 0.880 -6.873 -0.989) 6.999 34.726 ( -5.644 -2.647 8.702) 10.705 35.191 ( -9.727 0.121 -6.799) 11.868 35.927 ( 1.975 9.953 4.039) 10.921 36.164 ( 10.946 5.662 -6.280) 13.831 36.444 ( 9.340 9.534 2.518) 13.582 37.081 ( -12.496 4.084 -1.618) 13.245 ======================= Grid point 107 (47/95) ======================= q-point: (-0.33 0.22 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.796 ( -3.942 10.547 4.016) 11.954 2.079 ( -2.647 8.329 -5.849) 10.516 2.147 ( -5.092 3.302 13.711) 14.994 2.348 ( 5.816 -1.640 1.310) 6.183 2.487 ( 4.769 2.004 3.139) 6.051 2.569 ( 1.265 9.428 2.151) 9.753 2.745 ( 5.545 -10.679 6.322) 13.593 3.073 ( -1.379 -7.128 -1.080) 7.340 3.165 ( -2.503 4.019 2.381) 5.300 3.255 ( -2.347 9.254 2.707) 9.923 3.369 ( 1.880 5.947 2.436) 6.695 3.455 ( 1.703 -5.261 -4.219) 6.955 3.640 ( -4.028 -5.208 3.938) 7.672 3.805 ( 2.634 6.950 -1.331) 7.550 3.859 ( 2.986 -0.269 -11.621) 12.002 3.975 ( -8.168 3.175 0.058) 8.764 4.011 ( 0.501 -2.866 -7.055) 7.631 4.257 ( -2.257 -1.974 -7.334) 7.923 4.346 ( -0.715 -3.562 4.039) 5.432 4.487 ( -4.228 2.921 3.796) 6.389 4.529 ( -0.512 1.661 -0.406) 1.785 4.626 ( -5.512 0.682 -0.091) 5.555 4.706 ( 3.541 1.072 2.191) 4.300 4.801 ( 3.480 -0.573 -2.084) 4.097 4.874 ( 0.266 2.024 -2.098) 2.928 5.018 ( 2.194 -0.954 -2.108) 3.189 5.240 ( -2.973 -4.370 3.787) 6.503 5.292 ( 6.106 7.426 -0.547) 9.629 5.466 ( 8.128 -0.119 -1.165) 8.212 5.665 ( -0.212 -5.365 0.571) 5.400 5.797 ( 2.742 -0.549 -1.545) 3.195 5.872 ( 2.529 -4.763 -1.938) 5.731 6.015 ( 2.163 -5.664 -0.762) 6.111 6.204 ( -11.778 -6.746 -2.459) 13.794 7.232 ( 1.168 -1.321 0.784) 1.930 7.394 ( 0.224 -2.975 -3.625) 4.695 7.600 ( -1.975 1.213 3.814) 4.463 7.703 ( 4.379 -4.313 -1.688) 6.374 7.795 ( 1.930 5.164 -0.118) 5.514 7.912 ( -3.155 -2.936 1.605) 4.599 8.322 ( -2.489 -5.880 4.850) 8.019 8.411 ( -2.869 -6.522 0.168) 7.127 8.540 ( 0.280 4.725 6.448) 7.999 8.797 ( 2.743 2.966 -4.057) 5.726 8.826 ( -4.912 6.715 0.320) 8.326 8.913 ( -1.813 5.107 -0.989) 5.509 9.118 ( 1.172 -5.124 2.029) 5.635 9.356 ( 0.432 -2.046 -3.861) 4.391 9.759 ( 0.893 -7.328 2.363) 7.751 9.978 ( -1.825 -0.823 -1.614) 2.572 10.142 ( 3.767 -3.283 4.015) 6.410 10.446 ( -1.654 1.267 -3.522) 4.092 10.823 ( -1.913 -0.678 3.772) 4.283 10.989 ( 4.364 2.356 -2.316) 5.473 11.324 ( 4.373 7.089 -1.766) 8.515 11.387 ( -6.096 5.911 1.647) 8.650 11.816 ( 1.258 -3.001 0.184) 3.259 11.917 ( -2.126 -1.973 -0.431) 2.932 12.713 ( -2.492 -1.175 2.224) 3.541 12.736 ( 8.530 1.122 -4.732) 9.819 12.952 ( -5.273 -1.530 0.577) 5.520 13.100 ( -2.427 -4.146 -3.866) 6.167 13.632 ( 1.586 1.039 -0.828) 2.068 13.677 ( -2.019 -1.117 -0.017) 2.308 13.837 ( 2.907 2.454 10.046) 10.742 14.046 ( -4.076 -0.221 4.803) 6.303 14.728 ( 7.946 3.646 -1.461) 8.864 14.791 ( 4.667 0.575 1.237) 4.862 14.862 ( 8.431 3.856 -2.795) 9.683 15.091 ( -3.994 2.926 -3.438) 6.028 15.391 ( -6.884 10.482 0.535) 12.552 15.472 ( -3.858 7.316 -0.458) 8.284 15.644 ( 3.950 5.849 -1.038) 7.134 15.733 ( -3.699 7.442 1.084) 8.381 16.545 ( 1.777 1.697 3.013) 3.888 16.679 ( -3.683 -2.050 3.395) 5.412 16.779 ( 3.579 -2.789 -2.565) 5.212 16.894 ( -1.928 1.293 -0.220) 2.332 16.956 ( -0.940 0.753 -2.534) 2.805 17.016 ( -0.205 -3.013 -3.435) 4.574 17.146 ( 0.231 -1.196 0.741) 1.426 17.164 ( 0.423 -1.332 0.409) 1.456 19.763 ( 0.200 4.706 2.788) 5.474 19.946 ( 1.733 5.663 -4.027) 7.162 21.191 ( -1.875 -4.705 2.757) 5.766 21.314 ( 0.373 -3.745 -2.997) 4.811 22.886 ( -3.051 -5.153 6.079) 8.533 23.190 ( 2.072 -3.588 -6.202) 7.459 27.842 ( -0.185 -0.508 1.587) 1.677 27.919 ( -0.796 1.278 -0.530) 1.596 29.485 ( 0.992 1.838 2.127) 2.981 29.650 ( 0.001 -0.064 -1.752) 1.753 29.813 ( 3.311 3.700 0.322) 4.975 29.879 ( -3.751 1.999 -0.792) 4.323 30.980 ( 0.907 1.551 1.314) 2.226 31.064 ( -0.210 2.077 -0.101) 2.090 31.481 ( 0.184 -3.633 2.163) 4.232 31.573 ( -0.984 -5.226 -0.613) 5.353 31.703 ( 3.043 0.994 0.496) 3.240 31.809 ( -3.488 -0.059 0.247) 3.497 31.985 ( 2.271 -5.795 2.125) 6.576 32.286 ( 1.514 -1.019 -2.937) 3.458 32.450 ( 0.881 2.857 -1.539) 3.362 32.478 ( 0.728 1.973 -2.244) 3.075 32.664 ( 2.326 2.114 1.348) 3.420 32.928 ( -2.778 4.498 -5.522) 7.644 34.512 ( -0.799 0.369 7.688) 7.738 34.641 ( -3.377 -3.501 8.855) 10.103 34.874 ( 0.808 -12.770 -0.988) 12.834 35.065 ( -5.520 3.752 -8.090) 10.488 35.811 ( 1.971 7.043 3.541) 8.126 36.077 ( 2.873 9.078 -6.424) 11.486 36.501 ( 15.176 -0.333 3.090) 15.491 36.905 ( -14.218 1.070 -1.699) 14.359 ======================= Grid point 108 (48/95) ======================= q-point: (-0.22 0.22 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.531 ( -1.379 17.517 6.788) 18.837 1.881 ( 0.044 10.491 -6.251) 12.212 1.949 ( -7.851 16.718 21.394) 28.263 2.336 ( -2.084 7.422 -2.140) 8.000 2.396 ( 0.060 4.654 -1.881) 5.020 2.668 ( 7.180 -6.494 -0.645) 9.703 2.908 ( -6.216 4.184 5.631) 9.373 3.031 ( -2.548 8.395 3.834) 9.574 3.064 ( 3.232 -1.450 2.598) 4.393 3.214 ( 0.446 2.563 5.555) 6.134 3.292 ( 4.793 2.999 5.604) 7.961 3.537 ( 0.744 -3.972 -5.499) 6.824 3.596 ( -1.695 4.428 -1.997) 5.145 3.760 ( -0.257 -2.283 1.508) 2.748 3.870 ( 7.971 3.199 -14.238) 16.628 3.952 ( 0.117 -2.246 -2.179) 3.132 4.014 ( -3.225 -1.213 -0.597) 3.497 4.261 ( -2.709 -4.935 -9.321) 10.889 4.312 ( -3.383 8.265 2.604) 9.302 4.422 ( 2.266 0.592 -2.001) 3.080 4.521 ( -1.591 1.310 2.243) 3.046 4.564 ( -3.446 1.540 4.085) 5.562 4.712 ( 2.281 0.223 5.352) 5.822 4.782 ( 2.305 3.875 -5.333) 6.984 4.915 ( -0.126 -6.165 -4.515) 7.643 5.029 ( -1.660 1.631 2.627) 3.510 5.176 ( 0.750 7.393 -0.991) 7.497 5.274 ( -1.014 0.097 -4.359) 4.476 5.454 ( 3.120 2.888 3.548) 5.538 5.816 ( 1.005 -7.859 -5.398) 9.587 5.848 ( 3.359 -2.648 1.316) 4.476 5.974 ( 1.279 -4.334 -0.109) 4.520 6.128 ( -6.499 -7.452 -0.818) 9.921 6.264 ( 3.183 -9.117 -3.908) 10.417 7.262 ( 1.787 -0.375 0.362) 1.861 7.404 ( -0.537 -0.434 -3.860) 3.921 7.562 ( -1.606 2.501 1.878) 3.516 7.681 ( 1.308 3.400 -2.144) 4.227 7.890 ( 3.637 -4.735 3.744) 7.047 7.968 ( -5.199 -8.931 -1.369) 10.424 8.387 ( -1.287 3.781 8.510) 9.401 8.447 ( 1.780 -7.390 6.458) 9.975 8.613 ( -4.050 -8.758 1.948) 9.843 8.694 ( 0.714 4.243 -1.800) 4.664 8.751 ( 0.617 4.204 -1.197) 4.414 8.828 ( 0.309 3.111 -1.460) 3.450 9.220 ( -0.069 -5.303 3.123) 6.155 9.412 ( -0.396 -5.750 -4.111) 7.079 9.902 ( 0.329 -7.432 2.505) 7.850 9.989 ( 0.658 -1.864 -1.492) 2.476 10.221 ( -0.601 -1.640 4.134) 4.487 10.407 ( 0.102 0.530 -3.934) 3.971 10.824 ( -1.588 -0.079 2.258) 2.762 10.975 ( 3.960 2.354 -3.862) 6.012 11.224 ( -6.872 6.371 1.193) 9.446 11.238 ( 5.036 7.687 0.556) 9.206 11.894 ( 1.537 -4.029 0.870) 4.399 11.943 ( -1.607 -3.650 -1.076) 4.131 12.706 ( -4.962 -2.088 -0.051) 5.384 12.793 ( 7.357 -0.204 -4.602) 8.680 12.962 ( -1.477 -3.569 4.260) 5.751 13.155 ( -0.554 -4.854 -3.224) 5.854 13.619 ( 0.785 1.476 1.022) 1.960 13.659 ( -3.155 0.354 -0.567) 3.225 13.851 ( 0.702 2.344 9.944) 10.241 14.041 ( -2.547 -1.639 2.253) 3.775 14.689 ( 0.510 7.789 1.449) 7.939 14.824 ( -0.412 5.928 -3.726) 7.013 14.839 ( 2.451 -1.328 1.133) 3.009 14.976 ( -2.466 3.578 -0.972) 4.452 15.171 ( 4.140 11.577 1.150) 12.348 15.321 ( -2.155 5.796 -5.147) 8.046 15.563 ( -3.148 8.178 0.472) 8.776 15.588 ( 3.300 5.262 -0.066) 6.212 16.528 ( 0.279 2.036 4.847) 5.265 16.693 ( -1.611 -1.249 1.645) 2.620 16.832 ( 1.845 0.467 -0.799) 2.064 16.876 ( -0.907 -1.427 -2.837) 3.303 16.926 ( 0.906 1.126 -1.935) 2.415 17.026 ( 0.217 0.089 -3.855) 3.862 17.163 ( -1.572 -1.019 1.339) 2.303 17.200 ( 0.850 -1.999 1.044) 2.410 19.696 ( -0.804 3.553 2.086) 4.198 19.862 ( 1.419 4.559 -4.162) 6.334 21.276 ( -1.516 -5.906 2.135) 6.460 21.388 ( 1.785 -4.513 -2.309) 5.374 22.958 ( -2.045 -4.314 5.085) 6.975 23.237 ( 1.949 -1.730 -5.777) 6.338 27.829 ( -1.608 1.287 3.021) 3.657 27.936 ( 1.123 -2.952 -1.324) 3.425 29.464 ( 1.335 3.177 4.421) 5.605 29.629 ( -0.580 1.977 -1.598) 2.608 29.768 ( -1.482 1.765 0.147) 2.309 29.845 ( 0.640 -0.174 -2.425) 2.514 30.955 ( -0.528 2.447 1.937) 3.165 31.028 ( 0.229 1.771 -0.637) 1.897 31.526 ( -0.598 -1.736 3.650) 4.086 31.604 ( 0.744 2.626 3.782) 4.664 31.732 ( 1.244 -2.688 -3.998) 4.975 31.810 ( -2.512 -2.909 -1.869) 4.274 32.103 ( 1.837 -4.758 2.903) 5.869 32.261 ( -2.807 1.452 -1.282) 3.410 32.390 ( 0.970 4.439 -1.079) 4.670 32.437 ( 0.706 3.196 -1.406) 3.562 32.681 ( -3.573 -1.214 -7.021) 7.971 32.802 ( 6.384 6.954 -4.869) 10.621 34.479 ( -0.773 4.295 8.434) 9.496 34.749 ( -5.155 -9.231 13.199) 16.911 34.919 ( -1.703 6.691 -7.764) 10.390 35.095 ( 4.812 -10.716 -1.652) 11.862 35.747 ( -1.226 2.983 3.617) 4.846 35.946 ( 2.835 6.465 -3.319) 7.801 36.713 ( -1.569 -10.962 0.635) 11.092 36.787 ( 1.060 -0.598 -2.089) 2.417 ======================= Grid point 109 (49/95) ======================= q-point: (-0.11 0.22 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.321 ( 11.499 14.404 11.021) 21.475 1.645 ( -2.228 19.819 21.483) 29.313 1.730 ( 3.757 8.049 -2.750) 9.299 2.025 ( -7.318 18.458 -2.089) 19.965 2.343 ( 2.108 9.986 -2.033) 10.407 2.673 ( -0.850 4.332 -6.681) 8.008 2.794 ( -0.716 4.634 5.993) 7.610 2.910 ( 0.066 3.652 7.164) 8.041 3.156 ( 0.470 -3.751 4.660) 6.001 3.192 ( -1.279 -0.886 3.155) 3.518 3.361 ( 3.864 -0.852 4.559) 6.037 3.508 ( 3.567 2.818 -3.878) 5.975 3.622 ( 6.554 1.035 -6.393) 9.213 3.755 ( -1.565 1.138 -4.525) 4.922 3.832 ( 3.929 4.162 -3.025) 6.474 3.985 ( 2.586 -0.561 -3.867) 4.686 4.032 ( 2.502 -1.625 0.498) 3.025 4.142 ( -3.253 7.651 -1.790) 8.505 4.289 ( -2.800 -2.363 -2.952) 4.705 4.390 ( -1.956 1.844 -4.323) 5.091 4.468 ( 2.610 3.816 5.432) 7.133 4.547 ( -4.206 0.453 2.603) 4.967 4.725 ( 4.331 3.833 -4.170) 7.130 4.787 ( 3.554 -2.751 0.079) 4.494 4.910 ( -6.517 8.094 1.828) 10.551 4.955 ( -2.224 -0.485 -0.961) 2.471 5.155 ( 1.773 -6.141 -0.437) 6.406 5.235 ( 0.466 2.545 -5.560) 6.132 5.481 ( 3.636 0.226 3.950) 5.373 5.864 ( -0.956 -1.401 -10.606) 10.741 5.918 ( -2.518 -3.568 0.231) 4.373 6.033 ( -1.770 -3.060 1.427) 3.812 6.174 ( -9.243 -8.425 -3.165) 12.901 6.450 ( 5.967 -6.094 -2.607) 8.918 7.271 ( 0.715 0.686 0.379) 1.061 7.402 ( -1.914 -1.833 -3.335) 4.260 7.510 ( 0.337 2.566 1.788) 3.145 7.657 ( 1.458 0.579 -2.408) 2.874 7.952 ( -4.504 -3.143 3.178) 6.346 8.085 ( -1.207 -7.288 -0.850) 7.436 8.378 ( -6.167 -1.889 16.061) 17.307 8.593 ( -3.720 -1.606 2.760) 4.902 8.626 ( 2.066 -0.529 6.671) 7.004 8.671 ( 0.214 -4.096 -2.803) 4.968 8.806 ( 5.548 -4.875 -2.253) 7.722 8.817 ( 3.851 -0.473 -1.378) 4.117 9.314 ( -1.631 -5.894 3.093) 6.853 9.491 ( -1.805 -6.024 -4.638) 7.814 9.978 ( -5.548 -4.650 -0.370) 7.248 10.063 ( 4.871 -2.738 0.357) 5.599 10.191 ( -6.487 1.156 2.851) 7.180 10.416 ( 2.876 0.007 -2.734) 3.968 10.800 ( -1.723 1.157 -0.042) 2.076 10.973 ( -0.398 0.258 -0.959) 1.070 11.080 ( 0.738 5.792 -2.035) 6.183 11.185 ( 8.064 6.618 2.766) 10.793 11.966 ( -1.903 -4.400 1.045) 4.907 11.997 ( -2.180 -4.832 -0.871) 5.372 12.700 ( -4.658 -3.213 -1.370) 5.822 12.862 ( 4.376 -2.543 -2.487) 5.639 13.057 ( 2.986 -4.352 5.263) 7.454 13.222 ( -0.986 -4.786 -1.793) 5.205 13.592 ( -1.306 2.689 -0.482) 3.028 13.615 ( -2.732 0.713 1.578) 3.235 13.815 ( -3.283 3.211 8.086) 9.299 14.045 ( -2.266 -0.722 0.485) 2.427 14.502 ( -8.321 7.678 0.923) 11.360 14.640 ( -5.524 7.543 -0.954) 9.398 14.871 ( -0.564 -0.512 1.927) 2.072 14.982 ( 12.773 3.910 1.059) 13.400 15.138 ( 16.905 6.162 0.248) 17.995 15.233 ( 3.349 2.359 -6.889) 8.015 15.401 ( -2.360 7.082 -0.198) 7.467 15.561 ( 6.230 3.679 0.361) 7.244 16.523 ( -0.821 -0.057 4.586) 4.659 16.697 ( -0.528 -0.125 1.102) 1.228 16.810 ( 1.667 2.921 -0.382) 3.385 16.844 ( -2.578 1.202 -6.677) 7.258 16.958 ( 2.738 -1.413 1.653) 3.497 17.010 ( 0.544 0.929 -2.843) 3.040 17.160 ( -2.654 -0.364 2.925) 3.966 17.237 ( -0.299 -1.601 0.456) 1.692 19.647 ( -0.163 2.198 1.353) 2.586 19.808 ( 2.824 2.775 -4.119) 5.713 21.357 ( -2.486 -5.326 1.475) 6.060 21.470 ( 1.061 -4.047 -1.713) 4.521 23.008 ( -3.190 -2.651 3.628) 5.511 23.246 ( 0.525 0.312 -5.344) 5.379 27.800 ( -2.802 0.999 4.601) 5.479 28.019 ( 2.727 -5.348 -1.134) 6.110 29.444 ( 2.636 2.728 6.369) 7.413 29.565 ( -1.090 3.733 -1.552) 4.187 29.750 ( -1.848 -1.540 -0.443) 2.446 29.871 ( 2.599 -1.527 -2.612) 3.989 30.899 ( -1.181 3.584 1.780) 4.172 31.014 ( 1.601 0.647 -1.196) 2.100 31.525 ( -2.188 4.141 4.861) 6.750 31.581 ( 0.781 -0.057 5.759) 5.812 31.754 ( -2.847 -0.151 -6.175) 6.801 31.815 ( -0.889 -1.996 -5.428) 5.851 32.168 ( -2.333 -1.745 3.183) 4.315 32.219 ( -2.289 -0.119 -0.701) 2.397 32.326 ( 1.884 4.088 -1.803) 4.849 32.387 ( 2.318 4.749 -1.691) 5.548 32.527 ( -7.122 5.290 -3.233) 9.443 32.848 ( 15.702 2.015 -12.491) 20.165 34.423 ( -0.642 4.154 7.121) 8.269 34.727 ( -2.469 8.147 -6.967) 11.000 34.930 ( -7.671 -10.455 15.958) 20.562 35.316 ( 10.285 -7.787 1.406) 12.977 35.699 ( -4.334 0.132 2.707) 5.112 35.920 ( 7.203 2.904 0.434) 7.778 36.685 ( -22.535 -12.245 -1.111) 25.671 37.085 ( 16.940 -13.199 -1.146) 21.505 ======================= Grid point 113 (50/95) ======================= q-point: ( 0.33 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.292 ( 3.375 0.000 15.342) 15.709 1.537 ( 1.585 0.000 14.333) 14.421 1.974 ( 7.318 0.000 -4.328) 8.502 2.196 ( 7.862 0.000 6.591) 10.259 2.657 ( -0.248 -0.000 1.181) 1.207 2.863 ( 8.132 0.000 6.066) 10.146 2.881 ( -0.659 -0.000 2.229) 2.324 3.046 ( -1.307 -0.000 4.221) 4.418 3.082 ( 1.360 0.000 -21.170) 21.213 3.390 ( 6.401 0.000 0.706) 6.440 3.452 ( 11.913 0.000 -0.969) 11.953 3.499 ( 2.913 0.000 -2.702) 3.973 3.598 ( -3.693 -0.000 4.510) 5.830 3.656 ( -1.891 -0.000 2.935) 3.492 3.699 ( 0.526 0.000 -7.769) 7.787 3.792 ( -4.366 -0.000 7.263) 8.474 3.997 ( 0.989 0.000 -3.392) 3.533 4.163 ( -1.050 -0.000 -0.177) 1.065 4.261 ( 3.945 0.000 -5.604) 6.854 4.416 ( 10.973 0.000 6.026) 12.518 4.422 ( -1.364 -0.000 -15.301) 15.361 4.616 ( 2.786 0.000 2.635) 3.834 4.680 ( 11.814 0.000 -3.671) 12.371 4.839 ( 2.453 0.000 -2.673) 3.628 4.880 ( 0.174 0.000 7.078) 7.080 5.065 ( 1.891 0.000 -2.756) 3.343 5.176 ( 0.188 0.000 -0.519) 0.552 5.354 ( 3.205 0.000 4.203) 5.286 5.583 ( -6.684 -0.000 2.256) 7.054 5.608 ( 0.056 0.000 0.002) 0.056 5.740 ( -2.617 -0.000 -0.538) 2.672 5.798 ( 1.497 0.000 -5.792) 5.983 5.886 ( -10.325 -0.000 0.289) 10.329 5.989 ( -13.658 -0.000 -1.454) 13.736 6.941 ( -6.465 -0.000 5.401) 8.424 7.492 ( -3.327 -0.000 2.804) 4.351 7.608 ( -0.149 -0.000 1.865) 1.871 7.804 ( -1.937 -0.000 -0.920) 2.144 7.896 ( -7.289 -0.000 3.156) 7.943 7.897 ( -7.964 -0.000 7.463) 10.914 8.215 ( -3.423 -0.000 3.116) 4.629 8.231 ( 2.726 0.000 -4.193) 5.001 8.729 ( -0.191 -0.000 -3.063) 3.069 8.919 ( 6.795 0.000 -1.417) 6.942 8.984 ( 1.039 0.000 -2.934) 3.113 9.175 ( 4.588 0.000 -7.158) 8.502 9.273 ( -6.612 -0.000 5.370) 8.517 9.439 ( -6.314 -0.000 -2.277) 6.712 9.688 ( -6.297 -0.000 -1.029) 6.380 9.920 ( -6.839 -0.000 -1.256) 6.954 10.098 ( -2.109 -0.000 7.987) 8.260 10.539 ( 4.769 0.000 -5.241) 7.086 10.812 ( 0.073 0.000 1.674) 1.676 10.866 ( 1.890 0.000 2.713) 3.306 11.377 ( 9.938 0.000 -3.770) 10.629 11.519 ( 8.456 0.000 3.208) 9.044 11.840 ( -5.116 -0.000 -1.259) 5.269 11.913 ( -5.127 -0.000 0.508) 5.152 12.814 ( -1.169 -0.000 1.044) 1.567 12.898 ( 4.005 0.000 -7.837) 8.801 12.963 ( -8.161 -0.000 3.373) 8.831 13.010 ( -5.178 -0.000 -2.251) 5.647 13.572 ( 5.049 0.000 -4.076) 6.489 13.612 ( -1.522 -0.000 1.221) 1.951 13.898 ( 0.954 0.000 6.321) 6.393 14.248 ( -6.657 -0.000 4.074) 7.804 14.721 ( -0.970 -0.000 -1.207) 1.548 14.820 ( 6.491 0.000 -5.397) 8.441 14.836 ( 13.893 0.000 -0.808) 13.917 15.069 ( 6.094 0.000 2.444) 6.566 15.668 ( 11.875 0.000 4.938) 12.861 15.769 ( 10.879 0.000 -0.051) 10.879 15.858 ( 3.650 0.000 2.644) 4.507 16.049 ( -1.623 -0.000 -2.110) 2.662 16.370 ( -6.232 -0.000 2.422) 6.686 16.497 ( 5.311 0.000 -8.965) 10.420 16.789 ( 0.937 0.000 3.125) 3.262 16.798 ( -0.365 -0.000 -1.208) 1.262 16.973 ( -1.187 -0.000 3.049) 3.272 17.020 ( -0.333 -0.000 -4.498) 4.510 17.069 ( -7.339 -0.000 2.481) 7.747 17.071 ( 4.314 0.000 0.375) 4.330 19.917 ( 10.530 0.000 0.020) 10.530 20.151 ( 9.015 0.000 1.682) 9.170 21.289 ( -9.878 -0.000 3.111) 10.356 21.314 ( -7.631 -0.000 -2.872) 8.154 22.670 ( -6.448 -0.000 4.874) 8.083 22.906 ( -1.682 -0.000 -7.222) 7.415 27.772 ( 0.074 0.000 2.528) 2.529 28.215 ( -8.403 -0.000 2.520) 8.773 29.652 ( 5.372 0.000 -6.957) 8.790 29.760 ( -1.028 -0.000 0.468) 1.130 29.793 ( 2.331 0.000 1.877) 2.993 29.908 ( -0.733 -0.000 4.514) 4.573 30.995 ( 8.746 0.000 -2.340) 9.054 31.053 ( -0.325 -0.000 1.911) 1.938 31.167 ( 0.884 0.000 -2.172) 2.345 31.203 ( -0.485 -0.000 1.085) 1.189 31.701 ( -4.042 -0.000 1.781) 4.417 31.878 ( -6.800 -0.000 -2.808) 7.357 32.012 ( 0.737 0.000 2.221) 2.340 32.121 ( 3.656 0.000 -1.524) 3.961 32.410 ( 4.472 0.000 -3.065) 5.421 32.489 ( 8.720 0.000 1.752) 8.895 32.760 ( 4.738 0.000 7.191) 8.612 33.062 ( 1.401 0.000 -11.476) 11.561 34.292 ( -0.372 -0.000 -0.422) 0.562 34.335 ( 0.686 0.000 -0.670) 0.959 34.835 ( -11.126 -0.000 11.916) 16.303 35.231 ( -8.626 -0.000 -5.656) 10.315 36.138 ( 11.895 0.000 -3.217) 12.323 36.179 ( 9.323 0.000 5.972) 11.071 37.119 ( -14.138 -0.000 8.108) 16.298 37.244 ( -4.040 -0.000 -11.757) 12.432 ======================= Grid point 114 (51/95) ======================= q-point: ( 0.44 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.459 ( 0.211 -11.566 12.304) 16.887 1.661 ( 3.385 -7.465 10.932) 13.664 2.062 ( 4.354 -4.918 -4.698) 8.075 2.241 ( -0.541 0.458 8.340) 8.370 2.644 ( -0.215 1.115 2.075) 2.365 2.739 ( 2.207 10.008 -1.577) 10.369 2.964 ( 3.988 1.608 0.894) 4.392 2.999 ( 0.688 -0.543 0.651) 1.092 3.155 ( 0.739 -5.532 -13.030) 14.175 3.401 ( 7.053 6.407 4.467) 10.524 3.469 ( -1.564 5.869 4.337) 7.464 3.503 ( 2.951 -0.529 -3.394) 4.529 3.647 ( -2.303 -6.202 1.674) 6.824 3.671 ( -6.615 1.018 -2.763) 7.241 3.724 ( 1.388 -5.305 -4.247) 6.936 3.799 ( 0.973 -5.489 7.124) 9.046 4.016 ( 0.124 -2.314 -0.293) 2.336 4.218 ( 6.697 -2.015 1.759) 7.211 4.281 ( -0.660 -1.267 -7.788) 7.918 4.365 ( 0.952 0.040 -10.747) 10.789 4.505 ( 8.537 1.938 2.152) 9.015 4.637 ( 2.106 0.148 0.592) 2.193 4.787 ( 4.664 2.273 3.948) 6.520 4.854 ( -1.032 -1.074 -3.320) 3.638 4.920 ( 6.755 -2.807 -0.515) 7.333 5.048 ( 2.045 4.064 -3.923) 6.007 5.117 ( 2.086 3.311 3.959) 5.567 5.375 ( -3.837 0.196 5.777) 6.938 5.545 ( -2.282 3.418 0.267) 4.118 5.632 ( -0.933 4.339 -2.532) 5.109 5.645 ( -1.703 -3.693 -1.217) 4.245 5.794 ( -2.441 -1.453 -3.931) 4.850 5.833 ( 0.010 -2.622 0.750) 2.727 5.991 ( -10.366 -8.929 -0.982) 13.717 6.942 ( -3.944 -4.347 7.372) 9.423 7.468 ( -1.020 1.177 2.793) 3.198 7.537 ( -2.886 4.323 -1.056) 5.304 7.743 ( -2.767 4.626 -2.569) 5.971 7.872 ( -6.105 -5.572 5.145) 9.736 7.937 ( -5.203 -7.012 3.503) 9.408 8.198 ( -1.836 0.351 2.748) 3.324 8.217 ( 3.099 4.274 -2.121) 5.689 8.732 ( 1.635 -0.523 -3.006) 3.461 8.936 ( 1.701 2.258 -4.171) 5.038 8.987 ( 5.723 2.589 -0.213) 6.285 9.155 ( -4.889 2.015 -0.278) 5.295 9.234 ( 2.434 2.743 -2.062) 4.207 9.363 ( -5.714 0.560 -2.034) 6.091 9.612 ( -4.716 1.670 0.083) 5.003 9.892 ( -5.776 -4.164 -3.282) 7.841 10.093 ( -1.000 1.531 9.061) 9.243 10.548 ( 2.346 1.348 -5.023) 5.706 10.807 ( -1.064 0.732 3.105) 3.363 10.921 ( 3.283 -2.592 1.453) 4.428 11.459 ( 9.905 0.560 -3.469) 10.510 11.590 ( 5.456 1.050 2.454) 6.074 11.787 ( -3.762 0.562 -0.828) 3.892 11.869 ( -5.410 -0.703 0.474) 5.476 12.781 ( -3.480 1.941 3.371) 5.219 12.839 ( 3.253 4.491 -3.925) 6.794 12.937 ( -5.734 -1.282 -0.712) 5.918 13.002 ( -0.946 -2.523 -4.787) 5.493 13.611 ( 6.040 0.194 -4.449) 7.504 13.614 ( -1.709 -1.567 0.939) 2.502 13.913 ( -0.233 1.081 8.383) 8.456 14.169 ( -6.958 2.458 4.467) 8.626 14.711 ( 0.078 0.114 -1.163) 1.171 14.849 ( 4.571 0.213 -6.448) 7.907 14.929 ( 11.248 2.735 -0.386) 11.582 15.143 ( 5.416 -0.544 1.325) 5.603 15.741 ( 4.510 2.162 2.912) 5.788 15.822 ( 5.000 4.143 1.021) 6.573 15.876 ( 2.939 3.008 -0.962) 4.314 15.986 ( 1.505 4.203 2.237) 4.993 16.354 ( -2.869 -3.281 2.803) 5.182 16.557 ( 1.439 -4.428 -6.392) 7.908 16.785 ( -0.453 1.316 2.492) 2.854 16.817 ( 0.955 -1.738 -0.918) 2.185 16.976 ( -0.123 -0.085 1.593) 1.600 16.999 ( -6.528 0.630 0.966) 6.629 17.027 ( -0.752 -2.265 -1.558) 2.850 17.117 ( 4.530 -0.439 -1.252) 4.720 19.984 ( 9.518 3.863 0.903) 10.312 20.194 ( 5.910 3.652 -0.024) 6.947 21.188 ( -9.580 1.511 3.504) 10.311 21.247 ( -5.190 -0.520 -3.149) 6.092 22.657 ( -5.065 -3.066 5.537) 8.106 22.922 ( 0.083 -4.903 -6.841) 8.417 27.786 ( 0.231 -0.491 2.904) 2.955 28.122 ( -6.200 2.644 -0.307) 6.747 29.621 ( 0.085 4.235 -2.546) 4.942 29.691 ( 2.407 4.027 -1.715) 4.995 29.880 ( 3.803 -1.884 1.410) 4.472 29.935 ( -1.450 -2.297 3.216) 4.209 31.028 ( 4.149 1.536 0.510) 4.454 31.136 ( 2.841 -1.574 -1.240) 3.477 31.143 ( 1.882 -2.828 -1.220) 3.609 31.251 ( -3.125 -4.801 1.473) 5.915 31.701 ( -2.458 -3.159 1.082) 4.146 31.802 ( -4.928 0.913 -2.024) 5.405 31.988 ( 0.607 3.641 2.346) 4.374 32.155 ( 2.011 -1.080 -1.952) 3.003 32.458 ( 5.234 -0.843 -2.246) 5.758 32.563 ( 6.512 1.071 1.464) 6.760 32.793 ( 0.407 1.476 6.229) 6.415 33.038 ( 0.326 0.026 -8.677) 8.684 34.326 ( 0.298 -3.970 -0.188) 3.986 34.361 ( 0.983 -2.668 -1.244) 3.103 34.761 ( -9.066 1.089 11.165) 14.423 35.158 ( -6.110 -1.156 -6.228) 8.801 36.193 ( 7.191 5.097 1.041) 8.875 36.268 ( 9.611 0.856 1.359) 9.744 36.887 ( -4.936 12.531 2.633) 13.723 37.196 ( -7.504 0.485 -6.319) 9.822 ======================= Grid point 115 (52/95) ======================= q-point: ( 0.56 0.33 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.690 ( -2.627 -12.866 8.126) 15.442 1.888 ( 2.674 -11.870 9.059) 15.169 2.139 ( -3.228 -2.781 -3.974) 5.827 2.293 ( 3.319 -5.198 4.968) 7.919 2.589 ( 6.261 10.209 1.592) 12.082 2.654 ( -1.209 -0.115 1.838) 2.203 2.956 ( -0.545 2.545 -1.450) 2.979 3.012 ( 0.192 2.496 6.485) 6.952 3.179 ( 5.307 -0.625 -14.925) 15.853 3.290 ( -4.463 6.593 5.275) 9.550 3.431 ( 0.613 1.936 5.404) 5.773 3.526 ( 2.887 0.806 -2.054) 3.634 3.552 ( -7.421 0.940 0.629) 7.506 3.717 ( -2.197 -6.185 -6.198) 9.028 3.872 ( 1.187 -7.814 3.438) 8.619 3.908 ( 3.810 -3.508 -4.323) 6.746 4.062 ( 1.177 -0.747 2.551) 2.907 4.237 ( -1.664 1.135 -8.561) 8.795 4.286 ( 2.487 2.264 2.362) 4.110 4.387 ( -1.255 -3.576 1.574) 4.104 4.547 ( 1.263 -1.288 -5.041) 5.354 4.653 ( 2.568 0.272 1.659) 3.069 4.745 ( 1.396 1.778 4.784) 5.291 4.846 ( -0.631 3.442 -6.521) 7.400 4.951 ( 3.914 2.183 1.020) 4.596 5.034 ( -0.340 0.179 -2.414) 2.445 5.170 ( 8.516 -0.481 3.075) 9.067 5.348 ( -3.191 -1.015 3.121) 4.578 5.440 ( -1.562 2.428 0.529) 2.935 5.640 ( -1.251 0.705 -2.787) 3.136 5.678 ( 3.628 -4.697 -1.988) 6.259 5.804 ( -1.442 -2.227 -3.772) 4.612 5.880 ( 0.140 -2.159 2.353) 3.196 6.024 ( -8.199 -5.640 -1.516) 10.067 7.058 ( 0.461 -8.434 7.537) 11.320 7.391 ( -1.490 5.220 1.042) 5.527 7.536 ( 0.849 -4.612 -1.603) 4.956 7.636 ( -2.722 3.264 -3.761) 5.675 7.909 ( -3.201 -1.544 6.192) 7.139 8.025 ( -2.394 -4.565 -0.530) 5.182 8.142 ( -0.126 3.676 2.536) 4.467 8.192 ( -2.656 -1.506 2.086) 3.698 8.748 ( 3.919 1.796 -3.349) 5.459 8.879 ( -0.214 3.050 -3.352) 4.538 8.994 ( 5.265 2.809 0.548) 5.992 9.052 ( -4.932 3.980 1.439) 6.499 9.148 ( -3.063 6.298 -0.518) 7.022 9.337 ( 0.902 -0.549 -6.135) 6.226 9.585 ( -1.324 -2.010 2.736) 3.644 9.906 ( -4.655 -4.336 -5.242) 8.243 10.097 ( 1.640 0.905 9.160) 9.350 10.511 ( 0.053 2.481 -5.150) 5.717 10.801 ( -1.403 -0.229 5.059) 5.255 10.994 ( 2.661 -2.046 -0.511) 3.395 11.509 ( 8.466 3.359 -2.857) 9.545 11.575 ( -0.509 4.513 1.295) 4.723 11.759 ( -1.279 -0.396 0.505) 1.431 11.846 ( -4.426 -2.307 -0.240) 4.997 12.721 ( -3.939 1.527 3.872) 5.730 12.822 ( 7.588 3.122 -4.148) 9.194 12.916 ( -1.248 -1.048 -1.798) 2.427 12.998 ( -4.192 -1.611 -4.399) 6.286 13.626 ( -2.438 -1.733 0.527) 3.037 13.652 ( 6.020 0.414 -3.943) 7.208 13.911 ( -0.400 1.642 10.085) 10.226 14.076 ( -7.348 2.078 5.221) 9.250 14.716 ( 1.335 -0.371 -1.290) 1.893 14.876 ( 6.023 -0.018 -7.048) 9.271 14.964 ( 7.130 3.558 0.627) 7.993 15.167 ( 0.469 1.541 -0.263) 1.632 15.703 ( 0.975 6.582 1.095) 6.743 15.721 ( -2.208 7.396 -0.158) 7.720 15.834 ( 4.855 5.737 1.143) 7.602 15.944 ( -0.332 4.494 1.353) 4.705 16.429 ( -0.940 -6.192 2.993) 6.941 16.627 ( 1.458 -4.353 -5.212) 6.946 16.747 ( -2.411 2.589 4.155) 5.457 16.870 ( 0.684 -3.813 -0.654) 3.929 16.939 ( -3.706 0.572 -0.541) 3.788 16.977 ( 0.839 0.526 -0.871) 1.319 17.065 ( -1.027 -3.032 0.721) 3.282 17.157 ( 3.663 -0.103 -1.815) 4.089 19.966 ( 4.495 6.968 2.555) 8.677 20.150 ( 2.756 5.822 -2.492) 6.907 21.107 ( -6.188 -0.245 3.375) 7.052 21.224 ( -1.014 -1.569 -3.375) 3.857 22.702 ( -3.904 -5.184 6.335) 9.069 23.012 ( 1.773 -6.574 -6.596) 9.480 27.808 ( 0.368 -0.798 3.066) 3.189 28.023 ( -3.066 3.397 -1.854) 4.938 29.551 ( -0.011 3.241 0.683) 3.312 29.659 ( 1.586 1.679 -2.907) 3.713 29.918 ( 2.655 1.192 1.513) 3.280 29.947 ( -1.477 0.587 0.710) 1.741 31.035 ( 2.214 1.570 0.874) 2.851 31.119 ( -0.030 1.379 -0.625) 1.515 31.283 ( 2.457 -6.828 0.297) 7.263 31.314 ( -3.064 -7.340 0.234) 7.957 31.737 ( -1.643 -1.207 -0.039) 2.039 31.776 ( -0.934 -3.282 -0.891) 3.527 31.933 ( 0.680 4.264 3.710) 5.693 32.188 ( 0.855 -2.435 -3.892) 4.670 32.509 ( 5.097 0.397 -1.160) 5.243 32.572 ( 1.673 2.810 0.577) 3.321 32.762 ( -2.183 2.751 4.967) 6.083 33.019 ( 1.482 0.945 -6.423) 6.659 34.398 ( 0.488 -3.866 0.378) 3.915 34.458 ( 1.081 -8.401 -1.490) 8.601 34.697 ( -7.199 1.186 11.092) 13.276 35.109 ( -2.979 -0.335 -6.667) 7.310 36.112 ( 1.061 9.372 3.854) 10.189 36.321 ( 8.560 3.623 -4.753) 10.440 36.688 ( 1.430 10.012 4.632) 11.124 37.049 ( -7.376 5.720 -5.225) 10.697 ======================= Grid point 116 (53/95) ======================= q-point: (-0.33 -0.67 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.844 ( -1.953 -5.050 4.072) 6.775 2.070 ( -9.567 -2.185 7.076) 12.098 2.129 ( 2.979 -3.851 -0.987) 4.968 2.365 ( -0.869 1.678 0.117) 1.894 2.569 ( 2.648 -3.003 6.432) 7.577 2.707 ( 8.343 -1.532 5.496) 10.107 2.801 ( -2.000 16.218 6.348) 17.531 2.958 ( -2.747 -3.333 -4.491) 6.231 3.188 ( -4.922 1.246 2.591) 5.700 3.264 ( 3.650 -5.228 -11.586) 13.225 3.385 ( -3.307 4.644 6.538) 8.674 3.509 ( -5.591 -3.020 1.883) 6.628 3.544 ( 4.492 1.628 2.143) 5.237 3.775 ( -2.015 -4.533 -6.011) 7.794 3.950 ( 6.166 0.327 -4.415) 7.590 3.979 ( 0.586 1.357 0.585) 1.590 4.013 ( 2.446 4.634 -6.076) 8.024 4.180 ( -3.439 -0.237 -8.404) 9.084 4.315 ( 3.245 -3.343 5.497) 7.206 4.425 ( -2.521 -2.858 5.303) 6.531 4.537 ( -2.223 -0.798 -1.573) 2.838 4.690 ( -1.501 10.304 -3.332) 10.933 4.719 ( 3.661 -3.107 -0.572) 4.836 4.814 ( 2.039 -3.180 3.923) 5.446 4.943 ( -0.146 3.039 -3.433) 4.587 4.996 ( 0.053 1.413 -2.495) 2.868 5.199 ( -1.942 0.478 7.995) 8.241 5.393 ( -1.902 -0.387 -1.078) 2.220 5.499 ( 9.810 -6.797 -0.498) 11.945 5.570 ( -6.547 1.455 -2.340) 7.103 5.798 ( -0.561 -3.569 -2.864) 4.611 5.822 ( 5.305 -2.483 -1.647) 6.084 5.932 ( -2.044 -3.596 1.882) 4.544 6.034 ( -0.670 -4.040 -3.180) 5.185 7.219 ( 2.431 -4.262 5.278) 7.207 7.338 ( -0.504 -1.469 -1.343) 2.053 7.575 ( -3.115 -0.241 -2.003) 3.711 7.644 ( 2.755 -6.026 -0.393) 6.638 7.889 ( -2.652 2.100 3.571) 4.919 7.945 ( 1.585 9.119 -0.925) 9.302 8.210 ( -4.164 -9.723 2.823) 10.948 8.235 ( -0.917 -5.197 3.842) 6.528 8.682 ( 1.050 7.863 0.727) 7.966 8.845 ( 1.843 1.668 -4.955) 5.543 8.929 ( -0.564 6.683 0.854) 6.761 8.986 ( 0.151 5.441 -1.462) 5.636 9.064 ( -0.673 -2.204 3.457) 4.155 9.326 ( 0.277 0.365 -7.022) 7.037 9.667 ( 1.577 -5.682 5.056) 7.768 9.913 ( -3.377 -3.160 -4.722) 6.609 10.149 ( 2.698 -1.379 7.341) 7.941 10.450 ( -0.679 2.230 -5.560) 6.029 10.813 ( -1.058 -0.511 5.478) 5.602 11.024 ( 0.343 -0.142 -2.208) 2.239 11.452 ( -3.521 6.761 0.253) 7.627 11.485 ( 4.612 6.612 -1.003) 8.123 11.787 ( 1.650 -2.419 1.433) 3.260 11.854 ( -2.157 -2.360 -1.360) 3.474 12.679 ( -3.855 0.368 2.153) 4.431 12.852 ( 10.301 2.201 -4.542) 11.471 12.894 ( -4.720 0.488 -0.879) 4.826 13.004 ( 0.045 -4.012 -3.236) 5.155 13.624 ( -2.861 -0.983 0.240) 3.034 13.682 ( 4.105 0.983 -2.358) 4.835 13.916 ( 0.264 1.381 10.027) 10.125 14.001 ( -7.105 0.159 5.717) 9.121 14.740 ( 1.435 -1.086 -1.358) 2.254 14.923 ( 5.157 -0.615 -8.043) 9.574 14.943 ( 3.549 5.002 2.825) 6.752 15.093 ( -6.313 3.812 -1.692) 7.567 15.551 ( 0.902 10.268 1.104) 10.367 15.584 ( -1.430 8.622 -0.146) 8.741 15.778 ( 2.868 5.803 1.780) 6.714 15.828 ( -2.997 7.132 -0.727) 7.770 16.534 ( -0.941 -6.176 2.235) 6.635 16.649 ( -1.488 2.640 1.891) 3.572 16.735 ( -0.060 -3.653 -0.756) 3.731 16.902 ( 0.121 0.673 -2.150) 2.256 16.946 ( 0.496 -3.267 -1.043) 3.465 16.973 ( 1.495 0.491 -0.471) 1.643 17.104 ( -1.248 -2.675 0.505) 2.995 17.177 ( 2.379 0.440 -1.292) 2.743 19.869 ( -0.515 7.107 3.228) 7.823 20.052 ( 0.652 6.419 -3.783) 7.479 21.109 ( -2.133 -3.387 2.812) 4.892 21.260 ( 2.349 -2.837 -3.105) 4.818 22.784 ( -2.411 -5.891 6.520) 9.112 23.117 ( 2.523 -5.500 -6.389) 8.800 27.835 ( 0.345 -0.944 2.584) 2.773 27.946 ( -0.886 2.968 -1.691) 3.529 29.521 ( 0.337 1.169 1.959) 2.306 29.645 ( 0.522 0.348 -2.805) 2.874 29.879 ( -4.736 3.022 0.397) 5.632 29.917 ( 3.929 3.551 0.096) 5.297 31.022 ( 0.608 1.853 1.404) 2.403 31.086 ( -1.227 1.593 -0.666) 2.118 31.372 ( -4.658 -6.739 1.812) 8.390 31.472 ( 5.240 -7.965 -1.154) 9.603 31.741 ( 0.966 -0.011 1.096) 1.461 31.796 ( -2.860 0.646 -1.405) 3.251 31.934 ( 2.410 -2.486 5.167) 6.220 32.223 ( -1.586 -3.313 -6.245) 7.245 32.517 ( 0.304 2.870 -0.549) 2.938 32.530 ( 3.343 2.980 -0.928) 4.573 32.703 ( -3.645 2.462 4.897) 6.583 32.988 ( 3.558 3.548 -6.217) 7.994 34.476 ( -0.043 -4.828 3.299) 5.847 34.611 ( -0.359 -3.692 4.050) 5.492 34.668 ( -4.600 -6.728 4.489) 9.305 35.078 ( 2.561 1.290 -7.089) 7.647 35.960 ( -1.326 9.421 4.109) 10.363 36.248 ( 3.165 9.155 -8.509) 12.893 36.603 ( -4.162 2.957 7.770) 9.297 36.890 ( 2.240 6.427 -4.925) 8.401 ======================= Grid point 117 (54/95) ======================= q-point: (-0.22 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.804 ( 1.840 11.242 4.124) 12.115 1.960 ( -6.692 2.885 1.366) 7.414 2.130 ( -1.855 4.993 5.922) 7.965 2.384 ( -6.155 -2.392 -0.789) 6.651 2.491 ( -0.649 13.569 4.108) 14.192 2.655 ( 1.899 -1.479 8.272) 8.615 2.861 ( -1.348 -2.043 5.490) 6.011 2.988 ( -2.705 -3.408 -4.809) 6.485 3.193 ( 3.864 -4.147 0.950) 5.747 3.249 ( -3.067 7.287 6.511) 10.242 3.342 ( -0.874 -3.990 -5.213) 6.622 3.532 ( 1.541 0.947 2.359) 2.973 3.566 ( -0.664 -2.281 2.312) 3.315 3.768 ( -2.731 0.874 -3.099) 4.222 3.874 ( 2.250 2.391 -6.502) 7.284 4.007 ( 10.140 0.228 -6.559) 12.078 4.032 ( 4.973 2.859 -1.266) 5.874 4.161 ( 1.966 -2.055 -9.082) 9.517 4.407 ( 1.767 -0.890 6.021) 6.338 4.453 ( -0.704 3.350 1.786) 3.861 4.506 ( -4.084 3.238 1.014) 5.310 4.550 ( -0.527 -2.461 -0.530) 2.571 4.751 ( 0.635 1.643 -2.435) 3.005 4.853 ( 1.145 3.144 3.242) 4.659 4.874 ( 1.404 0.335 -2.012) 2.476 5.018 ( 0.824 -3.000 -5.404) 6.236 5.160 ( -7.579 1.767 3.078) 8.369 5.348 ( -2.303 3.131 1.400) 4.131 5.495 ( -3.342 0.003 0.941) 3.472 5.687 ( 3.643 -7.017 -4.067) 8.891 5.833 ( -0.321 -2.912 -0.322) 2.947 5.913 ( -6.228 -1.476 1.677) 6.617 5.921 ( 0.433 -4.941 -3.263) 5.937 6.199 ( 11.007 -7.990 -2.231) 13.783 7.263 ( 0.818 -0.842 1.371) 1.805 7.389 ( 2.554 -1.304 -5.223) 5.959 7.560 ( -4.538 -1.398 3.567) 5.939 7.743 ( 1.070 -0.033 -1.920) 2.199 7.833 ( -4.888 0.879 0.145) 4.969 7.860 ( 3.363 -0.813 3.619) 5.006 8.343 ( -2.265 -9.122 0.471) 9.411 8.365 ( 1.764 -7.567 4.853) 9.161 8.557 ( -2.195 6.757 5.314) 8.872 8.789 ( 2.031 4.517 -2.484) 5.540 8.844 ( 2.089 5.339 -0.561) 5.760 8.897 ( 1.861 4.647 -1.848) 5.336 9.141 ( -0.568 -4.590 2.890) 5.454 9.314 ( -1.396 -2.759 -4.828) 5.733 9.791 ( -0.759 -5.832 3.795) 6.999 9.943 ( 0.759 -4.102 -2.316) 4.771 10.201 ( -1.430 -0.652 4.748) 5.001 10.410 ( 1.355 0.549 -4.736) 4.956 10.825 ( -0.306 0.023 3.786) 3.798 10.997 ( -2.368 0.963 -2.294) 3.435 11.300 ( -2.680 7.145 -1.100) 7.710 11.412 ( 4.556 6.738 0.984) 8.193 11.859 ( 2.073 -2.543 1.800) 3.742 11.872 ( -1.146 -2.494 -2.074) 3.440 12.645 ( -3.610 -0.240 -0.521) 3.655 12.823 ( -2.522 0.399 -2.150) 3.338 12.944 ( 7.913 -1.763 0.520) 8.124 13.077 ( 2.173 -3.822 -3.513) 5.628 13.612 ( -2.478 -0.590 0.636) 2.626 13.677 ( 1.463 2.212 -0.269) 2.666 13.897 ( -5.679 1.402 9.552) 11.201 13.992 ( -1.061 -1.548 3.693) 4.142 14.734 ( -4.622 2.859 -1.883) 5.752 14.836 ( -5.551 3.472 2.197) 6.906 14.900 ( -8.086 6.141 -0.152) 10.154 15.017 ( 7.409 -1.111 -6.333) 9.810 15.406 ( 3.562 9.421 0.357) 10.079 15.453 ( 6.049 8.307 -0.184) 10.278 15.661 ( -3.347 8.039 -1.931) 8.920 15.721 ( 3.372 5.407 1.842) 6.633 16.588 ( -1.618 3.297 4.841) 6.077 16.616 ( -2.387 -4.727 1.351) 5.465 16.794 ( -0.950 -3.637 -2.977) 4.795 16.894 ( 2.942 1.619 -1.130) 3.543 16.959 ( 3.119 1.097 -1.956) 3.842 17.007 ( 0.301 -1.782 -1.694) 2.477 17.131 ( -1.045 -1.739 0.268) 2.047 17.190 ( 1.141 -0.434 0.118) 1.227 19.762 ( -1.932 4.988 2.813) 6.043 19.946 ( 0.650 5.359 -4.049) 6.748 21.175 ( -1.069 -4.893 2.130) 5.442 21.334 ( 3.022 -3.599 -2.384) 5.270 22.879 ( -1.210 -5.112 5.892) 7.894 23.196 ( 2.184 -3.381 -5.997) 7.223 27.852 ( 0.132 0.667 2.016) 2.127 27.907 ( 0.072 -0.080 -0.959) 0.965 29.518 ( 0.199 0.746 2.877) 2.979 29.639 ( 0.521 0.217 -2.538) 2.600 29.774 ( -4.858 3.344 0.169) 5.900 29.893 ( 3.358 3.125 -0.612) 4.628 30.998 ( -0.133 2.096 2.035) 2.924 31.045 ( -1.351 1.238 -0.812) 2.004 31.442 ( -3.863 -6.079 1.213) 7.304 31.622 ( 4.829 -2.312 1.051) 5.456 31.730 ( -4.280 -0.705 -0.833) 4.417 31.768 ( 2.923 0.790 0.943) 3.171 32.039 ( 1.205 -5.071 4.150) 6.663 32.211 ( -5.123 -1.216 -5.648) 7.721 32.465 ( 0.147 3.009 -1.882) 3.553 32.504 ( 3.536 3.447 -2.186) 5.400 32.636 ( -5.773 2.041 2.429) 6.587 32.950 ( 7.858 4.467 -5.753) 10.714 34.557 ( -0.129 1.173 9.808) 9.879 34.602 ( -5.472 -4.902 7.854) 10.754 34.833 ( -1.281 -9.518 -4.211) 10.486 35.098 ( 10.931 -0.040 -5.960) 12.450 35.808 ( -4.212 6.991 3.447) 8.859 36.093 ( 2.689 8.038 -6.609) 10.748 36.483 ( -18.643 0.050 3.333) 18.938 36.906 ( 14.967 1.189 -1.659) 15.105 ======================= Grid point 118 (55/95) ======================= q-point: (-0.11 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.657 ( 8.450 10.831 7.208) 15.513 1.865 ( -1.805 5.475 8.275) 10.085 1.987 ( 3.112 13.982 6.604) 15.773 2.204 ( -6.586 10.842 -0.833) 12.713 2.420 ( 1.935 0.861 -2.960) 3.640 2.674 ( -6.412 2.723 -5.357) 8.788 2.796 ( -7.381 -1.186 9.097) 11.775 3.008 ( -0.211 2.606 0.006) 2.615 3.130 ( 0.472 2.782 6.130) 6.748 3.279 ( 2.265 4.701 5.265) 7.413 3.382 ( 1.740 -3.100 -1.157) 3.738 3.579 ( 5.592 -0.446 -1.238) 5.745 3.595 ( 0.108 -4.381 0.370) 4.398 3.761 ( 0.826 -0.254 -0.617) 1.062 3.847 ( -0.548 -0.393 -12.696) 12.714 4.046 ( 8.714 3.095 3.039) 9.734 4.076 ( 7.239 -0.194 -5.189) 8.908 4.193 ( 2.755 -0.697 -4.782) 5.563 4.290 ( -0.166 9.031 0.658) 9.057 4.431 ( 0.133 3.724 -0.676) 3.787 4.506 ( 0.029 -1.723 3.237) 3.667 4.576 ( 1.653 1.342 3.234) 3.872 4.743 ( 1.072 -2.213 -4.348) 4.996 4.820 ( 0.977 2.640 3.549) 4.530 4.897 ( -0.143 -1.619 -3.460) 3.823 4.989 ( -3.289 4.916 2.471) 6.411 5.062 ( -5.976 -0.949 -4.124) 7.323 5.284 ( -0.871 2.177 -0.746) 2.461 5.502 ( -0.618 -1.402 0.925) 1.789 5.768 ( -6.815 -3.908 -3.643) 8.659 5.820 ( -4.777 -2.587 -2.039) 5.802 5.944 ( -2.328 -6.918 -2.692) 7.779 6.000 ( 1.857 -2.003 1.265) 3.010 6.409 ( 7.200 -6.065 -1.357) 9.511 7.287 ( 0.044 -0.530 -0.636) 0.829 7.383 ( 1.536 1.821 -3.949) 4.612 7.544 ( -1.355 0.834 2.183) 2.701 7.697 ( 1.065 3.127 -2.266) 4.006 7.804 ( -7.381 -4.692 0.901) 8.792 7.985 ( 0.931 -6.572 3.747) 7.622 8.407 ( -2.007 3.772 8.963) 9.929 8.494 ( -2.498 -6.917 -0.667) 7.384 8.534 ( -0.503 -5.941 4.300) 7.351 8.722 ( 0.764 4.928 -2.371) 5.522 8.819 ( 6.901 -0.147 -0.456) 6.917 8.872 ( 4.110 1.771 0.083) 4.476 9.207 ( -2.722 -4.911 1.835) 5.907 9.365 ( -2.058 -5.486 -2.085) 6.219 9.851 ( -4.441 -4.193 0.294) 6.114 10.042 ( 3.148 -4.513 0.023) 5.503 10.156 ( -6.351 1.753 1.434) 6.742 10.430 ( 2.747 -0.785 -2.046) 3.514 10.818 ( 0.193 1.632 0.892) 1.870 10.950 ( -4.230 0.461 0.571) 4.293 11.187 ( 2.688 4.933 -3.010) 6.373 11.368 ( 6.721 5.470 2.061) 8.908 11.892 ( -1.228 -2.556 -1.077) 3.033 11.915 ( -1.278 -2.454 0.703) 2.854 12.623 ( -2.653 -1.305 -1.836) 3.480 12.828 ( -1.252 -3.045 -0.251) 3.301 13.057 ( 6.744 -2.530 1.465) 7.350 13.144 ( 1.504 -3.422 -3.197) 4.918 13.591 ( -2.323 0.959 0.300) 2.531 13.649 ( 0.980 2.196 1.764) 2.982 13.837 ( -6.425 1.575 7.689) 10.143 14.006 ( -2.674 -0.691 1.914) 3.360 14.558 ( -6.683 7.196 0.138) 9.821 14.664 ( -9.192 5.062 -0.053) 10.494 14.841 ( -2.694 -0.607 2.248) 3.561 15.100 ( 6.351 -1.976 -5.494) 8.627 15.339 ( 10.212 6.730 -0.063) 12.230 15.425 ( 12.785 5.672 -0.472) 13.995 15.500 ( -1.162 7.227 -2.277) 7.666 15.684 ( 4.679 4.135 1.662) 6.462 16.543 ( -1.839 1.901 5.045) 5.696 16.658 ( -2.153 -2.815 1.447) 3.828 16.804 ( -2.401 -0.928 -5.158) 5.765 16.887 ( 3.599 2.827 -0.451) 4.599 16.981 ( 4.083 0.216 -0.166) 4.092 17.015 ( 0.192 -0.031 -3.048) 3.054 17.142 ( -1.097 -0.510 0.897) 1.506 17.211 ( -0.409 -1.178 0.563) 1.368 19.691 ( -0.737 2.827 2.008) 3.545 19.874 ( 2.235 3.368 -3.809) 5.554 21.249 ( -2.130 -4.957 1.729) 5.665 21.409 ( 1.201 -3.542 -1.965) 4.225 22.950 ( -1.866 -2.841 4.852) 5.925 23.231 ( 0.841 -0.932 -5.528) 5.669 27.826 ( -0.458 2.300 2.361) 3.328 27.950 ( 0.842 -4.237 -0.723) 4.380 29.512 ( 0.480 1.211 3.635) 3.862 29.617 ( 0.688 2.815 -2.296) 3.697 29.704 ( -3.132 0.079 0.102) 3.134 29.889 ( 3.251 0.636 -0.864) 3.423 30.953 ( -0.683 3.242 1.312) 3.563 31.029 ( 0.241 0.027 -0.132) 0.276 31.511 ( -1.959 -5.103 1.758) 5.742 31.591 ( -4.415 3.730 4.012) 7.036 31.768 ( 1.514 -2.587 -3.443) 4.565 31.770 ( 1.989 2.484 -0.610) 3.240 32.116 ( -2.154 -2.679 2.696) 4.369 32.165 ( -4.759 -1.332 -3.066) 5.815 32.403 ( 0.799 4.078 -2.081) 4.648 32.471 ( 1.346 3.319 -4.004) 5.372 32.552 ( -1.046 2.693 2.386) 3.747 32.967 ( 9.825 1.859 -7.796) 12.679 34.509 ( -1.876 4.319 9.147) 10.288 34.699 ( -5.349 -6.444 7.321) 11.124 34.857 ( -0.101 2.536 -3.506) 4.328 35.291 ( 14.115 -8.648 -1.539) 16.625 35.684 ( -4.818 2.783 1.630) 5.798 36.039 ( 6.552 2.526 -2.269) 7.379 36.308 ( -23.278 -3.804 -0.844) 23.602 37.078 ( 12.918 -5.358 -0.451) 13.992 ======================= Grid point 123 (56/95) ======================= q-point: ( 0.44 0.44 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( -2.259 -0.000 13.386) 13.576 1.668 ( 3.536 0.000 12.515) 13.005 2.051 ( 3.024 0.000 -2.203) 3.741 2.223 ( -6.516 -0.000 5.987) 8.849 2.632 ( -1.521 -0.000 1.518) 2.150 2.853 ( -1.959 -0.000 -1.583) 2.518 2.944 ( 0.852 0.000 -2.631) 2.766 3.057 ( -0.153 -0.000 3.814) 3.817 3.092 ( 9.381 0.000 -14.928) 17.631 3.449 ( -4.944 -0.000 5.954) 7.739 3.496 ( 1.225 0.000 -3.858) 4.048 3.565 ( -4.371 -0.000 0.025) 4.371 3.594 ( 1.332 0.000 -8.639) 8.741 3.678 ( 7.153 0.000 5.903) 9.274 3.693 ( -9.043 -0.000 14.929) 17.455 3.715 ( 4.105 0.000 -5.770) 7.081 4.005 ( 2.257 0.000 0.558) 2.325 4.262 ( 2.515 0.000 -7.222) 7.647 4.275 ( 6.994 0.000 3.342) 7.752 4.352 ( 4.202 0.000 -11.284) 12.041 4.598 ( 0.611 0.000 -1.047) 1.213 4.674 ( 4.856 0.000 4.312) 6.494 4.817 ( -1.760 -0.000 -7.336) 7.544 4.882 ( -6.284 -0.000 6.958) 9.375 4.898 ( 9.265 0.000 -3.486) 9.899 5.080 ( 1.544 0.000 -2.156) 2.652 5.192 ( 3.425 0.000 1.310) 3.667 5.326 ( -8.209 -0.000 7.882) 11.380 5.596 ( 3.433 0.000 2.285) 4.124 5.609 ( 0.823 0.000 -2.689) 2.812 5.691 ( -2.647 -0.000 2.136) 3.401 5.730 ( -1.622 -0.000 -8.972) 9.117 5.806 ( -5.057 -0.000 0.704) 5.106 5.809 ( 0.657 0.000 -0.396) 0.767 6.894 ( -2.882 -0.000 10.218) 10.617 7.441 ( -2.001 -0.000 -1.353) 2.415 7.608 ( -0.719 -0.000 2.002) 2.127 7.727 ( -4.385 -0.000 -0.415) 4.405 7.797 ( -5.505 -0.000 5.001) 7.438 7.809 ( -2.381 -0.000 -2.162) 3.216 8.195 ( -1.206 -0.000 3.193) 3.413 8.292 ( 4.224 0.000 -2.454) 4.885 8.740 ( 2.437 0.000 -0.620) 2.515 8.946 ( 0.100 0.000 -5.312) 5.313 9.087 ( 8.738 0.000 -1.251) 8.828 9.131 ( -4.126 -0.000 0.693) 4.184 9.278 ( 3.636 0.000 -3.956) 5.373 9.292 ( -8.324 -0.000 -0.626) 8.348 9.600 ( -2.540 -0.000 0.590) 2.608 9.783 ( -4.893 -0.000 -4.653) 6.752 10.126 ( -0.465 -0.000 10.541) 10.551 10.563 ( 1.476 0.000 -6.141) 6.316 10.823 ( -0.564 -0.000 3.168) 3.217 10.916 ( 1.385 0.000 1.429) 1.990 11.552 ( 10.228 0.000 -2.672) 10.572 11.652 ( 2.630 0.000 1.666) 3.113 11.753 ( -2.293 -0.000 -1.254) 2.613 11.810 ( -6.403 -0.000 1.155) 6.507 12.762 ( -6.148 -0.000 4.831) 7.819 12.884 ( -0.211 -0.000 -0.796) 0.824 12.885 ( -0.699 -0.000 -1.955) 2.076 12.986 ( 4.174 0.000 -7.731) 8.785 13.587 ( -1.264 -0.000 -0.081) 1.266 13.662 ( 7.197 0.000 -5.854) 9.277 13.938 ( -1.754 -0.000 9.677) 9.835 14.127 ( -8.763 -0.000 5.119) 10.149 14.715 ( 1.262 0.000 -1.268) 1.790 14.859 ( 3.040 0.000 -7.798) 8.369 15.047 ( 7.455 0.000 0.816) 7.500 15.181 ( 2.299 0.000 1.542) 2.768 15.803 ( 3.173 0.000 1.214) 3.397 15.870 ( -1.190 -0.000 -0.220) 1.210 15.957 ( 6.084 0.000 1.439) 6.251 16.025 ( -2.267 -0.000 2.626) 3.470 16.303 ( -2.636 -0.000 3.336) 4.252 16.509 ( 0.849 0.000 -4.848) 4.921 16.798 ( -0.868 -0.000 1.571) 1.795 16.820 ( 3.089 0.000 -2.826) 4.187 16.927 ( -7.317 -0.000 1.958) 7.574 16.997 ( 0.944 0.000 -3.585) 3.707 17.003 ( 0.689 0.000 3.924) 3.984 17.149 ( 3.887 0.000 -1.612) 4.208 20.113 ( 8.835 0.000 0.325) 8.841 20.262 ( 1.133 0.000 0.208) 1.152 21.123 ( -8.455 -0.000 3.735) 9.243 21.201 ( -1.345 -0.000 -2.724) 3.038 22.606 ( -3.545 -0.000 5.097) 6.208 22.866 ( 1.577 0.000 -6.239) 6.435 27.796 ( 0.775 0.000 3.768) 3.847 28.085 ( -4.993 -0.000 -2.023) 5.387 29.666 ( 1.903 0.000 -3.268) 3.782 29.734 ( -1.301 -0.000 -1.961) 2.353 29.895 ( 4.521 0.000 1.736) 4.842 29.902 ( -2.515 -0.000 4.398) 5.066 31.057 ( -0.425 -0.000 1.989) 2.034 31.140 ( 6.567 0.000 -1.872) 6.829 31.171 ( 1.034 0.000 -2.257) 2.483 31.181 ( -2.709 -0.000 1.038) 2.901 31.658 ( -1.179 -0.000 1.198) 1.681 31.757 ( -3.631 -0.000 -1.680) 4.000 32.030 ( -0.127 -0.000 2.334) 2.337 32.158 ( 1.148 0.000 -2.096) 2.390 32.499 ( 6.086 0.000 -0.975) 6.163 32.623 ( 2.423 0.000 0.250) 2.436 32.813 ( -3.194 -0.000 6.533) 7.272 33.024 ( 2.694 0.000 -7.345) 7.823 34.293 ( 0.219 0.000 0.292) 0.365 34.349 ( 1.684 0.000 -2.597) 3.095 34.718 ( -8.085 -0.000 10.966) 13.625 35.096 ( -1.714 -0.000 -6.305) 6.534 36.315 ( 0.864 0.000 4.600) 4.680 36.346 ( 11.735 0.000 -2.886) 12.084 36.905 ( -13.315 -0.000 6.779) 14.941 37.160 ( 2.304 0.000 -10.011) 10.273 ======================= Grid point 124 (57/95) ======================= q-point: (-0.44 -0.56 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.476 ( -5.330 -10.116 10.434) 15.479 1.786 ( 0.290 -6.539 15.111) 16.467 2.067 ( -2.075 -0.566 -3.158) 3.821 2.219 ( -2.246 -5.483 2.843) 6.572 2.630 ( -1.338 0.293 -0.536) 1.471 2.788 ( 3.666 4.792 0.921) 6.104 2.935 ( -2.934 0.640 -4.099) 5.081 3.052 ( 0.732 1.054 3.857) 4.065 3.153 ( 4.132 -2.086 -9.414) 10.490 3.416 ( -4.245 0.038 2.374) 4.864 3.480 ( -4.183 9.883 1.332) 10.814 3.515 ( -1.184 2.004 -1.436) 2.735 3.539 ( -0.232 -2.622 -0.716) 2.728 3.597 ( -1.535 -1.561 -3.838) 4.419 3.779 ( 1.138 -4.896 7.583) 9.098 3.862 ( 5.280 -6.008 0.224) 8.002 4.056 ( 2.740 -2.319 -0.221) 3.597 4.269 ( 5.195 2.067 -7.128) 9.059 4.345 ( 1.886 -1.252 4.964) 5.456 4.366 ( 3.610 1.790 -4.550) 6.078 4.537 ( -2.433 1.396 -5.146) 5.861 4.701 ( 0.766 2.023 -0.985) 2.376 4.780 ( -4.659 2.495 2.116) 5.693 4.819 ( -1.802 -2.477 0.692) 3.140 4.961 ( -3.008 -2.845 -5.291) 6.718 5.079 ( 6.048 4.116 -1.895) 7.557 5.228 ( 1.975 0.510 3.742) 4.262 5.289 ( -5.129 -1.948 5.730) 7.933 5.510 ( 0.426 7.014 3.264) 7.748 5.631 ( 0.941 1.507 -3.315) 3.761 5.674 ( 3.577 -1.670 -2.436) 4.639 5.730 ( -2.253 -2.253 -4.621) 5.613 5.857 ( 1.215 -4.116 1.884) 4.687 5.873 ( -0.493 -6.506 -0.645) 6.556 6.963 ( 0.816 -5.948 11.214) 12.721 7.451 ( -0.689 -2.555 -5.052) 5.703 7.499 ( -0.515 6.915 3.535) 7.783 7.685 ( -1.046 5.384 -2.947) 6.227 7.808 ( -2.991 -8.308 1.724) 8.996 7.878 ( -2.742 -6.382 3.849) 7.941 8.183 ( -1.252 0.949 2.520) 2.970 8.269 ( 2.405 5.758 -1.570) 6.434 8.777 ( 3.685 -1.052 -0.665) 3.889 8.910 ( -0.617 2.343 -5.180) 5.719 9.074 ( -2.860 2.867 0.513) 4.082 9.110 ( 2.970 3.960 -0.984) 5.047 9.194 ( -3.116 3.551 0.577) 4.759 9.319 ( 2.836 -1.689 -5.579) 6.482 9.582 ( 1.351 0.502 2.729) 3.086 9.775 ( -2.966 -4.075 -5.696) 7.606 10.150 ( 0.791 0.622 10.366) 10.415 10.537 ( 0.479 2.084 -6.575) 6.914 10.812 ( -0.923 0.908 4.679) 4.855 10.957 ( -0.561 -3.103 -0.040) 3.154 11.617 ( -3.951 2.588 -0.599) 4.761 11.628 ( 8.107 1.582 -2.118) 8.527 11.746 ( -3.764 0.084 1.719) 4.139 11.776 ( 0.270 -1.760 -0.105) 1.784 12.712 ( -4.466 1.051 3.656) 5.867 12.875 ( 0.624 0.495 -0.599) 0.996 12.904 ( 1.833 -1.656 -1.049) 2.684 12.988 ( 4.569 2.251 -7.952) 9.443 13.584 ( -1.307 -0.950 -0.898) 1.849 13.710 ( 6.946 0.502 -5.624) 8.952 13.942 ( -2.724 0.329 10.981) 11.318 14.044 ( -8.839 1.426 5.411) 10.461 14.728 ( 2.353 0.093 -1.246) 2.664 14.874 ( 2.871 -1.259 -8.167) 8.748 15.074 ( 2.688 2.640 2.230) 4.378 15.176 ( -3.239 0.977 0.098) 3.384 15.801 ( 1.759 3.635 0.457) 4.064 15.821 ( 0.344 5.204 -1.050) 5.320 15.947 ( -0.807 3.943 3.361) 5.244 15.989 ( -3.126 2.082 1.440) 4.023 16.331 ( -1.953 -4.381 3.433) 5.899 16.544 ( 1.161 -4.280 -4.607) 6.395 16.786 ( -0.820 2.009 2.587) 3.377 16.833 ( 0.485 -1.048 -1.116) 1.606 16.892 ( -2.832 -1.851 -1.129) 3.567 16.999 ( 2.331 0.556 -1.825) 3.012 17.032 ( 0.458 -1.048 3.090) 3.295 17.179 ( 2.933 -0.293 -1.947) 3.533 20.122 ( 2.304 6.172 2.110) 6.918 20.226 ( -1.882 2.925 -1.908) 3.967 21.068 ( -3.487 0.340 3.092) 4.673 21.207 ( 3.009 -0.541 -2.312) 3.833 22.619 ( -2.311 -3.056 5.377) 6.602 22.916 ( 3.093 -4.944 -6.027) 8.386 27.819 ( 1.259 -0.061 4.607) 4.777 28.028 ( -2.396 1.371 -3.385) 4.368 29.621 ( 0.273 4.857 0.095) 4.866 29.700 ( 0.999 2.236 -3.789) 4.511 29.903 ( -2.785 -1.385 3.419) 4.622 29.958 ( 2.064 -1.701 0.922) 2.829 31.062 ( -0.346 0.001 1.637) 1.673 31.136 ( -1.443 1.379 -0.827) 2.161 31.196 ( -1.856 -2.977 -0.331) 3.524 31.223 ( 3.440 -4.568 -0.874) 5.785 31.683 ( 0.101 -2.724 0.839) 2.852 31.743 ( 0.616 -0.838 -1.352) 1.706 32.008 ( -0.228 2.911 2.981) 4.172 32.159 ( -0.079 -0.391 -3.008) 3.035 32.559 ( 5.390 -0.194 0.169) 5.396 32.603 ( -2.863 1.255 -1.304) 3.387 32.774 ( -5.872 1.303 5.474) 8.132 33.047 ( 6.078 0.551 -5.501) 8.216 34.333 ( 0.451 -4.192 -0.159) 4.219 34.375 ( 1.469 -2.371 -2.567) 3.790 34.677 ( -6.439 0.460 11.241) 12.962 35.082 ( 1.824 -0.326 -6.206) 6.477 36.257 ( -2.551 6.172 3.309) 7.454 36.429 ( 8.330 2.170 -3.340) 9.233 36.764 ( -11.597 3.886 6.116) 13.675 37.126 ( 5.215 5.340 -7.663) 10.697 ======================= Grid point 125 (58/95) ======================= q-point: (-0.33 -0.56 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.655 ( -5.199 -13.585 6.334) 15.866 1.920 ( -10.081 -6.749 16.435) 20.427 2.065 ( 0.631 -5.182 -3.620) 6.352 2.355 ( 3.180 -5.983 -3.834) 7.785 2.539 ( -7.325 3.611 6.409) 10.382 2.797 ( 0.901 -0.477 -4.086) 4.211 2.877 ( 2.784 2.663 -2.151) 4.413 3.025 ( -3.219 4.972 9.400) 11.110 3.210 ( 3.333 -3.982 -5.945) 7.894 3.220 ( -3.678 11.537 -0.528) 12.121 3.402 ( -3.241 -0.148 0.922) 3.373 3.444 ( -6.650 2.807 0.145) 7.220 3.607 ( 5.384 -1.068 0.599) 5.522 3.644 ( -1.343 -6.741 -5.009) 8.504 3.895 ( -0.531 -6.322 2.520) 6.827 4.005 ( 7.456 -3.868 1.822) 8.595 4.087 ( 0.200 0.832 -3.318) 3.427 4.210 ( 4.017 6.139 -6.366) 9.714 4.338 ( 3.031 1.706 -1.626) 3.840 4.394 ( -1.083 -1.589 5.277) 5.616 4.508 ( -1.283 -0.266 -2.466) 2.793 4.684 ( 0.803 -1.835 -5.823) 6.157 4.763 ( -1.944 -3.628 5.553) 6.912 4.812 ( -2.374 4.026 0.947) 4.769 4.940 ( -3.737 -0.502 -3.125) 4.897 5.018 ( -1.271 3.412 -4.494) 5.784 5.218 ( -2.790 0.197 5.492) 6.163 5.318 ( -2.959 -1.938 3.488) 4.968 5.468 ( 1.012 2.331 -0.509) 2.592 5.588 ( 3.237 1.463 -2.884) 4.575 5.730 ( -0.829 -2.375 -3.823) 4.576 5.769 ( 0.132 -5.402 -1.220) 5.540 5.937 ( 4.770 -1.212 2.410) 5.480 5.986 ( 6.129 -5.167 -2.424) 8.375 7.146 ( 2.999 -8.783 10.393) 13.934 7.362 ( -0.971 4.966 -2.517) 5.652 7.537 ( -0.366 -3.014 0.914) 3.170 7.603 ( 2.128 1.400 -5.122) 5.720 7.890 ( -2.216 -2.472 2.601) 4.217 7.983 ( -2.149 -6.863 4.356) 8.408 8.146 ( -0.673 5.921 1.835) 6.235 8.193 ( 1.496 -0.175 0.831) 1.720 8.797 ( 1.399 4.854 -4.056) 6.479 8.857 ( 1.136 -0.475 -2.581) 2.860 8.991 ( -2.798 3.595 0.548) 4.589 9.051 ( -3.803 1.617 2.182) 4.673 9.120 ( 5.688 6.645 -1.290) 8.841 9.333 ( 1.832 1.156 -6.260) 6.624 9.643 ( 4.325 -2.410 5.767) 7.601 9.805 ( -1.676 -4.154 -5.873) 7.386 10.183 ( 1.519 0.053 8.655) 8.788 10.475 ( 0.258 2.970 -6.808) 7.432 10.814 ( -1.012 -0.247 5.820) 5.913 10.984 ( -2.966 -2.197 -1.281) 3.907 11.502 ( -6.047 4.253 -1.744) 7.596 11.608 ( -0.014 4.650 0.083) 4.651 11.764 ( 2.398 -2.703 0.746) 3.689 11.821 ( 2.748 -1.091 -0.330) 2.975 12.667 ( -2.279 1.354 1.528) 3.059 12.853 ( -4.337 1.080 -0.656) 4.517 12.947 ( 3.819 -0.725 -1.615) 4.209 12.996 ( 9.363 0.874 -6.003) 11.157 13.583 ( -1.773 -1.008 -1.028) 2.284 13.738 ( 4.627 1.407 -2.862) 5.619 13.926 ( -7.633 0.944 9.723) 12.397 13.977 ( -2.362 0.154 5.926) 6.381 14.745 ( 2.184 0.180 -1.200) 2.498 14.901 ( 0.854 -1.597 -7.085) 7.313 15.035 ( -1.004 3.210 1.905) 3.865 15.080 ( -8.405 3.552 -1.133) 9.195 15.706 ( -2.643 7.732 1.211) 8.261 15.720 ( 2.741 7.551 -0.294) 8.038 15.873 ( -2.724 3.887 1.634) 5.020 15.895 ( -3.591 4.872 0.694) 6.092 16.410 ( -2.952 -6.246 2.899) 7.492 16.624 ( 1.212 -4.898 -4.711) 6.903 16.734 ( -1.331 3.166 3.578) 4.959 16.883 ( 2.051 -3.326 -0.680) 3.966 16.911 ( 0.755 -1.631 -0.971) 2.043 17.008 ( 3.100 1.062 -0.970) 3.417 17.059 ( -0.587 -1.512 1.694) 2.345 17.199 ( 1.854 0.120 -1.929) 2.678 19.989 ( -4.301 8.231 3.394) 9.888 20.129 ( -2.881 4.839 -3.330) 6.543 21.075 ( 1.801 -0.947 2.225) 3.015 21.257 ( 5.518 -1.043 -2.230) 6.042 22.692 ( -0.717 -5.351 5.906) 8.002 23.029 ( 3.744 -6.161 -6.161) 9.484 27.843 ( 1.014 0.189 4.595) 4.709 27.979 ( 0.059 2.129 -3.385) 3.999 29.550 ( -1.316 2.797 0.716) 3.173 29.663 ( 1.104 1.977 -3.071) 3.815 29.883 ( -3.366 1.671 1.601) 4.085 29.983 ( 1.144 0.702 0.750) 1.537 31.047 ( -1.626 1.032 1.386) 2.372 31.092 ( -2.240 1.333 -1.026) 2.801 31.240 ( -2.063 -4.738 0.036) 5.168 31.374 ( 3.976 -9.157 0.411) 9.991 31.739 ( 1.079 -2.951 0.027) 3.142 31.768 ( 1.592 0.233 -0.626) 1.726 31.970 ( 0.536 1.935 4.468) 4.898 32.153 ( -1.495 -1.036 -4.875) 5.203 32.532 ( -4.081 1.399 -1.333) 4.516 32.602 ( 3.709 1.440 -0.956) 4.092 32.700 ( -7.160 1.542 5.548) 9.188 33.071 ( 7.139 2.419 -5.594) 9.387 34.407 ( 0.330 -3.928 -0.936) 4.051 34.469 ( 1.110 -8.614 -1.209) 8.769 34.646 ( -4.588 1.052 11.966) 12.858 35.108 ( 6.195 -0.485 -6.316) 8.861 36.106 ( -4.207 8.734 3.499) 10.307 36.380 ( 1.264 7.862 -6.103) 10.033 36.596 ( -12.639 4.771 5.477) 14.577 37.073 ( 11.081 7.023 -4.384) 13.833 ======================= Grid point 126 (59/95) ======================= q-point: (-0.22 -0.56 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.814 ( -4.986 -7.912 5.396) 10.797 1.937 ( -7.288 -2.682 8.128) 11.242 2.186 ( 2.138 -1.580 1.251) 2.938 2.260 ( -8.806 2.303 1.183) 9.178 2.582 ( -5.473 -3.334 2.977) 7.067 2.759 ( -2.081 5.211 2.587) 6.179 2.806 ( -5.527 0.731 -4.021) 6.874 2.971 ( 6.560 2.269 6.576) 9.561 3.084 ( -5.232 0.219 -2.698) 5.891 3.295 ( 3.365 -2.468 -6.630) 7.834 3.316 ( -6.257 2.457 5.049) 8.407 3.423 ( -2.421 -5.845 2.140) 6.679 3.653 ( 4.334 2.214 -1.860) 5.210 3.715 ( -0.602 -2.909 0.226) 2.979 3.950 ( 1.196 3.360 -2.753) 4.505 4.033 ( 1.341 -0.698 -9.120) 9.245 4.124 ( 8.617 -0.170 2.237) 8.905 4.200 ( 9.603 0.212 -4.773) 10.726 4.390 ( 0.566 -5.121 3.002) 5.963 4.415 ( -2.889 -1.590 5.116) 6.087 4.510 ( 0.604 -0.839 -0.293) 1.075 4.651 ( -0.084 10.446 -1.352) 10.533 4.734 ( -0.854 -2.275 -2.550) 3.522 4.827 ( -3.387 -3.736 4.244) 6.591 4.906 ( -0.097 1.031 -5.288) 5.389 4.969 ( -2.406 -2.704 -2.106) 4.188 5.189 ( -1.944 4.672 3.888) 6.382 5.287 ( -7.602 1.068 2.740) 8.151 5.402 ( -6.295 -2.505 -3.941) 7.838 5.655 ( 4.965 -2.186 -1.237) 5.564 5.746 ( -3.564 -3.310 -1.907) 5.224 5.846 ( 1.576 -2.770 -2.266) 3.910 5.981 ( 6.596 2.387 1.000) 7.086 6.173 ( 11.735 -7.019 -1.625) 13.770 7.273 ( 0.454 1.081 0.181) 1.186 7.349 ( 1.505 -5.998 3.287) 7.004 7.511 ( -0.581 1.643 -3.513) 3.921 7.685 ( 0.958 -5.638 0.985) 5.803 7.854 ( -2.793 3.609 1.443) 4.787 7.971 ( 1.814 7.001 -0.166) 7.234 8.163 ( -2.701 -8.359 6.554) 10.960 8.291 ( 3.722 -6.459 3.008) 8.039 8.672 ( -1.957 7.325 -0.715) 7.615 8.853 ( 1.101 2.626 -2.712) 3.932 8.928 ( 0.279 2.609 -0.826) 2.751 8.993 ( -0.175 3.734 -0.109) 3.740 9.110 ( 4.652 0.404 1.357) 4.863 9.286 ( -0.288 2.304 -4.808) 5.339 9.732 ( 0.991 -2.569 3.133) 4.171 9.870 ( 2.781 -5.081 -1.686) 6.032 10.207 ( -0.776 0.887 4.825) 4.967 10.426 ( 1.781 1.336 -5.118) 5.581 10.828 ( -0.951 -0.728 4.692) 4.843 10.965 ( -4.393 -0.229 -0.955) 4.502 11.367 ( -4.450 4.917 -2.550) 7.105 11.529 ( -0.366 4.087 1.039) 4.233 11.833 ( 2.259 -1.774 -1.840) 3.412 11.860 ( 2.535 -0.875 1.695) 3.172 12.631 ( -0.717 1.531 -1.197) 2.072 12.779 ( -5.098 0.663 -0.099) 5.142 13.011 ( 6.577 -0.915 -0.279) 6.646 13.066 ( 7.754 -0.806 -5.395) 9.480 13.583 ( -1.218 -0.994 -0.200) 1.585 13.731 ( 1.213 2.299 0.251) 2.612 13.856 ( -8.433 0.463 8.508) 11.988 13.993 ( -0.102 -0.332 4.410) 4.424 14.736 ( -1.769 2.118 -2.171) 3.511 14.826 ( -10.504 3.926 -0.144) 11.215 14.919 ( -7.996 5.155 2.799) 9.917 15.024 ( 3.600 -1.746 -7.066) 8.120 15.547 ( -2.474 6.897 1.300) 7.441 15.636 ( 4.655 6.628 0.396) 8.109 15.745 ( -3.690 6.487 -2.821) 7.978 15.817 ( -0.989 3.372 3.237) 4.778 16.483 ( -4.355 -5.579 1.731) 7.286 16.660 ( 0.058 1.672 2.240) 2.796 16.718 ( 0.049 -2.548 -2.972) 3.915 16.940 ( 3.794 0.099 -0.404) 3.816 16.960 ( 0.609 -3.083 -0.276) 3.155 17.017 ( 3.823 1.414 -0.564) 4.115 17.087 ( -0.627 -2.425 0.277) 2.520 17.201 ( 0.849 0.451 -1.332) 1.643 19.829 ( -5.399 5.800 3.362) 8.608 20.012 ( -2.150 4.532 -3.927) 6.370 21.130 ( 2.955 -1.732 1.915) 3.924 21.323 ( 5.081 -1.375 -2.120) 5.675 22.804 ( 0.820 -5.604 5.841) 8.136 23.137 ( 3.306 -4.645 -6.070) 8.328 27.859 ( 0.356 -0.106 3.446) 3.466 27.936 ( 0.965 2.689 -2.165) 3.585 29.511 ( -2.423 -0.044 0.129) 2.427 29.643 ( 0.679 0.491 -2.172) 2.327 29.802 ( -3.259 4.179 1.560) 5.524 29.967 ( 1.031 2.404 0.332) 2.637 31.019 ( -1.819 0.544 1.783) 2.605 31.046 ( -2.225 1.374 -1.124) 2.846 31.310 ( -1.774 -5.787 0.098) 6.054 31.577 ( 4.902 -8.973 0.327) 10.230 31.726 ( -2.690 3.349 1.162) 4.450 31.796 ( 3.087 -0.755 0.505) 3.218 32.004 ( 2.152 -2.430 4.532) 5.574 32.129 ( -3.673 -0.718 -6.182) 7.227 32.481 ( -2.044 0.654 -1.859) 2.839 32.565 ( -2.292 2.766 -2.521) 4.389 32.639 ( -3.060 2.035 4.830) 6.069 33.071 ( 7.246 3.608 -5.884) 10.007 34.476 ( -2.031 -5.263 1.770) 5.913 34.609 ( -3.440 -1.078 7.515) 8.335 34.665 ( 3.534 -8.166 2.842) 9.340 35.181 ( 11.150 -0.787 -6.575) 12.968 35.918 ( -5.479 9.638 3.866) 11.741 36.191 ( -5.011 8.333 -7.284) 12.149 36.401 ( -12.342 5.745 3.638) 14.091 37.085 ( 13.131 4.698 -1.566) 14.034 ======================= Grid point 127 (60/95) ======================= q-point: (-0.11 -0.56 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.865 ( -0.658 2.854 5.868) 6.559 1.877 ( -4.298 0.606 10.215) 11.099 2.147 ( -0.264 0.773 0.736) 1.100 2.252 ( -3.938 1.338 0.688) 4.215 2.467 ( -3.027 5.720 -3.220) 7.228 2.669 ( -5.862 5.331 3.085) 8.503 2.716 ( -7.926 -0.341 4.038) 8.902 3.025 ( 3.656 1.097 0.554) 3.857 3.167 ( -3.839 -14.298 -2.137) 14.958 3.229 ( -2.392 2.765 4.110) 5.501 3.367 ( 3.435 -1.843 -3.713) 5.384 3.545 ( 0.212 -4.988 8.950) 10.249 3.610 ( 0.839 1.151 -7.951) 8.077 3.730 ( 1.136 1.245 2.715) 3.195 3.854 ( -0.814 4.236 -6.537) 7.832 4.077 ( 4.336 -1.591 -8.214) 9.423 4.209 ( 9.213 1.099 1.569) 9.410 4.283 ( 10.141 1.889 -1.789) 10.470 4.404 ( -4.734 0.976 -0.789) 4.897 4.482 ( 0.344 -2.734 5.976) 6.580 4.502 ( 5.246 6.152 2.990) 8.620 4.564 ( 1.104 -3.328 0.642) 3.565 4.724 ( -0.888 0.065 -3.466) 3.579 4.852 ( -2.397 -0.549 -0.244) 2.471 4.871 ( -0.611 -0.225 -1.622) 1.748 5.035 ( -2.922 1.427 1.320) 3.509 5.045 ( 2.124 3.359 -3.838) 5.525 5.195 ( -10.962 -1.273 1.634) 11.156 5.427 ( -2.623 -4.641 -2.002) 5.695 5.656 ( -7.849 0.820 -1.496) 8.033 5.782 ( 2.939 -2.041 -0.264) 3.588 5.878 ( 2.522 -0.869 -4.151) 4.934 6.018 ( 4.160 0.119 1.010) 4.283 6.377 ( 7.801 -5.462 -0.628) 9.544 7.265 ( 0.140 -0.722 -2.736) 2.833 7.443 ( 5.367 1.276 -2.923) 6.244 7.487 ( -4.516 -3.761 3.212) 6.697 7.734 ( -1.088 0.281 -1.023) 1.520 7.753 ( -3.061 4.146 -0.146) 5.156 7.936 ( 2.020 -0.446 3.499) 4.065 8.309 ( -1.714 -9.393 4.530) 10.568 8.451 ( 3.639 -6.276 2.377) 7.634 8.534 ( -2.494 6.822 3.324) 7.988 8.797 ( -0.310 4.249 -2.966) 5.191 8.891 ( 3.150 2.308 -0.005) 3.905 8.942 ( 1.188 2.416 0.340) 2.714 9.148 ( 1.964 -0.488 -0.288) 2.045 9.272 ( -1.367 -2.465 -0.305) 2.835 9.771 ( -0.972 -2.178 0.118) 2.388 9.989 ( 3.406 -4.767 0.681) 5.898 10.150 ( -4.303 3.382 0.040) 5.473 10.436 ( 2.399 -0.582 -1.849) 3.084 10.844 ( 0.045 -0.153 2.611) 2.616 10.917 ( -4.029 0.468 0.230) 4.062 11.259 ( -0.992 3.475 -2.734) 4.531 11.483 ( 1.836 2.675 1.266) 3.483 11.855 ( 0.476 -0.842 -2.449) 2.633 11.895 ( 0.429 -0.355 1.953) 2.031 12.599 ( -0.067 0.851 -2.450) 2.594 12.762 ( -1.941 -2.123 0.959) 3.032 13.080 ( 3.215 -1.419 0.250) 3.523 13.136 ( 6.922 -0.857 -4.594) 8.352 13.589 ( -0.099 -0.297 0.585) 0.663 13.698 ( 0.029 2.123 1.909) 2.855 13.799 ( -7.410 0.329 7.512) 10.557 13.990 ( -2.380 0.507 2.417) 3.429 14.594 ( -8.983 5.243 -0.425) 10.410 14.663 ( -6.347 4.602 -0.629) 7.865 14.826 ( -3.653 1.335 4.468) 5.924 15.084 ( 4.224 -2.865 -8.060) 9.540 15.474 ( 1.989 2.239 0.863) 3.116 15.590 ( 3.719 4.158 -0.506) 5.602 15.604 ( 0.461 6.521 -1.952) 6.823 15.774 ( 0.439 2.371 2.427) 3.421 16.518 ( -4.569 -3.152 1.827) 5.844 16.643 ( 0.948 1.360 4.467) 4.765 16.745 ( -0.756 -2.118 -5.497) 5.939 16.960 ( 3.408 1.821 0.681) 3.923 16.990 ( -1.424 -1.488 -1.050) 2.312 17.034 ( 4.435 1.016 -1.492) 4.788 17.126 ( 0.721 -1.532 -0.025) 1.694 17.196 ( -0.491 -0.048 -0.282) 0.569 19.729 ( -2.913 2.622 2.525) 4.662 19.928 ( -0.135 2.856 -3.737) 4.705 21.187 ( 1.168 -1.941 2.033) 3.044 21.377 ( 2.349 -1.402 -2.204) 3.513 22.906 ( 0.500 -3.409 5.265) 6.293 23.203 ( 2.051 -2.115 -5.674) 6.393 27.866 ( -0.227 1.343 2.578) 2.915 27.909 ( 0.754 -0.310 -1.348) 1.575 29.500 ( -2.507 -1.339 -0.524) 2.890 29.642 ( 0.437 0.135 -1.826) 1.882 29.719 ( -1.181 3.308 2.743) 4.457 29.936 ( 1.191 2.132 -0.080) 2.443 30.992 ( -1.586 2.066 0.979) 2.783 31.018 ( -0.753 -0.838 0.004) 1.126 31.397 ( -0.729 -6.145 0.247) 6.193 31.623 ( -5.160 3.486 1.401) 6.383 31.743 ( 5.017 -3.359 0.714) 6.080 31.824 ( 2.445 1.107 0.931) 2.841 32.066 ( -2.709 -0.488 -1.979) 3.390 32.094 ( -0.555 -2.703 -0.175) 2.764 32.451 ( -0.202 1.578 -2.163) 2.685 32.492 ( -2.886 1.494 -2.216) 3.934 32.596 ( -0.195 1.812 2.244) 2.891 33.061 ( 6.026 2.997 -6.318) 9.231 34.534 ( -5.352 -3.080 6.216) 8.762 34.605 ( -0.534 -0.478 7.825) 7.858 34.850 ( 4.095 -5.861 0.037) 7.150 35.309 ( 13.258 -3.356 -6.706) 15.232 35.720 ( -5.910 7.231 1.955) 9.541 36.029 ( -8.443 1.047 -5.360) 10.055 36.211 ( -7.057 6.292 2.752) 9.847 37.143 ( 9.112 0.913 -0.496) 9.171 ======================= Grid point 133 (61/95) ======================= q-point: (-0.44 -0.44 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.350 ( -9.212 -0.000 11.451) 14.697 1.758 ( -5.961 -0.000 21.050) 21.878 2.066 ( -0.095 -0.000 -2.932) 2.934 2.111 ( -5.818 -0.000 0.169) 5.821 2.630 ( 1.770 0.000 -5.304) 5.592 2.830 ( 0.009 0.000 -0.688) 0.688 2.933 ( 0.304 0.000 -1.793) 1.819 3.066 ( -2.838 -0.000 8.813) 9.259 3.151 ( 4.240 0.000 -10.899) 11.695 3.366 ( -4.125 -0.000 1.112) 4.273 3.472 ( -0.758 -0.000 -7.512) 7.550 3.479 ( -4.792 -0.000 2.466) 5.389 3.579 ( 3.176 0.000 -0.714) 3.255 3.657 ( -2.832 -0.000 12.744) 13.055 3.692 ( -1.985 -0.000 -9.781) 9.981 3.891 ( 8.395 0.000 7.969) 11.575 4.059 ( 2.730 0.000 -3.255) 4.248 4.319 ( 5.070 0.000 -6.565) 8.295 4.339 ( -4.160 -0.000 1.071) 4.296 4.440 ( 7.474 0.000 -3.119) 8.098 4.493 ( -4.999 -0.000 0.466) 5.021 4.646 ( -7.237 -0.000 -13.211) 15.064 4.749 ( -8.971 -0.000 6.842) 11.282 4.788 ( 0.680 0.000 3.860) 3.919 4.911 ( -2.078 -0.000 -5.580) 5.955 5.176 ( 7.915 0.000 -2.510) 8.304 5.216 ( -8.098 -0.000 6.967) 10.682 5.297 ( 3.647 0.000 5.649) 6.723 5.598 ( 0.118 0.000 -3.424) 3.426 5.629 ( -1.521 -0.000 4.437) 4.690 5.695 ( 1.749 0.000 0.919) 1.976 5.715 ( 4.366 0.000 -9.827) 10.754 5.793 ( 3.796 0.000 -0.109) 3.798 5.828 ( 1.306 0.000 0.732) 1.497 6.968 ( 4.010 0.000 12.867) 13.478 7.417 ( 1.581 0.000 -6.422) 6.614 7.615 ( 0.048 0.000 2.566) 2.566 7.662 ( -2.966 -0.000 3.628) 4.686 7.767 ( -0.304 -0.000 3.909) 3.921 7.774 ( 0.220 0.000 -3.280) 3.287 8.187 ( -1.536 -0.000 2.605) 3.024 8.334 ( 1.448 0.000 -2.107) 2.556 8.797 ( 2.506 0.000 1.492) 2.916 8.908 ( -0.433 -0.000 -6.942) 6.956 9.080 ( -1.348 -0.000 -1.325) 1.891 9.093 ( -8.871 -0.000 -0.400) 8.880 9.276 ( 9.130 0.000 -1.251) 9.215 9.305 ( 1.224 0.000 -2.383) 2.680 9.624 ( 4.679 0.000 2.275) 5.203 9.714 ( 0.819 0.000 -5.188) 5.252 10.191 ( 0.444 0.000 10.531) 10.540 10.543 ( 0.813 0.000 -7.246) 7.291 10.825 ( -1.190 -0.000 3.602) 3.793 10.906 ( -3.358 -0.000 0.867) 3.468 11.567 ( -8.276 -0.000 -2.190) 8.561 11.681 ( -7.282 -0.000 1.601) 7.456 11.722 ( 8.022 0.000 -1.532) 8.167 11.802 ( 4.529 0.000 1.076) 4.655 12.701 ( -1.555 -0.000 2.392) 2.853 12.887 ( 1.156 0.000 -1.121) 1.610 12.905 ( 1.986 0.000 -0.077) 1.987 13.040 ( 6.268 0.000 -6.839) 9.277 13.565 ( -0.314 -0.000 -2.551) 2.570 13.760 ( 6.291 0.000 -6.478) 9.030 13.944 ( -4.035 -0.000 12.836) 13.455 13.987 ( -8.338 -0.000 4.544) 9.495 14.753 ( 3.200 0.000 -0.982) 3.347 14.861 ( 1.660 0.000 -7.627) 7.805 15.100 ( -3.072 -0.000 2.852) 4.192 15.137 ( -6.924 -0.000 -0.380) 6.934 15.851 ( 0.469 0.000 1.511) 1.582 15.882 ( 3.653 0.000 -2.315) 4.325 15.937 ( -8.421 -0.000 2.104) 8.680 15.977 ( -4.855 -0.000 3.719) 6.115 16.280 ( -2.471 -0.000 2.855) 3.776 16.509 ( 2.220 0.000 -4.560) 5.072 16.801 ( -0.776 -0.000 2.797) 2.903 16.828 ( -1.130 -0.000 -1.967) 2.268 16.850 ( 1.182 0.000 -1.509) 1.916 17.026 ( 3.407 0.000 -1.307) 3.649 17.044 ( 0.884 0.000 3.580) 3.687 17.195 ( 2.156 0.000 -1.992) 2.935 20.193 ( -2.619 -0.000 3.143) 4.091 20.194 ( -6.672 -0.000 -2.610) 7.164 21.075 ( 2.673 0.000 2.062) 3.375 21.244 ( 6.155 0.000 -1.039) 6.242 22.593 ( -0.602 -0.000 4.459) 4.500 22.892 ( 4.546 0.000 -5.609) 7.220 27.855 ( 2.623 0.000 6.465) 6.977 28.011 ( -0.852 -0.000 -4.729) 4.806 29.687 ( -1.880 -0.000 -4.136) 4.543 29.709 ( 3.675 0.000 -0.816) 3.765 29.871 ( -2.898 -0.000 3.181) 4.303 29.949 ( -0.349 -0.000 2.711) 2.733 31.058 ( -0.822 -0.000 2.062) 2.219 31.118 ( -3.307 -0.000 -1.264) 3.541 31.167 ( 0.513 0.000 -2.245) 2.303 31.195 ( -1.073 -0.000 0.370) 1.135 31.673 ( 1.824 0.000 1.676) 2.477 31.756 ( 4.760 0.000 -2.169) 5.230 32.035 ( -0.886 -0.000 2.605) 2.752 32.147 ( -0.611 -0.000 -2.361) 2.439 32.554 ( -7.054 -0.000 -2.660) 7.539 32.609 ( 4.596 0.000 1.238) 4.760 32.729 ( -8.511 -0.000 4.701) 9.723 33.111 ( 8.386 0.000 -5.011) 9.769 34.301 ( 0.538 0.000 0.542) 0.764 34.362 ( 1.517 0.000 -4.121) 4.391 34.660 ( -4.756 -0.000 12.010) 12.917 35.093 ( 4.751 0.000 -5.875) 7.556 36.260 ( -7.573 -0.000 1.359) 7.694 36.536 ( 8.564 0.000 0.519) 8.580 36.689 ( -12.214 -0.000 2.862) 12.545 37.217 ( 8.039 0.000 -6.297) 10.211 ======================= Grid point 134 (62/95) ======================= q-point: (-0.33 -0.44 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.382 ( -10.106 -11.571 8.719) 17.664 1.774 ( -14.228 -4.154 25.311) 29.332 1.999 ( -1.008 -0.205 -5.439) 5.535 2.196 ( -2.209 -10.578 -1.502) 10.910 2.579 ( -5.031 4.726 -5.331) 8.721 2.786 ( -2.115 4.022 -2.797) 5.336 2.946 ( 3.364 -0.297 0.873) 3.488 3.054 ( -2.734 1.241 9.536) 9.997 3.168 ( 2.042 -2.133 -4.201) 5.135 3.351 ( -3.487 -0.538 -3.101) 4.698 3.387 ( -3.916 6.996 0.446) 8.030 3.455 ( -5.913 3.381 1.791) 7.043 3.527 ( 1.907 -0.229 -6.733) 7.001 3.639 ( 4.786 -1.797 1.692) 5.385 3.790 ( -0.205 -6.823 2.763) 7.364 4.006 ( 5.955 -2.838 2.836) 7.181 4.079 ( 0.830 -1.772 -5.126) 5.486 4.257 ( -4.187 0.779 -3.741) 5.669 4.336 ( -6.406 -3.637 -0.265) 7.371 4.446 ( 1.367 5.220 -3.628) 6.503 4.489 ( 3.487 -0.279 2.209) 4.137 4.608 ( 1.063 -2.690 -11.274) 11.639 4.698 ( -5.999 -1.614 3.949) 7.361 4.787 ( -4.908 -0.396 6.579) 8.218 4.897 ( 0.216 -1.387 -4.606) 4.816 5.069 ( -7.347 6.020 -4.008) 10.309 5.223 ( 0.366 2.824 5.394) 6.099 5.330 ( 3.513 1.046 4.714) 5.971 5.601 ( -3.420 5.623 -1.143) 6.681 5.633 ( -1.422 -0.914 -3.508) 3.894 5.637 ( 7.036 0.675 2.595) 7.529 5.723 ( 3.006 -1.421 -4.766) 5.811 5.917 ( 3.935 -6.828 -0.107) 7.882 5.956 ( 10.093 -6.918 -0.866) 12.268 7.101 ( 6.048 -4.819 12.538) 14.731 7.411 ( 0.795 1.603 -9.298) 9.468 7.538 ( 0.935 2.767 7.290) 7.853 7.675 ( 1.919 5.734 -3.873) 7.181 7.773 ( -2.202 -7.724 3.313) 8.688 7.885 ( 0.351 -6.286 5.534) 8.382 8.176 ( -0.433 0.349 1.745) 1.831 8.287 ( 0.781 5.567 -1.659) 5.861 8.835 ( 2.008 -1.643 -0.454) 2.634 8.856 ( -1.691 2.760 -6.519) 7.278 8.996 ( -6.856 1.819 1.714) 7.297 9.054 ( -0.823 1.221 -3.038) 3.376 9.266 ( 4.136 4.658 -0.687) 6.267 9.365 ( 6.119 0.561 -2.588) 6.667 9.692 ( 6.742 -0.137 3.488) 7.592 9.739 ( 3.064 -2.324 -4.244) 5.727 10.220 ( 0.207 0.149 9.027) 9.031 10.507 ( 0.785 2.421 -7.411) 7.836 10.816 ( -1.893 0.377 4.449) 4.850 10.900 ( -4.581 -3.003 0.172) 5.480 11.465 ( -9.126 1.127 -2.944) 9.655 11.609 ( -7.599 0.510 2.038) 7.884 11.792 ( 7.244 -0.133 -1.280) 7.357 11.849 ( 4.209 -0.051 0.890) 4.303 12.692 ( 1.400 1.530 0.658) 2.176 12.856 ( -1.457 3.026 -1.742) 3.783 12.954 ( 3.638 -2.150 -0.256) 4.234 13.083 ( 8.213 0.571 -4.957) 9.610 13.556 ( -0.456 -0.235 -3.019) 3.062 13.783 ( 1.719 0.648 -2.738) 3.297 13.905 ( -5.820 2.115 7.702) 9.882 13.965 ( -2.035 -1.314 6.854) 7.269 14.775 ( 2.629 0.710 -0.744) 2.823 14.856 ( -1.459 -1.068 -6.404) 6.655 15.036 ( -7.835 2.398 -1.351) 8.304 15.050 ( -7.265 1.199 2.765) 7.865 15.777 ( -7.832 5.458 3.281) 10.094 15.847 ( -2.984 3.344 -1.966) 4.893 15.873 ( -1.120 2.755 1.082) 3.165 15.916 ( -5.281 2.325 2.522) 6.297 16.307 ( -1.233 -4.108 2.060) 4.758 16.551 ( 2.301 -3.519 -5.289) 6.757 16.772 ( -1.539 1.918 2.758) 3.695 16.854 ( 2.124 -2.085 0.253) 2.987 16.884 ( 2.163 -2.597 -2.508) 4.208 17.051 ( 2.300 0.509 -0.060) 2.357 17.059 ( 1.600 0.337 2.500) 2.987 17.208 ( 1.505 0.004 -1.847) 2.382 20.057 ( -8.921 6.091 1.687) 10.933 20.133 ( -6.811 2.134 -0.779) 7.180 21.125 ( 7.409 0.648 1.261) 7.543 21.308 ( 7.407 -0.032 -0.906) 7.462 22.636 ( 1.355 -3.280 4.554) 5.774 22.963 ( 5.326 -4.353 -5.892) 9.057 27.892 ( 2.847 1.517 7.218) 7.906 27.995 ( 1.284 0.381 -4.605) 4.796 29.599 ( -2.342 4.989 -2.197) 5.933 29.710 ( 1.349 3.097 -1.926) 3.889 29.872 ( -1.667 -0.958 1.973) 2.755 29.966 ( -2.243 -2.029 2.555) 3.959 31.042 ( -2.838 0.826 1.010) 3.123 31.080 ( -2.473 0.759 -1.628) 3.057 31.179 ( 0.229 -1.891 -1.496) 2.422 31.251 ( 0.038 -8.123 1.668) 8.293 31.714 ( 2.184 -1.470 1.586) 3.074 31.809 ( 6.599 0.045 -2.455) 7.041 32.011 ( -1.375 1.958 3.053) 3.879 32.130 ( -0.893 0.395 -2.755) 2.923 32.479 ( -6.909 -0.448 -2.331) 7.305 32.626 ( -4.297 0.768 -2.063) 4.828 32.668 ( -3.211 0.031 7.241) 7.921 33.160 ( 7.611 1.450 -6.637) 10.202 34.344 ( 0.791 -3.544 -0.422) 3.656 34.381 ( 1.003 -2.901 -3.141) 4.392 34.659 ( -2.406 0.341 13.551) 13.767 35.142 ( 7.571 -1.053 -5.873) 9.639 36.151 ( -8.879 3.605 0.937) 9.628 36.514 ( -8.098 6.211 10.995) 15.001 36.578 ( 0.016 5.213 -9.134) 10.516 37.256 ( 10.614 3.412 -4.163) 11.901 ======================= Grid point 135 (63/95) ======================= q-point: (-0.22 -0.44 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.567 ( -8.403 -16.385 7.010) 19.703 1.777 ( -12.385 -6.626 17.391) 22.354 2.058 ( -1.987 -7.532 1.225) 7.886 2.330 ( -18.632 7.915 -0.355) 20.246 2.379 ( -0.143 -11.688 -3.758) 12.278 2.676 ( -3.814 2.955 -5.564) 7.365 2.943 ( 0.655 5.938 7.030) 9.225 3.030 ( -2.172 3.610 2.347) 4.823 3.172 ( -2.484 7.441 -1.867) 8.063 3.247 ( -1.730 -4.674 3.629) 6.165 3.296 ( -4.126 5.225 -4.106) 7.822 3.359 ( -0.045 -1.227 -0.175) 1.241 3.607 ( 1.387 -6.020 -5.049) 7.979 3.729 ( 5.010 -1.671 2.242) 5.738 3.923 ( 2.593 -6.500 1.630) 7.185 4.029 ( -1.573 1.662 -8.145) 8.460 4.168 ( 4.782 -5.159 4.262) 8.225 4.247 ( 0.729 -0.348 -3.624) 3.713 4.300 ( -7.614 -2.853 -2.263) 8.440 4.388 ( 0.649 -0.192 2.587) 2.674 4.504 ( -1.279 0.287 1.321) 1.861 4.664 ( 2.853 -3.726 -8.533) 9.738 4.716 ( -2.693 -3.073 3.159) 5.165 4.765 ( -5.559 -1.495 4.990) 7.618 4.892 ( -3.806 5.368 -4.702) 8.088 4.913 ( 1.711 0.666 -3.580) 4.023 5.200 ( -3.170 -2.207 3.778) 5.403 5.346 ( 5.351 3.874 2.151) 6.948 5.418 ( -3.074 11.043 -1.564) 11.569 5.618 ( -5.658 -2.101 -4.214) 7.361 5.698 ( 3.859 -2.101 0.725) 4.453 5.816 ( 6.661 -2.979 -1.628) 7.477 6.053 ( 6.201 -2.651 -1.647) 6.942 6.183 ( 13.580 -6.339 -0.488) 14.995 7.266 ( 3.395 -4.634 7.747) 9.644 7.332 ( 0.087 3.687 -4.389) 5.732 7.577 ( 3.920 2.666 2.362) 5.297 7.619 ( 1.342 -1.983 -2.642) 3.565 7.845 ( -3.521 -2.260 1.344) 4.394 8.000 ( -0.331 -4.524 8.512) 9.645 8.161 ( 1.172 4.977 3.571) 6.236 8.246 ( 3.766 -3.022 0.640) 4.871 8.747 ( -2.313 5.270 -5.152) 7.724 8.879 ( 1.281 -0.320 -2.415) 2.752 8.923 ( -4.668 -0.034 2.039) 5.094 9.015 ( -0.768 1.667 -3.450) 3.908 9.226 ( 4.831 4.723 0.975) 6.826 9.362 ( 5.325 5.110 -2.947) 7.947 9.735 ( 2.977 0.005 -1.343) 3.266 9.846 ( 7.452 -3.523 2.545) 8.627 10.235 ( -0.598 1.048 5.167) 5.306 10.455 ( 1.352 2.032 -5.572) 6.083 10.805 ( -3.375 -0.869 3.347) 4.832 10.908 ( -3.456 -2.013 0.824) 4.083 11.352 ( -7.959 1.446 -3.310) 8.741 11.540 ( -5.699 0.585 1.946) 6.051 11.847 ( 4.355 0.124 -2.054) 4.817 11.886 ( 3.544 0.151 1.551) 3.871 12.676 ( 2.761 3.015 -2.340) 4.710 12.776 ( -1.639 3.018 0.137) 3.437 13.026 ( 3.678 -2.095 -0.501) 4.262 13.142 ( 8.857 0.689 -4.551) 9.981 13.554 ( -0.403 -1.100 -1.522) 1.921 13.749 ( -4.982 1.000 2.743) 5.774 13.852 ( -1.473 2.820 6.828) 7.533 13.989 ( -0.730 -0.873 2.644) 2.879 14.744 ( -7.513 3.033 -1.925) 8.327 14.785 ( -5.791 2.203 -1.601) 6.399 14.931 ( -6.484 3.292 3.740) 8.177 14.993 ( -0.367 -1.536 -5.040) 5.281 15.599 ( -9.227 5.537 2.196) 10.983 15.737 ( -5.032 3.955 -1.428) 6.557 15.811 ( 0.682 5.559 -1.323) 5.755 15.822 ( -7.238 1.427 4.184) 8.481 16.376 ( -0.979 -4.185 1.398) 4.520 16.615 ( 0.917 -3.609 -5.086) 6.304 16.741 ( 0.541 1.968 2.212) 3.009 16.908 ( -0.744 -2.939 1.168) 3.249 16.961 ( 4.842 -2.670 -1.690) 5.781 17.051 ( -0.376 -0.080 -0.217) 0.442 17.083 ( 3.911 0.835 1.660) 4.330 17.208 ( 0.407 0.444 -1.332) 1.462 19.865 ( -9.672 5.962 3.488) 11.885 20.025 ( -5.565 2.571 -3.283) 6.954 21.186 ( 7.768 1.402 1.499) 8.034 21.369 ( 6.538 0.530 -1.524) 6.734 22.747 ( 3.344 -5.295 4.968) 7.994 23.077 ( 4.997 -4.942 -6.189) 9.365 27.895 ( 1.434 2.226 4.773) 5.458 27.986 ( 2.287 2.157 -1.777) 3.611 29.495 ( -4.138 2.478 -1.514) 5.055 29.658 ( -0.565 2.124 -1.792) 2.836 29.846 ( -1.762 2.840 1.696) 3.748 29.977 ( -2.026 -0.842 1.473) 2.642 31.002 ( -3.145 0.215 0.617) 3.212 31.038 ( -2.556 0.909 -1.050) 2.909 31.228 ( 0.837 -3.747 -0.858) 3.935 31.450 ( 3.756 -11.348 2.023) 12.124 31.742 ( -0.465 0.555 0.759) 1.049 31.843 ( 4.999 1.569 -0.176) 5.243 32.005 ( 1.460 -1.225 2.275) 2.967 32.099 ( -1.056 1.252 -3.525) 3.887 32.436 ( -4.473 -1.530 -1.888) 5.090 32.536 ( -8.158 0.912 -0.545) 8.227 32.662 ( -1.688 1.308 3.732) 4.300 33.167 ( 5.745 2.611 -8.461) 10.555 34.388 ( -1.601 -3.323 -1.219) 3.885 34.494 ( 2.272 -8.144 -0.855) 8.498 34.684 ( 0.775 0.331 14.596) 14.620 35.240 ( 10.504 -2.339 -5.901) 12.273 35.991 ( -9.079 5.766 1.889) 10.920 36.299 ( -9.676 11.735 6.516) 16.547 36.421 ( -3.635 7.678 -7.526) 11.349 37.284 ( 11.419 5.218 -1.903) 12.698 ======================= Grid point 136 (64/95) ======================= q-point: (-0.11 -0.44 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.724 ( -9.774 -10.278 15.215) 20.801 1.898 ( -2.290 -5.480 5.217) 7.905 2.041 ( -16.105 -1.424 0.887) 16.192 2.173 ( -5.197 -7.670 4.051) 10.111 2.462 ( -3.134 1.040 -7.427) 8.128 2.666 ( -2.399 -2.037 -3.493) 4.701 2.824 ( 1.336 10.275 8.938) 13.684 2.889 ( -7.923 -3.813 -1.337) 8.894 3.117 ( 1.889 2.588 0.870) 3.320 3.220 ( -4.362 -1.916 4.531) 6.574 3.283 ( -2.809 -2.811 -8.424) 9.314 3.453 ( 2.784 -5.872 3.885) 7.571 3.667 ( 1.985 0.307 -3.071) 3.669 3.776 ( 2.312 0.862 -0.767) 2.584 3.907 ( -1.131 4.133 -4.981) 6.570 4.072 ( 5.004 -3.616 -0.950) 6.246 4.211 ( -4.382 -2.158 -0.293) 4.894 4.332 ( 2.034 -4.080 3.277) 5.615 4.359 ( -0.054 -7.256 -0.920) 7.314 4.404 ( -1.632 -0.953 -1.970) 2.730 4.513 ( -0.444 -2.087 4.006) 4.538 4.683 ( -1.999 -0.499 -0.850) 2.228 4.694 ( -0.386 4.705 4.529) 6.542 4.787 ( -2.855 -4.194 -7.952) 9.433 4.818 ( 0.886 -1.983 -0.018) 2.172 4.944 ( 0.744 -2.965 -0.179) 3.063 5.158 ( -2.015 11.625 1.063) 11.846 5.264 ( 1.165 0.602 -1.702) 2.148 5.344 ( 4.971 1.034 -0.916) 5.160 5.580 ( -5.969 -0.981 -3.950) 7.224 5.772 ( 1.810 -2.992 -0.241) 3.505 5.900 ( 6.116 0.202 -0.318) 6.128 6.095 ( 5.494 2.923 -2.995) 6.906 6.384 ( 9.586 -3.809 0.045) 10.315 7.263 ( 0.432 1.439 -4.414) 4.663 7.383 ( -0.596 -4.285 5.358) 6.886 7.543 ( 5.321 3.805 -4.952) 8.205 7.695 ( -0.324 -2.928 3.163) 4.322 7.796 ( -3.557 3.092 -0.500) 4.740 8.016 ( 2.877 4.378 0.432) 5.257 8.192 ( -0.175 -5.129 11.895) 12.955 8.389 ( 4.582 -6.651 3.031) 8.626 8.621 ( -2.218 5.844 -1.797) 6.503 8.834 ( -2.627 2.473 0.112) 3.610 8.924 ( -0.349 0.278 -1.781) 1.836 8.957 ( -2.555 1.207 -2.161) 3.557 9.214 ( 3.990 2.928 1.479) 5.166 9.309 ( 5.556 5.483 -1.475) 7.945 9.761 ( 3.005 -0.252 -1.125) 3.219 9.974 ( 6.071 -2.833 2.291) 7.080 10.182 ( -2.489 4.189 -0.292) 4.881 10.446 ( 1.713 -0.054 -1.987) 2.624 10.810 ( -2.557 -2.500 1.209) 3.775 10.901 ( -2.233 0.086 2.096) 3.064 11.258 ( -5.345 0.828 -3.014) 6.192 11.498 ( -3.636 -0.151 1.633) 3.988 11.858 ( 1.675 0.783 -2.250) 2.912 11.913 ( 2.073 0.625 1.483) 2.624 12.632 ( 1.880 2.887 -3.090) 4.628 12.754 ( 2.109 0.868 1.068) 2.519 13.081 ( 2.195 -1.320 -0.711) 2.658 13.195 ( 6.962 0.872 -3.800) 7.979 13.574 ( -0.229 -1.542 0.130) 1.564 13.701 ( -4.761 -0.147 4.186) 6.341 13.803 ( -2.145 3.647 6.320) 7.605 13.982 ( -2.280 0.491 1.008) 2.541 14.563 ( -11.417 3.556 -0.563) 11.972 14.685 ( -4.918 3.802 -0.890) 6.280 14.840 ( -3.437 2.690 5.305) 6.870 15.045 ( 3.680 -3.595 -7.128) 8.790 15.479 ( -5.347 0.650 0.001) 5.387 15.630 ( -5.121 2.368 -1.043) 5.737 15.699 ( -1.805 5.692 -0.238) 5.976 15.769 ( -6.265 -0.692 2.782) 6.890 16.429 ( -1.680 -3.373 1.474) 4.046 16.654 ( -0.360 -2.047 -1.215) 2.408 16.732 ( 2.497 1.192 -0.807) 2.882 16.938 ( -2.413 -2.248 0.190) 3.303 17.013 ( 2.725 0.822 0.077) 2.848 17.061 ( 0.636 -1.103 -2.189) 2.532 17.120 ( 3.568 -0.639 1.754) 4.027 17.197 ( -0.270 0.617 -0.806) 1.050 19.732 ( -5.885 2.000 2.778) 6.808 19.937 ( -3.292 1.486 -3.658) 5.140 21.226 ( 5.267 1.976 2.138) 6.018 21.398 ( 3.786 1.179 -2.298) 4.583 22.877 ( 3.287 -3.970 4.989) 7.173 23.170 ( 3.795 -3.061 -5.940) 7.685 27.883 ( -0.168 1.289 3.864) 4.076 27.950 ( 1.276 3.335 -1.528) 3.884 29.444 ( -3.889 -1.261 -0.872) 4.180 29.632 ( -0.391 -0.168 -1.993) 2.038 29.777 ( -1.440 3.581 2.651) 4.682 29.962 ( -1.496 0.851 0.398) 1.766 30.989 ( -2.139 -1.188 1.932) 3.118 30.998 ( -1.670 0.828 -1.598) 2.455 31.312 ( 1.924 -4.904 -0.151) 5.270 31.601 ( -2.512 -1.645 0.382) 3.027 31.750 ( 4.264 -2.494 2.793) 5.674 31.867 ( 3.359 0.884 1.322) 3.716 32.035 ( -2.098 1.063 -5.729) 6.193 32.085 ( 4.535 -1.488 2.420) 5.351 32.429 ( -2.226 -1.894 -2.452) 3.816 32.460 ( -5.215 -0.160 -0.333) 5.228 32.614 ( -3.481 1.801 1.690) 4.268 33.136 ( 2.983 3.035 -8.789) 9.765 34.430 ( -3.252 -4.417 1.902) 5.805 34.620 ( 0.964 -2.649 4.538) 5.342 34.782 ( 4.498 -6.112 8.300) 11.246 35.363 ( 9.701 -1.816 -6.193) 11.651 35.798 ( -8.999 7.982 2.883) 12.370 36.038 ( -4.919 9.855 -0.074) 11.015 36.254 ( -4.520 5.245 -2.975) 7.536 37.274 ( 6.540 5.865 -0.693) 8.812 ======================= Grid point 143 (65/95) ======================= q-point: (-0.33 -0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.187 ( -14.035 -0.000 10.952) 17.802 1.662 ( -19.579 -0.000 32.751) 38.157 2.004 ( -2.837 -0.000 -9.226) 9.653 2.018 ( -3.829 -0.000 -1.827) 4.242 2.513 ( -14.896 -0.000 -7.472) 16.665 2.841 ( 1.092 0.000 0.618) 1.254 2.948 ( 1.399 0.000 1.794) 2.275 3.088 ( -0.522 -0.000 13.276) 13.286 3.146 ( -0.227 -0.000 -5.494) 5.498 3.305 ( -2.857 -0.000 -3.814) 4.765 3.401 ( -5.273 -0.000 -1.076) 5.381 3.413 ( -3.298 -0.000 4.563) 5.630 3.583 ( 2.129 0.000 -18.570) 18.692 3.667 ( 3.714 0.000 2.543) 4.501 3.730 ( 3.003 0.000 10.749) 11.161 4.011 ( -5.709 -0.000 -12.769) 13.988 4.050 ( 5.019 0.000 2.415) 5.570 4.161 ( -11.616 -0.000 -2.837) 11.958 4.204 ( -4.439 -0.000 -2.844) 5.272 4.490 ( -1.143 -0.000 10.997) 11.056 4.569 ( 1.222 0.000 -4.414) 4.580 4.606 ( 11.803 0.000 -11.507) 16.484 4.637 ( -6.228 -0.000 4.513) 7.691 4.759 ( -4.993 -0.000 5.030) 7.087 4.857 ( 1.010 0.000 -6.814) 6.888 5.017 ( -10.636 -0.000 -2.071) 10.836 5.331 ( -3.059 -0.000 4.845) 5.730 5.377 ( 11.561 0.000 2.074) 11.745 5.584 ( -0.527 -0.000 -2.067) 2.133 5.621 ( -2.434 -0.000 5.308) 5.839 5.701 ( -1.209 -0.000 -7.044) 7.147 5.742 ( 3.102 0.000 -3.013) 4.325 5.917 ( 8.271 0.000 1.219) 8.360 5.973 ( 15.786 0.000 -1.892) 15.899 7.174 ( 8.749 0.000 13.381) 15.988 7.400 ( 1.454 0.000 -11.132) 11.227 7.629 ( -0.704 -0.000 3.537) 3.606 7.669 ( -1.072 -0.000 11.262) 11.313 7.779 ( 1.601 0.000 -0.422) 1.656 7.815 ( 2.392 0.000 3.665) 4.376 8.181 ( 0.426 0.000 1.546) 1.603 8.336 ( 0.983 0.000 -2.567) 2.749 8.820 ( -1.616 -0.000 1.163) 1.991 8.843 ( -1.934 -0.000 -8.326) 8.548 8.954 ( -5.314 -0.000 1.759) 5.598 9.042 ( -1.008 -0.000 -5.225) 5.321 9.335 ( 2.990 0.000 1.903) 3.544 9.451 ( 9.952 0.000 -2.542) 10.271 9.744 ( 4.759 0.000 -4.225) 6.364 9.783 ( 9.234 0.000 3.857) 10.008 10.240 ( -1.358 -0.000 8.444) 8.552 10.512 ( 0.163 0.000 -7.896) 7.898 10.816 ( -5.791 -0.000 1.399) 5.958 10.823 ( -1.153 -0.000 3.295) 3.491 11.368 ( -10.597 -0.000 -3.141) 11.053 11.538 ( -8.597 -0.000 2.613) 8.985 11.853 ( 6.550 0.000 -1.928) 6.828 11.897 ( 4.933 0.000 1.137) 5.062 12.734 ( 4.027 0.000 -0.173) 4.031 12.889 ( 0.550 0.000 -4.157) 4.194 12.951 ( 2.672 0.000 0.660) 2.752 13.148 ( 7.270 0.000 -1.813) 7.493 13.544 ( 0.303 0.000 -4.719) 4.728 13.768 ( -5.099 -0.000 1.802) 5.408 13.924 ( 2.870 0.000 -5.202) 5.941 13.954 ( -2.694 -0.000 14.503) 14.752 14.793 ( -7.185 -0.000 -5.429) 9.005 14.801 ( 0.850 0.000 -0.101) 0.856 14.986 ( -4.885 -0.000 -2.297) 5.398 14.989 ( -8.995 -0.000 3.971) 9.832 15.741 ( -11.388 -0.000 -1.026) 11.434 15.761 ( -13.790 -0.000 6.758) 15.357 15.850 ( -10.346 -0.000 4.350) 11.223 15.979 ( 7.302 0.000 -4.949) 8.821 16.286 ( 3.970 0.000 -0.370) 3.987 16.531 ( 2.826 0.000 -5.125) 5.853 16.786 ( -0.830 -0.000 3.237) 3.341 16.852 ( -0.384 -0.000 -0.316) 0.497 16.876 ( 4.594 0.000 -2.286) 5.132 17.074 ( 0.922 0.000 1.568) 1.819 17.084 ( 1.819 0.000 0.285) 1.841 17.227 ( 3.136 0.000 -0.175) 3.141 20.022 ( -8.635 -0.000 -3.832) 9.447 20.072 ( -11.220 -0.000 5.666) 12.569 21.221 ( 10.256 0.000 0.596) 10.273 21.377 ( 7.341 0.000 -0.363) 7.350 22.642 ( 3.600 0.000 3.613) 5.100 22.964 ( 6.407 0.000 -6.139) 8.873 27.981 ( 5.714 0.000 11.746) 13.062 27.992 ( 2.026 0.000 -6.503) 6.812 29.615 ( -2.804 -0.000 -5.495) 6.169 29.771 ( 1.553 0.000 0.395) 1.602 29.834 ( -2.233 -0.000 1.105) 2.492 29.923 ( -3.320 -0.000 3.967) 5.173 31.028 ( -2.142 -0.000 -1.775) 2.782 31.080 ( 0.009 0.000 -0.796) 0.796 31.139 ( -4.676 -0.000 3.458) 5.816 31.163 ( 0.319 0.000 -2.335) 2.357 31.740 ( 3.543 0.000 3.040) 4.669 31.872 ( 8.083 0.000 -4.117) 9.071 32.019 ( -2.565 -0.000 2.439) 3.539 32.118 ( -1.064 -0.000 -1.837) 2.122 32.398 ( -6.791 -0.000 -2.040) 7.091 32.549 ( -10.122 -0.000 -0.557) 10.137 32.676 ( -1.195 -0.000 6.090) 6.207 33.211 ( 5.430 0.000 -10.678) 11.980 34.327 ( 1.967 0.000 0.663) 2.075 34.351 ( -0.107 -0.000 -4.587) 4.589 34.696 ( 0.552 0.000 16.579) 16.588 35.188 ( 8.210 0.000 -5.800) 10.053 36.089 ( -9.923 -0.000 0.119) 9.923 36.445 ( -15.008 -0.000 7.301) 16.690 36.698 ( 7.929 0.000 -4.694) 9.214 37.364 ( 10.085 0.000 -3.739) 10.755 ======================= Grid point 144 (66/95) ======================= q-point: (-0.22 -0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.212 ( -13.145 -14.640 9.671) 21.924 1.601 ( -20.198 -5.099 32.821) 38.874 1.948 ( -1.854 -2.869 -4.791) 5.884 2.073 ( -11.473 -8.038 -4.985) 14.869 2.266 ( -22.122 1.669 -3.236) 22.420 2.756 ( -0.998 7.862 -0.746) 7.960 3.026 ( 3.472 -2.968 3.114) 5.528 3.059 ( -3.686 3.536 5.195) 7.285 3.169 ( -3.139 -3.116 7.398) 8.619 3.213 ( -7.179 6.272 -5.679) 11.096 3.331 ( -3.567 1.731 -3.259) 5.132 3.379 ( 0.408 2.608 1.828) 3.211 3.551 ( 5.627 -0.748 -11.158) 12.519 3.727 ( 2.553 -2.806 1.822) 4.208 3.853 ( 2.918 -5.686 3.863) 7.468 3.936 ( -9.094 -5.274 -13.969) 17.483 4.112 ( -1.588 -3.309 0.198) 3.676 4.127 ( -0.997 -3.206 0.361) 3.376 4.203 ( -0.383 -3.324 -2.256) 4.036 4.453 ( -2.649 5.057 1.423) 5.883 4.502 ( -4.326 1.290 4.094) 6.094 4.605 ( -3.555 -1.629 2.119) 4.448 4.706 ( -0.644 0.641 2.642) 2.794 4.729 ( 6.393 -0.708 -7.323) 9.747 4.905 ( -3.971 -1.499 -0.653) 4.294 4.911 ( 3.091 -0.801 -9.434) 9.959 5.214 ( -4.401 7.644 6.773) 11.120 5.459 ( -6.916 2.775 -3.833) 8.380 5.503 ( 11.698 1.323 -0.769) 11.798 5.585 ( -4.054 3.893 -0.296) 5.628 5.718 ( 3.970 1.029 0.294) 4.112 5.867 ( 9.517 -6.388 -2.846) 11.810 6.006 ( 7.663 -4.314 -1.423) 8.908 6.206 ( 14.913 -6.491 -0.575) 16.275 7.295 ( 6.195 -0.385 8.741) 10.720 7.371 ( 0.766 1.648 -7.992) 8.196 7.596 ( 0.095 0.474 5.350) 5.372 7.708 ( 3.274 4.948 -2.871) 6.592 7.765 ( -1.956 -3.462 10.850) 11.556 7.942 ( 1.390 -6.261 9.886) 11.784 8.213 ( 3.705 -1.361 2.322) 4.579 8.301 ( 2.317 4.311 -2.191) 5.363 8.776 ( -2.147 2.799 -6.430) 7.334 8.828 ( -2.741 -3.681 -1.325) 4.777 8.906 ( -3.316 1.638 1.616) 4.036 9.011 ( -1.598 0.790 -4.519) 4.858 9.345 ( 4.725 3.618 2.548) 6.473 9.504 ( 8.808 3.701 -2.871) 9.976 9.774 ( 5.172 0.825 -3.324) 6.203 9.897 ( 9.154 -1.544 3.945) 10.087 10.248 ( -1.907 -0.138 6.067) 6.361 10.472 ( -0.713 1.264 -6.538) 6.698 10.768 ( -3.726 0.131 1.393) 3.980 10.846 ( -1.874 -2.548 2.324) 3.925 11.261 ( -10.231 -0.282 -2.981) 10.660 11.472 ( -8.351 -0.953 2.549) 8.783 11.897 ( 5.079 1.063 -2.138) 5.612 11.942 ( 5.256 0.791 1.005) 5.410 12.756 ( 4.940 2.741 -2.952) 6.375 12.835 ( 0.879 3.787 -1.126) 4.048 13.013 ( 2.804 -2.745 -0.518) 3.959 13.213 ( 6.707 -0.070 -0.959) 6.776 13.535 ( 0.402 -0.270 -3.824) 3.855 13.711 ( -6.958 0.519 3.943) 8.014 13.928 ( 3.219 2.397 2.056) 4.510 13.975 ( -0.931 -0.309 4.608) 4.711 14.671 ( -12.709 1.789 -3.016) 13.184 14.769 ( -6.742 1.033 -0.147) 6.822 14.924 ( -4.540 1.267 4.570) 6.565 14.958 ( 0.315 -0.802 -3.537) 3.640 15.572 ( -14.344 3.781 3.491) 15.239 15.665 ( -12.863 -1.487 0.426) 12.955 15.750 ( -11.212 0.614 4.413) 12.065 15.950 ( 3.499 8.043 -6.076) 10.670 16.350 ( 5.120 -1.357 -0.705) 5.344 16.567 ( 2.663 -2.400 -5.325) 6.419 16.780 ( 0.524 1.299 2.488) 2.855 16.860 ( -1.455 -1.835 1.075) 2.577 16.940 ( 3.415 -3.179 -2.126) 5.128 17.062 ( -0.243 1.418 -0.215) 1.454 17.116 ( 2.081 -1.312 0.035) 2.461 17.245 ( 3.380 2.625 2.374) 4.894 19.871 ( -10.896 5.659 2.110) 12.458 19.977 ( -8.478 0.505 -0.687) 8.521 21.305 ( 9.653 1.837 0.915) 9.869 21.439 ( 6.372 0.495 -0.960) 6.462 22.728 ( 5.914 -3.544 3.716) 7.833 23.041 ( 6.427 -3.524 -6.624) 9.880 27.972 ( 2.900 2.652 -2.638) 4.733 28.062 ( 5.550 2.624 10.033) 11.762 29.511 ( -5.207 5.367 -4.302) 8.627 29.696 ( -2.463 4.321 -0.095) 4.975 29.849 ( -3.435 -0.782 1.942) 4.023 29.936 ( -0.473 -1.906 1.376) 2.398 30.982 ( -3.391 1.421 0.257) 3.685 31.032 ( -1.498 1.543 -2.419) 3.236 31.181 ( 0.959 -2.808 -1.528) 3.337 31.283 ( 2.736 -13.450 2.900) 14.028 31.769 ( 1.780 1.649 2.643) 3.588 31.916 ( 4.488 1.625 -2.473) 5.376 32.003 ( 1.000 -0.851 0.514) 1.410 32.103 ( -0.490 0.280 -1.762) 1.850 32.353 ( -4.953 -1.745 -1.243) 5.397 32.453 ( -9.635 -0.281 -0.453) 9.649 32.664 ( -4.063 0.781 4.908) 6.419 33.200 ( 1.853 0.677 -15.548) 15.673 34.334 ( -0.959 -0.973 -2.305) 2.680 34.404 ( 2.784 -5.320 -0.787) 6.056 34.762 ( 3.745 1.013 19.703) 20.081 35.273 ( 8.852 -2.513 -5.305) 10.622 35.975 ( -9.139 2.911 0.563) 9.608 36.302 ( -14.406 2.445 6.345) 15.930 36.619 ( 3.627 14.046 -4.849) 15.296 37.444 ( 10.636 1.853 -2.259) 11.030 ======================= Grid point 145 (67/95) ======================= q-point: (-0.11 -0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.413 ( -13.439 -18.297 12.986) 26.153 1.689 ( -13.175 -14.538 19.840) 27.903 1.834 ( -26.005 1.462 1.595) 26.095 2.007 ( -3.457 -6.944 -0.373) 7.766 2.308 ( -5.195 -13.363 -4.048) 14.898 2.615 ( -2.497 4.119 -3.338) 5.860 2.912 ( -8.328 10.014 -0.683) 13.043 2.992 ( -4.791 3.730 2.940) 6.746 3.109 ( 1.092 0.447 1.499) 1.908 3.189 ( -1.912 0.226 5.802) 6.113 3.243 ( -2.054 2.925 -5.082) 6.213 3.424 ( 4.542 -3.743 1.910) 6.187 3.628 ( 3.574 -4.433 -5.704) 8.060 3.790 ( -0.434 -0.767 -1.096) 1.407 3.885 ( -3.934 -2.805 -5.723) 7.490 4.002 ( -0.039 -7.720 -0.968) 7.780 4.092 ( -7.891 -2.156 -1.259) 8.277 4.229 ( 1.279 -5.683 2.009) 6.162 4.267 ( -1.166 -5.414 -2.903) 6.253 4.390 ( 1.742 0.520 -2.449) 3.050 4.481 ( -3.159 -0.727 4.679) 5.692 4.615 ( -9.085 0.561 3.572) 9.778 4.655 ( 0.045 -3.991 2.479) 4.699 4.796 ( 6.559 1.664 -7.583) 10.164 4.843 ( 0.581 0.734 -1.840) 2.064 4.980 ( 5.838 1.655 -2.637) 6.617 5.149 ( -3.391 -4.592 1.835) 5.996 5.325 ( -6.032 6.603 -1.738) 9.110 5.474 ( -2.142 3.933 -1.847) 4.844 5.562 ( 11.569 3.071 -2.672) 12.264 5.760 ( 4.302 -0.232 2.089) 4.788 6.001 ( 10.622 0.867 -0.956) 10.700 6.145 ( 6.774 -2.787 -6.887) 10.054 6.415 ( 9.769 -3.771 -0.257) 10.474 7.290 ( 0.277 2.824 -6.093) 6.721 7.373 ( 1.864 0.097 7.066) 7.308 7.600 ( 0.100 0.704 -6.717) 6.754 7.699 ( 4.064 0.145 3.134) 5.134 7.788 ( -2.833 0.802 6.382) 7.029 8.073 ( 2.557 -2.018 11.777) 12.219 8.236 ( 3.457 3.851 5.319) 7.421 8.342 ( 5.295 -5.385 3.136) 8.178 8.680 ( -1.562 4.698 -4.118) 6.439 8.827 ( -6.342 0.692 2.672) 6.917 8.894 ( 1.569 -2.835 -3.675) 4.899 8.949 ( -3.389 2.587 -2.991) 5.208 9.327 ( 4.521 4.866 2.567) 7.121 9.482 ( 7.808 6.820 -2.597) 10.687 9.802 ( 5.449 0.672 -2.030) 5.853 10.014 ( 7.316 -1.441 2.881) 7.994 10.225 ( -1.793 2.614 1.405) 3.467 10.444 ( -0.322 -0.405 -3.230) 3.272 10.754 ( -1.486 -1.363 -0.113) 2.020 10.874 ( -1.850 -1.832 2.736) 3.776 11.174 ( -8.726 -1.304 -2.837) 9.267 11.428 ( -7.844 -2.034 2.188) 8.394 11.903 ( 3.914 2.275 -1.638) 4.814 11.969 ( 4.332 1.941 0.569) 4.781 12.710 ( 3.235 4.529 -3.694) 6.680 12.819 ( 4.424 2.242 0.461) 4.981 13.072 ( 1.817 -1.788 -0.403) 2.581 13.261 ( 5.014 0.875 -1.285) 5.250 13.544 ( -0.084 -1.251 -1.476) 1.936 13.659 ( -5.351 -0.320 4.042) 6.713 13.893 ( -0.062 5.745 7.811) 9.696 13.967 ( -1.481 0.077 -1.726) 2.276 14.503 ( -11.455 2.516 -0.911) 11.763 14.667 ( -8.188 1.249 0.184) 8.285 14.879 ( -1.071 2.647 4.241) 5.113 14.996 ( 1.625 -3.388 -3.890) 5.408 15.412 ( -11.011 0.790 1.423) 11.130 15.569 ( -10.245 -0.512 -1.298) 10.339 15.664 ( -11.147 -1.884 3.058) 11.711 15.767 ( -7.354 8.656 -3.504) 11.886 16.404 ( 3.080 -0.589 0.396) 3.161 16.615 ( 2.030 -2.165 -3.704) 4.746 16.774 ( 1.591 0.996 1.082) 2.166 16.878 ( -2.403 -2.090 0.603) 3.242 17.015 ( 0.452 -3.506 -1.618) 3.888 17.035 ( -0.476 0.628 -1.217) 1.450 17.159 ( 3.356 -0.346 -0.270) 3.384 17.220 ( 0.480 2.825 3.685) 4.668 19.710 ( -7.631 2.539 2.847) 8.531 19.898 ( -5.515 0.215 -3.222) 6.391 21.341 ( 6.657 3.605 1.847) 7.792 21.463 ( 4.277 2.297 -2.210) 5.334 22.870 ( 6.495 -3.911 4.094) 8.617 23.142 ( 5.491 -3.503 -6.455) 9.170 27.941 ( 1.714 3.493 0.866) 3.986 28.035 ( 0.871 6.265 5.370) 8.298 29.385 ( -6.116 0.413 -1.438) 6.296 29.628 ( -1.363 1.257 -1.142) 2.178 29.807 ( -3.955 1.673 2.502) 4.971 29.950 ( -0.796 -0.123 -0.379) 0.890 30.948 ( -3.494 -1.079 2.349) 4.346 30.994 ( -0.536 0.936 -3.241) 3.415 31.258 ( 2.832 -4.610 -1.016) 5.505 31.538 ( 3.136 -7.030 2.806) 8.193 31.755 ( 2.490 -0.977 1.754) 3.199 31.922 ( 3.018 1.229 1.183) 3.466 32.032 ( 0.804 1.033 -5.071) 5.237 32.117 ( 5.395 -1.604 0.446) 5.646 32.345 ( -4.718 -2.950 -1.655) 5.805 32.392 ( -5.480 -1.695 0.157) 5.739 32.599 ( -6.968 1.666 2.102) 7.466 33.144 ( -1.666 0.536 -16.675) 16.767 34.349 ( -1.810 -2.790 0.234) 3.334 34.547 ( 3.804 -7.929 -0.943) 8.844 34.831 ( 4.216 2.087 18.907) 19.483 35.389 ( 6.686 -2.611 -3.001) 7.780 35.823 ( -9.023 5.488 1.951) 10.740 36.137 ( -11.356 4.844 7.250) 14.318 36.372 ( 4.688 13.975 -8.119) 16.828 37.445 ( 5.713 7.652 -1.032) 9.605 ======================= Grid point 153 (68/95) ======================= q-point: (-0.22 -0.22 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.964 ( -17.339 -0.000 14.396) 22.536 1.430 ( -26.306 -0.000 38.628) 46.735 1.831 ( -17.437 -0.000 -8.742) 19.506 1.946 ( -3.003 -0.000 1.471) 3.344 2.008 ( -23.868 -0.000 -2.510) 24.000 2.808 ( -8.177 -0.000 -1.827) 8.379 2.998 ( 0.976 0.000 5.671) 5.754 3.036 ( -9.970 -0.000 -0.008) 9.970 3.154 ( -1.742 -0.000 8.352) 8.531 3.230 ( -0.194 -0.000 -2.280) 2.288 3.285 ( -4.275 -0.000 -1.341) 4.480 3.420 ( -0.032 -0.000 5.486) 5.486 3.577 ( 7.361 0.000 -19.362) 20.714 3.701 ( -0.492 -0.000 -9.448) 9.461 3.768 ( -3.714 -0.000 -6.363) 7.368 3.828 ( 0.235 0.000 4.307) 4.313 4.085 ( 1.062 0.000 -0.993) 1.454 4.114 ( -0.176 -0.000 0.077) 0.192 4.178 ( 2.840 0.000 -0.641) 2.911 4.418 ( -8.104 -0.000 -4.803) 9.420 4.529 ( 0.216 0.000 7.483) 7.487 4.569 ( -5.502 -0.000 10.843) 12.159 4.718 ( -0.399 -0.000 -1.683) 1.729 4.754 ( 4.133 0.000 -10.425) 11.214 4.832 ( -4.302 -0.000 0.772) 4.370 4.920 ( 8.489 0.000 -13.306) 15.783 5.284 ( -3.649 -0.000 3.791) 5.262 5.502 ( -6.377 -0.000 -6.789) 9.315 5.521 ( -3.610 -0.000 -8.720) 9.438 5.592 ( 0.600 0.000 8.681) 8.702 5.733 ( 11.068 0.000 -0.663) 11.088 5.815 ( 7.100 0.000 -2.264) 7.452 6.116 ( 10.015 0.000 3.295) 10.543 6.289 ( 16.610 0.000 -1.952) 16.725 7.348 ( 0.117 0.000 -10.683) 10.683 7.398 ( 6.461 0.000 10.193) 12.069 7.613 ( -3.701 -0.000 3.733) 5.257 7.703 ( -0.357 -0.000 1.924) 1.957 7.888 ( 5.560 0.000 23.896) 24.535 7.892 ( 3.912 0.000 4.517) 5.976 8.249 ( 5.551 0.000 2.930) 6.277 8.358 ( 2.876 0.000 -3.736) 4.715 8.738 ( -6.713 -0.000 -0.685) 6.748 8.765 ( -1.394 -0.000 -5.397) 5.574 8.903 ( -1.385 -0.000 0.559) 1.494 8.994 ( -1.459 -0.000 -2.384) 2.795 9.435 ( 5.517 0.000 2.488) 6.052 9.607 ( 7.830 0.000 -3.319) 8.504 9.833 ( 6.584 0.000 -2.957) 7.217 9.976 ( 8.187 0.000 2.885) 8.681 10.236 ( -3.112 -0.000 5.994) 6.754 10.444 ( -2.599 -0.000 -6.311) 6.825 10.751 ( -1.029 -0.000 0.239) 1.056 10.812 ( -1.815 -0.000 2.221) 2.868 11.152 ( -10.374 -0.000 -2.111) 10.587 11.383 ( -9.511 -0.000 2.169) 9.756 11.956 ( 5.890 0.000 -1.789) 6.155 12.005 ( 6.039 0.000 0.422) 6.053 12.829 ( 6.273 0.000 -2.590) 6.787 12.868 ( 0.315 0.000 -5.007) 5.016 13.014 ( 3.093 0.000 2.719) 4.118 13.268 ( 5.113 0.000 1.483) 5.324 13.527 ( 1.019 0.000 -4.900) 5.005 13.661 ( -6.689 -0.000 3.989) 7.788 13.955 ( 2.787 0.000 -8.403) 8.853 14.020 ( 1.274 0.000 13.583) 13.643 14.560 ( -11.676 -0.000 -2.896) 12.030 14.679 ( -13.070 -0.000 1.768) 13.189 14.930 ( -0.428 -0.000 4.092) 4.115 14.939 ( -0.834 -0.000 -2.278) 2.426 15.461 ( -19.968 -0.000 8.192) 21.583 15.522 ( -9.366 -0.000 -4.322) 10.315 15.656 ( -12.455 -0.000 4.385) 13.205 16.046 ( 3.355 0.000 -15.623) 15.979 16.405 ( 8.067 0.000 -1.985) 8.308 16.558 ( 3.061 0.000 -3.857) 4.924 16.807 ( 0.662 0.000 4.052) 4.106 16.827 ( -2.304 -0.000 -0.358) 2.332 16.929 ( 1.617 0.000 -2.039) 2.603 17.069 ( -2.194 -0.000 -2.356) 3.219 17.112 ( 2.899 0.000 0.391) 2.925 17.350 ( 8.262 0.000 4.945) 9.629 19.847 ( -7.323 -0.000 -3.264) 8.018 19.881 ( -11.642 -0.000 5.343) 12.809 21.416 ( 9.095 0.000 0.486) 9.108 21.493 ( 5.022 0.000 -0.867) 5.096 22.769 ( 7.454 0.000 2.968) 8.024 23.053 ( 6.698 0.000 -6.983) 9.676 28.005 ( 3.545 0.000 -7.336) 8.148 28.233 ( 12.218 0.000 20.844) 24.161 29.504 ( -5.565 -0.000 -8.768) 10.385 29.712 ( -8.607 -0.000 5.056) 9.983 29.803 ( -1.147 -0.000 -0.198) 1.164 29.929 ( 2.295 0.000 -0.022) 2.295 30.991 ( 0.224 0.000 -4.170) 4.176 31.082 ( 0.433 0.000 -0.662) 0.791 31.084 ( -3.320 -0.000 5.578) 6.491 31.157 ( 0.445 0.000 -2.364) 2.406 31.831 ( 3.495 0.000 4.227) 5.485 31.934 ( -2.988 -0.000 -0.525) 3.034 32.013 ( 5.291 0.000 -3.764) 6.494 32.086 ( -1.384 -0.000 -1.855) 2.314 32.299 ( -3.057 -0.000 -0.184) 3.062 32.357 ( -8.752 -0.000 -0.249) 8.755 32.638 ( -6.415 -0.000 5.688) 8.574 33.124 ( -6.023 -0.000 -26.250) 26.932 34.317 ( -0.708 -0.000 -2.842) 2.929 34.379 ( 2.959 0.000 0.134) 2.962 34.907 ( 10.161 0.000 27.071) 28.915 35.305 ( 6.495 0.000 -5.153) 8.291 35.928 ( -6.242 -0.000 0.324) 6.250 36.194 ( -14.349 -0.000 1.946) 14.480 36.796 ( 3.879 0.000 1.745) 4.254 37.543 ( 10.260 0.000 -1.914) 10.437 ======================= Grid point 154 (69/95) ======================= q-point: (-0.11 -0.22 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.997 ( -16.568 -17.286 14.073) 27.773 1.335 ( -31.879 -7.697 18.940) 37.872 1.587 ( -28.764 -5.102 22.751) 37.028 1.890 ( -1.566 -3.070 -5.042) 6.107 2.032 ( -4.663 -10.120 -3.955) 11.824 2.637 ( -11.782 4.899 -3.713) 13.290 2.891 ( -12.292 1.084 0.528) 12.351 3.000 ( -6.389 7.007 -3.078) 9.969 3.137 ( -1.421 -3.849 7.072) 8.176 3.195 ( 1.616 2.461 7.469) 8.028 3.309 ( 3.135 1.005 -1.677) 3.694 3.419 ( 1.280 0.016 4.152) 4.345 3.597 ( 5.686 -1.431 -11.641) 13.034 3.723 ( -3.227 -5.255 -12.866) 14.268 3.765 ( 1.597 -2.033 -0.960) 2.758 3.874 ( -1.972 -5.480 -1.009) 5.911 4.052 ( -3.750 2.508 -1.264) 4.685 4.140 ( -0.735 -3.297 -3.262) 4.696 4.211 ( 3.111 -1.845 -0.125) 3.619 4.386 ( -1.298 -1.448 -2.410) 3.097 4.513 ( 0.906 3.591 0.797) 3.788 4.549 ( -5.055 -0.620 8.109) 9.576 4.645 ( -1.868 2.932 -1.524) 3.796 4.806 ( -2.685 -4.406 -0.094) 5.160 4.836 ( 4.719 -2.314 -6.875) 8.653 4.974 ( 3.248 -2.208 -10.483) 11.194 5.174 ( -2.849 7.836 7.184) 11.006 5.311 ( -5.698 2.328 -1.548) 6.347 5.457 ( -4.379 0.385 -4.190) 6.073 5.765 ( 11.674 1.779 0.114) 11.809 5.857 ( 9.704 1.860 1.469) 9.989 5.944 ( 5.121 -13.759 -11.615) 18.721 6.201 ( 9.523 0.863 2.971) 10.013 6.450 ( 10.511 -2.506 -2.019) 10.992 7.311 ( 0.495 1.344 -7.355) 7.493 7.446 ( 2.330 2.871 7.352) 8.229 7.573 ( -3.420 0.009 -0.756) 3.503 7.706 ( -0.647 -0.053 -1.756) 1.872 7.884 ( 4.974 4.717 12.090) 13.898 8.120 ( 9.473 -3.665 23.881) 25.951 8.336 ( 3.434 0.710 -1.377) 3.767 8.344 ( 5.969 -0.146 4.866) 7.702 8.724 ( -0.060 2.393 -4.167) 4.806 8.730 ( -5.692 -5.155 0.751) 7.716 8.880 ( -0.353 0.998 -0.298) 1.100 8.957 ( -2.433 2.121 -0.835) 3.334 9.457 ( 4.912 4.043 2.184) 6.726 9.633 ( 6.201 3.645 -3.621) 8.053 9.872 ( 6.568 1.470 -1.841) 6.978 10.063 ( 5.902 -1.197 1.455) 6.195 10.231 ( -2.299 -0.436 4.054) 4.681 10.410 ( -1.621 -0.616 -4.655) 4.968 10.746 ( 1.446 0.385 -1.124) 1.871 10.826 ( -1.468 -2.551 2.218) 3.685 11.057 ( -9.925 -0.902 -1.659) 10.103 11.312 ( -10.048 -1.898 1.563) 10.345 11.989 ( 5.984 2.188 -0.861) 6.430 12.051 ( 5.835 1.696 0.073) 6.077 12.807 ( 3.225 4.329 -4.204) 6.842 12.888 ( 4.461 0.591 -1.898) 4.884 13.065 ( 2.289 -1.269 3.157) 4.101 13.311 ( 3.373 0.553 1.502) 3.734 13.530 ( 1.348 -0.378 -3.425) 3.700 13.615 ( -5.142 -0.190 3.488) 6.216 13.946 ( -0.443 -0.176 -6.224) 6.242 14.030 ( 1.909 5.827 11.094) 12.676 14.430 ( -10.775 2.178 -1.259) 11.065 14.577 ( -9.855 -1.782 1.543) 10.133 14.915 ( -0.787 0.858 0.620) 1.319 14.943 ( -3.060 -1.549 2.115) 4.030 15.309 ( -14.017 0.041 4.584) 14.748 15.445 ( -7.616 -1.392 -4.994) 9.213 15.545 ( -12.594 0.218 3.136) 12.980 15.831 ( -13.523 13.627 -16.568) 25.359 16.462 ( 6.579 1.457 -1.272) 6.858 16.600 ( 3.406 -1.683 -2.743) 4.686 16.789 ( -2.316 0.507 0.291) 2.389 16.842 ( 0.635 -1.256 2.361) 2.749 16.953 ( -0.806 -2.703 -2.149) 3.546 17.028 ( -2.234 0.763 -1.840) 2.993 17.166 ( 3.527 -1.883 -0.069) 3.999 17.348 ( 3.186 8.942 6.351) 11.422 19.699 ( -8.141 4.339 2.705) 9.613 19.827 ( -6.099 -1.237 -2.169) 6.590 21.460 ( 5.426 3.055 1.005) 6.307 21.527 ( 3.788 1.207 -1.969) 4.436 22.892 ( 8.868 -3.684 2.802) 10.003 23.123 ( 6.188 -2.942 -6.622) 9.528 28.007 ( 3.990 1.807 -5.945) 7.384 28.272 ( 5.408 16.161 19.831) 26.148 29.336 ( -10.017 3.798 -5.278) 11.942 29.625 ( -5.455 1.149 2.389) 6.065 29.785 ( -2.978 0.436 1.791) 3.503 29.955 ( 1.523 0.310 -1.740) 2.333 30.916 ( -4.636 1.882 3.130) 5.902 31.005 ( 1.120 1.725 -5.366) 5.747 31.199 ( 1.983 -4.568 -2.009) 5.370 31.411 ( 9.527 -18.422 2.574) 20.899 31.791 ( -0.533 3.738 2.145) 4.342 31.954 ( 2.102 -1.587 1.458) 3.010 32.047 ( 0.844 1.060 -4.608) 4.804 32.104 ( 3.644 -4.898 -3.038) 6.819 32.269 ( -3.945 0.039 0.127) 3.947 32.314 ( -3.860 -2.131 0.592) 4.449 32.556 ( -9.722 2.313 2.357) 10.268 32.983 ( -12.732 -5.201 -29.594) 32.634 34.309 ( -0.435 -0.709 -0.220) 0.860 34.458 ( 3.141 -5.805 -1.287) 6.724 35.046 ( 12.101 7.391 26.346) 29.919 35.390 ( 5.598 -3.767 0.335) 6.756 35.838 ( -6.305 4.951 0.542) 8.035 36.064 ( -12.821 0.115 0.951) 12.857 36.677 ( 4.974 15.799 5.610) 17.488 37.609 ( 7.148 4.474 -1.056) 8.499 ======================= Grid point 163 (70/95) ======================= q-point: (-0.11 -0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.705 ( -19.416 -0.000 21.913) 29.277 0.953 ( -41.868 -0.000 8.782) 42.779 1.349 ( -27.157 -0.000 49.797) 56.720 1.819 ( -0.821 -0.000 -15.601) 15.622 1.913 ( -4.431 -0.000 -1.781) 4.776 2.527 ( -13.197 -0.000 -0.916) 13.229 2.788 ( -11.212 -0.000 -4.178) 11.965 3.024 ( -2.139 -0.000 5.026) 5.463 3.103 ( -4.508 -0.000 2.711) 5.260 3.276 ( -0.330 -0.000 6.135) 6.144 3.293 ( 3.593 0.000 3.912) 5.312 3.460 ( -0.227 -0.000 9.651) 9.654 3.600 ( 4.038 0.000 -11.765) 12.439 3.646 ( 6.504 0.000 -21.257) 22.230 3.775 ( -5.708 -0.000 -0.869) 5.773 3.783 ( 4.031 0.000 -2.803) 4.910 4.031 ( -4.630 -0.000 -1.010) 4.739 4.134 ( 4.580 0.000 -2.680) 5.306 4.221 ( -3.353 -0.000 -9.572) 10.142 4.332 ( 1.207 0.000 -2.144) 2.460 4.519 ( -2.348 -0.000 4.597) 5.162 4.610 ( 2.624 0.000 -2.030) 3.318 4.663 ( -5.678 -0.000 -2.977) 6.411 4.688 ( -1.310 -0.000 3.510) 3.747 4.812 ( 3.239 0.000 -9.873) 10.390 4.955 ( -0.875 -0.000 -9.308) 9.349 5.241 ( -6.335 -0.000 5.856) 8.627 5.302 ( -8.000 -0.000 0.688) 8.030 5.419 ( -0.800 -0.000 -3.489) 3.580 5.618 ( 0.986 0.000 -0.844) 1.298 5.964 ( 7.687 0.000 0.861) 7.735 5.984 ( 12.345 0.000 -0.254) 12.347 6.284 ( 4.252 0.000 5.015) 6.575 6.520 ( 8.717 0.000 -3.447) 9.374 7.310 ( 1.873 0.000 -5.851) 6.144 7.513 ( -0.402 -0.000 4.859) 4.875 7.533 ( -3.944 -0.000 1.846) 4.355 7.704 ( 1.280 0.000 -2.486) 2.796 8.016 ( 4.627 0.000 5.751) 7.381 8.337 ( 14.276 0.000 10.838) 17.924 8.401 ( 7.012 0.000 6.242) 9.388 8.405 ( 16.727 0.000 21.269) 27.058 8.597 ( -7.434 -0.000 1.883) 7.668 8.738 ( 0.120 0.000 -1.945) 1.949 8.904 ( 1.597 0.000 2.439) 2.915 8.958 ( -2.241 -0.000 1.971) 2.984 9.543 ( 3.939 0.000 1.808) 4.334 9.695 ( 3.882 0.000 -4.355) 5.834 9.946 ( 6.064 0.000 -1.350) 6.212 10.097 ( 3.607 0.000 -0.445) 3.634 10.210 ( -2.456 -0.000 4.599) 5.214 10.383 ( -0.134 -0.000 -4.332) 4.334 10.771 ( 3.609 0.000 -2.179) 4.216 10.797 ( 0.117 0.000 2.148) 2.152 10.952 ( -10.405 -0.000 -0.941) 10.447 11.199 ( -10.692 -0.000 0.727) 10.717 12.062 ( 5.723 0.000 -0.120) 5.724 12.126 ( 6.191 0.000 0.627) 6.222 12.863 ( 2.152 0.000 -2.364) 3.197 12.924 ( 5.466 0.000 -4.526) 7.097 13.094 ( 2.354 0.000 6.114) 6.552 13.354 ( 3.269 0.000 1.768) 3.716 13.535 ( 2.469 0.000 -2.844) 3.766 13.578 ( -4.208 -0.000 3.470) 5.454 13.916 ( -0.953 -0.000 -6.576) 6.644 14.156 ( 6.057 0.000 9.879) 11.588 14.387 ( -5.497 -0.000 -1.668) 5.745 14.444 ( -11.374 -0.000 2.413) 11.627 14.872 ( -5.887 -0.000 0.005) 5.887 14.903 ( -8.009 -0.000 0.519) 8.026 15.209 ( -7.762 -0.000 3.333) 8.447 15.373 ( -2.123 -0.000 -6.100) 6.459 15.445 ( -11.810 -0.000 3.547) 12.332 15.732 ( -27.499 -0.000 -38.854) 47.601 16.535 ( 6.404 0.000 -2.270) 6.794 16.618 ( 4.279 0.000 -0.171) 4.282 16.759 ( -3.771 -0.000 -1.080) 3.923 16.847 ( -0.275 -0.000 5.556) 5.563 16.916 ( -0.246 -0.000 -3.336) 3.345 17.011 ( -2.014 -0.000 -1.549) 2.540 17.182 ( 3.484 0.000 1.279) 3.711 17.545 ( 8.093 0.000 -3.478) 8.808 19.709 ( -8.711 -0.000 2.629) 9.099 19.723 ( -3.870 -0.000 -2.125) 4.415 21.537 ( 2.775 0.000 -1.194) 3.021 21.558 ( 2.742 0.000 -1.488) 3.120 22.930 ( 6.768 0.000 2.974) 7.392 23.140 ( 6.362 0.000 -4.596) 7.849 28.048 ( 5.472 0.000 -6.083) 8.182 28.709 ( 20.840 0.000 11.988) 24.042 29.247 ( -13.528 -0.000 -9.064) 16.284 29.561 ( -9.852 -0.000 5.768) 11.416 29.798 ( 0.389 0.000 1.665) 1.710 29.968 ( 2.048 0.000 -1.982) 2.850 30.990 ( 1.957 0.000 -3.571) 4.072 31.073 ( -2.593 -0.000 1.623) 3.059 31.087 ( 0.771 0.000 -1.436) 1.630 31.157 ( 1.023 0.000 -1.828) 2.094 31.860 ( -3.619 -0.000 1.008) 3.757 31.898 ( 0.308 0.000 3.775) 3.787 32.040 ( -1.428 -0.000 -1.878) 2.359 32.081 ( 3.969 0.000 -6.609) 7.709 32.257 ( -1.951 -0.000 1.133) 2.256 32.265 ( -1.091 -0.000 0.603) 1.247 32.511 ( -9.249 -0.000 3.342) 9.834 32.587 ( -31.165 -0.000 -29.371) 42.824 34.307 ( 0.613 0.000 0.044) 0.615 34.426 ( 1.890 0.000 -1.146) 2.210 35.362 ( 2.464 0.000 -1.767) 3.033 35.435 ( 26.412 0.000 25.663) 36.826 35.871 ( -0.450 -0.000 -0.199) 0.492 35.919 ( -13.750 -0.000 -6.685) 15.289 36.983 ( 16.280 0.000 27.614) 32.056 37.707 ( 6.940 0.000 -0.341) 6.949 ======================= Grid point 164 (71/95) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 50 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.156 ( -12.390 -0.000 -25.518) 28.367 1.156 ( 12.390 0.000 25.518) 28.367 1.216 ( 3.647 0.000 -27.677) 27.916 1.216 ( -3.647 -0.000 27.677) 27.916 2.290 ( 8.048 0.000 -33.738) 34.685 2.290 ( -8.048 -0.000 33.738) 34.685 2.908 ( -9.707 -0.000 -12.635) 15.933 2.908 ( 9.707 0.000 12.635) 15.933 3.165 ( 5.351 0.000 -13.349) 14.382 3.165 ( -5.351 -0.000 13.349) 14.382 3.415 ( -3.964 -0.000 1.191) 4.139 3.415 ( 3.964 0.000 -1.191) 4.139 3.443 ( 9.068 0.000 -8.996) 12.773 3.443 ( -9.068 -0.000 8.996) 12.773 3.818 ( 3.809 0.000 -3.335) 5.063 3.818 ( -3.809 -0.000 3.335) 5.063 4.001 ( 7.462 0.000 -10.628) 12.986 4.001 ( -7.462 -0.000 10.628) 12.986 4.215 ( -6.051 -0.000 -6.614) 8.964 4.215 ( 6.051 0.000 6.614) 8.964 4.561 ( 1.912 0.000 -1.068) 2.190 4.561 ( -1.912 -0.000 1.068) 2.190 4.639 ( 2.630 0.000 -7.123) 7.593 4.639 ( -2.630 -0.000 7.123) 7.593 4.757 ( -0.169 -0.000 -1.240) 1.252 4.757 ( 0.169 0.000 1.240) 1.252 5.339 ( 10.437 0.000 -10.562) 14.848 5.339 ( -10.437 -0.000 10.562) 14.848 5.490 ( -0.590 -0.000 -7.984) 8.006 5.490 ( 0.590 0.000 7.984) 8.006 6.101 ( 0.288 0.000 -1.668) 1.693 6.101 ( -0.288 -0.000 1.668) 1.693 6.459 ( 2.096 0.000 -7.090) 7.394 6.459 ( -2.096 -0.000 7.090) 7.394 7.379 ( -8.976 -0.000 -0.429) 8.986 7.379 ( 8.976 0.000 0.429) 8.986 7.639 ( 0.511 0.000 -3.710) 3.745 7.639 ( -0.511 -0.000 3.710) 3.745 8.184 ( 1.719 0.000 -7.296) 7.496 8.184 ( -1.719 -0.000 7.296) 7.496 8.651 ( 3.142 0.000 -5.879) 6.666 8.651 ( -3.142 -0.000 5.879) 6.666 8.706 ( -2.220 -0.000 -6.388) 6.763 8.706 ( 2.220 0.000 6.388) 6.763 9.096 ( 0.458 0.000 -8.214) 8.227 9.096 ( -0.458 -0.000 8.214) 8.227 9.632 ( 1.169 0.000 -3.393) 3.589 9.632 ( -1.169 -0.000 3.393) 3.589 10.047 ( -1.807 -0.000 -2.929) 3.442 10.047 ( 1.807 0.000 2.929) 3.442 10.282 ( 2.821 0.000 -5.242) 5.953 10.282 ( -2.821 -0.000 5.242) 5.953 10.792 ( 5.519 0.000 -2.358) 6.002 10.792 ( -5.519 -0.000 2.358) 6.002 10.981 ( -7.065 -0.000 -2.969) 7.664 10.981 ( 7.065 0.000 2.969) 7.664 12.187 ( -1.583 -0.000 -1.618) 2.263 12.187 ( 1.583 0.000 1.618) 2.263 12.918 ( 0.693 0.000 -0.801) 1.059 12.918 ( -0.693 -0.000 0.801) 1.059 13.296 ( 1.068 0.000 -6.754) 6.838 13.296 ( -1.068 -0.000 6.754) 6.838 13.600 ( 4.787 0.000 -2.538) 5.418 13.600 ( -4.787 -0.000 2.538) 5.418 13.909 ( -21.802 -0.000 1.715) 21.869 13.909 ( 21.802 0.000 -1.715) 21.869 14.289 ( -0.941 -0.000 -1.081) 1.433 14.289 ( 0.941 0.000 1.081) 1.433 14.747 ( -4.847 -0.000 -2.139) 5.298 14.747 ( 4.847 0.000 2.139) 5.298 15.180 ( 4.352 0.000 -2.624) 5.082 15.180 ( -4.352 -0.000 2.624) 5.082 15.321 ( 10.465 0.000 -4.110) 11.243 15.321 ( -10.465 -0.000 4.110) 11.243 16.606 ( -3.017 -0.000 -0.884) 3.143 16.606 ( 3.017 0.000 0.884) 3.143 16.795 ( -3.511 -0.000 -2.211) 4.149 16.795 ( 3.511 0.000 2.211) 4.149 16.960 ( -0.736 -0.000 -1.725) 1.875 16.960 ( 0.736 0.000 1.725) 1.875 17.331 ( -4.259 -0.000 -5.131) 6.668 17.331 ( 4.259 0.000 5.131) 6.668 19.654 ( 2.227 0.000 -1.979) 2.979 19.654 ( -2.227 -0.000 1.979) 2.979 21.547 ( 1.218 0.000 -1.794) 2.168 21.547 ( -1.218 -0.000 1.794) 2.168 23.113 ( 0.260 0.000 -5.001) 5.007 23.113 ( -0.260 -0.000 5.001) 5.007 28.146 ( -19.533 -0.000 0.820) 19.550 28.146 ( 19.533 0.000 -0.820) 19.550 29.499 ( 12.441 0.000 -4.305) 13.165 29.499 ( -12.441 -0.000 4.305) 13.165 29.905 ( 0.010 0.000 -3.918) 3.918 29.905 ( -0.010 -0.000 3.918) 3.918 30.948 ( 8.329 0.000 -5.508) 9.986 30.948 ( -8.329 -0.000 5.508) 9.986 31.106 ( 0.615 0.000 -2.275) 2.357 31.106 ( -0.615 -0.000 2.275) 2.357 31.871 ( -0.984 -0.000 -1.553) 1.839 31.871 ( 0.984 0.000 1.553) 1.839 32.107 ( -0.464 -0.000 -3.671) 3.701 32.107 ( 0.464 0.000 3.671) 3.701 32.260 ( -1.425 -0.000 0.119) 1.430 32.260 ( 1.425 0.000 -0.119) 1.430 32.349 ( -9.625 -0.000 -1.240) 9.704 32.349 ( 9.625 0.000 1.240) 9.704 34.370 ( -1.012 -0.000 -2.633) 2.820 34.370 ( 1.012 0.000 2.633) 2.820 35.498 ( -9.863 -0.000 -3.432) 10.443 35.498 ( 9.863 0.000 3.432) 10.443 35.831 ( -2.725 -0.000 -1.394) 3.061 35.831 ( 2.725 0.000 1.394) 3.061 37.745 ( -6.154 -0.000 -1.049) 6.243 37.745 ( 6.154 0.000 1.049) 6.243 ======================= Grid point 166 (72/95) ======================= q-point: ( 0.11 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.125 ( 8.335 -6.959 -20.813) 23.475 1.282 ( 8.879 -10.396 -18.257) 22.809 1.371 ( 2.958 -10.448 19.262) 22.112 1.474 ( 19.120 -7.582 19.862) 28.593 2.330 ( 9.201 -4.787 -22.824) 25.070 2.347 ( -3.041 -2.436 18.367) 18.776 2.824 ( -3.612 -2.979 -9.973) 11.018 2.986 ( 2.300 3.591 4.426) 6.146 3.136 ( -0.472 2.201 1.184) 2.543 3.173 ( 4.788 0.191 2.397) 5.358 3.378 ( -2.243 0.718 2.145) 3.185 3.430 ( -5.529 -2.587 4.266) 7.447 3.460 ( 4.315 -1.798 1.140) 4.812 3.543 ( 8.367 -2.328 -6.951) 11.124 3.834 ( -3.080 -5.033 -1.264) 6.034 3.875 ( 2.490 -4.610 -5.346) 7.485 3.962 ( -5.324 0.433 11.156) 12.369 4.047 ( 6.850 -0.192 -3.799) 7.835 4.171 ( -5.179 -3.723 -5.677) 8.538 4.289 ( 1.777 -2.157 2.789) 3.948 4.508 ( -3.165 2.467 0.809) 4.094 4.542 ( 1.063 1.745 1.477) 2.521 4.630 ( -2.252 -0.492 4.145) 4.743 4.682 ( 3.263 -2.137 -0.870) 3.996 4.797 ( -0.080 -2.241 2.905) 3.669 4.832 ( 5.703 -5.123 -5.349) 9.348 5.255 ( -8.800 1.591 9.882) 13.328 5.347 ( 3.770 3.499 -6.348) 8.170 5.479 ( -0.791 -0.875 -8.658) 8.738 5.605 ( 6.166 -5.987 5.514) 10.211 6.036 ( -7.531 3.178 -0.111) 8.175 6.067 ( -3.564 1.535 -1.778) 4.269 6.407 ( -6.652 2.763 1.962) 7.466 6.472 ( 0.622 -0.974 -0.360) 1.211 7.294 ( -7.625 0.302 0.287) 7.637 7.446 ( 7.937 2.461 0.007) 8.310 7.607 ( -0.327 2.115 -4.239) 4.749 7.622 ( -1.068 1.683 4.380) 4.812 8.128 ( -2.004 4.260 -3.396) 5.805 8.183 ( 0.976 1.371 4.771) 5.059 8.591 ( -9.172 0.812 0.907) 9.252 8.639 ( -6.152 -1.157 3.950) 7.402 8.711 ( 2.918 -1.065 -9.887) 10.364 8.770 ( 3.042 -2.354 2.328) 4.496 8.983 ( -2.394 8.149 -3.164) 9.064 9.003 ( -2.254 8.695 0.946) 9.032 9.566 ( -2.546 5.344 -0.285) 5.927 9.587 ( -1.157 3.859 1.769) 4.400 10.012 ( -5.418 0.153 -2.831) 6.115 10.085 ( 0.961 -1.723 2.040) 2.837 10.262 ( -4.524 0.387 4.474) 6.375 10.315 ( 3.151 -2.116 -2.666) 4.638 10.768 ( -2.789 -0.564 0.694) 2.929 10.868 ( 5.155 -3.194 -1.762) 6.315 10.937 ( -0.791 -0.465 -3.235) 3.363 11.089 ( 9.698 -2.413 2.803) 10.379 12.119 ( -5.129 3.155 -1.346) 6.170 12.153 ( -2.940 3.349 0.560) 4.491 12.839 ( -6.261 4.155 1.102) 7.595 12.907 ( -0.275 0.809 -0.236) 0.887 13.272 ( -1.381 1.235 -4.209) 4.598 13.297 ( -0.929 0.948 2.733) 3.039 13.554 ( -4.108 0.177 1.074) 4.250 13.605 ( 1.362 0.980 -1.402) 2.187 13.824 ( -6.366 -3.135 5.486) 8.970 14.082 ( 14.910 5.587 0.752) 15.940 14.301 ( -1.050 -3.344 -0.684) 3.571 14.425 ( 7.966 -8.375 4.234) 12.310 14.777 ( 9.261 -3.276 -4.027) 10.617 14.847 ( 8.454 -3.222 -0.324) 9.053 15.133 ( 2.997 4.417 -0.148) 5.340 15.212 ( 10.759 2.905 -1.073) 11.196 15.284 ( -5.531 -3.026 3.989) 7.461 15.440 ( 11.114 -2.319 -2.809) 11.696 16.566 ( -4.420 0.055 -0.953) 4.522 16.626 ( 0.973 0.047 0.227) 1.001 16.759 ( -2.475 -0.515 -0.825) 2.660 16.825 ( 2.092 0.278 3.473) 4.064 16.949 ( -0.813 0.006 -2.021) 2.178 16.986 ( 2.072 -1.202 -0.319) 2.416 17.257 ( -5.598 1.286 -0.679) 5.783 17.339 ( 0.875 3.472 4.340) 5.627 19.651 ( 0.628 0.072 0.992) 1.176 19.683 ( 4.769 -0.014 -1.135) 4.903 21.520 ( -1.993 2.113 1.882) 3.460 21.534 ( 0.162 1.789 -1.602) 2.407 23.093 ( -4.015 -1.373 -2.158) 4.760 23.111 ( -4.013 -1.067 2.393) 4.793 27.976 ( -11.551 2.351 5.913) 13.188 28.251 ( 16.490 9.967 1.718) 19.344 29.400 ( -8.331 -1.264 -1.811) 8.619 29.572 ( 8.553 2.227 -2.631) 9.221 29.854 ( -0.127 3.135 -4.905) 5.822 29.881 ( -0.149 2.649 4.451) 5.182 30.886 ( -3.694 0.094 5.236) 6.409 30.945 ( 5.074 2.047 -4.578) 7.134 31.230 ( -4.556 -12.064 -1.747) 13.014 31.346 ( 3.636 -17.436 6.834) 19.077 31.820 ( 0.038 4.397 -3.466) 5.599 31.871 ( 2.542 2.696 5.079) 6.287 32.124 ( -2.293 -4.373 -2.148) 5.384 32.131 ( -7.773 -3.864 -0.614) 8.702 32.239 ( 2.893 -0.149 1.008) 3.067 32.262 ( 0.091 -0.053 -0.081) 0.133 32.356 ( 2.262 -3.803 -2.023) 4.866 32.511 ( 15.195 -4.140 -3.319) 16.095 34.377 ( -1.318 -3.143 -3.645) 4.990 34.411 ( -0.321 -3.403 4.060) 5.307 35.368 ( -9.030 4.488 -0.177) 10.085 35.576 ( 11.156 4.132 3.996) 12.550 35.768 ( -6.700 1.129 -2.421) 7.213 35.873 ( 3.140 -2.174 1.280) 4.028 37.383 ( -18.240 24.858 -8.645) 32.021 37.639 ( 4.326 14.634 1.157) 15.304 ======================= Grid point 167 (73/95) ======================= q-point: ( 0.22 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.370 ( 19.904 -10.213 -11.289) 25.058 1.587 ( 13.299 -16.601 -13.991) 25.460 1.682 ( 5.665 -15.330 12.422) 20.528 1.809 ( 10.624 -8.378 15.554) 20.615 2.353 ( -5.072 1.090 3.237) 6.115 2.480 ( 7.416 -7.541 -8.589) 13.624 2.855 ( -6.092 -0.622 1.263) 6.252 2.939 ( 7.942 -1.300 -6.223) 10.173 3.105 ( -0.785 1.371 -2.077) 2.610 3.213 ( 0.572 -0.177 1.248) 1.384 3.355 ( 2.927 2.124 -4.077) 5.450 3.460 ( -5.399 -4.908 5.571) 9.180 3.539 ( 5.648 -0.435 1.700) 5.914 3.621 ( 7.860 -0.717 -4.576) 9.123 3.889 ( -2.691 -6.249 -0.751) 6.845 3.955 ( 0.932 -2.746 -7.445) 7.990 3.999 ( 1.028 -4.531 9.019) 10.145 4.129 ( 5.016 -4.094 3.496) 7.358 4.201 ( -1.153 -3.811 -1.290) 4.185 4.332 ( -0.571 0.631 2.897) 3.019 4.459 ( -0.398 -0.942 -1.676) 1.963 4.529 ( -2.077 -1.512 2.065) 3.296 4.679 ( 1.831 -3.757 2.817) 5.040 4.750 ( 3.166 -1.426 1.012) 3.617 4.807 ( -3.848 -0.891 2.719) 4.795 4.976 ( 4.279 -7.273 -3.500) 9.136 5.160 ( -3.272 5.987 1.303) 6.946 5.298 ( 2.147 4.226 2.597) 5.405 5.436 ( -2.038 1.152 -10.430) 10.689 5.751 ( 1.594 -1.543 4.893) 5.372 5.895 ( -8.882 1.313 1.707) 9.140 5.984 ( -5.537 2.054 -4.195) 7.244 6.262 ( -10.109 5.391 3.180) 11.890 6.489 ( 0.507 -0.263 -0.370) 0.681 7.235 ( -4.959 -0.235 0.486) 4.988 7.436 ( 2.850 4.150 2.830) 5.776 7.557 ( -0.767 1.276 -5.094) 5.307 7.625 ( 2.151 0.133 3.879) 4.437 8.006 ( -3.432 5.881 -3.563) 7.685 8.182 ( 0.001 1.682 4.532) 4.834 8.475 ( -9.788 1.002 -2.434) 10.136 8.589 ( -7.882 0.122 4.395) 9.025 8.693 ( 0.308 2.762 -8.414) 8.861 8.829 ( 0.794 2.826 2.244) 3.694 8.848 ( 2.922 2.514 0.547) 3.893 8.884 ( 4.756 4.614 -4.545) 8.035 9.434 ( -3.305 6.732 -0.643) 7.527 9.509 ( -2.214 4.494 2.695) 5.689 9.926 ( -7.271 1.432 -2.420) 7.796 10.111 ( 0.359 0.280 0.368) 0.585 10.206 ( -6.468 1.448 4.187) 7.840 10.384 ( 3.623 -2.499 -1.287) 4.585 10.755 ( -1.283 -0.672 -0.557) 1.551 10.925 ( -2.920 -2.842 -0.894) 4.172 10.999 ( 9.919 -1.911 -2.565) 10.422 11.248 ( 10.173 -4.076 2.280) 11.194 12.001 ( -5.405 4.308 -0.945) 6.977 12.049 ( -4.678 4.119 0.577) 6.260 12.716 ( -5.205 4.094 1.650) 6.824 12.889 ( -0.286 1.222 -0.901) 1.545 13.201 ( -2.402 3.026 -5.007) 6.325 13.256 ( -1.429 3.333 3.884) 5.314 13.532 ( -2.033 -1.154 0.476) 2.386 13.631 ( 2.033 -1.899 0.661) 2.860 13.854 ( -1.541 -2.167 3.779) 4.621 14.054 ( 2.686 4.934 -2.738) 6.250 14.369 ( 1.827 -3.706 -0.042) 4.132 14.568 ( 0.643 -3.376 1.781) 3.871 14.881 ( -0.550 -1.626 0.874) 1.927 15.037 ( 6.127 -3.342 -4.468) 8.287 15.144 ( 18.798 0.078 2.834) 19.011 15.315 ( 9.712 -2.054 1.482) 10.037 15.337 ( 9.852 -1.103 1.520) 10.029 15.573 ( 10.286 -2.078 -1.982) 10.679 16.530 ( -3.952 -1.623 -2.743) 5.077 16.622 ( -2.154 -0.350 -0.650) 2.277 16.771 ( 0.180 -1.514 1.331) 2.024 16.855 ( 1.740 -0.580 4.245) 4.624 16.935 ( 0.212 0.221 -3.011) 3.026 17.022 ( 1.859 -0.598 -0.207) 1.964 17.196 ( -4.386 0.468 1.794) 4.762 17.281 ( -1.358 3.501 1.293) 3.971 19.669 ( 2.269 -0.435 -0.038) 2.310 19.736 ( 5.309 -0.698 -0.447) 5.373 21.451 ( -2.952 4.051 2.218) 5.482 21.481 ( -1.481 3.083 -1.996) 3.960 23.077 ( -5.375 -1.867 2.983) 6.425 23.093 ( -3.980 -1.571 -2.266) 4.842 27.891 ( -5.024 0.960 5.833) 7.758 28.158 ( 7.122 12.288 -2.770) 14.470 29.399 ( -0.878 -4.376 -5.081) 6.763 29.582 ( 2.239 1.830 0.961) 3.047 29.791 ( 0.346 3.356 -0.290) 3.387 29.880 ( 3.172 0.341 0.837) 3.298 30.895 ( -1.562 -2.075 3.599) 4.438 30.972 ( 3.882 -0.935 -3.299) 5.180 31.352 ( -5.896 -9.565 -3.645) 11.812 31.607 ( -1.255 -7.879 5.698) 9.804 31.740 ( -0.138 2.882 1.470) 3.238 31.859 ( 2.625 3.615 5.789) 7.313 32.082 ( -8.601 -1.615 -3.383) 9.382 32.188 ( -3.958 -5.442 2.246) 7.094 32.260 ( 1.581 -0.440 -1.093) 1.971 32.323 ( 4.144 -2.827 1.004) 5.116 32.465 ( 7.831 -3.181 -1.872) 8.657 32.720 ( 12.945 -5.077 -2.081) 14.060 34.424 ( -0.795 -5.133 -5.542) 7.595 34.500 ( -1.837 -6.731 6.555) 9.573 35.181 ( -8.360 7.593 1.096) 11.346 35.579 ( 6.134 5.751 -1.950) 8.632 35.699 ( -0.065 1.969 -1.137) 2.275 35.969 ( 6.192 -3.044 1.693) 7.104 36.721 ( -20.586 25.548 -8.861) 33.985 37.438 ( 5.807 14.408 0.677) 15.549 ======================= Grid point 168 (74/95) ======================= q-point: ( 0.33 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.716 ( 20.309 -9.792 -5.371) 23.177 1.925 ( 12.597 -11.208 -6.152) 17.949 2.000 ( 8.533 -9.970 4.883) 14.002 2.038 ( -3.028 -11.309 10.598) 15.792 2.264 ( -6.557 0.976 -6.308) 9.151 2.538 ( -2.647 6.247 9.295) 11.508 2.872 ( -2.050 -9.922 -1.129) 10.194 3.033 ( -1.328 -1.231 -0.128) 1.816 3.114 ( 9.827 -3.593 -11.144) 15.286 3.201 ( -1.546 1.998 0.225) 2.537 3.317 ( -0.253 0.455 -10.003) 10.017 3.480 ( -3.136 -0.713 3.855) 5.020 3.591 ( 3.985 -0.425 0.689) 4.066 3.728 ( 7.898 -2.968 -0.232) 8.440 3.911 ( -2.757 0.998 -6.657) 7.274 4.028 ( 4.541 -3.223 8.151) 9.872 4.121 ( 2.863 -0.231 3.632) 4.631 4.222 ( -1.960 -1.125 3.352) 4.043 4.278 ( 5.036 -5.992 3.457) 8.557 4.321 ( 2.392 -5.940 0.554) 6.428 4.554 ( 3.803 -6.341 -1.607) 7.566 4.595 ( 0.923 -5.086 1.427) 5.362 4.714 ( -0.846 5.026 -0.115) 5.098 4.754 ( 2.518 -0.553 -1.471) 2.968 4.851 ( -4.052 -6.672 3.031) 8.374 5.009 ( -2.999 4.392 -4.357) 6.876 5.078 ( -0.182 2.862 4.058) 4.969 5.261 ( 1.949 2.563 2.388) 4.009 5.386 ( -0.936 -1.340 -5.278) 5.525 5.638 ( -13.587 3.452 -3.133) 14.364 5.878 ( -3.851 2.771 -4.733) 6.701 5.901 ( 1.686 0.757 6.656) 6.908 6.102 ( -6.922 3.750 2.047) 8.134 6.486 ( -0.016 0.788 -0.221) 0.819 7.209 ( -2.399 -0.717 -0.386) 2.534 7.419 ( 0.851 1.059 4.715) 4.907 7.534 ( -1.249 -1.409 -3.922) 4.351 7.656 ( 2.091 0.200 3.066) 3.716 7.855 ( -3.382 6.868 -2.627) 8.093 8.116 ( -3.675 5.027 0.651) 6.262 8.419 ( -3.100 -3.026 -3.059) 5.304 8.532 ( -5.039 0.359 2.561) 5.664 8.612 ( -0.079 3.635 -4.082) 5.466 8.752 ( 1.743 5.581 2.517) 6.366 8.881 ( 4.554 0.568 -0.655) 4.636 8.913 ( 4.962 -1.712 -2.171) 5.680 9.287 ( -3.680 6.557 0.214) 7.522 9.410 ( -3.724 4.434 0.422) 5.806 9.833 ( -6.218 1.116 -0.823) 6.371 10.078 ( -0.550 3.203 -0.053) 3.250 10.133 ( -5.814 0.937 2.120) 6.259 10.438 ( 2.169 -0.674 -0.485) 2.323 10.780 ( 0.981 -2.753 -0.356) 2.944 10.932 ( -0.869 -0.372 -0.569) 1.104 11.115 ( 6.774 -2.610 -1.296) 7.374 11.406 ( 7.878 -3.350 1.102) 8.632 11.889 ( -3.767 3.093 -0.794) 4.938 11.958 ( -2.911 2.361 0.967) 3.871 12.621 ( -3.463 2.853 1.446) 4.714 12.845 ( -2.280 2.054 -1.417) 3.380 13.130 ( -0.920 1.798 -2.792) 3.445 13.196 ( -0.883 3.374 2.922) 4.549 13.556 ( 0.601 -1.991 0.444) 2.126 13.686 ( 1.479 -1.864 1.378) 2.750 13.865 ( -0.259 0.727 0.106) 0.779 14.002 ( -0.542 1.011 -1.809) 2.142 14.441 ( 1.555 -2.852 -0.252) 3.258 14.603 ( -0.582 -0.601 1.511) 1.727 14.883 ( -2.468 -0.700 2.858) 3.841 15.020 ( 0.507 1.980 -4.979) 5.382 15.366 ( 8.656 -3.893 -1.097) 9.554 15.455 ( 10.870 -3.131 4.504) 12.175 15.489 ( 13.868 -0.361 0.105) 13.873 15.690 ( 7.782 -2.565 -1.461) 8.323 16.537 ( -0.990 -3.259 -5.847) 6.767 16.601 ( -3.796 -0.713 2.005) 4.352 16.788 ( -0.410 0.554 1.704) 1.838 16.903 ( 2.134 -1.875 0.543) 2.892 16.942 ( 2.003 -0.509 0.255) 2.083 17.035 ( 0.977 0.700 0.736) 1.409 17.168 ( -1.971 -0.064 1.253) 2.336 17.220 ( -2.615 1.756 0.331) 3.168 19.705 ( 2.602 -0.979 -0.267) 2.793 19.797 ( 4.154 -1.132 -0.074) 4.306 21.352 ( -3.312 4.503 1.864) 5.893 21.405 ( -2.079 2.995 -1.790) 4.061 23.070 ( -4.746 -1.403 6.747) 8.367 23.080 ( -1.656 -1.456 -6.066) 6.454 27.868 ( -2.044 -0.205 3.947) 4.449 28.020 ( 2.384 7.953 -3.721) 9.098 29.458 ( 1.100 -2.966 -5.491) 6.337 29.578 ( -0.531 -0.567 2.046) 2.189 29.758 ( 1.159 1.859 2.360) 3.220 29.913 ( 3.822 0.334 -0.065) 3.837 30.931 ( -0.643 -2.262 2.122) 3.168 31.013 ( 2.571 -0.952 -2.327) 3.597 31.424 ( -5.409 -7.178 -3.636) 9.695 31.602 ( 0.386 3.967 -2.375) 4.640 31.777 ( -3.037 -4.057 7.907) 9.391 31.840 ( 3.214 3.348 4.036) 6.151 32.018 ( -6.583 -0.560 -2.964) 7.241 32.192 ( -4.868 -0.676 1.849) 5.251 32.328 ( 2.912 -3.591 0.401) 4.641 32.397 ( 2.425 -2.148 -0.252) 3.249 32.565 ( 6.617 -0.904 -2.309) 7.067 32.887 ( 7.781 -3.010 1.314) 8.446 34.497 ( 0.244 -5.876 -5.542) 8.080 34.629 ( -3.132 -8.486 6.700) 11.257 35.002 ( -4.287 6.050 1.752) 7.619 35.502 ( 2.649 7.089 -7.344) 10.545 35.676 ( 5.380 4.481 0.328) 7.010 36.075 ( 9.103 0.820 -1.350) 9.239 36.182 ( -20.417 11.771 0.053) 23.567 37.290 ( 4.498 9.434 0.153) 10.453 ======================= Grid point 169 (75/95) ======================= q-point: ( 0.44 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.995 ( 11.673 -5.873 -4.793) 13.919 2.079 ( 5.078 3.399 7.328) 9.542 2.170 ( -3.536 -6.289 5.042) 8.802 2.205 ( -0.115 -4.422 -0.679) 4.476 2.232 ( 0.411 -6.917 -10.823) 12.851 2.392 ( -3.836 6.680 5.849) 9.672 2.879 ( -4.208 3.425 1.571) 5.648 3.130 ( 4.767 -1.425 5.293) 7.264 3.188 ( -2.319 -4.536 -1.791) 5.400 3.249 ( 4.394 -8.678 -12.968) 16.210 3.278 ( -1.028 0.940 -3.826) 4.072 3.467 ( -0.772 2.577 5.766) 6.363 3.618 ( 1.262 0.416 -0.064) 1.330 3.817 ( 2.564 -0.660 1.224) 2.916 3.850 ( 0.209 -1.334 -11.071) 11.153 3.952 ( -5.931 7.919 13.209) 16.504 4.224 ( 2.463 -1.344 0.949) 2.962 4.273 ( 6.269 -3.801 -1.907) 7.575 4.454 ( 3.488 -4.102 1.770) 5.668 4.487 ( 5.202 -6.216 -0.399) 8.115 4.601 ( 1.290 1.792 -2.831) 3.590 4.676 ( -2.237 3.095 1.567) 4.128 4.684 ( 1.011 -1.928 4.089) 4.632 4.732 ( -0.646 -5.906 -0.622) 5.973 4.894 ( -5.437 5.038 0.787) 7.454 4.945 ( 0.930 0.811 -2.023) 2.370 5.016 ( 4.658 -3.342 -0.276) 5.740 5.199 ( -9.274 5.320 1.526) 10.800 5.414 ( 3.010 -0.232 0.146) 3.022 5.480 ( -7.207 -0.300 -2.500) 7.634 5.832 ( 1.103 -0.197 -2.223) 2.489 5.893 ( -0.301 2.340 3.134) 3.923 6.027 ( -2.123 0.820 -0.030) 2.276 6.467 ( -0.387 0.749 -0.074) 0.846 7.207 ( -0.542 -0.549 -0.335) 0.841 7.439 ( 0.971 -0.727 1.990) 2.331 7.548 ( -1.518 -1.945 -1.556) 2.917 7.663 ( -0.431 0.745 1.907) 2.092 7.734 ( -0.324 3.766 -0.999) 3.910 8.007 ( -2.022 3.091 -0.658) 3.752 8.457 ( -0.278 -3.014 -2.826) 4.140 8.499 ( -1.568 0.380 0.999) 1.898 8.559 ( 0.067 2.050 0.029) 2.051 8.702 ( 0.557 2.195 1.480) 2.705 8.923 ( 4.002 -0.774 -0.709) 4.137 8.967 ( 0.751 -0.665 -0.189) 1.020 9.178 ( -0.490 2.973 0.251) 3.024 9.309 ( -3.537 2.583 -0.482) 4.406 9.776 ( -2.556 0.375 -0.012) 2.583 10.027 ( -0.399 1.671 -0.044) 1.719 10.083 ( -2.392 0.557 0.495) 2.505 10.451 ( 0.575 0.207 -0.158) 0.631 10.849 ( 1.655 -3.416 0.186) 3.801 10.911 ( -0.909 1.828 -0.408) 2.082 11.190 ( 2.492 -1.093 -0.333) 2.742 11.496 ( 2.831 -1.037 0.165) 3.020 11.832 ( -1.178 0.869 -0.268) 1.488 11.922 ( -0.669 0.460 0.476) 0.941 12.569 ( -1.234 1.034 0.579) 1.711 12.791 ( -1.590 1.109 -0.685) 2.056 13.104 ( -0.074 0.445 -0.776) 0.897 13.155 ( -0.294 1.393 1.085) 1.790 13.593 ( 0.669 -1.071 0.244) 1.286 13.718 ( 0.459 -0.392 0.928) 1.107 13.844 ( 0.015 0.715 -1.224) 1.417 13.994 ( -0.370 -0.294 -0.185) 0.507 14.487 ( 0.750 -1.334 -0.388) 1.579 14.597 ( -0.747 0.446 1.037) 1.354 14.883 ( -0.827 -0.358 1.231) 1.526 14.988 ( 0.228 0.888 -1.834) 2.050 15.463 ( 2.034 -2.318 -0.521) 3.128 15.563 ( 4.113 -0.141 0.927) 4.219 15.580 ( 4.785 0.155 0.326) 4.798 15.784 ( 3.581 -1.574 -0.519) 3.946 16.553 ( -0.013 -0.618 -4.229) 4.274 16.611 ( -1.394 -2.404 2.804) 3.948 16.761 ( -0.541 1.618 0.342) 1.740 16.939 ( 0.722 -0.738 -1.071) 1.487 16.987 ( 1.891 -1.372 2.239) 3.236 17.028 ( 0.309 0.891 -0.352) 1.007 17.156 ( -0.444 0.746 1.247) 1.520 17.182 ( -1.787 -0.082 -0.603) 1.888 19.739 ( 1.239 -0.580 -0.133) 1.374 19.841 ( 1.590 -0.563 0.040) 1.687 21.272 ( -1.591 2.066 0.662) 2.690 21.348 ( -0.965 1.274 -0.661) 1.729 23.070 ( -2.368 -0.489 5.159) 5.697 23.075 ( 0.177 -0.624 -4.897) 4.939 27.877 ( -0.781 -1.250 2.209) 2.655 27.929 ( 0.764 3.677 -2.320) 4.415 29.471 ( -0.080 -0.157 -2.042) 2.050 29.605 ( 0.082 -1.464 0.593) 1.582 29.756 ( 0.683 0.394 1.255) 1.482 29.933 ( 1.659 0.418 0.023) 1.711 30.960 ( -0.198 -0.982 0.663) 1.201 31.034 ( 0.901 -0.242 -0.899) 1.295 31.477 ( -3.626 -5.798 -3.444) 7.657 31.534 ( 1.581 4.918 1.508) 5.381 31.819 ( -2.421 -2.255 2.899) 4.399 31.836 ( 3.278 1.975 1.374) 4.066 31.967 ( -3.139 -0.034 -1.367) 3.424 32.164 ( -1.969 0.120 0.546) 2.046 32.396 ( 1.096 -1.692 0.542) 2.087 32.436 ( 0.897 -0.703 -0.341) 1.189 32.608 ( 2.394 -0.007 -1.194) 2.676 32.970 ( 2.469 -0.823 1.009) 2.792 34.588 ( 1.863 -5.144 -3.646) 6.575 34.686 ( -4.267 0.482 2.867) 5.163 34.974 ( 0.351 -3.722 4.548) 5.888 35.347 ( 1.009 9.242 -6.728) 11.476 35.651 ( 2.434 2.566 0.174) 3.541 35.917 ( -5.739 3.002 -0.104) 6.477 36.154 ( 1.298 -1.270 1.108) 2.127 37.213 ( 1.598 3.300 0.016) 3.667 ======================= Grid point 175 (76/95) ======================= q-point: ( 0.11 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 95 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.172 ( 22.879 0.000 -9.099) 24.622 1.210 ( 12.628 0.000 -25.571) 28.519 1.392 ( 7.246 0.000 18.658) 20.015 1.701 ( 21.042 0.000 17.309) 27.246 2.326 ( 16.797 0.000 -36.445) 40.130 2.397 ( 2.840 0.000 25.305) 25.464 2.771 ( 4.338 0.000 -5.958) 7.370 3.048 ( -0.087 -0.000 -0.694) 0.699 3.127 ( -6.955 -0.000 11.073) 13.077 3.228 ( 4.512 0.000 -4.197) 6.162 3.347 ( -6.981 -0.000 11.171) 13.173 3.384 ( 1.317 0.000 -3.497) 3.736 3.503 ( 6.446 0.000 -5.026) 8.174 3.598 ( 8.760 0.000 -3.891) 9.585 3.753 ( -3.726 -0.000 0.781) 3.807 3.834 ( 1.801 0.000 -6.929) 7.159 3.950 ( -5.403 -0.000 14.151) 15.147 4.061 ( 1.584 0.000 -4.533) 4.802 4.143 ( 7.483 0.000 -4.639) 8.804 4.281 ( -1.202 -0.000 2.824) 3.070 4.495 ( -3.621 -0.000 0.462) 3.650 4.554 ( -1.182 -0.000 3.849) 4.026 4.646 ( -3.310 -0.000 9.678) 10.228 4.672 ( 4.041 0.000 -5.670) 6.963 4.806 ( 5.203 0.000 -3.952) 6.534 4.835 ( 4.758 0.000 -1.937) 5.138 5.217 ( -6.315 -0.000 14.023) 15.379 5.351 ( -1.876 -0.000 -5.177) 5.506 5.529 ( 8.126 0.000 -13.271) 15.561 5.570 ( 2.881 0.000 4.775) 5.577 5.994 ( -9.308 -0.000 -1.811) 9.483 6.001 ( -9.451 -0.000 -0.726) 9.479 6.396 ( -5.327 -0.000 -5.579) 7.714 6.403 ( -8.746 -0.000 7.787) 11.710 7.226 ( -7.078 -0.000 1.862) 7.319 7.548 ( 7.125 0.000 0.494) 7.142 7.615 ( 0.879 0.000 -4.648) 4.731 7.636 ( -1.306 -0.000 3.601) 3.830 8.148 ( -2.370 -0.000 -6.958) 7.350 8.196 ( -2.292 -0.000 8.995) 9.282 8.518 ( -10.332 -0.000 -2.405) 10.608 8.543 ( -10.613 -0.000 6.248) 12.315 8.708 ( 3.792 0.000 -8.389) 9.206 8.761 ( -0.375 -0.000 -0.651) 0.751 9.005 ( -3.998 -0.000 -1.924) 4.437 9.030 ( -5.288 -0.000 -3.163) 6.161 9.588 ( -3.427 -0.000 -2.658) 4.337 9.590 ( -4.979 -0.000 4.797) 6.913 9.952 ( -6.492 -0.000 -2.026) 6.801 10.073 ( -0.137 -0.000 1.397) 1.404 10.256 ( -3.266 -0.000 7.397) 8.086 10.306 ( 3.215 0.000 -4.622) 5.630 10.759 ( 0.692 0.000 -0.910) 1.143 10.834 ( -1.003 -0.000 -1.180) 1.549 10.988 ( 9.538 0.000 -3.501) 10.160 11.171 ( 10.406 0.000 3.091) 10.855 12.081 ( -7.146 -0.000 -1.619) 7.327 12.135 ( -6.378 -0.000 -0.043) 6.378 12.846 ( -5.264 -0.000 2.560) 5.853 12.856 ( -3.850 -0.000 -1.078) 3.998 13.237 ( -3.730 -0.000 -7.374) 8.263 13.288 ( -3.887 -0.000 5.759) 6.948 13.526 ( -2.691 -0.000 -0.227) 2.700 13.621 ( 1.116 0.000 1.050) 1.532 13.807 ( 2.422 0.000 3.137) 3.963 14.287 ( 1.105 0.000 -4.236) 4.378 14.350 ( 5.181 0.000 1.554) 5.409 14.396 ( 16.927 0.000 7.316) 18.440 14.863 ( 1.372 0.000 1.183) 1.812 14.889 ( 17.968 0.000 -0.435) 17.973 15.212 ( -1.189 -0.000 9.038) 9.116 15.309 ( 20.309 0.000 -8.091) 21.861 15.354 ( 13.662 0.000 2.704) 13.927 15.518 ( 12.030 0.000 -2.870) 12.368 16.518 ( -5.824 -0.000 -0.488) 5.844 16.616 ( -3.631 -0.000 -0.083) 3.632 16.742 ( 0.539 0.000 1.112) 1.235 16.848 ( 0.332 0.000 2.931) 2.949 16.948 ( 1.154 0.000 -3.919) 4.086 16.986 ( 1.148 0.000 0.635) 1.312 17.202 ( -6.834 -0.000 -0.085) 6.835 17.383 ( -3.533 -0.000 8.515) 9.219 19.676 ( 2.941 0.000 2.259) 3.708 19.749 ( 8.841 0.000 -1.491) 8.965 21.524 ( -2.406 -0.000 1.649) 2.917 21.537 ( -2.105 -0.000 -1.028) 2.342 23.016 ( -6.207 -0.000 -5.058) 8.007 23.046 ( -8.634 -0.000 4.727) 9.844 27.916 ( -8.091 -0.000 7.083) 10.753 28.524 ( 8.590 0.000 12.547) 15.206 29.314 ( -2.708 -0.000 -4.319) 5.098 29.680 ( 9.586 0.000 -5.498) 11.051 29.855 ( -2.614 -0.000 -3.644) 4.485 29.908 ( -1.437 -0.000 3.561) 3.840 30.873 ( -3.137 -0.000 6.178) 6.929 31.075 ( 3.575 0.000 0.794) 3.662 31.108 ( 0.905 0.000 -2.386) 2.552 31.122 ( 2.392 0.000 -0.016) 2.392 31.870 ( 0.458 0.000 0.351) 0.577 31.929 ( 3.431 0.000 1.647) 3.806 32.032 ( -5.222 -0.000 -0.578) 5.254 32.049 ( -2.683 -0.000 -3.476) 4.391 32.270 ( 1.553 0.000 -0.105) 1.556 32.274 ( 2.997 0.000 0.380) 3.021 32.384 ( 12.048 0.000 1.168) 12.105 32.607 ( 15.048 0.000 -6.656) 16.454 34.328 ( -1.728 -0.000 -1.838) 2.522 34.385 ( -1.078 -0.000 2.488) 2.712 35.333 ( -7.884 -0.000 1.947) 8.121 35.659 ( -12.027 -0.000 -1.313) 12.099 35.766 ( 12.455 0.000 3.708) 12.995 35.857 ( 1.095 0.000 1.047) 1.514 37.451 ( -16.350 -0.000 -14.794) 22.049 37.696 ( -9.412 -0.000 0.885) 9.453 ======================= Grid point 176 (77/95) ======================= q-point: ( 0.22 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.362 ( 14.379 -10.642 -19.600) 26.536 1.470 ( 19.111 -10.084 3.894) 21.956 1.584 ( 14.915 -4.897 7.644) 17.460 1.899 ( 8.166 -2.487 9.382) 12.685 2.393 ( 13.669 0.975 -25.070) 28.571 2.516 ( 14.118 1.714 9.319) 17.003 2.837 ( 0.794 0.894 8.939) 9.018 3.006 ( 4.896 0.871 -3.707) 6.202 3.098 ( -4.785 0.359 2.322) 5.331 3.229 ( 1.665 1.247 -1.156) 2.380 3.350 ( -5.098 -3.228 8.086) 10.089 3.391 ( 2.152 0.313 -8.161) 8.445 3.575 ( 5.978 -2.586 -3.208) 7.260 3.640 ( 2.553 -2.870 -5.270) 6.521 3.750 ( -4.160 -3.280 0.677) 5.341 3.895 ( 4.699 -3.858 -2.984) 6.773 3.980 ( -0.609 -3.710 13.248) 13.771 4.071 ( 2.129 -0.342 -3.086) 3.765 4.211 ( 5.769 -1.075 -3.140) 6.656 4.319 ( 1.728 -2.847 3.360) 4.731 4.462 ( 0.097 0.957 0.085) 0.966 4.531 ( -6.419 2.964 7.398) 10.233 4.631 ( -0.394 -1.900 5.171) 5.523 4.727 ( 2.685 -2.868 -0.707) 3.992 4.827 ( 1.833 1.481 -2.382) 3.351 4.904 ( 3.574 -4.253 -4.334) 7.046 5.212 ( -1.220 1.830 10.401) 10.631 5.326 ( 0.187 0.263 -4.132) 4.145 5.487 ( 4.678 4.550 -8.734) 10.903 5.716 ( 1.638 -6.244 3.516) 7.351 5.831 ( -11.398 3.076 0.098) 11.806 5.927 ( -8.025 -0.375 -3.422) 8.732 6.235 ( -12.719 4.396 1.745) 13.570 6.408 ( -7.511 -4.995 0.459) 9.032 7.183 ( -5.180 -0.774 4.294) 6.773 7.542 ( -0.353 3.741 1.531) 4.058 7.578 ( 1.075 4.082 -3.867) 5.724 7.664 ( 4.418 -0.151 1.330) 4.616 8.055 ( -3.354 4.038 -6.034) 7.998 8.195 ( -3.664 0.150 6.396) 7.372 8.389 ( -10.215 0.970 -1.588) 10.383 8.488 ( -11.092 -2.993 2.836) 11.834 8.711 ( 0.978 1.509 -6.706) 6.943 8.776 ( -0.481 -3.634 -1.804) 4.086 8.938 ( -0.509 3.546 0.294) 3.595 8.966 ( 1.550 2.653 -6.308) 7.016 9.495 ( -4.897 4.753 0.361) 6.834 9.541 ( -4.898 2.233 2.538) 5.951 9.868 ( -7.790 1.165 -1.558) 8.030 10.081 ( -2.644 -1.651 -0.486) 3.155 10.224 ( -1.967 2.932 6.740) 7.609 10.362 ( 3.537 -3.138 -2.600) 5.396 10.757 ( 1.572 0.737 -1.758) 2.471 10.858 ( 0.417 -2.788 -0.485) 2.860 11.073 ( 9.833 -0.328 -2.914) 10.261 11.299 ( 10.315 -2.238 2.641) 10.880 11.991 ( -7.034 2.026 -0.988) 7.387 12.051 ( -6.033 2.207 0.024) 6.424 12.748 ( -3.643 4.447 1.438) 5.926 12.864 ( -2.370 -1.530 -0.286) 2.835 13.166 ( -5.938 0.532 -5.384) 8.033 13.261 ( -5.336 0.069 4.579) 7.032 13.509 ( -0.767 -0.542 -0.154) 0.951 13.644 ( 3.088 -0.023 1.780) 3.565 13.850 ( 2.397 -1.152 2.105) 3.391 14.195 ( 1.588 7.942 -4.387) 9.211 14.420 ( 10.915 0.573 -0.556) 10.944 14.567 ( 8.065 -1.780 2.710) 8.693 14.863 ( -1.871 -0.176 3.288) 3.787 15.009 ( 0.793 -2.078 -2.649) 3.459 15.329 ( 13.948 -3.019 9.400) 17.088 15.410 ( 18.914 6.177 -2.138) 20.012 15.524 ( 18.850 1.143 -1.519) 18.946 15.646 ( 11.582 -1.520 -0.929) 11.718 16.460 ( -5.624 -0.710 -1.128) 5.779 16.577 ( -4.998 -0.831 -0.414) 5.083 16.770 ( 2.452 -0.592 2.157) 3.318 16.861 ( 0.008 -0.810 1.771) 1.948 16.945 ( 1.283 0.319 -1.932) 2.341 17.009 ( 0.492 -1.334 -0.393) 1.476 17.150 ( -5.206 -0.709 1.713) 5.526 17.322 ( -5.642 3.545 5.362) 8.553 19.713 ( 4.933 0.769 1.812) 5.312 19.816 ( 9.757 2.226 -1.545) 10.126 21.481 ( -3.984 2.381 1.752) 4.961 21.487 ( -4.296 1.564 -1.210) 4.729 22.972 ( -6.256 -3.454 -3.754) 8.072 22.996 ( -8.539 -2.412 4.129) 9.787 27.875 ( -4.208 0.317 6.621) 7.851 28.427 ( -2.971 13.352 2.839) 13.971 29.346 ( 6.149 -1.829 -4.366) 7.760 29.666 ( 2.565 5.646 -1.805) 6.459 29.841 ( 1.320 0.554 -2.059) 2.508 29.906 ( 1.184 -0.156 1.920) 2.261 30.875 ( -0.240 -0.585 4.374) 4.420 31.011 ( 4.286 2.658 -3.562) 6.174 31.165 ( -2.322 -6.812 0.855) 7.248 31.376 ( -3.604 -16.230 4.162) 17.139 31.828 ( 1.777 5.200 -1.746) 5.766 31.913 ( -3.376 1.010 4.501) 5.717 32.008 ( -1.652 1.149 -0.852) 2.185 32.080 ( -0.589 -5.367 -1.397) 5.577 32.280 ( 3.173 0.463 -0.762) 3.296 32.323 ( 3.609 -1.936 -0.141) 4.097 32.542 ( 14.472 -0.406 3.900) 14.993 32.754 ( 12.119 -4.008 -4.714) 13.607 34.335 ( -1.010 -3.042 -2.304) 3.947 34.408 ( -2.158 -3.618 3.284) 5.341 35.212 ( -9.146 5.425 2.764) 10.987 35.528 ( -12.918 -2.103 -7.067) 14.874 35.835 ( 9.084 3.661 0.733) 9.822 35.963 ( 7.672 -3.842 6.672) 10.869 36.999 ( -11.166 25.931 -15.959) 32.432 37.590 ( -8.104 3.852 0.494) 8.987 ======================= Grid point 177 (78/95) ======================= q-point: ( 0.33 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.674 ( 8.963 -17.599 -12.489) 23.368 1.824 ( 9.481 -11.965 9.809) 18.146 1.853 ( 20.489 -5.173 0.946) 21.153 2.011 ( 1.853 -4.893 -2.015) 5.607 2.365 ( 7.151 9.102 -1.346) 11.653 2.678 ( 14.584 -3.074 1.038) 14.941 2.735 ( -5.606 5.759 2.385) 8.383 3.031 ( -4.598 2.428 4.476) 6.861 3.126 ( 8.641 -3.322 -7.856) 12.141 3.233 ( 3.061 1.663 -0.814) 3.577 3.329 ( 0.172 3.313 -10.706) 11.208 3.398 ( -3.665 -4.816 5.095) 7.911 3.626 ( 2.540 -0.879 -4.272) 5.047 3.733 ( 2.992 -2.214 -0.386) 3.742 3.825 ( -1.641 -7.088 0.550) 7.296 4.008 ( 5.981 -5.660 3.612) 8.992 4.121 ( 6.418 -5.296 8.033) 11.566 4.147 ( 0.909 -6.590 -1.785) 6.887 4.252 ( -0.605 -1.384 -0.845) 1.731 4.300 ( -4.954 3.354 4.248) 7.337 4.502 ( 3.052 -5.160 1.435) 6.165 4.527 ( 2.848 -3.475 2.081) 4.952 4.709 ( 0.988 -4.450 2.370) 5.137 4.773 ( -0.338 1.613 -2.176) 2.730 4.804 ( 2.942 0.368 -0.425) 2.996 4.959 ( -4.026 -1.856 -2.670) 5.176 5.161 ( 0.518 4.797 3.971) 6.249 5.356 ( 3.478 -2.228 0.362) 4.146 5.403 ( 2.459 8.151 -3.248) 9.112 5.588 ( -9.911 5.709 -3.608) 11.993 5.843 ( -4.548 -0.458 -4.839) 6.657 5.898 ( -1.450 -3.805 6.344) 7.538 6.063 ( -11.556 1.668 2.300) 11.901 6.416 ( -7.812 -4.351 -0.402) 8.951 7.174 ( -2.967 -1.125 4.636) 5.618 7.476 ( -0.666 3.697 3.998) 5.486 7.510 ( -0.939 1.934 -4.839) 5.295 7.694 ( 1.762 0.822 1.438) 2.418 7.937 ( -0.527 5.712 -5.569) 7.995 8.140 ( -5.456 2.922 1.970) 6.495 8.326 ( -4.716 -2.841 -1.293) 5.655 8.453 ( -8.717 -3.407 2.062) 9.583 8.654 ( 0.241 2.861 -5.152) 5.898 8.828 ( -0.808 -0.685 2.182) 2.426 8.893 ( 2.071 1.452 -0.005) 2.529 8.953 ( 5.710 1.177 -6.767) 8.932 9.352 ( -6.042 6.271 1.662) 8.866 9.441 ( -5.091 4.145 -0.258) 6.570 9.777 ( -7.162 0.479 -0.170) 7.180 10.065 ( -4.762 -1.206 -1.888) 5.263 10.165 ( -0.859 4.633 6.483) 8.014 10.431 ( 2.181 -2.080 -1.896) 3.561 10.772 ( 3.385 -0.550 -1.531) 3.756 10.906 ( 0.347 -2.116 0.363) 2.175 11.164 ( 8.856 -0.542 -2.087) 9.115 11.436 ( 7.983 -2.414 1.497) 8.474 11.887 ( -5.555 2.434 -0.243) 6.070 11.971 ( -3.089 1.981 0.210) 3.676 12.652 ( -2.212 3.957 1.249) 4.702 12.837 ( -3.176 1.342 -1.267) 3.673 13.101 ( -4.382 -0.507 -2.752) 5.200 13.208 ( -6.187 0.901 2.939) 6.908 13.532 ( 0.568 -1.934 0.350) 2.046 13.686 ( 2.685 -0.777 2.029) 3.454 13.890 ( 1.718 -0.244 1.044) 2.025 14.079 ( 3.388 6.398 -4.743) 8.655 14.502 ( 11.235 1.972 -0.780) 11.433 14.638 ( 4.962 1.353 2.452) 5.697 14.861 ( -2.262 -0.637 5.000) 5.525 15.008 ( -1.097 -0.429 -4.281) 4.440 15.446 ( 11.189 2.459 -2.154) 11.657 15.562 ( 15.236 0.092 3.332) 15.596 15.637 ( 11.668 2.113 1.576) 11.962 15.748 ( 8.849 0.256 -1.478) 8.975 16.454 ( -1.342 -3.621 -3.520) 5.225 16.552 ( -4.040 -1.354 0.525) 4.293 16.800 ( 1.022 0.307 1.060) 1.504 16.886 ( 0.867 -1.765 -0.756) 2.107 16.963 ( 1.877 -0.504 2.516) 3.179 17.029 ( -0.750 -1.184 -0.505) 1.490 17.137 ( -2.454 -1.346 1.465) 3.159 17.222 ( -5.851 2.806 2.590) 6.986 19.753 ( 6.175 1.311 0.783) 6.361 19.857 ( 7.746 2.252 -1.208) 8.157 21.381 ( -6.107 3.412 -0.509) 7.014 21.413 ( -4.459 2.287 0.928) 5.097 22.980 ( -4.188 -4.676 -5.925) 8.631 22.990 ( -6.816 -3.712 6.803) 10.321 27.860 ( -2.046 0.035 4.982) 5.386 28.179 ( -2.678 11.157 -3.726) 12.064 29.424 ( 5.477 -1.896 -4.675) 7.446 29.601 ( 0.243 2.937 1.066) 3.134 29.822 ( 1.592 2.793 1.820) 3.694 29.946 ( 3.470 -0.654 -0.377) 3.551 30.909 ( 1.304 -1.372 2.662) 3.266 31.025 ( 3.585 -0.075 -2.845) 4.578 31.256 ( -2.950 -7.034 -1.156) 7.714 31.555 ( -5.711 -9.588 2.782) 11.501 31.753 ( 0.763 4.069 0.404) 4.160 31.893 ( -3.577 -1.004 4.861) 6.118 31.961 ( -1.604 2.268 -0.640) 2.850 32.132 ( -1.806 -2.362 -1.040) 3.150 32.328 ( 4.889 -1.483 -0.113) 5.110 32.393 ( 4.244 -1.730 -0.220) 4.588 32.646 ( 9.257 1.832 -0.887) 9.478 32.911 ( 6.811 -3.260 2.464) 7.943 34.393 ( 0.558 -5.273 -3.619) 6.419 34.483 ( -3.094 -6.982 4.789) 9.014 35.041 ( -7.326 5.203 0.717) 9.014 35.439 ( -11.695 -2.637 -6.798) 13.782 35.859 ( 9.902 3.991 -1.501) 10.781 36.092 ( 4.602 -0.319 9.178) 10.272 36.451 ( -0.621 25.626 -11.690) 28.173 37.429 ( -5.936 7.004 0.177) 9.183 ======================= Grid point 178 (79/95) ======================= q-point: ( 0.44 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.964 ( -0.838 -12.197 -2.351) 12.449 2.071 ( 10.213 -2.271 -9.022) 13.815 2.091 ( 8.179 -2.858 -6.436) 10.793 2.111 ( 3.398 -10.079 7.412) 12.965 2.295 ( 8.751 5.600 8.551) 13.456 2.573 ( 1.693 10.498 6.972) 12.715 2.901 ( 1.899 -0.009 8.255) 8.471 2.986 ( 1.351 -9.320 -11.612) 14.951 3.150 ( -3.854 0.943 0.058) 3.969 3.190 ( 2.206 0.485 -10.001) 10.253 3.321 ( 5.659 1.611 -1.325) 6.031 3.471 ( -0.138 -3.824 3.744) 5.353 3.648 ( 1.802 -0.131 -1.772) 2.530 3.759 ( -0.713 -1.885 -6.057) 6.383 3.864 ( 0.176 1.013 0.847) 1.333 4.025 ( -10.200 5.523 10.343) 15.541 4.219 ( -2.070 -1.617 1.777) 3.171 4.246 ( 6.894 -4.862 1.290) 8.534 4.362 ( 0.731 -8.673 0.330) 8.710 4.406 ( 6.314 -9.848 -1.751) 11.829 4.615 ( 2.601 -2.286 -3.078) 4.633 4.629 ( -0.362 -5.901 1.241) 6.041 4.680 ( -1.654 2.550 2.439) 3.897 4.735 ( -2.493 5.998 1.551) 6.678 4.843 ( 1.565 -3.932 -2.988) 5.181 4.947 ( 1.229 -2.714 -1.672) 3.417 5.107 ( 0.350 5.459 6.725) 8.669 5.249 ( -0.151 7.574 -3.733) 8.445 5.394 ( -2.939 2.375 -2.667) 4.626 5.493 ( 5.642 -1.066 3.038) 6.496 5.810 ( -1.756 -1.266 -3.339) 3.980 5.900 ( -5.455 0.049 0.690) 5.498 6.001 ( -3.702 -0.500 3.515) 5.130 6.399 ( -8.396 -3.397 -1.019) 9.114 7.189 ( -0.363 -1.206 2.397) 2.708 7.438 ( -2.111 1.141 4.527) 5.123 7.492 ( 0.230 -2.482 -4.724) 5.342 7.686 ( -0.862 0.682 2.759) 2.970 7.832 ( 2.443 6.653 -3.159) 7.760 8.031 ( -4.193 3.948 -0.152) 5.761 8.364 ( -1.751 -5.267 -3.148) 6.381 8.444 ( -6.060 -3.071 1.777) 7.022 8.607 ( 1.753 2.634 -2.154) 3.827 8.783 ( -0.141 4.355 3.160) 5.382 8.932 ( 1.560 -2.100 0.232) 2.626 8.971 ( 3.694 1.223 -5.007) 6.341 9.202 ( -6.689 4.471 2.056) 8.304 9.327 ( -3.178 3.371 -2.526) 5.277 9.730 ( -4.215 -1.491 0.955) 4.571 10.030 ( -4.181 -0.736 -2.612) 4.984 10.108 ( 1.132 3.831 5.950) 7.167 10.452 ( -0.075 -0.133 -2.064) 2.070 10.829 ( 3.869 -2.059 -0.363) 4.398 10.927 ( 0.325 0.252 0.231) 0.472 11.230 ( 5.860 0.986 -0.917) 6.012 11.514 ( 2.897 -0.033 0.366) 2.920 11.823 ( -2.727 0.584 0.850) 2.915 11.933 ( -0.516 0.706 -0.410) 0.966 12.589 ( -0.176 2.410 0.549) 2.478 12.779 ( -2.519 0.932 -1.125) 2.912 13.078 ( -3.111 -1.096 -0.605) 3.353 13.143 ( -5.971 0.273 0.932) 6.050 13.572 ( 0.306 -1.921 0.342) 1.976 13.720 ( 0.699 -0.272 1.854) 2.000 13.886 ( 2.123 2.169 -0.966) 3.186 14.039 ( 5.097 2.512 -2.561) 6.233 14.563 ( 10.655 3.106 -0.490) 11.109 14.642 ( 3.137 2.780 2.186) 4.727 14.867 ( -3.039 -0.897 7.496) 8.138 14.995 ( 2.204 0.721 -7.127) 7.495 15.499 ( 8.017 1.709 -1.930) 8.422 15.619 ( 3.722 3.087 0.386) 4.851 15.664 ( 2.451 3.910 2.401) 5.202 15.817 ( 5.789 0.354 -1.137) 5.910 16.516 ( 2.468 -3.212 -6.831) 7.941 16.564 ( -1.013 -3.371 4.738) 5.903 16.780 ( -0.674 1.759 -1.426) 2.363 16.928 ( 1.122 -1.716 0.007) 2.050 16.995 ( 0.497 -0.375 3.759) 3.810 17.028 ( -1.286 -0.032 -1.256) 1.798 17.141 ( -4.725 -0.240 0.152) 4.734 17.155 ( -0.953 -0.843 2.131) 2.483 19.784 ( 5.449 2.064 0.109) 5.828 19.878 ( 4.322 2.041 -0.391) 4.796 21.274 ( -5.015 1.958 -1.286) 5.535 21.345 ( -3.980 1.069 1.527) 4.395 23.008 ( -1.437 -4.155 -7.132) 8.378 23.020 ( -4.878 -3.668 7.673) 9.804 27.861 ( -0.949 -0.449 3.137) 3.308 28.006 ( -1.355 6.294 -3.412) 7.286 29.468 ( 2.402 -0.321 -2.972) 3.835 29.593 ( 1.267 -0.578 1.244) 1.867 29.796 ( 1.396 2.589 1.238) 3.191 29.967 ( 1.605 1.292 -0.101) 2.063 30.951 ( 1.643 -1.019 1.762) 2.615 31.047 ( 2.422 0.280 -2.256) 3.321 31.339 ( -1.566 -6.526 -2.569) 7.186 31.608 ( -0.337 -0.476 0.075) 0.588 31.733 ( -3.678 -2.201 4.297) 6.069 31.901 ( -3.943 -0.004 -2.293) 4.561 31.912 ( 1.328 0.237 5.516) 5.678 32.140 ( -0.371 -1.242 -2.740) 3.031 32.394 ( 3.005 -1.199 0.590) 3.289 32.448 ( 3.668 -0.101 0.303) 3.682 32.665 ( 4.593 2.871 -2.223) 5.855 32.984 ( 0.908 -0.262 3.276) 3.410 34.497 ( 2.527 -6.723 -3.616) 8.041 34.593 ( -3.389 -7.400 4.432) 9.268 34.930 ( -4.494 1.094 0.783) 4.691 35.331 ( -13.034 -0.001 -5.257) 14.054 35.869 ( 11.796 8.300 -3.493) 14.840 35.984 ( -2.132 11.497 4.764) 12.626 36.242 ( 9.932 5.351 -2.060) 11.468 37.264 ( -6.666 5.357 0.027) 8.552 ======================= Grid point 179 (80/95) ======================= q-point: ( 0.56 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.000 ( -8.215 3.706 -0.429) 9.023 2.023 ( -2.460 3.557 -5.589) 7.067 2.194 ( 5.018 -3.853 -3.347) 7.158 2.270 ( 7.503 -0.937 -1.515) 7.712 2.395 ( 9.856 4.507 4.201) 11.623 2.492 ( 7.325 6.814 10.263) 14.333 2.839 ( -1.664 -1.549 2.380) 3.291 3.099 ( -2.887 1.225 -5.128) 6.011 3.176 ( -1.480 -8.344 -4.635) 9.659 3.258 ( 3.247 -4.093 3.535) 6.309 3.338 ( 5.093 -0.248 -2.365) 5.621 3.468 ( -2.412 5.180 5.168) 7.705 3.638 ( 0.446 2.721 -0.041) 2.758 3.812 ( 2.754 -7.032 -11.500) 13.758 3.831 ( -1.763 1.241 1.216) 2.475 3.886 ( -6.990 3.265 8.247) 11.293 4.200 ( -7.833 0.862 0.623) 7.905 4.276 ( -4.855 3.056 1.386) 5.902 4.409 ( -4.074 -2.408 -2.148) 5.197 4.539 ( -0.104 2.040 -0.979) 2.265 4.572 ( -2.356 0.021 -0.039) 2.357 4.620 ( -1.871 -1.220 -4.972) 5.451 4.704 ( 2.934 -0.141 -1.129) 3.147 4.801 ( -0.170 -5.993 4.471) 7.479 4.831 ( 0.686 2.856 0.877) 3.065 4.959 ( 0.236 1.682 1.550) 2.300 5.113 ( 3.911 7.662 -4.303) 9.619 5.205 ( 12.900 -6.718 0.616) 14.557 5.375 ( -0.871 -1.474 1.915) 2.569 5.591 ( 9.001 0.140 4.113) 9.897 5.819 ( -1.706 -1.555 -2.298) 3.258 5.833 ( -4.654 0.142 -0.674) 4.705 6.006 ( -1.142 -2.161 1.091) 2.676 6.382 ( -8.078 -4.639 -0.935) 9.362 7.214 ( 1.081 -0.684 1.234) 1.777 7.412 ( -3.797 -0.416 0.610) 3.868 7.566 ( 4.621 -3.684 -3.544) 6.891 7.682 ( 0.286 1.233 4.117) 4.307 7.747 ( 1.953 4.421 -0.635) 4.874 7.969 ( -1.870 -1.113 -0.328) 2.201 8.426 ( -1.294 -4.708 -3.794) 6.183 8.457 ( -3.239 -3.544 2.225) 5.292 8.582 ( 2.366 2.542 -0.140) 3.475 8.725 ( 0.501 3.416 2.060) 4.020 8.913 ( -4.084 2.774 -1.626) 5.198 8.962 ( -1.527 1.460 -1.080) 2.372 9.124 ( -2.075 -1.736 1.380) 3.037 9.297 ( 0.968 -1.819 -2.249) 3.050 9.758 ( 0.861 -3.358 0.897) 3.581 10.008 ( -2.585 -1.408 -0.553) 2.995 10.109 ( 4.425 0.804 3.102) 5.463 10.437 ( -1.612 -0.051 -1.794) 2.413 10.893 ( 2.522 -1.079 -0.455) 2.781 10.902 ( -0.116 2.334 0.804) 2.471 11.228 ( 2.193 3.624 -0.354) 4.250 11.496 ( -2.562 2.278 0.213) 3.435 11.816 ( -0.587 -1.245 1.149) 1.793 11.927 ( 0.347 -0.108 -1.047) 1.108 12.576 ( 2.303 0.417 -0.471) 2.388 12.772 ( -0.006 -1.548 0.174) 1.558 13.066 ( -4.452 -1.724 1.453) 4.990 13.104 ( -3.893 -1.720 -1.881) 4.653 13.595 ( 0.171 -0.416 -0.158) 0.477 13.715 ( -1.165 0.540 0.206) 1.300 13.881 ( 3.897 1.728 0.989) 4.377 14.048 ( 4.866 1.937 -1.768) 5.528 14.579 ( 6.133 4.681 0.733) 7.750 14.650 ( 7.882 2.666 -0.112) 8.321 14.880 ( -2.919 -1.388 8.847) 9.419 14.981 ( 2.389 1.017 -8.139) 8.543 15.509 ( 0.850 2.345 -2.303) 3.395 15.554 ( -2.372 5.731 1.897) 6.486 15.587 ( -3.834 4.459 0.421) 5.896 15.805 ( -1.289 3.469 -0.229) 3.707 16.560 ( 1.974 -1.587 0.131) 2.536 16.647 ( 3.785 -1.571 0.628) 4.146 16.738 ( -1.116 0.412 -2.620) 2.877 16.949 ( -0.079 0.313 1.500) 1.534 16.980 ( -4.086 1.146 -0.184) 4.248 17.007 ( -1.753 -0.266 0.132) 1.778 17.130 ( -0.515 -1.759 -0.306) 1.858 17.181 ( 0.157 -1.430 0.865) 1.678 19.780 ( 2.871 3.259 -0.110) 4.344 19.862 ( 0.600 2.655 0.028) 2.722 21.237 ( -1.260 -1.832 -1.744) 2.826 21.322 ( -2.385 -1.526 1.927) 3.425 23.045 ( 1.082 -3.002 -7.600) 8.243 23.058 ( -3.154 -2.778 7.634) 8.715 27.875 ( -0.574 -1.214 1.827) 2.268 27.918 ( -0.480 2.552 -1.953) 3.249 29.485 ( 1.869 -0.038 0.906) 2.078 29.619 ( 0.776 -0.310 -0.201) 0.860 29.767 ( 0.718 2.168 -0.960) 2.478 29.933 ( -1.644 2.307 0.015) 2.833 30.977 ( 1.317 0.214 1.378) 1.918 31.046 ( 0.886 1.112 -1.435) 2.020 31.434 ( 1.068 -6.021 -2.713) 6.690 31.603 ( 3.624 2.840 2.586) 5.281 31.742 ( -5.911 -2.699 1.554) 6.682 31.853 ( -1.717 1.189 -1.142) 2.380 31.973 ( 2.961 -2.744 3.479) 5.329 32.164 ( 2.373 -1.842 -4.313) 5.256 32.416 ( 0.599 0.915 0.475) 1.192 32.459 ( 1.261 1.882 0.834) 2.414 32.635 ( 1.610 3.404 -0.908) 3.873 32.962 ( -3.922 1.801 1.312) 4.511 34.632 ( 2.609 -3.147 1.816) 4.473 34.655 ( 1.182 -3.887 -0.670) 4.118 34.928 ( -4.948 -4.192 -2.584) 6.981 35.184 ( -12.974 -0.898 0.817) 13.031 35.752 ( 6.917 9.947 -0.209) 12.117 35.952 ( 4.958 0.689 0.764) 5.063 36.249 ( 9.633 4.697 -0.730) 10.742 37.137 ( -9.233 0.643 -0.049) 9.256 ======================= Grid point 180 (81/95) ======================= q-point: (-0.33 0.11 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.773 ( -10.773 11.998 4.121) 16.643 1.866 ( -9.964 5.991 -6.681) 13.409 2.191 ( 4.549 10.572 -2.146) 11.707 2.302 ( 4.865 13.759 -3.127) 14.925 2.356 ( 6.498 -0.375 2.266) 6.892 2.490 ( 3.406 -0.413 5.113) 6.157 2.951 ( 4.334 -3.695 -4.220) 7.088 3.050 ( -0.316 -0.739 -0.304) 0.860 3.201 ( -3.367 6.953 6.727) 10.244 3.247 ( 2.407 6.972 -0.426) 7.388 3.358 ( -0.190 0.131 12.557) 12.559 3.443 ( 0.147 -4.517 -4.138) 6.128 3.586 ( -1.205 2.457 -2.834) 3.940 3.701 ( -8.494 5.814 -1.855) 10.459 3.896 ( -2.089 -4.122 9.411) 10.484 3.950 ( 0.746 -6.589 -9.996) 11.995 4.072 ( -6.554 0.726 2.276) 6.976 4.200 ( -6.426 0.530 -5.505) 8.478 4.343 ( -0.212 4.548 -4.486) 6.392 4.411 ( -3.387 8.341 1.342) 9.102 4.583 ( -1.607 -0.956 -0.086) 1.872 4.623 ( -0.322 -3.719 -1.563) 4.047 4.681 ( 1.490 4.876 -2.913) 5.872 4.771 ( -3.035 3.256 4.816) 6.558 4.926 ( 0.298 -6.309 2.802) 6.910 4.996 ( 1.661 -5.014 -2.463) 5.828 5.030 ( 7.511 8.200 -1.907) 11.282 5.305 ( 0.158 5.805 -2.405) 6.285 5.433 ( 4.830 -1.448 5.864) 7.734 5.701 ( 5.709 -3.104 0.886) 6.558 5.844 ( 3.535 -3.911 -1.047) 5.374 5.858 ( 2.575 -3.525 1.284) 4.551 6.061 ( 1.582 -4.928 -2.077) 5.577 6.391 ( -8.407 -5.574 -0.024) 10.087 7.240 ( 2.199 -0.152 2.272) 3.166 7.384 ( -2.797 -0.365 -2.923) 4.062 7.592 ( 2.190 3.021 -0.506) 3.766 7.652 ( -1.413 2.431 0.648) 2.885 7.803 ( 6.448 -5.687 0.721) 8.628 8.032 ( -0.729 -6.538 -0.158) 6.580 8.476 ( 0.157 -1.379 2.956) 3.266 8.507 ( -0.103 -4.935 0.254) 4.943 8.581 ( 2.840 -0.437 -0.838) 2.993 8.697 ( 0.805 0.927 -0.986) 1.574 8.825 ( -6.189 0.830 -0.750) 6.289 8.875 ( -7.108 1.719 -0.053) 7.313 9.219 ( 4.013 -5.901 1.111) 7.223 9.356 ( 0.375 -4.403 -1.755) 4.755 9.849 ( 5.029 -3.570 0.427) 6.183 10.027 ( -2.127 -3.108 1.470) 4.043 10.172 ( 7.073 -0.898 -0.036) 7.130 10.415 ( -3.220 -0.329 -0.913) 3.363 10.841 ( 1.442 4.022 -1.092) 4.410 10.929 ( -0.755 -0.940 2.280) 2.579 11.157 ( 0.591 5.879 -0.403) 5.923 11.393 ( -7.368 4.283 -0.191) 8.525 11.863 ( 1.981 -3.295 1.081) 3.994 11.942 ( 0.845 -1.831 -1.244) 2.369 12.615 ( 4.531 -1.512 -1.338) 4.961 12.809 ( -1.601 -2.642 1.420) 3.400 13.074 ( -3.660 -3.596 2.718) 5.806 13.116 ( -2.026 -3.897 -3.409) 5.560 13.592 ( 1.623 1.445 -0.185) 2.181 13.690 ( -1.701 0.748 -1.404) 2.329 13.904 ( 5.059 1.377 2.765) 5.928 14.048 ( 3.308 2.180 -1.541) 4.251 14.549 ( 6.455 6.097 0.663) 8.904 14.677 ( 8.526 3.753 -1.274) 9.402 14.909 ( 0.786 -0.696 4.283) 4.409 14.967 ( -2.360 -1.627 -2.262) 3.651 15.350 ( -14.641 7.432 -0.549) 16.428 15.418 ( -9.904 5.680 -0.080) 11.417 15.488 ( 2.171 5.705 -1.148) 6.212 15.694 ( -5.974 5.118 0.725) 7.900 16.600 ( 1.235 0.482 6.788) 6.916 16.650 ( 3.663 2.483 -4.467) 6.288 16.767 ( 1.517 -2.568 -2.035) 3.611 16.901 ( -4.385 1.662 -1.368) 4.885 16.946 ( -0.941 0.899 2.741) 3.034 16.997 ( -1.999 -1.027 -1.593) 2.755 17.166 ( 1.520 -1.734 -0.998) 2.513 17.207 ( -0.039 -1.446 0.692) 1.603 19.737 ( 0.982 3.581 -0.227) 3.720 19.805 ( -2.182 3.167 0.255) 3.854 21.294 ( 2.030 -4.704 -1.939) 5.478 21.358 ( -1.084 -3.798 2.112) 4.479 23.082 ( 2.900 -1.742 -7.455) 8.187 23.094 ( -1.660 -1.765 7.141) 7.541 27.881 ( 1.166 0.441 -2.641) 2.921 27.916 ( -1.952 -3.122 2.681) 4.555 29.506 ( 1.527 0.868 4.141) 4.498 29.604 ( -0.114 1.987 -1.827) 2.702 29.741 ( 1.146 0.936 -2.183) 2.637 29.876 ( -4.050 0.917 -0.043) 4.153 30.974 ( 1.268 1.896 -0.050) 2.282 31.021 ( -0.923 1.580 0.221) 1.843 31.538 ( 2.543 -4.831 -0.046) 5.460 31.597 ( 6.105 4.905 3.875) 8.738 31.732 ( -5.799 -3.415 -1.062) 6.813 31.813 ( -1.436 1.554 -3.962) 4.492 32.069 ( 5.610 -2.452 3.424) 7.015 32.215 ( 3.459 -2.037 -4.657) 6.148 32.378 ( -0.355 3.546 -0.645) 3.621 32.418 ( -1.907 2.803 0.993) 3.532 32.582 ( 0.867 4.292 0.693) 4.433 32.862 ( -8.346 3.500 0.303) 9.055 34.609 ( 1.078 4.846 6.155) 7.908 34.757 ( 4.125 4.250 -7.258) 9.368 34.904 ( -1.189 -6.551 -2.858) 7.246 35.215 ( -12.965 -13.519 5.107) 19.415 35.706 ( 6.606 3.777 0.238) 7.613 35.970 ( -4.852 -0.810 2.270) 5.417 36.326 ( 20.744 0.201 -1.853) 20.828 37.073 ( -12.969 -5.610 -0.113) 14.131 ======================= Grid point 181 (82/95) ======================= q-point: (-0.22 0.11 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.481 ( -6.362 13.734 8.526) 17.373 1.605 ( -13.181 9.269 -7.603) 17.817 1.958 ( 1.587 19.590 3.550) 19.973 2.024 ( -0.821 19.616 -6.756) 20.763 2.420 ( 7.745 1.156 -2.261) 8.151 2.526 ( -3.618 0.558 1.692) 4.033 2.950 ( 2.736 5.555 6.660) 9.094 3.003 ( 1.106 7.586 -5.377) 9.364 3.109 ( 0.340 0.916 7.658) 7.721 3.194 ( -2.478 0.132 -3.198) 4.048 3.356 ( 0.889 2.392 5.050) 5.658 3.474 ( -7.847 1.764 -3.329) 8.705 3.536 ( 2.347 -1.107 2.894) 3.887 3.584 ( -2.315 0.366 -2.476) 3.410 3.941 ( -0.190 0.658 -2.826) 2.908 3.966 ( -2.740 -2.876 6.543) 7.654 4.054 ( -2.448 3.565 1.777) 4.675 4.111 ( -3.128 1.906 -9.884) 10.541 4.285 ( 3.422 1.935 -2.411) 4.612 4.312 ( -0.568 0.685 0.797) 1.194 4.541 ( 1.491 5.490 3.368) 6.611 4.599 ( 0.714 4.976 -3.753) 6.274 4.677 ( -0.985 -0.940 -3.625) 3.873 4.709 ( -4.045 0.011 4.814) 6.288 4.943 ( 5.800 7.037 -1.145) 9.190 5.027 ( -2.083 -0.026 -3.048) 3.691 5.094 ( 1.956 -4.239 5.989) 7.594 5.181 ( -3.489 -0.977 -4.469) 5.753 5.514 ( 6.811 0.330 8.783) 11.120 5.702 ( -6.629 -0.490 -7.013) 9.663 5.947 ( 7.754 -1.949 -0.447) 8.008 5.990 ( 2.574 -3.347 3.914) 5.757 6.222 ( 9.200 -8.668 -3.375) 13.084 6.403 ( -8.666 -5.504 0.830) 10.299 7.277 ( 3.351 -0.315 3.175) 4.627 7.358 ( -2.649 -1.083 -4.481) 5.317 7.572 ( 0.679 0.953 2.941) 3.166 7.604 ( -1.417 0.994 -2.319) 2.894 7.973 ( 6.914 -5.322 2.641) 9.116 8.106 ( -3.849 -4.363 -3.283) 6.680 8.536 ( 6.342 -2.856 4.115) 8.082 8.625 ( 4.527 -5.701 -0.390) 7.290 8.636 ( 0.885 -3.664 -0.553) 3.810 8.707 ( -1.085 -2.304 1.616) 3.016 8.768 ( -5.632 -1.519 -3.123) 6.617 8.802 ( -7.052 -1.098 1.038) 7.212 9.363 ( 3.599 -6.046 2.302) 7.403 9.427 ( -0.903 -5.082 -2.932) 5.937 9.961 ( 6.375 -2.916 1.081) 7.093 10.061 ( -3.343 -3.198 0.436) 4.647 10.254 ( 7.645 -0.448 -2.014) 7.919 10.373 ( -5.280 0.666 0.746) 5.374 10.810 ( 4.591 2.383 -1.336) 5.343 10.915 ( -6.184 0.082 3.120) 6.927 11.070 ( 4.806 6.457 -0.108) 8.050 11.227 ( -9.627 5.310 -1.093) 11.049 11.964 ( 3.454 -5.092 0.951) 6.226 12.001 ( 0.831 -4.473 -0.978) 4.654 12.701 ( 6.090 -3.253 -1.533) 7.072 12.822 ( -5.970 -3.060 1.336) 6.840 13.141 ( -0.683 -5.408 4.533) 7.090 13.171 ( -0.607 -5.244 -4.461) 6.912 13.587 ( 3.477 1.840 0.193) 3.938 13.647 ( -2.129 1.843 -1.130) 3.034 13.936 ( 6.721 2.303 -0.086) 7.105 14.028 ( -1.085 1.478 0.375) 1.871 14.506 ( 9.065 7.982 0.722) 12.100 14.656 ( 2.701 6.052 -2.517) 7.089 14.920 ( 0.849 1.623 -1.517) 2.379 14.982 ( -9.583 -2.976 3.410) 10.598 15.058 ( -8.978 8.263 3.919) 12.816 15.200 ( -13.536 4.623 -4.066) 14.870 15.421 ( 5.176 5.643 -1.794) 7.865 15.546 ( -8.168 4.708 1.639) 9.569 16.603 ( 2.225 2.146 4.376) 5.357 16.641 ( 0.660 0.903 -1.706) 2.040 16.795 ( 1.581 0.616 -1.203) 2.080 16.837 ( -2.485 1.091 -2.621) 3.773 16.945 ( 0.689 -0.224 3.208) 3.289 16.992 ( -2.361 -1.137 -1.656) 3.100 17.206 ( 2.465 -1.476 -1.274) 3.143 17.235 ( -0.840 -2.203 0.620) 2.438 19.691 ( 0.909 2.756 -0.268) 2.914 19.728 ( -3.100 2.773 0.392) 4.178 21.396 ( 2.757 -4.954 -1.903) 5.980 21.426 ( -1.089 -4.428 1.971) 4.968 23.114 ( 3.359 -0.716 -5.506) 6.489 23.124 ( -0.653 -0.876 5.156) 5.271 27.900 ( 4.006 -1.473 -4.492) 6.197 27.965 ( -5.137 -5.252 4.239) 8.482 29.495 ( 1.499 3.334 5.465) 6.575 29.557 ( -1.499 1.611 -3.942) 4.515 29.760 ( 2.702 -1.406 -0.603) 3.104 29.832 ( -4.413 -0.593 -0.241) 4.459 30.945 ( 2.027 2.684 -2.284) 4.065 30.977 ( -2.573 2.151 2.270) 4.049 31.571 ( 6.782 6.950 4.778) 10.823 31.635 ( 1.445 -2.563 3.870) 4.862 31.735 ( -2.193 2.553 -7.258) 8.000 31.747 ( -3.920 -3.761 -3.918) 6.698 32.167 ( 6.457 -1.070 2.927) 7.170 32.252 ( 0.195 -0.923 -2.261) 2.450 32.306 ( 1.605 4.531 -2.426) 5.385 32.340 ( -3.596 3.599 0.717) 5.138 32.520 ( 3.908 5.762 0.346) 6.971 32.693 ( -11.977 5.457 1.602) 13.259 34.547 ( 1.285 6.228 7.550) 9.872 34.613 ( -0.163 7.980 -8.583) 11.721 35.110 ( 8.615 -10.448 -0.471) 13.550 35.318 ( -13.310 -11.810 1.737) 17.879 35.741 ( 7.630 0.427 0.159) 7.644 35.904 ( -9.594 -0.009 1.560) 9.720 36.652 ( 25.715 -12.435 1.355) 28.596 37.080 ( -17.390 -12.828 -0.776) 21.624 ======================= Grid point 182 (83/95) ======================= q-point: (-0.11 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 86 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.312 ( -3.862 9.445 -16.746) 19.610 1.312 ( 3.862 9.445 16.746) 19.610 1.638 ( 1.643 21.066 -13.985) 25.339 1.638 ( -1.643 21.066 13.985) 25.339 2.417 ( 9.121 5.788 -18.863) 21.737 2.417 ( -9.121 5.788 18.863) 21.737 2.923 ( 1.661 1.369 -8.770) 9.030 2.923 ( -1.661 1.369 8.770) 9.030 3.129 ( -2.969 0.812 -4.299) 5.287 3.129 ( 2.969 0.812 4.299) 5.287 3.395 ( -3.369 -1.118 -3.347) 4.879 3.395 ( 3.369 -1.118 3.347) 4.879 3.544 ( 6.105 2.857 -9.715) 11.824 3.544 ( -6.105 2.857 9.715) 11.824 3.944 ( 1.718 2.973 -9.520) 10.121 3.944 ( -1.718 2.973 9.520) 10.121 4.000 ( -3.377 2.722 -5.334) 6.875 4.000 ( 3.377 2.722 5.334) 6.875 4.296 ( -3.405 1.943 -2.267) 4.528 4.296 ( 3.405 1.943 2.267) 4.528 4.508 ( -1.188 1.414 -5.691) 5.984 4.508 ( 1.188 1.414 5.691) 5.984 4.671 ( 2.738 1.212 -4.188) 5.148 4.671 ( -2.738 1.212 4.188) 5.148 4.891 ( 4.058 6.028 -4.358) 8.473 4.891 ( -4.058 6.028 4.358) 8.473 5.233 ( 1.113 -6.109 -7.060) 9.402 5.233 ( -1.113 -6.109 7.060) 9.402 5.590 ( -3.717 2.474 -13.387) 14.111 5.590 ( 3.717 2.474 13.387) 14.111 6.037 ( 0.680 -2.573 -2.693) 3.786 6.037 ( -0.680 -2.573 2.693) 3.786 6.413 ( 0.663 -4.108 -5.193) 6.654 6.413 ( -0.663 -4.108 5.193) 6.654 7.341 ( -2.051 -1.870 -4.582) 5.357 7.341 ( 2.051 -1.870 4.582) 5.357 7.589 ( 0.417 -1.119 -5.051) 5.190 7.589 ( -0.417 -1.119 5.051) 5.190 8.106 ( -2.111 -3.128 -7.042) 7.989 8.106 ( 2.111 -3.128 7.042) 7.989 8.652 ( -0.085 -0.207 -2.915) 2.924 8.652 ( 0.085 -0.207 2.915) 2.924 8.741 ( -2.791 -1.564 -6.236) 7.009 8.741 ( 2.791 -1.564 6.236) 7.009 8.827 ( 0.900 -9.888 -1.068) 9.986 8.827 ( -0.900 -9.888 1.068) 9.986 9.493 ( -0.315 -5.657 -4.950) 7.523 9.493 ( 0.315 -5.657 4.950) 7.523 10.058 ( -3.923 -1.293 -2.730) 4.951 10.058 ( 3.923 -1.293 2.730) 4.951 10.308 ( 2.372 0.936 -4.101) 4.829 10.308 ( -2.372 0.936 4.101) 4.829 10.835 ( -3.953 1.530 0.482) 4.266 10.835 ( 3.953 1.530 -0.482) 4.266 11.050 ( -8.699 4.409 -1.835) 9.924 11.050 ( 8.699 4.409 1.835) 9.924 12.082 ( -1.263 -5.269 -1.073) 5.523 12.082 ( 1.263 -5.269 1.073) 5.523 12.824 ( -5.081 -4.229 0.224) 6.614 12.824 ( 5.081 -4.229 -0.224) 6.614 13.240 ( 0.842 -4.573 -5.742) 7.389 13.240 ( -0.842 -4.573 5.742) 7.389 13.592 ( 0.124 1.364 -2.061) 2.475 13.592 ( -0.124 1.364 2.061) 2.475 13.960 ( 2.484 2.297 -5.361) 6.340 13.960 ( -2.484 2.297 5.361) 6.340 14.465 ( -9.414 8.603 -3.511) 13.227 14.465 ( 9.414 8.603 3.511) 13.227 14.843 ( -3.108 5.404 -2.760) 6.817 14.843 ( 3.108 5.404 2.760) 6.817 15.085 ( -0.467 -2.748 -8.784) 9.216 15.085 ( 0.467 -2.748 8.784) 9.216 15.401 ( 0.470 3.705 -1.690) 4.099 15.401 ( -0.470 3.705 1.690) 4.099 16.610 ( -0.446 0.845 -4.125) 4.234 16.610 ( 0.446 0.845 4.125) 4.234 16.796 ( -1.795 0.709 -2.472) 3.136 16.796 ( 1.795 0.709 2.472) 3.136 16.973 ( -2.415 0.006 -1.256) 2.722 16.973 ( 2.415 0.006 1.256) 2.722 17.262 ( -2.769 -2.616 0.455) 3.836 17.262 ( 2.769 -2.616 -0.455) 3.836 19.667 ( 0.971 1.477 -3.906) 4.287 19.667 ( -0.971 1.477 3.906) 4.287 21.485 ( 1.597 -3.579 -2.029) 4.413 21.485 ( -1.597 -3.579 2.029) 4.413 23.132 ( 1.694 0.219 -4.664) 4.967 23.132 ( -1.694 0.219 4.664) 4.967 28.000 ( 8.899 -5.307 -4.912) 11.467 28.000 ( -8.899 -5.307 4.912) 11.467 29.493 ( -3.728 1.215 -4.458) 5.937 29.493 ( 3.728 1.215 4.458) 5.937 29.820 ( -0.378 -2.362 -4.248) 4.875 29.820 ( 0.378 -2.362 4.248) 4.875 30.922 ( 3.308 1.812 -3.735) 5.308 30.922 ( -3.308 1.812 3.735) 5.308 31.509 ( -5.803 10.797 -8.359) 14.837 31.509 ( 5.803 10.797 8.359) 14.837 31.772 ( -1.572 -4.128 -5.206) 6.828 31.772 ( 1.572 -4.128 5.206) 6.828 32.221 ( -3.295 2.459 -1.683) 4.442 32.221 ( 3.295 2.459 1.683) 4.442 32.258 ( -1.551 2.200 -2.518) 3.686 32.258 ( 1.551 2.200 2.518) 3.686 32.483 ( -7.552 6.308 -0.275) 9.844 32.483 ( 7.552 6.308 0.275) 9.844 34.474 ( -0.311 5.766 -6.885) 8.986 34.474 ( 0.311 5.766 6.885) 8.986 35.364 ( -10.469 -7.905 -0.952) 13.153 35.364 ( 10.469 -7.905 0.952) 13.153 35.824 ( -5.887 -0.545 -1.550) 6.111 35.824 ( 5.887 -0.545 1.550) 6.111 37.178 ( -14.835 -21.586 -7.824) 27.336 37.178 ( 14.835 -21.586 7.824) 27.336 ======================= Grid point 186 (84/95) ======================= q-point: ( 0.22 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 95 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.338 ( 12.980 0.000 -19.856) 23.723 1.504 ( 4.479 0.000 20.190) 20.681 1.816 ( 31.112 0.000 -3.666) 31.328 1.936 ( 1.939 0.000 4.992) 5.355 2.469 ( 18.366 0.000 -36.511) 40.870 2.737 ( 14.779 0.000 10.790) 18.299 2.946 ( 3.468 0.000 22.495) 22.761 2.997 ( -4.591 -0.000 2.839) 5.398 3.051 ( -0.996 -0.000 -0.826) 1.294 3.265 ( 3.993 0.000 -4.110) 5.730 3.322 ( -0.485 -0.000 7.257) 7.274 3.383 ( 2.107 0.000 -9.666) 9.893 3.565 ( 3.434 0.000 -4.163) 5.397 3.572 ( -2.925 -0.000 -9.077) 9.537 3.722 ( -0.485 -0.000 2.889) 2.929 3.907 ( 5.230 0.000 -2.164) 5.660 3.961 ( -0.979 -0.000 11.922) 11.962 4.123 ( 4.936 0.000 -1.285) 5.101 4.227 ( 0.622 0.000 -7.626) 7.652 4.323 ( 5.818 0.000 4.295) 7.232 4.496 ( 4.480 0.000 2.272) 5.023 4.497 ( -12.620 -0.000 13.132) 18.213 4.650 ( -0.320 -0.000 9.448) 9.453 4.713 ( 3.513 0.000 -5.774) 6.759 4.870 ( 2.931 0.000 -3.067) 4.243 4.881 ( 6.072 0.000 -8.624) 10.547 5.277 ( 0.868 0.000 13.281) 13.309 5.325 ( 2.274 0.000 0.002) 2.274 5.577 ( 5.197 0.000 -11.888) 12.974 5.634 ( 0.968 0.000 2.796) 2.958 5.792 ( -10.126 -0.000 0.252) 10.129 5.797 ( -8.693 -0.000 -3.904) 9.530 6.199 ( -11.750 -0.000 -4.320) 12.519 6.212 ( -15.179 -0.000 5.726) 16.223 7.148 ( -4.307 -0.000 7.804) 8.913 7.543 ( -2.785 -0.000 -3.310) 4.326 7.648 ( 0.253 0.000 3.563) 3.572 7.709 ( 6.499 0.000 -4.710) 8.026 8.015 ( -6.160 -0.000 -6.984) 9.312 8.157 ( -8.074 -0.000 5.569) 9.808 8.304 ( -9.795 -0.000 0.009) 9.795 8.351 ( -8.146 -0.000 -1.970) 8.381 8.705 ( -1.953 -0.000 -2.203) 2.944 8.767 ( 6.061 0.000 -3.408) 6.953 8.956 ( -1.293 -0.000 0.553) 1.407 8.983 ( 2.932 0.000 -6.686) 7.301 9.492 ( -4.666 -0.000 -3.030) 5.564 9.506 ( -7.498 -0.000 5.980) 9.591 9.806 ( -7.399 -0.000 -0.415) 7.411 10.023 ( -5.604 -0.000 -1.649) 5.841 10.269 ( -0.785 -0.000 9.856) 9.887 10.357 ( 4.955 0.000 -5.637) 7.505 10.781 ( 2.445 0.000 -1.947) 3.125 10.846 ( 2.259 0.000 -0.403) 2.295 11.153 ( 9.410 0.000 -2.194) 9.662 11.384 ( 9.994 0.000 2.081) 10.208 11.940 ( -6.640 -0.000 -0.369) 6.650 12.010 ( -5.826 -0.000 -0.210) 5.830 12.790 ( -1.745 -0.000 0.210) 1.757 12.815 ( -0.428 -0.000 0.298) 0.521 13.096 ( -6.505 -0.000 -4.541) 7.933 13.210 ( -7.850 -0.000 5.547) 9.612 13.497 ( -0.086 -0.000 -0.743) 0.748 13.679 ( 2.045 0.000 3.281) 3.866 13.863 ( 2.388 0.000 0.225) 2.398 14.256 ( 0.068 0.000 -8.659) 8.660 14.526 ( 12.418 0.000 0.174) 12.419 14.671 ( 10.742 0.000 2.727) 11.083 14.851 ( -2.933 -0.000 5.500) 6.234 14.988 ( 0.167 0.000 -2.215) 2.221 15.456 ( 14.760 0.000 3.961) 15.282 15.685 ( 21.432 0.000 -12.921) 25.026 15.685 ( 10.835 0.000 15.297) 18.745 15.731 ( 12.743 0.000 -3.192) 13.137 16.393 ( -6.037 -0.000 -0.938) 6.110 16.513 ( -5.858 -0.000 1.035) 5.949 16.800 ( 2.787 0.000 2.535) 3.767 16.849 ( -1.310 -0.000 0.704) 1.488 16.937 ( -0.491 -0.000 -3.529) 3.563 17.012 ( 0.928 0.000 2.332) 2.510 17.104 ( -3.250 -0.000 1.548) 3.600 17.300 ( -8.959 -0.000 6.284) 10.944 19.783 ( 6.599 0.000 2.842) 7.184 19.948 ( 12.041 0.000 -1.268) 12.108 21.436 ( -7.776 -0.000 -1.502) 7.919 21.465 ( -5.058 -0.000 1.688) 5.332 22.864 ( -5.651 -0.000 -6.093) 8.310 22.905 ( -8.589 -0.000 6.492) 10.766 27.863 ( -2.819 -0.000 6.553) 7.134 28.453 ( -14.051 -0.000 0.107) 14.051 29.422 ( 10.500 0.000 -1.436) 10.598 29.784 ( 2.667 0.000 -1.290) 2.963 29.800 ( -0.954 -0.000 -0.456) 1.057 29.915 ( 1.542 0.000 0.931) 1.801 30.891 ( 1.740 0.000 4.025) 4.385 31.098 ( -0.494 -0.000 2.924) 2.965 31.112 ( 0.913 0.000 -2.492) 2.654 31.166 ( 2.421 0.000 -2.545) 3.512 31.850 ( -4.665 -0.000 4.883) 6.753 31.926 ( -3.874 -0.000 -4.614) 6.025 32.014 ( 3.382 0.000 -2.121) 3.992 32.032 ( 1.434 0.000 2.978) 3.306 32.313 ( 2.492 0.000 -1.459) 2.887 32.350 ( 7.118 0.000 0.522) 7.137 32.720 ( 14.402 0.000 12.115) 18.820 32.791 ( 9.023 0.000 -9.488) 13.093 34.297 ( -0.698 -0.000 -0.337) 0.775 34.363 ( -2.109 -0.000 1.449) 2.559 35.192 ( -9.931 -0.000 6.505) 11.872 35.321 ( -15.116 -0.000 -12.508) 19.620 35.931 ( 6.826 0.000 -0.176) 6.828 36.071 ( 13.679 0.000 8.634) 16.175 37.113 ( -7.584 -0.000 -19.855) 21.254 37.483 ( -13.388 -0.000 4.067) 13.992 ======================= Grid point 187 (85/95) ======================= q-point: ( 0.33 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.485 ( 10.111 -9.930 -14.648) 20.381 1.680 ( 1.544 -10.286 17.360) 20.238 1.970 ( 2.377 -1.039 -1.264) 2.886 2.095 ( 27.420 -0.486 0.086) 27.424 2.514 ( 10.852 0.948 -25.177) 27.432 2.745 ( 2.210 8.553 -1.401) 8.944 2.899 ( -3.115 3.262 17.818) 18.380 3.048 ( 0.611 1.291 5.385) 5.571 3.112 ( 1.360 -3.384 6.089) 7.097 3.299 ( 5.584 -0.216 -2.751) 6.229 3.349 ( 3.558 3.207 -10.644) 11.672 3.362 ( 3.774 0.158 -1.565) 4.089 3.556 ( -1.721 -3.317 -8.258) 9.064 3.684 ( 5.344 -8.929 6.452) 12.244 3.734 ( -1.803 -1.739 1.821) 3.097 3.974 ( 3.973 -3.784 -2.835) 6.176 4.056 ( 3.187 -5.756 8.273) 10.570 4.163 ( 4.532 -0.110 -0.912) 4.624 4.189 ( -3.624 -1.903 -8.155) 9.124 4.341 ( -7.500 5.491 10.480) 14.008 4.442 ( -0.599 -2.568 7.603) 8.047 4.559 ( 7.104 -0.236 0.837) 7.157 4.681 ( 3.801 -2.070 0.874) 4.416 4.774 ( 1.824 -3.190 -0.450) 3.702 4.865 ( 5.467 3.118 -4.402) 7.680 4.916 ( 1.206 0.235 -4.006) 4.190 5.250 ( -2.401 5.293 7.334) 9.358 5.377 ( 5.785 -1.460 2.223) 6.367 5.512 ( 1.885 4.745 -7.087) 8.735 5.619 ( -5.660 6.693 -0.717) 8.794 5.744 ( -3.631 -6.063 -0.130) 7.068 5.808 ( -2.621 -4.820 0.158) 5.488 5.978 ( -13.385 2.896 1.706) 13.801 6.209 ( -12.766 -8.015 -0.467) 15.081 7.145 ( -3.325 -1.039 9.534) 10.151 7.489 ( -3.087 0.956 -5.438) 6.326 7.589 ( -0.640 6.619 2.646) 7.157 7.720 ( 0.106 1.814 -3.303) 3.769 7.963 ( -0.986 -0.634 -7.063) 7.160 8.103 ( -8.205 -2.045 1.779) 8.641 8.240 ( -5.454 -1.338 1.525) 5.820 8.303 ( -6.243 -2.080 -1.876) 6.842 8.682 ( 0.337 1.352 -0.542) 1.495 8.822 ( 4.070 -0.594 -1.165) 4.275 8.939 ( 0.409 1.456 1.236) 1.953 8.998 ( 5.161 0.327 -6.730) 8.487 9.386 ( -7.074 4.764 1.264) 8.621 9.441 ( -6.198 1.836 0.586) 6.490 9.727 ( -6.486 1.174 0.878) 6.650 9.973 ( -7.100 -2.104 -3.046) 8.007 10.254 ( -0.307 3.698 8.514) 9.287 10.410 ( 3.137 -2.132 -4.169) 5.636 10.802 ( 3.788 0.062 -1.337) 4.018 10.882 ( 1.774 -1.700 -0.246) 2.469 11.240 ( 9.544 -0.166 -1.263) 9.629 11.488 ( 8.260 -1.012 1.153) 8.401 11.868 ( -5.396 1.398 0.315) 5.583 11.955 ( -4.436 0.476 -0.345) 4.474 12.720 ( 0.142 4.743 -0.197) 4.749 12.830 ( -1.063 0.325 -0.779) 1.357 13.034 ( -4.998 -1.047 -2.229) 5.572 13.144 ( -9.429 -0.149 4.450) 10.427 13.511 ( 1.120 -1.225 -0.530) 1.742 13.703 ( -0.022 -0.575 4.321) 4.359 13.898 ( 3.345 -0.727 -0.983) 3.562 14.188 ( 1.576 4.623 -7.919) 9.304 14.641 ( 11.900 0.690 -0.425) 11.928 14.734 ( 5.033 2.213 2.704) 6.127 14.848 ( -1.755 -0.189 6.029) 6.283 15.002 ( 4.142 -0.127 -3.089) 5.169 15.597 ( 13.724 1.239 -0.162) 13.780 15.754 ( 9.208 4.263 6.553) 12.079 15.775 ( 9.254 3.390 -3.343) 10.407 15.843 ( 10.149 1.170 -2.913) 10.624 16.374 ( -1.085 -3.321 -2.977) 4.590 16.485 ( -4.339 -1.934 1.682) 5.039 16.821 ( 0.832 0.659 0.456) 1.154 16.853 ( -1.260 -2.134 1.186) 2.747 16.937 ( -1.180 -1.990 -2.384) 3.322 17.028 ( 1.407 0.205 2.397) 2.787 17.100 ( -1.193 -1.091 1.412) 2.147 17.207 ( -8.609 2.125 4.459) 9.925 19.849 ( 7.811 1.296 2.795) 8.397 20.009 ( 11.018 4.859 -2.202) 12.241 21.340 ( -8.770 1.136 -2.257) 9.127 21.401 ( -6.670 1.530 2.445) 7.266 22.839 ( -3.798 -4.353 -6.840) 8.953 22.880 ( -7.232 -3.429 7.797) 11.174 27.859 ( -1.637 0.076 5.657) 5.889 28.258 ( -10.432 6.349 -4.624) 13.058 29.484 ( 7.398 1.955 -2.355) 8.006 29.684 ( 0.690 6.115 0.861) 6.214 29.859 ( 0.597 -0.952 1.238) 1.672 29.955 ( 2.902 -1.540 -0.261) 3.295 30.929 ( 3.877 -0.170 2.313) 4.518 31.064 ( 3.221 1.919 -2.693) 4.616 31.142 ( -1.008 -4.254 1.635) 4.667 31.317 ( -2.905 -11.562 0.031) 11.921 31.819 ( -3.942 0.543 2.838) 4.887 31.840 ( -3.933 1.912 -1.784) 4.723 32.006 ( 1.080 2.541 1.627) 3.204 32.089 ( 1.316 -2.002 -1.149) 2.657 32.347 ( 4.039 -1.140 -0.794) 4.271 32.435 ( 8.295 -0.485 1.027) 8.372 32.776 ( 7.244 3.912 -2.330) 8.556 32.921 ( 5.527 -3.586 5.428) 8.537 34.320 ( 0.322 -3.141 -0.565) 3.207 34.378 ( -2.217 -3.669 1.771) 4.638 35.048 ( -8.434 4.714 -0.324) 9.668 35.227 ( -12.822 -4.972 -5.956) 14.986 35.989 ( 9.364 1.944 -0.995) 9.615 36.209 ( 10.292 1.215 9.428) 14.010 36.806 ( -1.052 19.874 -14.734) 24.762 37.395 ( -12.390 -0.446 1.775) 12.524 ======================= Grid point 188 (86/95) ======================= q-point: ( 0.44 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.743 ( 6.347 -14.112 -7.638) 17.255 1.929 ( -2.101 -12.784 10.558) 16.712 2.025 ( 6.129 -3.729 -5.641) 9.126 2.291 ( 14.247 4.082 3.050) 15.131 2.498 ( 7.570 6.584 1.183) 10.102 2.671 ( 4.431 -1.313 -12.037) 12.893 2.872 ( -3.230 -0.162 4.724) 5.725 3.046 ( 5.888 4.133 9.759) 12.124 3.114 ( -6.951 1.997 1.895) 7.476 3.249 ( 4.347 6.095 -10.075) 12.552 3.394 ( 3.699 -5.276 -1.672) 6.657 3.401 ( 6.356 1.218 -1.572) 6.660 3.588 ( -0.560 -4.221 -7.102) 8.280 3.728 ( -5.080 -0.697 1.482) 5.337 3.872 ( 2.537 -3.459 4.861) 6.482 4.027 ( -4.425 2.356 -0.822) 5.080 4.164 ( -5.808 -2.198 7.435) 9.687 4.192 ( -3.558 -6.192 -1.083) 7.223 4.251 ( 7.979 -5.405 4.384) 10.587 4.312 ( 3.585 -5.942 -0.848) 6.991 4.508 ( -1.307 -5.134 3.157) 6.167 4.618 ( 3.393 -0.425 -3.251) 4.718 4.771 ( 2.711 5.462 3.547) 7.054 4.798 ( 7.080 -4.397 -5.159) 9.802 4.834 ( -3.452 6.734 0.337) 7.574 4.905 ( 4.531 -3.257 -2.120) 5.969 5.174 ( -0.938 2.199 4.838) 5.396 5.382 ( 0.353 7.073 -2.992) 7.688 5.462 ( 0.113 7.323 -1.062) 7.401 5.525 ( 7.051 -3.422 2.113) 8.117 5.748 ( -6.607 0.063 -3.261) 7.369 5.799 ( -5.311 -4.720 -0.381) 7.116 5.957 ( -3.407 -2.904 5.193) 6.856 6.209 ( -12.450 -6.393 -1.736) 14.103 7.175 ( -0.644 -1.802 7.827) 8.057 7.447 ( -1.464 -0.461 -7.106) 7.270 7.482 ( -1.754 4.499 4.927) 6.898 7.667 ( -3.510 0.060 -2.156) 4.120 7.943 ( 3.464 3.301 -5.487) 7.280 8.057 ( -4.065 2.191 2.066) 5.059 8.249 ( -3.526 -4.168 0.243) 5.465 8.297 ( -6.664 -5.419 -2.262) 8.882 8.665 ( 2.380 2.212 0.296) 3.262 8.830 ( -0.535 1.583 0.673) 1.801 8.939 ( 2.579 0.707 1.241) 2.948 9.026 ( 6.073 1.027 -5.662) 8.366 9.227 ( -7.961 5.900 2.326) 10.178 9.339 ( -4.780 3.406 -1.868) 6.159 9.674 ( -3.988 -0.854 2.767) 4.929 9.939 ( -6.401 -2.774 -4.680) 8.400 10.210 ( 0.974 4.227 7.876) 8.991 10.435 ( -0.274 -0.439 -4.112) 4.144 10.846 ( 4.132 -0.874 0.315) 4.235 10.925 ( 1.538 -1.396 -0.630) 2.171 11.316 ( 8.362 1.390 -0.442) 8.489 11.556 ( 4.367 0.908 0.497) 4.488 11.810 ( -3.313 0.691 1.133) 3.569 11.915 ( -3.302 -0.406 -1.002) 3.475 12.655 ( 2.335 4.045 -0.822) 4.742 12.787 ( -0.709 2.222 -0.581) 2.404 13.019 ( -4.091 -1.620 0.105) 4.402 13.067 ( -9.298 -0.590 1.705) 9.471 13.548 ( 1.509 -1.684 -0.395) 2.296 13.719 ( -1.927 -0.731 3.743) 4.273 13.932 ( 4.177 0.589 -1.470) 4.468 14.122 ( 3.059 3.295 -5.314) 6.961 14.700 ( 3.865 2.081 1.727) 4.717 14.755 ( 9.186 2.351 0.335) 9.488 14.845 ( -1.945 0.468 6.369) 6.676 15.039 ( 6.840 1.401 -4.507) 8.311 15.652 ( 11.044 5.652 -2.396) 12.636 15.732 ( 3.243 5.944 -0.197) 6.774 15.752 ( -0.195 4.251 3.606) 5.578 15.893 ( 6.703 1.949 -1.853) 7.223 16.459 ( 4.275 -5.163 -6.145) 9.094 16.505 ( -1.884 -3.596 4.154) 5.809 16.801 ( -0.020 1.648 -1.767) 2.416 16.893 ( -1.035 -3.120 1.666) 3.686 16.958 ( -2.338 -2.692 -0.898) 3.677 17.032 ( -0.930 1.377 0.957) 1.918 17.103 ( -2.145 0.024 0.002) 2.145 17.134 ( -2.908 -0.538 4.454) 5.346 19.895 ( 7.328 3.063 2.411) 8.300 19.998 ( 7.707 6.009 -2.472) 10.080 21.235 ( -6.945 1.027 -2.777) 7.550 21.317 ( -7.163 1.089 3.004) 7.843 22.884 ( -1.231 -6.015 -7.867) 9.979 22.915 ( -5.900 -5.106 8.602) 11.614 27.861 ( -0.619 0.063 4.163) 4.209 28.067 ( -5.322 5.586 -4.689) 9.028 29.500 ( 4.241 1.496 -2.336) 5.067 29.624 ( 0.874 2.498 1.401) 2.994 29.861 ( 2.125 2.253 0.517) 3.140 29.991 ( 0.874 -0.025 0.266) 0.914 30.975 ( 4.213 0.101 1.365) 4.430 31.072 ( 2.761 0.479 -2.309) 3.631 31.223 ( -0.069 -5.947 -0.504) 5.969 31.457 ( -5.728 -9.815 1.794) 11.506 31.759 ( -0.349 2.560 -0.765) 2.695 31.820 ( -4.551 -2.608 1.179) 5.376 31.977 ( 1.148 2.757 4.194) 5.149 32.108 ( 0.270 -0.942 -3.709) 3.837 32.410 ( 4.329 -1.100 0.269) 4.475 32.509 ( 6.569 0.949 1.496) 6.804 32.757 ( 4.207 3.612 -3.630) 6.627 32.992 ( -0.828 -0.424 5.165) 5.248 34.402 ( 1.738 -5.964 -2.006) 6.528 34.451 ( -2.418 -6.820 3.117) 7.879 34.922 ( -4.295 2.769 -2.109) 5.529 35.161 ( -12.912 -2.784 -2.569) 13.457 36.033 ( 9.691 3.397 -1.781) 10.423 36.224 ( 2.517 9.947 7.911) 12.956 36.500 ( 10.553 14.425 -8.779) 19.913 37.251 ( -12.451 3.638 0.654) 12.989 ======================= Grid point 189 (87/95) ======================= q-point: ( 0.56 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.946 ( 0.438 -5.002 -3.252) 5.982 2.039 ( -0.657 -2.172 -0.757) 2.392 2.168 ( 3.413 -3.582 -1.423) 5.148 2.331 ( 7.750 -0.878 -2.510) 8.194 2.516 ( 7.346 -0.527 12.438) 14.455 2.702 ( 9.589 5.994 -0.277) 11.311 2.856 ( -4.864 2.862 -1.809) 5.926 3.009 ( -3.883 -1.594 2.990) 5.154 3.109 ( 2.626 -2.097 -1.702) 3.767 3.187 ( 1.706 -0.320 -5.036) 5.327 3.431 ( 6.607 2.198 -2.038) 7.255 3.505 ( 1.979 -2.478 1.294) 3.425 3.631 ( 0.025 -3.068 -6.252) 6.965 3.696 ( -5.888 -3.639 2.564) 7.381 3.877 ( -1.072 7.493 4.142) 8.629 3.901 ( -2.349 1.758 1.732) 3.407 4.128 ( -7.454 0.149 -0.657) 7.484 4.225 ( -10.727 -0.549 -4.236) 11.546 4.369 ( 2.644 -3.020 7.230) 8.270 4.476 ( 3.276 -8.697 -4.905) 10.508 4.555 ( -4.559 0.431 2.801) 5.368 4.611 ( -0.667 1.250 -6.083) 6.246 4.745 ( 0.784 2.696 6.315) 6.911 4.760 ( 5.083 -0.399 1.245) 5.248 4.869 ( 3.090 0.667 -1.862) 3.668 4.983 ( 0.322 -0.537 -1.748) 1.857 5.215 ( 8.944 -3.095 1.606) 9.599 5.290 ( 5.304 4.711 1.372) 7.225 5.381 ( 2.426 2.402 -1.547) 3.749 5.638 ( 0.925 -1.734 0.975) 2.193 5.727 ( -0.626 -4.797 -1.109) 4.963 5.815 ( -2.793 -0.766 0.292) 2.911 5.961 ( -2.870 -0.888 2.057) 3.641 6.182 ( -12.583 -5.912 -1.959) 14.040 7.224 ( 2.385 -0.685 3.188) 4.040 7.385 ( -4.422 1.634 1.366) 4.908 7.516 ( 4.371 -5.142 -3.475) 7.591 7.669 ( -2.726 -3.461 2.145) 4.900 7.875 ( 3.170 7.004 -1.939) 7.929 7.968 ( -2.738 4.215 0.422) 5.044 8.304 ( -2.138 -6.098 -3.548) 7.372 8.337 ( -5.084 -6.317 0.624) 8.132 8.654 ( 3.561 2.633 0.212) 4.434 8.781 ( -1.832 2.859 1.821) 3.853 8.933 ( -0.261 2.962 -1.064) 3.158 9.012 ( 0.219 5.446 -1.654) 5.696 9.105 ( -1.653 0.498 2.609) 3.128 9.259 ( -2.945 0.027 -3.279) 4.407 9.709 ( 0.921 -3.905 3.682) 5.445 9.921 ( -5.030 -3.407 -4.763) 7.720 10.195 ( 3.752 2.456 6.499) 7.896 10.407 ( -2.859 0.148 -3.948) 4.876 10.898 ( 2.446 -0.883 2.167) 3.385 10.940 ( 1.254 0.944 -1.969) 2.518 11.338 ( 6.467 4.420 -0.258) 7.838 11.532 ( -1.104 4.029 0.683) 4.233 11.794 ( -1.067 -0.987 1.408) 2.024 11.899 ( -2.958 -1.395 -1.502) 3.598 12.632 ( 5.034 2.389 -1.642) 5.809 12.768 ( 1.058 0.617 1.306) 1.790 12.983 ( -7.596 -1.524 1.603) 7.911 13.026 ( -4.788 -2.015 -1.615) 5.440 13.587 ( 1.910 -1.209 -0.564) 2.329 13.706 ( -3.201 0.101 1.809) 3.678 13.956 ( 5.417 1.461 -0.019) 5.610 14.100 ( 1.746 1.228 -3.090) 3.756 14.696 ( 3.932 2.337 0.990) 4.680 14.807 ( 6.953 1.532 0.699) 7.154 14.844 ( 1.023 0.978 6.375) 6.530 15.039 ( 4.784 3.565 -5.770) 8.300 15.585 ( -0.177 7.869 -1.783) 8.071 15.642 ( -3.694 6.102 0.148) 7.134 15.686 ( 5.479 6.242 2.317) 8.623 15.866 ( 0.012 4.726 -1.181) 4.871 16.542 ( 3.228 -3.204 -2.172) 5.040 16.611 ( 2.053 -6.013 1.829) 6.612 16.759 ( 0.411 2.802 -2.373) 3.695 16.936 ( -2.152 -1.906 -0.164) 2.879 16.943 ( -5.068 0.244 0.095) 5.074 16.987 ( -2.183 0.007 2.337) 3.198 17.108 ( 1.572 -0.898 -1.226) 2.186 17.152 ( -1.110 -1.660 2.372) 3.100 19.890 ( 4.665 5.114 1.453) 7.073 19.946 ( 3.046 5.728 -1.537) 6.667 21.184 ( -2.315 -1.553 -2.513) 3.753 21.265 ( -5.720 -1.463 2.676) 6.483 22.958 ( 1.072 -5.570 -8.501) 10.220 22.977 ( -4.557 -5.067 8.754) 11.094 27.868 ( 0.047 -0.053 2.611) 2.611 27.948 ( -2.330 3.158 -2.943) 4.906 29.513 ( 3.089 0.534 0.165) 3.139 29.614 ( -0.265 -0.145 0.004) 0.302 29.834 ( 3.029 3.663 -0.926) 4.843 29.963 ( -2.205 2.774 0.612) 3.596 31.007 ( 2.832 0.629 1.544) 3.286 31.071 ( 1.123 1.231 -1.991) 2.596 31.340 ( 3.229 -6.828 -2.418) 7.930 31.545 ( -6.675 -7.187 3.053) 10.273 31.732 ( 1.319 1.667 0.694) 2.236 31.822 ( -2.900 -1.448 -1.886) 3.750 31.984 ( 2.395 -0.438 7.053) 7.461 32.122 ( 0.482 -2.371 -6.487) 6.923 32.450 ( 3.034 1.031 0.779) 3.298 32.523 ( 2.146 3.000 1.566) 4.007 32.725 ( 4.446 3.886 -2.259) 6.322 32.958 ( -5.248 2.052 2.511) 6.169 34.538 ( 3.259 -8.578 -3.215) 9.723 34.568 ( -1.827 -8.036 4.662) 9.468 34.857 ( -1.425 1.105 -3.175) 3.651 35.058 ( -12.712 0.070 0.255) 12.715 36.026 ( 6.423 12.779 -4.185) 14.902 36.043 ( 2.969 5.981 4.538) 8.074 36.457 ( 14.451 6.541 -1.293) 15.915 37.062 ( -14.166 3.558 0.207) 14.607 ======================= Grid point 190 (88/95) ======================= q-point: (-0.33 0.22 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.893 ( -2.948 8.099 3.741) 9.396 1.931 ( -2.974 9.132 -6.145) 11.402 2.303 ( 7.976 -3.636 -3.334) 9.378 2.379 ( 1.390 -0.892 0.103) 1.655 2.551 ( 6.127 10.195 0.179) 11.896 2.635 ( -1.994 11.532 7.929) 14.136 2.866 ( 5.716 -9.224 3.121) 11.291 3.015 ( -4.519 -2.484 -4.717) 6.989 3.184 ( 2.486 -6.524 3.723) 7.912 3.269 ( -2.062 -6.211 -4.811) 8.122 3.423 ( 5.473 4.502 -4.850) 8.587 3.457 ( -2.624 6.920 8.417) 11.208 3.651 ( 3.432 3.328 -3.524) 5.939 3.744 ( -7.100 1.038 1.757) 7.387 3.816 ( 0.989 -2.749 -3.734) 4.741 3.832 ( -1.450 0.057 4.055) 4.307 4.030 ( -5.349 0.405 2.287) 5.831 4.108 ( -8.904 -0.118 -5.593) 10.516 4.414 ( 2.782 2.383 3.110) 4.805 4.499 ( -4.200 3.413 -2.495) 5.959 4.548 ( 1.276 0.236 1.020) 1.650 4.580 ( -0.228 -0.516 -3.847) 3.889 4.749 ( 2.610 0.879 -1.623) 3.197 4.785 ( -2.654 -0.234 3.472) 4.376 4.884 ( 2.273 -0.597 4.049) 4.681 4.945 ( -1.432 0.335 -3.086) 3.419 5.239 ( 9.680 6.396 -3.205) 12.037 5.367 ( -3.286 2.779 1.971) 4.733 5.457 ( 9.818 -5.110 3.582) 11.633 5.630 ( -6.325 -2.904 -2.427) 7.371 5.813 ( 2.724 -3.698 2.687) 5.321 5.859 ( 5.358 -4.035 0.843) 6.760 5.982 ( 1.971 -4.072 -2.871) 5.358 6.169 ( -13.147 -7.355 -0.047) 15.065 7.263 ( 2.986 -0.432 1.861) 3.545 7.337 ( -3.729 -0.364 -1.167) 3.925 7.644 ( 4.947 -2.086 -3.719) 6.531 7.690 ( -2.061 1.144 3.560) 4.269 7.811 ( 4.463 1.344 1.740) 4.975 7.911 ( -4.146 -2.811 -1.497) 5.227 8.388 ( -0.251 -6.374 -0.840) 6.435 8.411 ( -2.335 -6.372 0.020) 6.786 8.643 ( 4.037 2.839 0.039) 4.935 8.719 ( -2.949 2.131 0.347) 3.655 8.840 ( -1.206 5.708 0.964) 5.913 8.882 ( -3.846 5.509 -1.444) 6.872 9.175 ( 4.131 -4.458 2.320) 6.506 9.262 ( -2.855 -4.169 -3.086) 5.921 9.824 ( 4.596 -5.013 2.540) 7.260 9.931 ( -4.549 -4.334 -2.346) 6.707 10.237 ( 6.243 0.125 3.633) 7.224 10.363 ( -4.695 -0.485 -2.927) 5.554 10.912 ( 1.255 2.711 -1.120) 3.190 10.922 ( -0.178 0.338 1.533) 1.580 11.297 ( 5.748 6.815 -0.711) 8.944 11.415 ( -6.126 5.896 0.728) 8.533 11.833 ( 1.942 -2.704 1.466) 3.637 11.895 ( -2.779 -2.195 -1.575) 3.876 12.659 ( 6.945 0.726 -2.197) 7.320 12.764 ( -3.692 -0.085 2.807) 4.639 12.982 ( -1.931 -3.973 0.160) 4.420 13.022 ( -3.888 -3.273 -1.184) 5.218 13.619 ( 2.568 -0.231 -0.304) 2.596 13.675 ( -2.935 0.282 -0.035) 2.949 13.989 ( 5.602 1.278 2.518) 6.273 14.079 ( -1.145 0.988 -2.848) 3.224 14.714 ( 8.405 2.666 -0.169) 8.819 14.826 ( 1.128 1.616 1.251) 2.334 14.869 ( 3.070 0.598 5.741) 6.538 14.982 ( 0.343 3.985 -6.038) 7.243 15.405 ( -4.262 10.433 0.484) 11.280 15.460 ( -7.317 9.211 -0.586) 11.779 15.636 ( 5.803 6.882 0.371) 9.009 15.743 ( -4.801 6.559 -0.237) 8.132 16.621 ( 3.190 -1.944 2.624) 4.565 16.692 ( -2.167 -0.701 -3.223) 3.946 16.741 ( 5.762 -0.993 -0.396) 5.860 16.859 ( -6.924 0.354 0.161) 6.935 16.957 ( 0.150 0.059 0.489) 0.514 16.974 ( -1.533 0.325 0.200) 1.579 17.146 ( 1.914 -1.909 -0.941) 2.862 17.174 ( -1.403 -1.809 1.101) 2.540 19.831 ( 2.304 5.625 0.101) 6.079 19.861 ( -0.727 5.289 -0.144) 5.341 21.229 ( 1.867 -4.450 -2.049) 5.243 21.275 ( -3.668 -4.073 2.177) 5.898 23.033 ( 2.511 -4.228 -8.443) 9.771 23.041 ( -3.338 -4.115 8.408) 9.938 27.879 ( -0.007 -0.440 1.675) 1.731 27.895 ( -0.632 0.909 -1.726) 2.051 29.543 ( 2.928 0.001 2.417) 3.796 29.606 ( -1.933 0.026 -1.607) 2.514 29.800 ( 3.813 3.589 -1.604) 5.477 29.876 ( -4.296 3.499 0.675) 5.582 31.015 ( 1.445 1.386 1.807) 2.697 31.043 ( -0.268 1.795 -1.828) 2.576 31.484 ( 5.440 -5.976 -2.167) 8.367 31.594 ( -6.830 -5.558 2.811) 9.243 31.723 ( 3.801 2.572 0.606) 4.629 31.797 ( -3.135 0.486 -1.347) 3.447 32.073 ( 3.882 -3.672 6.436) 8.365 32.159 ( -0.215 -3.956 -7.434) 8.424 32.435 ( 1.376 3.299 0.503) 3.610 32.466 ( -1.416 4.204 0.893) 4.525 32.702 ( 6.548 4.769 -0.714) 8.133 32.848 ( -8.185 3.896 0.855) 9.105 34.680 ( 2.008 -2.690 5.078) 6.087 34.733 ( 2.938 -11.156 -0.316) 11.540 34.822 ( 1.391 1.939 -10.745) 11.007 34.951 ( -12.759 -3.307 5.918) 14.448 35.884 ( 6.542 9.024 -0.396) 11.152 35.974 ( -2.839 5.005 0.836) 5.814 36.532 ( 18.896 2.455 -0.619) 19.064 36.882 ( -17.061 0.095 0.081) 17.062 ======================= Grid point 191 (89/95) ======================= q-point: (-0.22 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 86 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.707 ( 0.503 12.633 -9.614) 15.883 1.707 ( -0.503 12.633 9.614) 15.883 2.287 ( 1.351 13.646 -5.030) 14.606 2.287 ( -1.351 13.646 5.030) 14.606 2.487 ( 7.794 1.080 -13.566) 15.683 2.487 ( -7.794 1.080 13.566) 15.683 3.028 ( 1.784 -2.830 -3.775) 5.044 3.028 ( -1.784 -2.830 3.775) 5.044 3.228 ( 0.059 7.293 -9.362) 11.867 3.228 ( -0.059 7.293 9.362) 11.867 3.417 ( 1.261 -1.966 -8.017) 8.350 3.417 ( -1.261 -1.966 8.017) 8.350 3.575 ( 1.002 5.270 -4.086) 6.744 3.575 ( -1.002 5.270 4.086) 6.744 3.902 ( 1.998 -4.482 -7.643) 9.083 3.902 ( -1.998 -4.482 7.643) 9.083 4.057 ( -0.821 -2.130 -7.031) 7.392 4.057 ( 0.821 -2.130 7.031) 7.392 4.365 ( 2.816 5.953 -3.031) 7.250 4.365 ( -2.816 5.953 3.031) 7.250 4.593 ( 0.468 -2.446 -3.758) 4.508 4.593 ( -0.468 -2.446 3.758) 4.508 4.721 ( 4.190 4.305 -4.379) 7.434 4.721 ( -4.190 4.305 4.379) 7.434 4.963 ( 0.372 -4.359 -7.233) 8.453 4.963 ( -0.372 -4.359 7.233) 8.453 5.204 ( -5.877 7.911 -1.953) 10.047 5.204 ( 5.877 7.911 1.953) 10.047 5.595 ( -4.000 -1.696 -10.140) 11.032 5.595 ( 4.000 -1.696 10.140) 11.032 5.940 ( -0.584 -4.408 -3.332) 5.556 5.940 ( 0.584 -4.408 3.332) 5.556 6.172 ( -7.183 -8.443 -1.899) 11.247 6.172 ( 7.183 -8.443 1.899) 11.247 7.309 ( -2.380 -0.601 -4.095) 4.774 7.309 ( 2.380 -0.601 4.095) 4.774 7.625 ( 1.309 3.559 -3.241) 4.989 7.625 ( -1.309 3.559 3.241) 4.989 7.949 ( -6.942 -6.743 -1.469) 9.789 7.949 ( 6.942 -6.743 1.469) 9.789 8.499 ( -0.376 -6.004 -1.965) 6.329 8.499 ( 0.376 -6.004 1.965) 6.329 8.662 ( -4.830 -0.377 -0.705) 4.896 8.662 ( 4.830 -0.377 0.705) 4.896 8.769 ( -0.833 3.450 -3.553) 5.021 8.769 ( 0.833 3.450 3.553) 5.021 9.308 ( -1.212 -5.633 -5.154) 7.730 9.308 ( 1.212 -5.633 5.154) 7.730 9.956 ( -3.353 -4.354 -1.627) 5.732 9.956 ( 3.353 -4.354 1.627) 5.732 10.314 ( -2.809 -0.579 -4.266) 5.140 10.314 ( 2.809 -0.579 4.266) 5.140 10.889 ( 2.536 1.937 -3.869) 5.016 10.889 ( -2.536 1.937 3.870) 5.016 11.242 ( -7.695 6.650 0.343) 10.176 11.242 ( 7.695 6.650 -0.343) 10.176 11.917 ( -2.366 -3.936 -1.299) 4.773 11.917 ( 2.366 -3.936 1.299) 4.773 12.723 ( -7.230 -1.232 2.015) 7.606 12.723 ( 7.230 -1.232 -2.015) 7.606 13.063 ( 0.341 -5.067 -5.214) 7.278 13.063 ( -0.341 -5.067 5.214) 7.278 13.641 ( -2.633 0.760 -1.065) 2.940 13.641 ( 2.633 0.760 1.065) 2.940 14.025 ( -2.428 1.413 -4.967) 5.706 14.025 ( 2.428 1.413 4.967) 5.706 14.741 ( -5.340 6.106 -2.784) 8.576 14.741 ( 5.340 6.106 2.784) 8.576 14.910 ( -1.567 -0.634 -4.777) 5.067 14.910 ( 1.567 -0.634 4.777) 5.067 15.220 ( -4.812 10.551 -3.787) 12.199 15.220 ( 4.812 10.551 3.787) 12.199 15.578 ( -5.983 6.616 0.385) 8.928 15.578 ( 5.983 6.616 -0.385) 8.928 16.656 ( 0.084 1.249 -6.355) 6.477 16.656 ( -0.084 1.249 6.355) 6.477 16.813 ( -3.558 -0.809 0.016) 3.648 16.813 ( 3.558 -0.809 -0.016) 3.648 16.956 ( -0.393 0.009 -3.053) 3.078 16.956 ( 0.393 0.009 3.053) 3.078 17.193 ( 0.907 -1.851 -1.246) 2.409 17.193 ( -0.907 -1.851 1.246) 2.409 19.766 ( 1.265 4.390 -4.496) 6.410 19.766 ( -1.265 4.390 4.496) 6.410 21.331 ( 1.785 -5.228 -2.939) 6.258 21.331 ( -1.785 -5.228 2.939) 6.258 23.094 ( 2.721 -2.703 -7.560) 8.477 23.094 ( -2.721 -2.703 7.560) 8.477 27.894 ( 1.880 -1.240 -2.853) 3.635 27.894 ( -1.880 -1.240 2.853) 3.635 29.564 ( -1.349 1.661 -4.599) 5.072 29.564 ( 1.349 1.661 4.599) 5.072 29.792 ( -1.067 1.314 -1.676) 2.382 29.792 ( 1.067 1.314 1.676) 2.382 31.000 ( 0.203 2.218 -2.000) 2.993 31.000 ( -0.203 2.218 2.000) 2.993 31.618 ( -1.771 -4.138 -4.380) 6.280 31.618 ( 1.771 -4.138 4.380) 6.280 31.729 ( -3.877 2.585 -5.343) 7.090 31.729 ( 3.877 2.585 5.343) 7.090 32.189 ( -3.281 -3.326 -5.176) 6.972 32.189 ( 3.281 -3.326 5.176) 6.972 32.382 ( 0.505 4.107 -1.013) 4.260 32.382 ( -0.505 4.107 1.013) 4.260 32.687 ( -2.505 5.514 -4.135) 7.333 32.687 ( 2.505 5.514 4.135) 7.333 34.693 ( -1.164 5.843 -11.292) 12.767 34.693 ( 1.164 5.843 11.292) 12.767 35.003 ( 0.024 -12.231 -7.170) 14.178 35.003 ( -0.024 -12.231 7.170) 14.178 35.848 ( -0.908 3.426 -5.070) 6.186 35.848 ( 0.908 3.426 5.070) 6.186 36.741 ( -20.444 -4.863 -0.415) 21.018 36.741 ( 20.444 -4.863 0.415) 21.018 ======================= Grid point 197 (90/95) ======================= q-point: ( 0.33 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 95 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.467 ( 11.730 0.000 -13.979) 18.249 1.653 ( 0.134 0.000 18.329) 18.329 1.995 ( 3.445 0.000 1.324) 3.691 2.314 ( 21.120 0.000 -1.307) 21.161 2.499 ( 2.942 0.000 -27.013) 27.173 2.861 ( -2.599 -0.000 1.940) 3.243 2.943 ( -2.525 -0.000 2.628) 3.644 2.973 ( -5.748 -0.000 14.536) 15.632 3.155 ( 0.423 0.000 12.126) 12.133 3.348 ( 4.113 0.000 -10.550) 11.324 3.370 ( 6.054 0.000 -8.631) 10.543 3.438 ( 9.148 0.000 -1.883) 9.340 3.517 ( 2.791 0.000 -6.510) 7.083 3.681 ( 2.752 0.000 5.328) 5.997 3.694 ( -1.600 -0.000 9.240) 9.378 3.967 ( 4.102 0.000 -5.518) 6.876 4.082 ( 7.279 0.000 8.639) 11.296 4.100 ( -5.633 -0.000 -9.400) 10.958 4.185 ( 2.828 0.000 -1.790) 3.347 4.286 ( -14.877 -0.000 14.779) 20.970 4.519 ( 8.163 0.000 3.201) 8.768 4.648 ( 9.573 0.000 -0.727) 9.601 4.706 ( 0.820 0.000 6.659) 6.709 4.716 ( 0.734 0.000 -8.448) 8.480 4.941 ( 5.645 0.000 -9.019) 10.640 4.958 ( 6.558 0.000 2.402) 6.984 5.291 ( -6.378 -0.000 8.941) 10.982 5.418 ( 5.696 0.000 -0.156) 5.698 5.588 ( -1.435 -0.000 -4.866) 5.073 5.612 ( -2.712 -0.000 0.949) 2.873 5.670 ( -1.691 -0.000 1.987) 2.609 5.716 ( 0.675 0.000 -2.628) 2.714 5.938 ( -14.121 -0.000 2.234) 14.297 5.955 ( -10.466 -0.000 -1.916) 10.640 7.135 ( -3.503 -0.000 12.533) 13.013 7.427 ( -5.744 -0.000 -9.451) 11.060 7.670 ( -0.450 -0.000 3.776) 3.803 7.731 ( -0.152 -0.000 -5.339) 5.342 7.885 ( -4.691 -0.000 -2.882) 5.505 7.967 ( -9.247 -0.000 -4.757) 10.399 8.207 ( -0.131 -0.000 -0.177) 0.220 8.273 ( -1.785 -0.000 2.514) 3.083 8.706 ( 1.533 0.000 2.903) 3.283 8.856 ( 3.315 0.000 -3.110) 4.545 8.965 ( 2.674 0.000 1.703) 3.170 9.029 ( 5.424 0.000 -5.893) 8.009 9.376 ( -8.907 -0.000 4.533) 9.995 9.385 ( -4.826 -0.000 -2.843) 5.601 9.688 ( -5.245 -0.000 1.261) 5.395 9.863 ( -8.835 -0.000 -3.643) 9.557 10.311 ( -1.314 -0.000 11.134) 11.211 10.406 ( 3.708 0.000 -7.548) 8.410 10.833 ( 3.428 0.000 0.065) 3.428 10.883 ( 1.923 0.000 -1.454) 2.410 11.333 ( 10.475 0.000 -0.132) 10.476 11.561 ( 7.890 0.000 0.578) 7.912 11.828 ( -5.609 -0.000 0.287) 5.616 11.913 ( -4.673 -0.000 -0.397) 4.689 12.770 ( 0.666 0.000 -3.918) 3.974 12.829 ( 1.105 0.000 1.437) 1.813 12.971 ( -4.416 -0.000 -1.519) 4.670 13.062 ( -10.645 -0.000 5.488) 11.976 13.516 ( 2.579 0.000 -1.189) 2.840 13.692 ( -3.387 -0.000 5.667) 6.602 13.934 ( 5.944 0.000 -1.958) 6.258 14.204 ( -0.318 -0.000 -8.486) 8.492 14.724 ( 3.705 0.000 1.485) 3.991 14.777 ( -0.451 -0.000 1.035) 1.129 14.891 ( 7.153 0.000 5.447) 8.990 15.057 ( 8.164 0.000 -2.566) 8.558 15.742 ( 14.275 0.000 -0.335) 14.279 15.842 ( -0.179 -0.000 8.018) 8.020 15.874 ( 5.206 0.000 -1.903) 5.543 15.953 ( 9.560 0.000 -6.422) 11.517 16.334 ( 2.911 0.000 -5.478) 6.203 16.433 ( -4.095 -0.000 4.020) 5.739 16.808 ( -3.059 -0.000 1.506) 3.410 16.838 ( -0.180 -0.000 1.328) 1.340 16.903 ( 0.189 0.000 -5.386) 5.390 17.049 ( 0.437 0.000 3.461) 3.488 17.092 ( 0.720 0.000 0.172) 0.741 17.153 ( -8.930 -0.000 5.397) 10.434 19.951 ( 9.186 0.000 2.910) 9.636 20.153 ( 9.661 0.000 -1.851) 9.837 21.256 ( -8.760 -0.000 -2.576) 9.131 21.348 ( -8.375 -0.000 2.377) 8.706 22.754 ( -1.740 -0.000 -6.995) 7.208 22.806 ( -6.532 -0.000 8.077) 10.388 27.864 ( -0.924 -0.000 5.799) 5.872 28.184 ( -10.753 -0.000 -6.243) 12.434 29.562 ( 4.971 0.000 -0.980) 5.067 29.771 ( -2.753 -0.000 0.418) 2.784 29.832 ( 3.539 0.000 1.396) 3.805 29.961 ( 1.717 0.000 0.361) 1.755 30.981 ( 6.021 0.000 1.193) 6.138 31.105 ( -0.597 -0.000 2.986) 3.045 31.114 ( 0.869 0.000 -2.693) 2.830 31.195 ( 1.818 0.000 -1.740) 2.516 31.770 ( -6.097 -0.000 4.825) 7.776 31.810 ( -5.061 -0.000 -3.624) 6.225 32.067 ( 0.473 0.000 2.876) 2.915 32.076 ( 3.490 0.000 -2.789) 4.467 32.377 ( 5.289 0.000 -0.184) 5.292 32.522 ( 9.084 0.000 1.540) 9.214 32.844 ( 2.991 0.000 -9.642) 10.095 32.955 ( 2.450 0.000 11.945) 12.194 34.297 ( 0.287 0.000 1.089) 1.126 34.333 ( -1.376 -0.000 0.060) 1.378 35.031 ( -6.735 -0.000 -13.956) 15.496 35.043 ( -9.922 -0.000 8.523) 13.080 36.099 ( 10.681 0.000 -0.948) 10.723 36.342 ( 8.389 0.000 9.548) 12.710 36.926 ( -0.995 -0.000 -17.953) 17.981 37.260 ( -13.062 -0.000 6.038) 14.390 ======================= Grid point 198 (91/95) ======================= q-point: ( 0.44 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.610 ( 10.982 -7.952 -11.123) 17.537 1.763 ( -2.882 -7.841 15.220) 17.362 2.041 ( 6.274 -0.698 -0.864) 6.372 2.395 ( -6.008 1.167 1.388) 6.275 2.558 ( 17.892 -5.883 -20.027) 27.492 2.764 ( 2.414 8.263 -1.959) 8.829 2.865 ( -6.009 1.304 13.058) 14.433 3.019 ( -6.640 -2.330 2.799) 7.573 3.189 ( 0.698 0.840 11.304) 11.356 3.334 ( 2.250 1.312 -11.625) 11.913 3.391 ( 6.636 1.294 -5.121) 8.482 3.503 ( 6.159 2.975 -1.881) 7.094 3.522 ( 3.039 -1.455 -5.636) 6.566 3.641 ( -7.974 -1.627 0.549) 8.157 3.843 ( 3.728 -4.600 12.484) 13.817 4.006 ( 3.087 -1.605 -12.487) 12.963 4.038 ( -3.849 -3.280 2.317) 5.563 4.142 ( -9.414 -0.396 12.316) 15.507 4.248 ( 2.650 -3.196 1.692) 4.483 4.287 ( 9.311 -3.184 3.937) 10.599 4.513 ( 0.694 4.076 -0.193) 4.139 4.645 ( 1.274 2.223 -6.037) 6.559 4.777 ( 5.809 -4.034 -2.140) 7.389 4.799 ( 2.761 -3.733 1.046) 4.759 4.941 ( 2.510 4.492 -2.228) 5.607 4.968 ( 4.891 4.276 0.517) 6.517 5.219 ( -1.790 3.073 4.968) 6.109 5.470 ( -2.144 5.477 -6.158) 8.515 5.517 ( 4.450 -4.349 3.547) 7.162 5.577 ( 0.547 5.528 1.929) 5.880 5.643 ( -8.330 -2.473 0.916) 8.738 5.724 ( -2.073 0.549 -3.313) 3.947 5.871 ( -1.535 -5.400 2.675) 6.218 5.976 ( -9.347 -7.649 -0.989) 12.118 7.160 ( -1.743 -2.023 12.549) 12.830 7.367 ( -4.309 -2.751 -11.114) 12.233 7.582 ( -1.734 7.399 4.641) 8.904 7.658 ( -2.446 4.282 -5.079) 7.079 7.918 ( -0.763 -5.540 -5.373) 7.755 7.958 ( -6.223 -7.394 0.231) 9.667 8.204 ( 1.050 1.300 -0.343) 1.706 8.247 ( -1.298 2.216 1.654) 3.055 8.724 ( 2.658 1.346 3.474) 4.576 8.848 ( -0.404 1.332 -2.391) 2.767 8.997 ( 4.609 1.373 1.451) 5.024 9.074 ( 6.138 -0.434 -4.938) 7.889 9.255 ( -7.037 5.064 1.553) 8.807 9.328 ( -5.738 1.353 -0.349) 5.905 9.644 ( -3.104 0.122 3.053) 4.355 9.802 ( -7.723 -3.270 -5.028) 9.779 10.302 ( 0.121 3.024 9.271) 9.753 10.415 ( 0.571 -0.127 -6.737) 6.762 10.870 ( 2.680 -0.608 2.122) 3.472 10.911 ( 1.879 -1.604 -2.592) 3.581 11.426 ( 10.105 1.018 0.426) 10.165 11.624 ( 5.579 1.057 0.582) 5.708 11.776 ( -4.995 -0.272 0.014) 5.003 11.867 ( -4.724 -0.111 -0.630) 4.767 12.740 ( 3.249 3.131 -3.975) 6.013 12.828 ( 1.291 1.917 0.955) 2.501 12.952 ( -3.482 -1.825 -0.248) 3.939 12.975 ( -10.449 0.057 4.175) 11.253 13.548 ( 3.415 -0.813 -1.625) 3.868 13.681 ( -4.461 -1.192 4.975) 6.788 13.986 ( 6.103 0.379 -1.205) 6.233 14.159 ( -0.561 1.767 -6.292) 6.560 14.735 ( -0.638 0.434 3.011) 3.108 14.772 ( -1.682 -0.799 0.082) 1.864 14.967 ( 10.448 2.911 3.747) 11.475 15.117 ( 6.534 0.907 -2.973) 7.235 15.810 ( -0.276 4.027 2.216) 4.605 15.844 ( 3.367 5.004 -2.267) 6.443 15.847 ( 6.421 3.004 1.854) 7.328 15.985 ( 5.345 2.450 -2.430) 6.362 16.400 ( 4.883 -4.555 -5.745) 8.809 16.439 ( -2.387 -3.036 3.941) 5.518 16.809 ( -0.887 -1.457 0.584) 1.803 16.833 ( -1.521 -0.691 1.033) 1.964 16.905 ( 0.357 -1.286 -4.485) 4.679 17.030 ( -5.436 1.126 1.639) 5.788 17.099 ( 0.644 0.100 -0.007) 0.652 17.114 ( -1.754 -0.652 5.246) 5.570 20.027 ( 8.732 2.496 2.807) 9.505 20.169 ( 6.108 5.826 -2.335) 8.758 21.174 ( -5.552 0.283 -3.238) 6.433 21.265 ( -8.882 0.806 3.136) 9.454 22.766 ( 0.471 -4.394 -7.670) 8.852 22.806 ( -5.660 -3.901 8.442) 10.886 27.875 ( 0.134 0.184 5.201) 5.206 28.057 ( -6.946 2.359 -6.020) 9.489 29.574 ( 3.796 2.625 -0.607) 4.655 29.688 ( -1.468 4.479 0.526) 4.743 29.896 ( 3.102 -1.062 -0.087) 3.280 29.984 ( -0.316 -1.123 0.956) 1.508 31.036 ( 5.824 0.952 0.502) 5.923 31.099 ( 1.900 0.851 -2.232) 3.053 31.143 ( 0.463 -3.914 1.479) 4.210 31.270 ( -2.504 -7.027 0.034) 7.460 31.744 ( -4.588 -1.758 2.973) 5.743 31.756 ( -3.359 0.035 -2.166) 3.997 32.048 ( 1.523 2.697 2.401) 3.919 32.099 ( 0.638 0.050 -2.578) 2.656 32.445 ( 6.378 -0.866 0.781) 6.484 32.591 ( 5.130 0.985 1.431) 5.416 32.826 ( 3.661 1.935 -7.210) 8.315 32.986 ( -3.178 -0.114 7.886) 8.503 34.331 ( 0.590 -3.352 0.460) 3.435 34.352 ( -1.062 -3.601 0.382) 3.773 34.921 ( -2.507 2.170 -5.216) 6.180 35.010 ( -8.860 -2.374 1.591) 9.309 36.176 ( 10.476 2.697 -1.357) 10.903 36.385 ( 1.206 4.660 8.331) 9.621 36.781 ( 7.327 10.875 -12.270) 17.958 37.162 ( -13.547 0.465 3.537) 14.009 ======================= Grid point 199 (92/95) ======================= q-point: ( 0.56 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 163 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.835 ( 7.517 -10.186 -8.208) 15.087 1.911 ( -5.306 -9.568 9.245) 14.324 2.149 ( 8.519 -3.624 -0.563) 9.274 2.321 ( -7.212 -0.994 -1.538) 7.440 2.659 ( 7.645 4.687 5.744) 10.649 2.786 ( 6.751 -4.713 -16.005) 17.998 2.843 ( 1.192 1.488 6.633) 6.901 2.952 ( -9.368 0.681 5.634) 10.953 3.182 ( 1.566 4.465 7.455) 8.830 3.248 ( -0.027 6.365 -8.970) 10.999 3.452 ( 5.889 -3.039 -3.954) 7.717 3.523 ( 4.848 0.079 -0.552) 4.880 3.553 ( -1.955 -3.262 -3.043) 4.871 3.595 ( -6.946 -1.334 2.511) 7.505 3.924 ( 3.183 -0.306 4.765) 5.739 4.020 ( 3.115 4.145 0.852) 5.255 4.068 ( -7.275 -1.101 -2.299) 7.708 4.100 ( -5.053 -1.664 1.658) 5.573 4.328 ( 0.715 -4.785 3.113) 5.754 4.368 ( 0.506 -2.876 -2.352) 3.750 4.539 ( 1.688 -1.334 5.726) 6.116 4.600 ( -0.537 1.341 -7.421) 7.560 4.817 ( 1.412 1.455 3.891) 4.387 4.853 ( 0.691 2.402 2.163) 3.305 4.908 ( 6.308 0.465 -3.687) 7.321 4.960 ( 0.837 0.155 -2.177) 2.338 5.246 ( 6.759 -2.163 2.859) 7.651 5.361 ( -1.949 2.518 -0.741) 3.269 5.478 ( 1.120 4.814 0.539) 4.972 5.565 ( -7.248 -0.083 -2.427) 7.644 5.679 ( 5.025 -4.970 1.595) 7.246 5.745 ( -2.125 -3.964 -0.787) 4.566 5.929 ( -1.208 -1.993 2.374) 3.327 5.991 ( -7.556 -3.966 -1.814) 8.725 7.242 ( 2.619 -2.724 8.653) 9.442 7.354 ( -3.679 -1.717 -7.406) 8.446 7.502 ( 1.931 1.371 1.976) 3.085 7.575 ( -4.255 -0.775 -2.150) 4.830 7.971 ( 2.701 -0.042 -4.645) 5.374 8.005 ( -3.222 -0.491 3.108) 4.503 8.201 ( -1.611 -2.551 1.251) 3.266 8.209 ( -1.438 -1.185 -2.089) 2.800 8.732 ( 3.518 2.164 1.937) 4.562 8.801 ( -2.534 2.052 -0.853) 3.371 9.003 ( 3.965 3.312 -0.044) 5.166 9.097 ( -6.453 4.622 1.453) 8.070 9.125 ( 6.732 2.046 -2.874) 7.601 9.237 ( -5.683 2.415 0.006) 6.175 9.674 ( 1.642 -3.268 5.394) 6.517 9.785 ( -5.867 -4.262 -6.353) 9.641 10.288 ( 2.414 2.663 7.534) 8.348 10.376 ( -2.421 1.171 -6.248) 6.802 10.913 ( 1.482 -0.929 3.988) 4.354 10.941 ( 1.029 -1.045 -3.898) 4.165 11.480 ( 8.646 3.594 0.093) 9.364 11.598 ( -2.092 4.561 0.900) 5.098 11.767 ( 0.049 -1.714 0.282) 1.738 11.832 ( -4.585 -1.340 -0.973) 4.875 12.725 ( 6.591 2.729 -4.084) 8.220 12.812 ( -0.276 2.402 4.299) 4.932 12.899 ( -5.387 -0.935 0.321) 5.477 12.945 ( -4.849 -1.686 -0.358) 5.146 13.594 ( 3.976 -0.995 -1.774) 4.466 13.667 ( -4.830 -0.909 3.136) 5.830 14.027 ( 5.383 0.957 0.124) 5.468 14.110 ( -1.825 1.228 -3.253) 3.927 14.736 ( 1.128 -0.009 1.035) 1.531 14.772 ( -2.613 -1.391 1.141) 3.173 15.013 ( 9.217 4.049 3.461) 10.646 15.115 ( 1.370 2.956 -3.901) 5.083 15.718 ( -1.152 6.469 0.061) 6.571 15.721 ( -1.362 7.625 -0.029) 7.746 15.858 ( 7.293 5.967 1.231) 9.503 15.944 ( -0.425 4.998 -1.704) 5.298 16.500 ( 2.825 -4.525 -3.183) 6.212 16.519 ( -0.269 -6.234 2.504) 6.723 16.805 ( 1.644 1.590 -0.921) 2.466 16.858 ( -3.579 -2.389 0.451) 4.326 16.917 ( 0.599 -1.073 -1.496) 1.936 16.964 ( -4.469 0.081 1.734) 4.794 17.113 ( 2.038 -0.332 -2.256) 3.058 17.128 ( -1.416 -0.833 3.937) 4.266 20.034 ( 5.006 5.725 2.881) 8.132 20.084 ( 2.022 7.613 -2.796) 8.359 21.139 ( -0.243 -0.904 -3.391) 3.517 21.192 ( -6.988 -0.630 3.395) 7.795 22.848 ( 2.349 -6.199 -8.662) 10.908 22.866 ( -4.621 -5.811 8.937) 11.619 27.888 ( 1.136 0.593 3.919) 4.123 27.954 ( -3.511 2.117 -4.283) 5.929 29.564 ( 3.375 2.013 -0.023) 3.930 29.619 ( -1.982 2.061 0.114) 2.861 29.917 ( 3.859 2.065 -1.220) 4.543 29.976 ( -2.722 1.183 1.299) 3.240 31.058 ( 3.100 1.447 1.008) 3.567 31.092 ( 0.237 1.099 -1.553) 1.917 31.257 ( 4.537 -6.717 -1.499) 8.243 31.356 ( -6.235 -7.881 2.101) 10.267 31.743 ( -0.599 -1.009 0.286) 1.208 31.757 ( -2.006 -2.679 -0.397) 3.370 32.034 ( 1.570 1.595 5.171) 5.634 32.083 ( -0.416 0.076 -5.188) 5.205 32.508 ( 5.334 0.768 0.806) 5.449 32.583 ( -0.996 2.417 0.669) 2.698 32.823 ( 6.739 2.509 -3.841) 8.152 32.942 ( -6.671 1.680 3.966) 7.941 34.422 ( 1.220 -6.703 -1.599) 6.998 34.432 ( -1.224 -6.867 2.100) 7.285 34.878 ( 1.895 1.417 -3.640) 4.341 34.958 ( -8.190 -0.382 1.998) 8.439 36.184 ( 6.675 6.148 -1.445) 9.189 36.256 ( -2.109 10.390 2.875) 10.985 36.713 ( 14.891 7.669 -3.720) 17.158 36.990 ( -15.341 4.359 1.654) 16.034 ======================= Grid point 200 (93/95) ======================= q-point: ( 0.67 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 86 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.977 ( 1.956 -0.656 -7.883) 8.149 1.977 ( -1.956 -0.656 7.883) 8.149 2.296 ( -0.918 -4.399 -7.776) 8.981 2.296 ( 0.918 -4.399 7.776) 8.981 2.730 ( -7.130 2.032 -7.278) 10.389 2.730 ( 7.130 2.032 7.278) 10.389 2.881 ( -3.765 0.681 -5.373) 6.596 2.881 ( 3.765 0.681 5.373) 6.596 3.160 ( -1.405 -0.467 -3.682) 3.969 3.160 ( 1.405 -0.467 3.682) 3.969 3.523 ( 3.624 2.018 -5.138) 6.603 3.523 ( -3.624 2.018 5.138) 6.603 3.616 ( 3.888 -6.323 -7.851) 10.805 3.616 ( -3.888 -6.323 7.851) 10.805 3.922 ( -1.854 7.683 -1.663) 8.077 3.922 ( 1.854 7.683 1.663) 8.077 4.027 ( -3.029 0.481 -4.786) 5.684 4.027 ( 3.029 0.481 4.786) 5.684 4.444 ( -1.160 -4.293 -6.754) 8.086 4.444 ( 1.160 -4.293 6.754) 8.086 4.560 ( 0.626 -0.623 -7.411) 7.463 4.560 ( -0.626 -0.623 7.411) 7.463 4.796 ( 0.682 3.819 -6.484) 7.556 4.796 ( -0.682 3.819 6.484) 7.556 4.936 ( -1.783 0.989 -3.339) 3.913 4.936 ( 1.783 0.989 3.339) 3.913 5.350 ( 4.894 -0.811 -4.953) 7.010 5.350 ( -4.894 -0.811 4.953) 7.010 5.497 ( -9.325 -2.123 -2.635) 9.920 5.497 ( 9.325 -2.123 2.635) 9.920 5.788 ( 1.343 -3.768 -1.045) 4.134 5.788 ( -1.343 -3.768 1.045) 4.134 5.974 ( -4.392 -2.828 -1.765) 5.514 5.974 ( 4.392 -2.828 1.765) 5.514 7.303 ( -3.193 0.706 -2.294) 3.995 7.303 ( 3.193 0.706 2.294) 3.995 7.600 ( 1.760 -6.465 -2.943) 7.318 7.600 ( -1.760 -6.465 2.943) 7.318 7.923 ( 0.302 6.133 -0.864) 6.201 7.923 ( -0.302 6.133 0.864) 6.201 8.278 ( 1.406 -6.834 -1.312) 7.099 8.278 ( -1.406 -6.834 1.312) 7.099 8.729 ( 0.220 2.721 -4.505) 5.268 8.729 ( -0.220 2.721 4.505) 5.268 8.954 ( -1.495 6.300 -1.278) 6.600 8.954 ( 1.495 6.300 1.278) 6.600 9.172 ( -0.627 -1.177 -6.865) 6.994 9.172 ( 0.627 -1.177 6.865) 6.994 9.795 ( -3.734 -4.939 -6.561) 9.022 9.795 ( 3.734 -4.939 6.561) 9.022 10.309 ( -2.456 0.879 -7.716) 8.145 10.309 ( 2.456 0.879 7.716) 8.145 10.938 ( 0.941 0.427 -5.886) 5.976 10.938 ( -0.941 0.427 5.886) 5.976 11.465 ( -5.900 6.234 0.525) 8.600 11.465 ( 5.900 6.234 -0.525) 8.600 11.821 ( -3.016 -2.216 -1.724) 4.120 11.821 ( 3.016 -2.216 1.724) 4.120 12.743 ( 7.176 2.012 -4.328) 8.619 12.743 ( -7.176 2.012 4.328) 8.619 12.932 ( 0.437 -2.639 -2.959) 3.989 12.932 ( -0.437 -2.639 2.959) 3.989 13.641 ( 0.540 -0.519 -0.451) 0.874 13.641 ( -0.540 -0.519 0.451) 0.874 14.059 ( -4.027 0.867 -1.884) 4.530 14.059 ( 4.027 0.867 1.884) 4.530 14.770 ( 1.704 -1.300 -5.145) 5.574 14.770 ( -1.704 -1.300 5.145) 5.574 15.021 ( -4.966 4.668 -4.354) 8.087 15.021 ( 4.966 4.668 4.354) 8.087 15.575 ( -1.431 9.449 -0.906) 9.600 15.575 ( 1.431 9.449 0.906) 9.600 15.809 ( -5.052 6.988 -1.156) 8.700 15.809 ( 5.052 6.988 1.156) 8.700 16.603 ( 0.840 -4.727 -3.956) 6.221 16.603 ( -0.840 -4.727 3.956) 6.221 16.808 ( 0.798 1.362 -5.338) 5.567 16.808 ( -0.798 1.362 5.338) 5.567 16.955 ( 1.316 -1.191 -1.085) 2.081 16.955 ( -1.316 -1.191 1.085) 2.081 17.136 ( 2.013 -1.131 -2.307) 3.264 17.136 ( -2.013 -1.131 2.307) 3.264 19.957 ( 0.669 7.016 -4.953) 8.614 19.957 ( -0.669 7.016 4.953) 8.614 21.182 ( 2.507 -3.081 -3.961) 5.610 21.182 ( -2.507 -3.081 3.961) 5.610 22.951 ( 3.396 -5.706 -9.040) 11.217 22.951 ( -3.396 -5.706 9.040) 11.217 27.896 ( -1.026 1.014 -3.019) 3.346 27.896 ( 1.026 1.014 3.019) 3.346 29.577 ( -0.886 0.290 -3.201) 3.334 29.577 ( 0.886 0.290 3.201) 3.334 29.902 ( -2.806 3.785 0.799) 4.779 29.902 ( 2.806 3.785 -0.799) 4.779 31.058 ( -1.223 1.505 -1.852) 2.682 31.058 ( 1.223 1.505 1.852) 2.682 31.426 ( 4.598 -7.278 -2.471) 8.956 31.426 ( -4.598 -7.278 2.471) 8.956 31.768 ( -1.800 -0.572 -1.386) 2.343 31.768 ( 1.800 -0.572 1.386) 2.343 32.070 ( -1.615 -2.046 -7.822) 8.245 32.070 ( 1.615 -2.046 7.822) 8.245 32.514 ( -2.728 3.293 -0.005) 4.277 32.514 ( 2.728 3.293 0.005) 4.277 32.837 ( 0.975 3.388 -7.215) 8.030 32.837 ( -0.975 3.388 7.215) 8.030 34.565 ( 1.866 -9.570 -4.372) 10.686 34.565 ( -1.866 -9.570 4.372) 10.686 34.882 ( 4.374 1.796 -11.248) 12.202 34.882 ( -4.374 1.796 11.248) 12.202 36.080 ( 2.339 9.422 -7.490) 12.261 36.080 ( -2.339 9.422 7.490) 12.261 36.760 ( -8.726 4.551 -5.459) 11.254 36.760 ( 8.726 4.551 5.459) 11.254 ======================= Grid point 208 (94/95) ======================= q-point: ( 0.44 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 95 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.621 ( 11.487 0.000 -12.608) 17.057 1.706 ( -5.457 -0.000 15.709) 16.629 2.102 ( 7.330 0.000 2.378) 7.706 2.299 ( -10.289 -0.000 -5.346) 11.595 2.625 ( 15.482 0.000 -13.433) 20.497 2.784 ( -8.153 -0.000 7.602) 11.147 2.922 ( -0.255 -0.000 -0.894) 0.930 2.932 ( -3.496 -0.000 5.462) 6.485 3.226 ( 0.433 0.000 13.456) 13.463 3.313 ( 0.602 0.000 -13.525) 13.538 3.440 ( 5.179 0.000 -5.988) 7.917 3.548 ( -8.449 -0.000 2.789) 8.898 3.555 ( 2.382 0.000 1.815) 2.995 3.564 ( 3.754 0.000 -5.848) 6.950 3.889 ( 4.885 0.000 12.049) 13.001 3.968 ( 1.279 0.000 -13.006) 13.069 4.012 ( 2.142 0.000 -6.487) 6.832 4.060 ( -12.401 -0.000 18.084) 21.928 4.289 ( 8.115 0.000 2.261) 8.424 4.364 ( 8.189 0.000 4.525) 9.356 4.537 ( -3.121 -0.000 -2.111) 3.768 4.628 ( -3.802 -0.000 -9.649) 10.371 4.793 ( 4.117 0.000 5.998) 7.275 4.823 ( 7.354 0.000 -3.436) 8.117 4.965 ( 3.098 0.000 -8.777) 9.307 5.043 ( -5.596 -0.000 8.249) 9.968 5.268 ( 4.674 0.000 3.592) 5.895 5.443 ( -9.487 -0.000 -3.568) 10.136 5.513 ( 4.433 0.000 -0.191) 4.437 5.574 ( -2.443 -0.000 1.045) 2.657 5.683 ( 0.075 0.000 2.001) 2.003 5.704 ( -0.989 -0.000 -1.466) 1.768 5.804 ( -0.691 -0.000 -0.718) 0.996 5.826 ( -3.279 -0.000 0.905) 3.402 7.161 ( -1.634 -0.000 14.764) 14.854 7.259 ( -3.460 -0.000 -14.019) 14.440 7.679 ( -0.779 -0.000 4.277) 4.348 7.697 ( -0.108 -0.000 -4.394) 4.395 7.802 ( -2.789 -0.000 1.070) 2.987 7.818 ( -3.116 -0.000 -4.496) 5.471 8.243 ( 3.165 0.000 -2.507) 4.038 8.269 ( -1.393 -0.000 3.690) 3.944 8.774 ( 2.719 0.000 4.698) 5.428 8.842 ( -1.586 -0.000 -3.720) 4.044 9.065 ( 5.844 0.000 -0.377) 5.857 9.107 ( 3.808 0.000 -1.933) 4.271 9.250 ( -4.643 -0.000 0.977) 4.745 9.281 ( -5.146 -0.000 -0.044) 5.146 9.631 ( -1.384 -0.000 2.746) 3.075 9.691 ( -5.736 -0.000 -4.083) 7.041 10.354 ( -0.659 -0.000 10.854) 10.874 10.401 ( 1.043 0.000 -9.470) 9.527 10.889 ( 1.194 0.000 2.564) 2.828 10.902 ( 1.291 0.000 -2.915) 3.188 11.533 ( 9.923 0.000 0.779) 9.953 11.678 ( -0.090 -0.000 0.975) 0.979 11.727 ( -0.806 -0.000 -1.182) 1.430 11.818 ( -5.364 -0.000 -0.345) 5.375 12.788 ( 4.938 0.000 -5.940) 7.724 12.864 ( 1.299 0.000 2.109) 2.477 12.896 ( -9.321 -0.000 5.121) 10.636 12.906 ( -2.270 -0.000 -0.704) 2.377 13.572 ( 4.311 0.000 -2.703) 5.088 13.639 ( -4.828 -0.000 4.648) 6.702 14.045 ( 5.716 0.000 0.391) 5.729 14.140 ( -2.645 -0.000 -4.841) 5.516 14.737 ( -1.292 -0.000 3.877) 4.086 14.749 ( -0.867 -0.000 -2.040) 2.216 15.090 ( 7.799 0.000 3.107) 8.395 15.161 ( 2.478 0.000 -2.681) 3.651 15.843 ( -0.794 -0.000 1.944) 2.100 15.871 ( -2.659 -0.000 -0.207) 2.667 15.967 ( 8.807 0.000 -0.533) 8.823 16.037 ( 1.652 0.000 -1.529) 2.251 16.383 ( 3.634 0.000 -6.587) 7.523 16.398 ( -2.642 -0.000 5.638) 6.226 16.789 ( 1.014 0.000 0.236) 1.041 16.821 ( -1.939 -0.000 1.102) 2.230 16.900 ( 3.338 0.000 -5.288) 6.254 16.982 ( -7.200 -0.000 2.862) 7.748 17.110 ( -1.054 -0.000 5.655) 5.753 17.110 ( 1.486 0.000 -2.589) 2.985 20.142 ( 8.529 0.000 2.245) 8.820 20.246 ( 0.132 0.000 -1.801) 1.806 21.136 ( -0.608 -0.000 -3.471) 3.524 21.199 ( -8.047 -0.000 3.255) 8.680 22.719 ( 2.241 0.000 -7.396) 7.729 22.744 ( -4.821 -0.000 7.880) 9.238 27.900 ( 1.458 0.000 5.783) 5.964 27.996 ( -5.378 -0.000 -6.378) 8.343 29.634 ( 3.519 0.000 0.581) 3.567 29.707 ( -3.664 -0.000 -0.631) 3.718 29.913 ( 4.024 0.000 -0.548) 4.062 29.965 ( -1.842 -0.000 1.319) 2.266 31.110 ( -0.664 -0.000 2.995) 3.068 31.111 ( 6.751 0.000 -0.903) 6.811 31.113 ( 0.770 0.000 -2.840) 2.943 31.195 ( -2.089 -0.000 0.365) 2.121 31.700 ( -2.790 -0.000 2.796) 3.949 31.715 ( -2.690 -0.000 -2.233) 3.496 32.088 ( -0.018 -0.000 3.150) 3.150 32.099 ( 1.045 0.000 -3.350) 3.510 32.508 ( 7.343 0.000 1.611) 7.518 32.620 ( -1.592 -0.000 -0.345) 1.629 32.866 ( 6.936 0.000 -7.758) 10.407 32.967 ( -6.238 -0.000 8.082) 10.210 34.309 ( 0.005 0.000 1.421) 1.421 34.316 ( -0.194 -0.000 -0.971) 0.990 34.911 ( 1.361 0.000 -11.445) 11.526 34.933 ( -6.812 -0.000 9.550) 11.730 36.298 ( 10.592 0.000 -2.099) 10.798 36.434 ( -4.587 -0.000 6.646) 8.075 36.904 ( 9.002 0.000 -13.703) 16.395 37.059 ( -12.523 -0.000 8.265) 15.004 ======================= Grid point 209 (95/95) ======================= q-point: ( 0.56 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 86 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.736 ( 8.454 -6.590 -12.990) 16.842 1.736 ( -8.454 -6.590 12.990) 16.842 2.201 ( -5.741 -1.307 -6.284) 8.612 2.201 ( 5.741 -1.307 6.284) 8.612 2.739 ( 7.616 -1.823 -9.132) 12.030 2.739 ( -7.616 -1.823 9.132) 12.030 2.901 ( -1.258 1.758 -4.120) 4.653 2.901 ( 1.258 1.758 4.120) 4.653 3.272 ( -0.803 0.834 -12.901) 12.953 3.272 ( 0.803 0.834 12.901) 12.953 3.486 ( 3.165 -0.201 -2.646) 4.130 3.486 ( -3.165 -0.201 2.646) 4.130 3.554 ( 0.925 1.070 -1.539) 2.090 3.554 ( -0.925 1.070 1.539) 2.090 3.961 ( -2.140 -1.841 -7.744) 8.243 3.961 ( 2.140 -1.841 7.744) 8.243 4.044 ( 6.100 -2.572 -14.310) 15.767 4.044 ( -6.100 -2.572 14.310) 15.767 4.349 ( -5.721 2.201 -2.455) 6.603 4.349 ( 5.721 2.201 2.455) 6.603 4.570 ( -4.597 -1.119 -7.414) 8.795 4.570 ( 4.597 -1.119 7.414) 8.795 4.842 ( -0.075 -0.188 -4.407) 4.411 4.842 ( 0.075 -0.188 4.406) 4.411 4.974 ( 4.379 1.697 -7.465) 8.820 4.974 ( -4.379 1.697 7.465) 8.820 5.325 ( -7.959 1.651 -4.010) 9.064 5.325 ( 7.959 1.651 4.010) 9.064 5.552 ( -0.850 1.868 -1.972) 2.846 5.552 ( 0.850 1.868 1.972) 2.846 5.661 ( -3.338 -0.994 -2.505) 4.291 5.661 ( 3.338 -0.994 2.505) 4.291 5.878 ( -1.797 -5.127 -0.026) 5.433 5.878 ( 1.797 -5.127 0.026) 5.433 7.233 ( -1.429 -3.811 -13.767) 14.356 7.233 ( 1.429 -3.811 13.767) 14.356 7.597 ( -0.601 6.349 -5.089) 8.159 7.597 ( 0.601 6.349 5.089) 8.159 7.894 ( 1.704 -7.828 -3.600) 8.783 7.894 ( -1.704 -7.828 3.600) 8.783 8.232 ( 1.691 3.115 -1.953) 4.047 8.232 ( -1.691 3.115 1.953) 4.047 8.799 ( -2.360 1.387 -3.830) 4.708 8.799 ( 2.360 1.387 3.830) 4.708 9.095 ( -3.432 1.829 -0.363) 3.907 9.095 ( 3.432 1.829 0.363) 3.907 9.221 ( 1.084 2.193 -2.314) 3.367 9.221 ( -1.084 2.193 2.314) 3.367 9.663 ( -2.964 -2.422 -4.997) 6.294 9.663 ( 2.964 -2.422 4.997) 6.294 10.365 ( -0.059 1.651 -9.931) 10.068 10.365 ( 0.059 1.651 9.931) 10.068 10.913 ( 0.228 -1.218 -4.223) 4.401 10.913 ( -0.228 -1.218 4.223) 4.401 11.608 ( -8.096 1.923 -0.143) 8.323 11.608 ( 8.096 1.923 0.143) 8.323 11.769 ( -4.693 -0.647 -0.134) 4.739 11.769 ( 4.693 -0.647 0.134) 4.739 12.816 ( 7.652 1.637 -6.154) 9.955 12.816 ( -7.652 1.637 6.154) 9.955 12.887 ( -3.184 -0.366 -0.086) 3.206 12.887 ( 3.184 -0.366 0.086) 3.206 13.614 ( 4.814 -0.853 -3.368) 5.937 13.614 ( -4.814 -0.853 3.368) 5.937 14.090 ( -4.159 0.786 -2.224) 4.782 14.090 ( 4.159 0.786 2.224) 4.782 14.742 ( 0.563 -0.356 -3.666) 3.726 14.742 ( -0.563 -0.356 3.666) 3.726 15.135 ( -3.473 1.930 -3.292) 5.160 15.135 ( 3.473 1.930 3.292) 5.160 15.810 ( -1.303 4.401 -0.240) 4.596 15.810 ( 1.303 4.401 0.240) 4.596 15.997 ( -3.381 3.439 -0.968) 4.919 15.997 ( 3.381 3.439 0.968) 4.919 16.431 ( 1.992 -4.241 -5.879) 7.518 16.431 ( -1.992 -4.241 5.879) 7.518 16.815 ( -0.430 -1.067 -0.521) 1.263 16.815 ( 0.430 -1.067 0.521) 1.263 16.926 ( 4.967 0.206 -3.875) 6.303 16.926 ( -4.967 0.206 3.875) 6.303 17.116 ( 1.424 -0.316 -4.039) 4.294 17.116 ( -1.424 -0.316 4.039) 4.294 20.175 ( -3.599 4.560 -2.743) 6.424 20.175 ( 3.599 4.560 2.743) 6.424 21.143 ( 4.397 0.222 -3.751) 5.784 21.143 ( -4.397 0.222 3.751) 5.784 22.763 ( 3.742 -4.208 -8.115) 9.877 22.763 ( -3.742 -4.208 8.115) 9.877 27.932 ( -2.754 0.742 -5.708) 6.381 27.932 ( 2.754 0.742 5.708) 6.381 29.640 ( -1.687 2.968 -1.703) 3.815 29.640 ( 1.687 2.968 1.703) 3.815 29.956 ( 2.274 -0.712 -1.222) 2.678 29.956 ( -2.274 -0.712 1.222) 2.678 31.103 ( -0.069 0.977 -2.134) 2.348 31.103 ( 0.069 0.977 2.134) 2.348 31.203 ( -4.604 -4.532 0.731) 6.502 31.203 ( 4.604 -4.532 -0.731) 6.502 31.709 ( 0.199 -1.678 -1.709) 2.404 31.709 ( -0.199 -1.678 1.709) 2.404 32.083 ( 0.098 1.378 -4.052) 4.281 32.083 ( -0.098 1.378 4.052) 4.281 32.574 ( -5.468 0.487 -1.242) 5.628 32.574 ( 5.468 0.487 1.242) 5.628 32.910 ( 6.205 1.072 -7.109) 9.497 32.910 ( -6.205 1.072 7.109) 9.497 34.341 ( 0.107 -3.497 -0.980) 3.633 34.341 ( -0.107 -3.497 0.980) 3.633 34.907 ( 4.233 0.088 -10.489) 11.311 34.907 ( -4.233 0.088 10.489) 11.311 36.343 ( 2.432 4.735 -3.996) 6.656 36.343 ( -2.432 4.735 3.996) 6.656 36.935 ( 6.096 4.042 -9.083) 11.662 36.935 ( -6.096 4.042 9.083) 11.662 =================== 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 3/36936 10.0 379.893 351.350 419.017 -0.000 28.581 0.000 3/36936 20.0 57.463 46.515 75.230 -0.000 -6.831 0.000 3/36936 30.0 21.886 16.959 28.038 -0.000 -3.252 0.000 3/36936 40.0 12.104 9.244 15.366 -0.000 -1.907 0.000 3/36936 50.0 8.095 6.141 10.253 -0.000 -1.305 0.000 3/36936 60.0 6.033 4.554 7.621 -0.000 -0.979 0.000 3/36936 70.0 4.807 3.613 6.047 -0.000 -0.779 0.000 3/36936 80.0 4.006 2.997 5.010 -0.000 -0.646 0.000 3/36936 90.0 3.445 2.565 4.279 -0.000 -0.551 0.000 3/36936 100.0 3.033 2.247 3.739 -0.000 -0.481 0.000 3/36936 110.0 2.719 2.004 3.324 -0.000 -0.427 0.000 3/36936 120.0 2.473 1.812 2.996 -0.000 -0.384 0.000 3/36936 130.0 2.274 1.656 2.729 -0.000 -0.350 0.000 3/36936 140.0 2.111 1.527 2.510 -0.000 -0.322 0.000 3/36936 150.0 1.975 1.419 2.325 -0.000 -0.299 0.000 3/36936 160.0 1.858 1.327 2.167 -0.000 -0.279 0.000 3/36936 170.0 1.758 1.248 2.031 -0.000 -0.262 0.000 3/36936 180.0 1.670 1.178 1.912 -0.000 -0.247 0.000 3/36936 190.0 1.592 1.117 1.808 -0.000 -0.234 0.000 3/36936 200.0 1.523 1.063 1.715 -0.000 -0.223 0.000 3/36936 210.0 1.461 1.014 1.632 -0.000 -0.212 0.000 3/36936 220.0 1.405 0.970 1.557 -0.000 -0.203 0.000 3/36936 230.0 1.354 0.931 1.490 -0.000 -0.195 0.000 3/36936 240.0 1.307 0.895 1.429 -0.000 -0.187 0.000 3/36936 250.0 1.264 0.862 1.373 -0.000 -0.180 0.000 3/36936 260.0 1.224 0.832 1.322 -0.000 -0.174 0.000 3/36936 270.0 1.188 0.804 1.274 -0.000 -0.168 0.000 3/36936 280.0 1.153 0.779 1.231 -0.000 -0.162 0.000 3/36936 290.0 1.121 0.755 1.190 -0.000 -0.157 0.000 3/36936 300.0 1.091 0.733 1.153 -0.000 -0.152 0.000 3/36936 310.0 1.063 0.712 1.117 -0.000 -0.148 0.000 3/36936 320.0 1.037 0.693 1.085 -0.000 -0.144 0.000 3/36936 330.0 1.012 0.675 1.054 -0.000 -0.140 0.000 3/36936 340.0 0.988 0.658 1.025 -0.000 -0.136 0.000 3/36936 350.0 0.966 0.642 0.998 -0.000 -0.133 0.000 3/36936 360.0 0.945 0.627 0.972 -0.000 -0.129 0.000 3/36936 370.0 0.925 0.613 0.948 -0.000 -0.126 0.000 3/36936 380.0 0.905 0.599 0.925 -0.000 -0.123 0.000 3/36936 390.0 0.887 0.586 0.903 -0.000 -0.120 0.000 3/36936 400.0 0.870 0.574 0.882 -0.000 -0.118 0.000 3/36936 410.0 0.853 0.562 0.863 -0.000 -0.115 0.000 3/36936 420.0 0.837 0.551 0.844 -0.000 -0.113 0.000 3/36936 430.0 0.821 0.540 0.826 -0.000 -0.110 0.000 3/36936 440.0 0.806 0.530 0.809 -0.000 -0.108 0.000 3/36936 450.0 0.792 0.520 0.792 -0.000 -0.106 0.000 3/36936 460.0 0.778 0.511 0.777 -0.000 -0.104 0.000 3/36936 470.0 0.765 0.502 0.762 -0.000 -0.102 0.000 3/36936 480.0 0.752 0.493 0.747 -0.000 -0.100 0.000 3/36936 490.0 0.740 0.485 0.733 -0.000 -0.098 0.000 3/36936 500.0 0.728 0.476 0.720 -0.000 -0.097 0.000 3/36936 510.0 0.716 0.469 0.707 -0.000 -0.095 0.000 3/36936 520.0 0.705 0.461 0.694 -0.000 -0.093 0.000 3/36936 530.0 0.694 0.454 0.682 -0.000 -0.092 0.000 3/36936 540.0 0.684 0.447 0.671 -0.000 -0.090 0.000 3/36936 550.0 0.674 0.440 0.660 -0.000 -0.089 0.000 3/36936 560.0 0.664 0.433 0.649 -0.000 -0.087 0.000 3/36936 570.0 0.654 0.427 0.638 -0.000 -0.086 0.000 3/36936 580.0 0.645 0.421 0.628 -0.000 -0.085 0.000 3/36936 590.0 0.636 0.415 0.618 -0.000 -0.083 0.000 3/36936 600.0 0.627 0.409 0.609 -0.000 -0.082 0.000 3/36936 610.0 0.619 0.403 0.600 -0.000 -0.081 0.000 3/36936 620.0 0.610 0.397 0.591 -0.000 -0.080 0.000 3/36936 630.0 0.602 0.392 0.582 -0.000 -0.078 0.000 3/36936 640.0 0.594 0.387 0.574 -0.000 -0.077 0.000 3/36936 650.0 0.586 0.382 0.566 -0.000 -0.076 0.000 3/36936 660.0 0.579 0.377 0.558 -0.000 -0.075 0.000 3/36936 670.0 0.572 0.372 0.550 -0.000 -0.074 0.000 3/36936 680.0 0.564 0.367 0.542 -0.000 -0.073 0.000 3/36936 690.0 0.558 0.362 0.535 -0.000 -0.072 0.000 3/36936 700.0 0.551 0.358 0.528 -0.000 -0.071 0.000 3/36936 710.0 0.544 0.354 0.521 -0.000 -0.070 0.000 3/36936 720.0 0.538 0.349 0.514 -0.000 -0.069 0.000 3/36936 730.0 0.531 0.345 0.508 -0.000 -0.069 0.000 3/36936 740.0 0.525 0.341 0.501 -0.000 -0.068 0.000 3/36936 750.0 0.519 0.337 0.495 -0.000 -0.067 0.000 3/36936 760.0 0.513 0.333 0.489 -0.000 -0.066 0.000 3/36936 770.0 0.507 0.329 0.483 -0.000 -0.065 0.000 3/36936 780.0 0.501 0.326 0.477 -0.000 -0.064 0.000 3/36936 790.0 0.496 0.322 0.472 -0.000 -0.064 0.000 3/36936 800.0 0.490 0.318 0.466 -0.000 -0.063 0.000 3/36936 810.0 0.485 0.315 0.461 -0.000 -0.062 0.000 3/36936 820.0 0.480 0.311 0.455 -0.000 -0.062 0.000 3/36936 830.0 0.475 0.308 0.450 -0.000 -0.061 0.000 3/36936 840.0 0.470 0.305 0.445 -0.000 -0.060 0.000 3/36936 850.0 0.465 0.302 0.440 -0.000 -0.060 0.000 3/36936 860.0 0.460 0.298 0.435 -0.000 -0.059 0.000 3/36936 870.0 0.455 0.295 0.431 -0.000 -0.058 0.000 3/36936 880.0 0.451 0.292 0.426 -0.000 -0.058 0.000 3/36936 890.0 0.446 0.289 0.422 -0.000 -0.057 0.000 3/36936 900.0 0.442 0.286 0.417 -0.000 -0.056 0.000 3/36936 910.0 0.437 0.284 0.413 -0.000 -0.056 0.000 3/36936 920.0 0.433 0.281 0.408 -0.000 -0.055 0.000 3/36936 930.0 0.429 0.278 0.404 -0.000 -0.055 0.000 3/36936 940.0 0.425 0.275 0.400 -0.000 -0.054 0.000 3/36936 950.0 0.421 0.273 0.396 -0.000 -0.054 0.000 3/36936 960.0 0.417 0.270 0.392 -0.000 -0.053 0.000 3/36936 970.0 0.413 0.268 0.388 -0.000 -0.053 0.000 3/36936 980.0 0.409 0.265 0.385 -0.000 -0.052 0.000 3/36936 990.0 0.405 0.263 0.381 -0.000 -0.052 0.000 3/36936 1000.0 0.402 0.260 0.377 -0.000 -0.051 0.000 3/36936 Thermal conductivity related properties were written into "kappa-m994.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 03:59:09]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|