----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 13:44:49]------------------------- 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 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 8 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 8.092889090046015 0.000000000000000 0.000000000000000 b 0.000000000000000 10.255935230000002 0.000000000000000 c -2.061784907627885 0.000000000000000 7.811872142581329 Atomic positions (fractional): *1 Li 0.47802569956261 0.92471515024190 0.72776949586177 6.941 *2 Li 0.84914901205738 0.34799631374314 0.84760129766803 6.941 3 Li 0.15085098794262 0.84799631374314 0.65239870233197 6.941 4 Li 0.52197430043739 0.07528484975810 0.27223050413823 6.941 5 Li 0.47802569956261 0.57528484975810 0.22776949586177 6.941 6 Li 0.15085098794262 0.65200368625686 0.15239870233197 6.941 *7 Li 0.39936049179992 0.83656297483120 0.40091302504861 6.941 *8 Li 0.34328381539789 0.16210510737057 0.84158059709583 6.941 9 Li 0.52197430043739 0.42471515024190 0.77223050413823 6.941 10 Li 0.84914901205738 0.15200368625686 0.34760129766803 6.941 11 Li 0.65671618460211 0.66210510737057 0.65841940290417 6.941 12 Li 0.34328381539789 0.33789489262943 0.34158059709583 6.941 13 Li 0.60063950820008 0.16343702516880 0.59908697495139 6.941 14 Li 0.65671618460211 0.83789489262943 0.15841940290417 6.941 15 Li 0.60063950820008 0.33656297483120 0.09908697495139 6.941 16 Li 0.39936049179992 0.66343702516880 0.90091302504861 6.941 *17 Zn 0.09061525832214 0.15632981114621 0.08957818402043 65.380 18 Zn 0.09061525832214 0.34367018885379 0.58957818402043 65.380 19 Zn 0.90938474167786 0.84367018885379 0.91042181597957 65.380 20 Zn 0.90938474167786 0.65632981114621 0.41042181597957 65.380 *21 P 0.76919868931142 0.90748045189569 0.53488530955949 30.974 22 P 0.23080131068858 0.09251954810431 0.46511469044051 30.974 *23 P 0.70941648386110 0.09142661712393 0.97197516358861 30.974 24 P 0.29058351613890 0.59142661712393 0.52802483641139 30.974 25 P 0.76919868931142 0.59251954810431 0.03488530955949 30.974 26 P 0.70941648386110 0.40857338287607 0.47197516358861 30.974 27 P 0.29058351613890 0.90857338287607 0.02802483641139 30.974 28 P 0.23080131068858 0.40748045189569 0.96511469044051 30.974 *29 O 0.38301012805772 0.34414565178294 0.91114025698627 15.999 *30 O 0.33918212749893 0.65179324102541 0.37166603671628 15.999 *31 O 0.75600083661331 0.94547018945729 0.01004725521415 15.999 32 O 0.24399916338669 0.05452981054272 0.98995274478585 15.999 33 O 0.61698987194228 0.84414565178294 0.58885974301373 15.999 34 O 0.66081787250107 0.15179324102541 0.12833396328372 15.999 *35 O 0.80792159358423 0.66967959658721 0.88351513609079 15.999 *36 O 0.55843928696336 0.40065597655617 0.31013355913676 15.999 37 O 0.66081787250107 0.34820675897459 0.62833396328372 15.999 *38 O 0.06813106601075 0.10157853216628 0.31268532633148 15.999 *39 O 0.72528320931337 0.04921106742330 0.47747314722447 15.999 40 O 0.93186893398925 0.89842146783372 0.68731467366852 15.999 41 O 0.72528320931337 0.45078893257670 0.97747314722447 15.999 42 O 0.61698987194228 0.65585434821706 0.08885974301373 15.999 43 O 0.27471679068663 0.54921106742331 0.02252685277552 15.999 44 O 0.38301012805772 0.15585434821706 0.41114025698627 15.999 *45 O 0.86273172333922 0.33286451395664 0.43517660397260 15.999 46 O 0.80792159358423 0.83032040341279 0.38351513609079 15.999 47 O 0.19207840641577 0.33032040341279 0.11648486390922 15.999 48 O 0.13726827666078 0.83286451395664 0.06482339602740 15.999 49 O 0.19207840641577 0.16967959658721 0.61648486390921 15.999 50 O 0.75600083661331 0.55452981054271 0.51004725521415 15.999 51 O 0.44156071303664 0.90065597655617 0.18986644086324 15.999 52 O 0.86273172333922 0.16713548604336 0.93517660397260 15.999 53 O 0.27471679068663 0.95078893257669 0.52252685277553 15.999 54 O 0.93186893398925 0.60157853216628 0.18731467366852 15.999 55 O 0.13726827666078 0.66713548604336 0.56482339602740 15.999 56 O 0.24399916338669 0.44547018945729 0.48995274478585 15.999 57 O 0.06813106601075 0.39842146783372 0.81268532633148 15.999 58 O 0.33918212749893 0.84820675897459 0.87166603671628 15.999 59 O 0.55843928696336 0.09934402344383 0.81013355913676 15.999 60 O 0.44156071303664 0.59934402344383 0.68986644086324 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 8.092889090046015 0.000000000000000 0.000000000000000 b 0.000000000000000 10.255935230000002 0.000000000000000 c -2.061784907627885 0.000000000000000 7.811872142581329 Atomic positions (fractional): *1 Li 0.47802569956261 0.92471515024190 0.72776949586177 6.941 > 1 *2 Li 0.84914901205738 0.34799631374314 0.84760129766803 6.941 > 2 3 Li 0.15085098794262 0.84799631374314 0.65239870233197 6.941 > 3 4 Li 0.52197430043739 0.07528484975810 0.27223050413823 6.941 > 4 5 Li 0.47802569956261 0.57528484975810 0.22776949586177 6.941 > 5 6 Li 0.15085098794262 0.65200368625686 0.15239870233197 6.941 > 6 *7 Li 0.39936049179992 0.83656297483120 0.40091302504861 6.941 > 7 *8 Li 0.34328381539789 0.16210510737057 0.84158059709583 6.941 > 8 9 Li 0.52197430043739 0.42471515024190 0.77223050413823 6.941 > 9 10 Li 0.84914901205738 0.15200368625686 0.34760129766803 6.941 > 10 11 Li 0.65671618460211 0.66210510737057 0.65841940290417 6.941 > 11 12 Li 0.34328381539789 0.33789489262943 0.34158059709583 6.941 > 12 13 Li 0.60063950820008 0.16343702516880 0.59908697495139 6.941 > 13 14 Li 0.65671618460211 0.83789489262943 0.15841940290417 6.941 > 14 15 Li 0.60063950820008 0.33656297483120 0.09908697495139 6.941 > 15 16 Li 0.39936049179992 0.66343702516880 0.90091302504861 6.941 > 16 *17 Zn 0.09061525832214 0.15632981114621 0.08957818402043 65.380 > 17 18 Zn 0.09061525832214 0.34367018885379 0.58957818402043 65.380 > 18 19 Zn 0.90938474167786 0.84367018885379 0.91042181597957 65.380 > 19 20 Zn 0.90938474167786 0.65632981114621 0.41042181597957 65.380 > 20 *21 P 0.76919868931142 0.90748045189569 0.53488530955949 30.974 > 21 22 P 0.23080131068858 0.09251954810431 0.46511469044051 30.974 > 22 *23 P 0.70941648386110 0.09142661712393 0.97197516358861 30.974 > 23 24 P 0.29058351613890 0.59142661712393 0.52802483641139 30.974 > 24 25 P 0.76919868931142 0.59251954810431 0.03488530955949 30.974 > 25 26 P 0.70941648386110 0.40857338287607 0.47197516358861 30.974 > 26 27 P 0.29058351613890 0.90857338287607 0.02802483641139 30.974 > 27 28 P 0.23080131068858 0.40748045189569 0.96511469044051 30.974 > 28 *29 O 0.38301012805772 0.34414565178294 0.91114025698627 15.999 > 29 *30 O 0.33918212749893 0.65179324102541 0.37166603671628 15.999 > 30 *31 O 0.75600083661331 0.94547018945729 0.01004725521415 15.999 > 31 32 O 0.24399916338669 0.05452981054272 0.98995274478585 15.999 > 32 33 O 0.61698987194228 0.84414565178294 0.58885974301373 15.999 > 33 34 O 0.66081787250107 0.15179324102541 0.12833396328372 15.999 > 34 *35 O 0.80792159358423 0.66967959658721 0.88351513609079 15.999 > 35 *36 O 0.55843928696336 0.40065597655617 0.31013355913676 15.999 > 36 37 O 0.66081787250107 0.34820675897459 0.62833396328372 15.999 > 37 *38 O 0.06813106601075 0.10157853216628 0.31268532633148 15.999 > 38 *39 O 0.72528320931337 0.04921106742330 0.47747314722447 15.999 > 39 40 O 0.93186893398925 0.89842146783372 0.68731467366852 15.999 > 40 41 O 0.72528320931337 0.45078893257670 0.97747314722447 15.999 > 41 42 O 0.61698987194228 0.65585434821706 0.08885974301373 15.999 > 42 43 O 0.27471679068663 0.54921106742331 0.02252685277552 15.999 > 43 44 O 0.38301012805772 0.15585434821706 0.41114025698627 15.999 > 44 *45 O 0.86273172333922 0.33286451395664 0.43517660397260 15.999 > 45 46 O 0.80792159358423 0.83032040341279 0.38351513609079 15.999 > 46 47 O 0.19207840641577 0.33032040341279 0.11648486390922 15.999 > 47 48 O 0.13726827666078 0.83286451395664 0.06482339602740 15.999 > 48 49 O 0.19207840641577 0.16967959658721 0.61648486390921 15.999 > 49 50 O 0.75600083661331 0.55452981054271 0.51004725521415 15.999 > 50 51 O 0.44156071303664 0.90065597655617 0.18986644086324 15.999 > 51 52 O 0.86273172333922 0.16713548604336 0.93517660397260 15.999 > 52 53 O 0.27471679068663 0.95078893257669 0.52252685277553 15.999 > 53 54 O 0.93186893398925 0.60157853216628 0.18731467366852 15.999 > 54 55 O 0.13726827666078 0.66713548604336 0.56482339602740 15.999 > 55 56 O 0.24399916338669 0.44547018945729 0.48995274478585 15.999 > 56 57 O 0.06813106601075 0.39842146783372 0.81268532633148 15.999 > 57 58 O 0.33918212749893 0.84820675897459 0.87166603671628 15.999 > 58 59 O 0.55843928696336 0.09934402344383 0.81013355913676 15.999 > 59 60 O 0.44156071303664 0.59934402344383 0.68986644086324 15.999 > 60 -------------------------------- super cell -------------------------------- Lattice vectors: a 8.092889090046015 0.000000000000000 0.000000000000000 b 0.000000000000000 10.255935230000002 0.000000000000000 c -4.123569815255770 0.000000000000000 15.623744285162658 Atomic positions (fractional): *1 Li 0.47802569956261 0.92471515024190 0.36388474793089 6.941 > 1 2 Li 0.47802569956261 0.92471515024190 0.86388474793089 6.941 > 1 *3 Li 0.84914901205738 0.34799631374314 0.42380064883402 6.941 > 2 4 Li 0.84914901205738 0.34799631374314 0.92380064883402 6.941 > 2 5 Li 0.15085098794262 0.84799631374314 0.32619935116598 6.941 > 3 6 Li 0.15085098794262 0.84799631374314 0.82619935116598 6.941 > 3 7 Li 0.52197430043739 0.07528484975810 0.13611525206911 6.941 > 4 8 Li 0.52197430043739 0.07528484975810 0.63611525206911 6.941 > 4 9 Li 0.47802569956261 0.57528484975810 0.11388474793089 6.941 > 5 10 Li 0.47802569956261 0.57528484975810 0.61388474793089 6.941 > 5 11 Li 0.15085098794262 0.65200368625686 0.07619935116598 6.941 > 6 12 Li 0.15085098794262 0.65200368625686 0.57619935116598 6.941 > 6 *13 Li 0.39936049179992 0.83656297483120 0.20045651252430 6.941 > 7 14 Li 0.39936049179992 0.83656297483120 0.70045651252430 6.941 > 7 *15 Li 0.34328381539789 0.16210510737057 0.42079029854791 6.941 > 8 16 Li 0.34328381539789 0.16210510737057 0.92079029854791 6.941 > 8 17 Li 0.52197430043739 0.42471515024190 0.38611525206911 6.941 > 9 18 Li 0.52197430043739 0.42471515024190 0.88611525206911 6.941 > 9 19 Li 0.84914901205738 0.15200368625686 0.17380064883402 6.941 > 10 20 Li 0.84914901205738 0.15200368625686 0.67380064883402 6.941 > 10 21 Li 0.65671618460211 0.66210510737057 0.32920970145209 6.941 > 11 22 Li 0.65671618460211 0.66210510737057 0.82920970145209 6.941 > 11 23 Li 0.34328381539789 0.33789489262943 0.17079029854791 6.941 > 12 24 Li 0.34328381539789 0.33789489262943 0.67079029854791 6.941 > 12 25 Li 0.60063950820008 0.16343702516880 0.29954348747569 6.941 > 13 26 Li 0.60063950820008 0.16343702516880 0.79954348747570 6.941 > 13 27 Li 0.65671618460211 0.83789489262943 0.07920970145209 6.941 > 14 28 Li 0.65671618460211 0.83789489262943 0.57920970145209 6.941 > 14 29 Li 0.60063950820008 0.33656297483120 0.04954348747570 6.941 > 15 30 Li 0.60063950820008 0.33656297483120 0.54954348747570 6.941 > 15 31 Li 0.39936049179992 0.66343702516880 0.45045651252431 6.941 > 16 32 Li 0.39936049179992 0.66343702516880 0.95045651252430 6.941 > 16 *33 Zn 0.09061525832214 0.15632981114621 0.04478909201022 65.380 > 17 34 Zn 0.09061525832214 0.15632981114621 0.54478909201022 65.380 > 17 35 Zn 0.09061525832214 0.34367018885379 0.29478909201022 65.380 > 18 36 Zn 0.09061525832214 0.34367018885379 0.79478909201022 65.380 > 18 37 Zn 0.90938474167786 0.84367018885379 0.45521090798978 65.380 > 19 38 Zn 0.90938474167786 0.84367018885379 0.95521090798978 65.380 > 19 39 Zn 0.90938474167786 0.65632981114621 0.20521090798978 65.380 > 20 40 Zn 0.90938474167786 0.65632981114621 0.70521090798978 65.380 > 20 *41 P 0.76919868931142 0.90748045189569 0.26744265477974 30.974 > 21 42 P 0.76919868931142 0.90748045189569 0.76744265477974 30.974 > 21 43 P 0.23080131068858 0.09251954810431 0.23255734522026 30.974 > 22 44 P 0.23080131068858 0.09251954810431 0.73255734522026 30.974 > 22 *45 P 0.70941648386110 0.09142661712393 0.48598758179430 30.974 > 23 46 P 0.70941648386110 0.09142661712393 0.98598758179430 30.974 > 23 47 P 0.29058351613890 0.59142661712393 0.26401241820570 30.974 > 24 48 P 0.29058351613890 0.59142661712393 0.76401241820570 30.974 > 24 49 P 0.76919868931142 0.59251954810431 0.01744265477974 30.974 > 25 50 P 0.76919868931142 0.59251954810431 0.51744265477974 30.974 > 25 51 P 0.70941648386110 0.40857338287607 0.23598758179430 30.974 > 26 52 P 0.70941648386110 0.40857338287607 0.73598758179430 30.974 > 26 53 P 0.29058351613890 0.90857338287607 0.01401241820570 30.974 > 27 54 P 0.29058351613890 0.90857338287607 0.51401241820570 30.974 > 27 55 P 0.23080131068858 0.40748045189569 0.48255734522026 30.974 > 28 56 P 0.23080131068858 0.40748045189569 0.98255734522026 30.974 > 28 *57 O 0.38301012805772 0.34414565178294 0.45557012849314 15.999 > 29 58 O 0.38301012805772 0.34414565178294 0.95557012849314 15.999 > 29 *59 O 0.33918212749893 0.65179324102541 0.18583301835814 15.999 > 30 60 O 0.33918212749893 0.65179324102541 0.68583301835814 15.999 > 30 *61 O 0.75600083661331 0.94547018945729 0.00502362760708 15.999 > 31 62 O 0.75600083661331 0.94547018945729 0.50502362760708 15.999 > 31 63 O 0.24399916338669 0.05452981054272 0.49497637239292 15.999 > 32 64 O 0.24399916338669 0.05452981054272 0.99497637239292 15.999 > 32 65 O 0.61698987194228 0.84414565178294 0.29442987150686 15.999 > 33 66 O 0.61698987194228 0.84414565178294 0.79442987150686 15.999 > 33 67 O 0.66081787250107 0.15179324102541 0.06416698164186 15.999 > 34 68 O 0.66081787250107 0.15179324102541 0.56416698164186 15.999 > 34 *69 O 0.80792159358423 0.66967959658721 0.44175756804539 15.999 > 35 70 O 0.80792159358423 0.66967959658721 0.94175756804539 15.999 > 35 *71 O 0.55843928696336 0.40065597655617 0.15506677956838 15.999 > 36 72 O 0.55843928696336 0.40065597655617 0.65506677956838 15.999 > 36 73 O 0.66081787250107 0.34820675897459 0.31416698164186 15.999 > 37 74 O 0.66081787250107 0.34820675897459 0.81416698164186 15.999 > 37 *75 O 0.06813106601075 0.10157853216628 0.15634266316574 15.999 > 38 76 O 0.06813106601075 0.10157853216628 0.65634266316574 15.999 > 38 *77 O 0.72528320931337 0.04921106742330 0.23873657361224 15.999 > 39 78 O 0.72528320931337 0.04921106742330 0.73873657361224 15.999 > 39 79 O 0.93186893398925 0.89842146783372 0.34365733683426 15.999 > 40 80 O 0.93186893398925 0.89842146783372 0.84365733683426 15.999 > 40 81 O 0.72528320931337 0.45078893257670 0.48873657361224 15.999 > 41 82 O 0.72528320931337 0.45078893257670 0.98873657361224 15.999 > 41 83 O 0.61698987194228 0.65585434821706 0.04442987150686 15.999 > 42 84 O 0.61698987194228 0.65585434821706 0.54442987150686 15.999 > 42 85 O 0.27471679068663 0.54921106742331 0.01126342638776 15.999 > 43 86 O 0.27471679068663 0.54921106742331 0.51126342638776 15.999 > 43 87 O 0.38301012805772 0.15585434821706 0.20557012849314 15.999 > 44 88 O 0.38301012805772 0.15585434821706 0.70557012849314 15.999 > 44 *89 O 0.86273172333922 0.33286451395664 0.21758830198630 15.999 > 45 90 O 0.86273172333922 0.33286451395664 0.71758830198630 15.999 > 45 91 O 0.80792159358423 0.83032040341279 0.19175756804539 15.999 > 46 92 O 0.80792159358423 0.83032040341279 0.69175756804539 15.999 > 46 93 O 0.19207840641577 0.33032040341279 0.05824243195461 15.999 > 47 94 O 0.19207840641577 0.33032040341279 0.55824243195461 15.999 > 47 95 O 0.13726827666078 0.83286451395664 0.03241169801370 15.999 > 48 96 O 0.13726827666078 0.83286451395664 0.53241169801370 15.999 > 48 97 O 0.19207840641577 0.16967959658721 0.30824243195461 15.999 > 49 98 O 0.19207840641577 0.16967959658721 0.80824243195461 15.999 > 49 99 O 0.75600083661331 0.55452981054271 0.25502362760708 15.999 > 50 100 O 0.75600083661331 0.55452981054271 0.75502362760708 15.999 > 50 101 O 0.44156071303664 0.90065597655617 0.09493322043162 15.999 > 51 102 O 0.44156071303664 0.90065597655617 0.59493322043162 15.999 > 51 103 O 0.86273172333922 0.16713548604336 0.46758830198630 15.999 > 52 104 O 0.86273172333922 0.16713548604336 0.96758830198630 15.999 > 52 105 O 0.27471679068663 0.95078893257669 0.26126342638776 15.999 > 53 106 O 0.27471679068663 0.95078893257669 0.76126342638776 15.999 > 53 107 O 0.93186893398925 0.60157853216628 0.09365733683426 15.999 > 54 108 O 0.93186893398925 0.60157853216628 0.59365733683426 15.999 > 54 109 O 0.13726827666078 0.66713548604336 0.28241169801370 15.999 > 55 110 O 0.13726827666078 0.66713548604336 0.78241169801370 15.999 > 55 111 O 0.24399916338669 0.44547018945729 0.24497637239292 15.999 > 56 112 O 0.24399916338669 0.44547018945729 0.74497637239292 15.999 > 56 113 O 0.06813106601075 0.39842146783372 0.40634266316574 15.999 > 57 114 O 0.06813106601075 0.39842146783372 0.90634266316574 15.999 > 57 115 O 0.33918212749893 0.84820675897459 0.43583301835814 15.999 > 58 116 O 0.33918212749893 0.84820675897459 0.93583301835814 15.999 > 58 117 O 0.55843928696336 0.09934402344383 0.40506677956838 15.999 > 59 118 O 0.55843928696336 0.09934402344383 0.90506677956838 15.999 > 59 119 O 0.44156071303664 0.59934402344383 0.34493322043162 15.999 > 60 120 O 0.44156071303664 0.59934402344383 0.84493322043162 15.999 > 60 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.6219301 0.0000000 0.0265482 0.0000000 2.6091248 0.0000000 0.0265473 0.0000000 2.6217065 -------------------------- Born effective charges -------------------------- 1 Li 1.1575879 0.0767896 -0.0312387 -0.0597561 0.9375752 -0.0164070 -0.0223054 0.0674891 1.1356938 2 Li 1.0676875 0.0189430 -0.0358845 -0.1247374 1.0899212 -0.0388625 0.0274214 -0.0517265 1.0452861 3 Li 1.0676875 -0.0189430 -0.0358845 0.1247374 1.0899212 0.0388625 0.0274214 0.0517265 1.0452861 4 Li 1.1575879 0.0767896 -0.0312387 -0.0597561 0.9375752 -0.0164070 -0.0223054 0.0674891 1.1356938 5 Li 1.1575879 -0.0767896 -0.0312387 0.0597561 0.9375752 0.0164070 -0.0223054 -0.0674891 1.1356938 6 Li 1.0676875 0.0189430 -0.0358845 -0.1247374 1.0899212 -0.0388625 0.0274214 -0.0517265 1.0452861 7 Li 0.9926747 0.0474194 0.0988598 -0.0361386 1.1329742 0.0575724 0.0036055 -0.0871040 1.0525290 8 Li 1.0234591 -0.0701810 -0.0424428 -0.0028078 1.0417682 -0.0668237 0.0686810 -0.0518030 1.0619619 9 Li 1.1575879 -0.0767896 -0.0312387 0.0597561 0.9375752 0.0164070 -0.0223054 -0.0674891 1.1356938 10 Li 1.0676875 -0.0189430 -0.0358845 0.1247374 1.0899212 0.0388625 0.0274214 0.0517265 1.0452861 11 Li 1.0234591 0.0701810 -0.0424428 0.0028078 1.0417682 0.0668237 0.0686810 0.0518030 1.0619619 12 Li 1.0234591 0.0701810 -0.0424428 0.0028078 1.0417682 0.0668237 0.0686810 0.0518030 1.0619619 13 Li 0.9926747 0.0474194 0.0988598 -0.0361386 1.1329742 0.0575724 0.0036055 -0.0871040 1.0525290 14 Li 1.0234591 -0.0701810 -0.0424428 -0.0028078 1.0417682 -0.0668237 0.0686810 -0.0518030 1.0619619 15 Li 0.9926747 -0.0474194 0.0988598 0.0361386 1.1329742 -0.0575724 0.0036055 0.0871040 1.0525290 16 Li 0.9926747 -0.0474194 0.0988598 0.0361386 1.1329742 -0.0575724 0.0036055 0.0871040 1.0525290 17 Zn 2.0646704 0.0709594 0.2157050 -0.0115586 2.0078666 0.1533714 -0.0653183 -0.2055578 1.9819563 18 Zn 2.0646704 -0.0709594 0.2157050 0.0115586 2.0078666 -0.1533714 -0.0653183 0.2055578 1.9819563 19 Zn 2.0646704 0.0709594 0.2157050 -0.0115586 2.0078666 0.1533714 -0.0653183 -0.2055578 1.9819563 20 Zn 2.0646704 -0.0709594 0.2157050 0.0115586 2.0078666 -0.1533714 -0.0653183 0.2055578 1.9819563 21 P 3.0028833 -0.0842922 -0.1901593 -0.3303469 3.0551100 0.2409424 0.2531957 -0.1369120 3.3610504 22 P 3.0028833 -0.0842922 -0.1901593 -0.3303469 3.0551100 0.2409424 0.2531957 -0.1369120 3.3610504 23 P 3.3300931 0.0256250 -0.0757496 0.0353517 3.2018233 -0.1217009 0.1606292 0.3348563 2.9221992 24 P 3.3300931 -0.0256250 -0.0757496 -0.0353517 3.2018233 0.1217009 0.1606292 -0.3348563 2.9221992 25 P 3.0028833 0.0842922 -0.1901593 0.3303469 3.0551100 -0.2409424 0.2531957 0.1369120 3.3610504 26 P 3.3300931 -0.0256250 -0.0757496 -0.0353517 3.2018233 0.1217009 0.1606292 -0.3348563 2.9221992 27 P 3.3300931 0.0256250 -0.0757496 0.0353517 3.2018233 -0.1217009 0.1606292 0.3348563 2.9221992 28 P 3.0028833 0.0842922 -0.1901593 0.3303469 3.0551100 -0.2409424 0.2531957 0.1369120 3.3610504 29 O -1.9403399 0.3299920 0.1831486 0.1590832 -1.3516067 -0.0380498 0.1390540 -0.1147854 -1.3282098 30 O -1.4705032 -0.1928702 0.4088521 -0.1632507 -1.4241877 0.2521950 0.3181114 0.3531991 -1.8093979 31 O -1.3943532 0.3539190 0.0965101 0.3629358 -2.2481952 0.0994731 0.1383237 0.0054928 -1.1110148 32 O -1.3943532 0.3539190 0.0965101 0.3629358 -2.2481952 0.0994731 0.1383237 0.0054928 -1.1110148 33 O -1.9403399 -0.3299920 0.1831486 -0.1590832 -1.3516067 0.0380498 0.1390540 0.1147854 -1.3282098 34 O -1.4705032 0.1928702 0.4088521 0.1632507 -1.4241877 -0.2521950 0.3181114 -0.3531991 -1.8093979 35 O -1.2543072 -0.4429481 0.2803528 -0.4967066 -1.7669056 0.4878037 0.1900947 0.4628797 -1.7923330 36 O -1.6411987 0.0010094 -0.4987417 -0.0678023 -1.1766608 -0.0865387 -0.4739422 0.0209362 -1.8548501 37 O -1.4705032 -0.1928702 0.4088521 -0.1632507 -1.4241877 0.2521950 0.3181114 0.3531991 -1.8093979 38 O -1.5289202 0.0536808 -0.3197014 0.0561433 -0.9562032 0.0625175 -0.4825500 0.1922132 -2.1777532 39 O -1.2315301 0.1445122 0.0224411 0.2194322 -2.1068631 0.2677119 -0.0437078 0.3567017 -1.3491687 40 O -1.5289202 0.0536808 -0.3197014 0.0561433 -0.9562032 0.0625175 -0.4825500 0.1922132 -2.1777532 41 O -1.2315301 -0.1445122 0.0224411 -0.2194322 -2.1068631 -0.2677119 -0.0437078 -0.3567017 -1.3491687 42 O -1.9403399 0.3299920 0.1831486 0.1590832 -1.3516067 -0.0380498 0.1390540 -0.1147854 -1.3282098 43 O -1.2315301 -0.1445122 0.0224411 -0.2194322 -2.1068631 -0.2677119 -0.0437078 -0.3567017 -1.3491687 44 O -1.9403399 -0.3299920 0.1831486 -0.1590832 -1.3516067 0.0380498 0.1390540 0.1147854 -1.3282098 45 O -2.1779034 0.5256764 -0.1119514 0.4199902 -1.4364165 -0.1341255 -0.2112929 -0.0750330 -1.1379491 46 O -1.2543072 0.4429481 0.2803528 0.4967066 -1.7669056 -0.4878037 0.1900947 -0.4628797 -1.7923330 47 O -1.2543072 -0.4429481 0.2803528 -0.4967066 -1.7669056 0.4878037 0.1900947 0.4628797 -1.7923330 48 O -2.1779034 -0.5256764 -0.1119514 -0.4199902 -1.4364165 0.1341255 -0.2112929 0.0750330 -1.1379491 49 O -1.2543072 0.4429481 0.2803528 0.4967066 -1.7669056 -0.4878037 0.1900947 -0.4628797 -1.7923330 50 O -1.3943532 -0.3539190 0.0965101 -0.3629358 -2.2481952 -0.0994731 0.1383237 -0.0054928 -1.1110148 51 O -1.6411987 -0.0010094 -0.4987417 0.0678023 -1.1766608 0.0865387 -0.4739422 -0.0209362 -1.8548501 52 O -2.1779034 -0.5256764 -0.1119514 -0.4199902 -1.4364165 0.1341255 -0.2112929 0.0750330 -1.1379491 53 O -1.2315301 0.1445122 0.0224411 0.2194322 -2.1068631 0.2677119 -0.0437078 0.3567017 -1.3491687 54 O -1.5289202 -0.0536808 -0.3197014 -0.0561433 -0.9562032 -0.0625175 -0.4825500 -0.1922132 -2.1777532 55 O -2.1779034 0.5256764 -0.1119514 0.4199902 -1.4364165 -0.1341255 -0.2112929 -0.0750330 -1.1379491 56 O -1.3943532 -0.3539190 0.0965101 -0.3629358 -2.2481952 -0.0994731 0.1383237 -0.0054928 -1.1110148 57 O -1.5289202 -0.0536808 -0.3197014 -0.0561433 -0.9562032 -0.0625175 -0.4825500 -0.1922132 -2.1777532 58 O -1.4705032 0.1928702 0.4088521 0.1632507 -1.4241877 -0.2521950 0.3181114 -0.3531991 -1.8093979 59 O -1.6411987 -0.0010094 -0.4987417 0.0678023 -1.1766608 0.0865387 -0.4739422 -0.0209362 -1.8548501 60 O -1.6411987 0.0010094 -0.4987417 -0.0678023 -1.1766608 -0.0865387 -0.4739422 0.0209362 -1.8548501 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 360/360 Permutation basis: 32580/32580 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 8235 Number of blocks in projector: 8235 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 1800 Use submatrix version of eigh solver. (1) Block: 500 / 1800 (2) Block: 250 / 500 (2) 220 eigenvectors found. (2) Block: 500 / 500 (2) 226 eigenvectors found. (2) Complementary block size: 54 (2) Compute compressed projector. (2) Use standard solver. (2) 24 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1000 / 1800 (2) Block: 250 / 500 (2) 227 eigenvectors found. (2) Block: 500 / 500 (2) 220 eigenvectors found. (2) Complementary block size: 53 (2) Compute compressed projector. (2) Use standard solver. (2) 23 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1500 / 1800 (2) Block: 250 / 500 (2) 228 eigenvectors found. (2) Block: 500 / 500 (2) 224 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 22 eigenvectors found. (1) 474 eigenvectors found. (1) Block: 1800 / 1800 (1) 279 eigenvectors found. (1) Complementary block size: 107 (1) Compute compressed projector. (1) Use standard solver. (1) 77 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1800 Use submatrix version of eigh solver. (1) Block: 500 / 1800 (2) Block: 250 / 500 (2) 220 eigenvectors found. (2) Block: 500 / 500 (2) 226 eigenvectors found. (2) Complementary block size: 54 (2) Compute compressed projector. (2) Use standard solver. (2) 24 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1000 / 1800 (2) Block: 250 / 500 (2) 227 eigenvectors found. (2) Block: 500 / 500 (2) 220 eigenvectors found. (2) Complementary block size: 53 (2) Compute compressed projector. (2) Use standard solver. (2) 23 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1500 / 1800 (2) Block: 250 / 500 (2) 228 eigenvectors found. (2) Block: 500 / 500 (2) 224 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 22 eigenvectors found. (1) 474 eigenvectors found. (1) Block: 1800 / 1800 (1) 279 eigenvectors found. (1) Complementary block size: 107 (1) Compute compressed projector. (1) Use standard solver. (1) 77 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1800 Use submatrix version of eigh solver. (1) Block: 500 / 1800 (2) Block: 250 / 500 (2) 221 eigenvectors found. (2) Block: 500 / 500 (2) 223 eigenvectors found. (2) Complementary block size: 56 (2) Compute compressed projector. (2) Use standard solver. (2) 27 eigenvectors found. (1) 471 eigenvectors found. (1) Block: 1000 / 1800 (2) Block: 250 / 500 (2) 225 eigenvectors found. (2) Block: 500 / 500 (2) 227 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 23 eigenvectors found. (1) 475 eigenvectors found. (1) Block: 1500 / 1800 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 1800 / 1800 (1) 287 eigenvectors found. (1) Complementary block size: 86 (1) Compute compressed projector. (1) Use standard solver. (1) 57 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 945 Use submatrix version of eigh solver. (1) Block: 500 / 945 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 945 / 945 (1) 430 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 945 Use submatrix version of eigh solver. (1) Block: 500 / 945 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 945 / 945 (1) 430 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 945 Use submatrix version of eigh solver. (1) Block: 500 / 945 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 945 / 945 (1) 430 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. Tree of FC basis block matrices: - (8235, 8101), data: False |-- (945, 930), data: False |-- (945, 15), data: (945, 30) @ (30, 15) |-- (445, 430), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (945, 930), data: False |-- (945, 15), data: (945, 30) @ (30, 15) |-- (445, 430), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (945, 930), data: False |-- (945, 15), data: (945, 30) @ (30, 15) |-- (445, 430), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (1800, 1771), data: False |-- (1800, 57), data: (1800, 86) @ (86, 57) |-- (300, 287), data: True |-- (500, 481), data: False |-- (500, 17), data: (500, 36) @ (36, 17) |-- (250, 233), data: True |-- (250, 231), data: True |-- (500, 475), data: False |-- (500, 23), data: (500, 48) @ (48, 23) |-- (250, 227), data: True |-- (250, 225), data: True |-- (500, 471), data: False |-- (500, 27), data: (500, 56) @ (56, 27) |-- (250, 223), data: True |-- (250, 221), data: True |-- (1800, 1770), data: False |-- (1800, 77), data: (1800, 107) @ (107, 77) |-- (300, 279), data: True |-- (500, 474), data: False |-- (500, 22), data: (500, 48) @ (48, 22) |-- (250, 224), data: True |-- (250, 228), data: True |-- (500, 470), data: False |-- (500, 23), data: (500, 53) @ (53, 23) |-- (250, 220), data: True |-- (250, 227), data: True |-- (500, 470), data: False |-- (500, 24), data: (500, 54) @ (54, 24) |-- (250, 226), data: True |-- (250, 220), data: True |-- (1800, 1770), data: False |-- (1800, 77), data: (1800, 107) @ (107, 77) |-- (300, 279), data: True |-- (500, 474), data: False |-- (500, 22), data: (500, 48) @ (48, 22) |-- (250, 224), data: True |-- (250, 228), data: True |-- (500, 470), data: False |-- (500, 23), data: (500, 53) @ (53, 23) |-- (250, 220), data: True |-- (250, 227), data: True |-- (500, 470), data: False |-- (500, 24), data: (500, 54) @ (54, 24) |-- (250, 226), data: True |-- (250, 220), data: True ----- Solver_atoms: 1 -- 120 / 120 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 1840 - Time: 3.777 Solver_block: 200 / 1840 - Time: 3.857 Solver_block: 300 / 1840 - Time: 3.239 Solver_block: 400 / 1840 - Time: 2.994 Solver_block: 500 / 1840 - Time: 3.305 Solver_block: 600 / 1840 - Time: 2.843 Solver_block: 700 / 1840 - Time: 3.015 Solver_block: 800 / 1840 - Time: 3.622 Solver_block: 900 / 1840 - Time: 3.331 Solver_block: 1000 / 1840 - Time: 4.368 Solver_block: 1100 / 1840 - Time: 3.715 Solver_block: 1200 / 1840 - Time: 3.172 Solver_block: 1300 / 1840 - Time: 3.270 Solver_block: 1400 / 1840 - Time: 3.332 Solver_block: 1500 / 1840 - Time: 3.629 Solver_block: 1600 / 1840 - Time: 3.547 Solver_block: 1700 / 1840 - Time: 2.892 Solver_block: 1800 / 1840 - Time: 3.007 Solver_block: 1840 / 1840 - Time: 1.179 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 64.483 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 360/360 Permutation basis: 32580/32580 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 8235 Number of blocks in projector: 8235 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 1800 Use submatrix version of eigh solver. (1) Block: 500 / 1800 (2) Block: 250 / 500 (2) 220 eigenvectors found. (2) Block: 500 / 500 (2) 226 eigenvectors found. (2) Complementary block size: 54 (2) Compute compressed projector. (2) Use standard solver. (2) 24 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1000 / 1800 (2) Block: 250 / 500 (2) 227 eigenvectors found. (2) Block: 500 / 500 (2) 220 eigenvectors found. (2) Complementary block size: 53 (2) Compute compressed projector. (2) Use standard solver. (2) 23 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1500 / 1800 (2) Block: 250 / 500 (2) 228 eigenvectors found. (2) Block: 500 / 500 (2) 224 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 22 eigenvectors found. (1) 474 eigenvectors found. (1) Block: 1800 / 1800 (1) 279 eigenvectors found. (1) Complementary block size: 107 (1) Compute compressed projector. (1) Use standard solver. (1) 77 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1800 Use submatrix version of eigh solver. (1) Block: 500 / 1800 (2) Block: 250 / 500 (2) 220 eigenvectors found. (2) Block: 500 / 500 (2) 226 eigenvectors found. (2) Complementary block size: 54 (2) Compute compressed projector. (2) Use standard solver. (2) 24 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1000 / 1800 (2) Block: 250 / 500 (2) 227 eigenvectors found. (2) Block: 500 / 500 (2) 220 eigenvectors found. (2) Complementary block size: 53 (2) Compute compressed projector. (2) Use standard solver. (2) 23 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 1500 / 1800 (2) Block: 250 / 500 (2) 228 eigenvectors found. (2) Block: 500 / 500 (2) 224 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 22 eigenvectors found. (1) 474 eigenvectors found. (1) Block: 1800 / 1800 (1) 279 eigenvectors found. (1) Complementary block size: 107 (1) Compute compressed projector. (1) Use standard solver. (1) 77 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1800 Use submatrix version of eigh solver. (1) Block: 500 / 1800 (2) Block: 250 / 500 (2) 221 eigenvectors found. (2) Block: 500 / 500 (2) 223 eigenvectors found. (2) Complementary block size: 56 (2) Compute compressed projector. (2) Use standard solver. (2) 27 eigenvectors found. (1) 471 eigenvectors found. (1) Block: 1000 / 1800 (2) Block: 250 / 500 (2) 225 eigenvectors found. (2) Block: 500 / 500 (2) 227 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 23 eigenvectors found. (1) 475 eigenvectors found. (1) Block: 1500 / 1800 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 1800 / 1800 (1) 287 eigenvectors found. (1) Complementary block size: 86 (1) Compute compressed projector. (1) Use standard solver. (1) 57 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 945 Use submatrix version of eigh solver. (1) Block: 500 / 945 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 945 / 945 (1) 430 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 945 Use submatrix version of eigh solver. (1) Block: 500 / 945 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 945 / 945 (1) 430 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 945 Use submatrix version of eigh solver. (1) Block: 500 / 945 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 945 / 945 (1) 430 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. Tree of FC basis block matrices: - (8235, 8101), data: False |-- (945, 930), data: False |-- (945, 15), data: (945, 30) @ (30, 15) |-- (445, 430), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (945, 930), data: False |-- (945, 15), data: (945, 30) @ (30, 15) |-- (445, 430), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (945, 930), data: False |-- (945, 15), data: (945, 30) @ (30, 15) |-- (445, 430), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (1800, 1771), data: False |-- (1800, 57), data: (1800, 86) @ (86, 57) |-- (300, 287), data: True |-- (500, 481), data: False |-- (500, 17), data: (500, 36) @ (36, 17) |-- (250, 233), data: True |-- (250, 231), data: True |-- (500, 475), data: False |-- (500, 23), data: (500, 48) @ (48, 23) |-- (250, 227), data: True |-- (250, 225), data: True |-- (500, 471), data: False |-- (500, 27), data: (500, 56) @ (56, 27) |-- (250, 223), data: True |-- (250, 221), data: True |-- (1800, 1770), data: False |-- (1800, 77), data: (1800, 107) @ (107, 77) |-- (300, 279), data: True |-- (500, 474), data: False |-- (500, 22), data: (500, 48) @ (48, 22) |-- (250, 224), data: True |-- (250, 228), data: True |-- (500, 470), data: False |-- (500, 23), data: (500, 53) @ (53, 23) |-- (250, 220), data: True |-- (250, 227), data: True |-- (500, 470), data: False |-- (500, 24), data: (500, 54) @ (54, 24) |-- (250, 226), data: True |-- (250, 220), data: True |-- (1800, 1770), data: False |-- (1800, 77), data: (1800, 107) @ (107, 77) |-- (300, 279), data: True |-- (500, 474), data: False |-- (500, 22), data: (500, 48) @ (48, 22) |-- (250, 224), data: True |-- (250, 228), data: True |-- (500, 470), data: False |-- (500, 23), data: (500, 53) @ (53, 23) |-- (250, 220), data: True |-- (250, 227), data: True |-- (500, 470), data: False |-- (500, 24), data: (500, 54) @ (54, 24) |-- (250, 226), data: True |-- (250, 220), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 13:48:01]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 13:48:03]------------------------- 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 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 8.092889090046015 0.000000000000000 0.000000000000000 b 0.000000000000000 10.255935230000002 0.000000000000000 c -2.061784907627885 0.000000000000000 7.811872142581329 Atomic positions (fractional): 1 Li 0.47802569956261 0.92471515024190 0.72776949586177 6.941 2 Li 0.84914901205738 0.34799631374314 0.84760129766803 6.941 3 Li 0.15085098794262 0.84799631374314 0.65239870233197 6.941 4 Li 0.52197430043739 0.07528484975810 0.27223050413823 6.941 5 Li 0.47802569956261 0.57528484975810 0.22776949586177 6.941 6 Li 0.15085098794262 0.65200368625686 0.15239870233197 6.941 7 Li 0.39936049179992 0.83656297483120 0.40091302504861 6.941 8 Li 0.34328381539789 0.16210510737057 0.84158059709583 6.941 9 Li 0.52197430043739 0.42471515024190 0.77223050413823 6.941 10 Li 0.84914901205738 0.15200368625686 0.34760129766803 6.941 11 Li 0.65671618460211 0.66210510737057 0.65841940290417 6.941 12 Li 0.34328381539789 0.33789489262943 0.34158059709583 6.941 13 Li 0.60063950820008 0.16343702516880 0.59908697495139 6.941 14 Li 0.65671618460211 0.83789489262943 0.15841940290417 6.941 15 Li 0.60063950820008 0.33656297483120 0.09908697495139 6.941 16 Li 0.39936049179992 0.66343702516880 0.90091302504861 6.941 17 Zn 0.09061525832214 0.15632981114621 0.08957818402043 65.380 18 Zn 0.09061525832214 0.34367018885379 0.58957818402043 65.380 19 Zn 0.90938474167786 0.84367018885379 0.91042181597957 65.380 20 Zn 0.90938474167786 0.65632981114621 0.41042181597957 65.380 21 P 0.76919868931142 0.90748045189569 0.53488530955949 30.974 22 P 0.23080131068858 0.09251954810431 0.46511469044051 30.974 23 P 0.70941648386110 0.09142661712393 0.97197516358861 30.974 24 P 0.29058351613890 0.59142661712393 0.52802483641139 30.974 25 P 0.76919868931142 0.59251954810431 0.03488530955949 30.974 26 P 0.70941648386110 0.40857338287607 0.47197516358861 30.974 27 P 0.29058351613890 0.90857338287607 0.02802483641139 30.974 28 P 0.23080131068858 0.40748045189569 0.96511469044051 30.974 29 O 0.38301012805772 0.34414565178294 0.91114025698627 15.999 30 O 0.33918212749893 0.65179324102541 0.37166603671628 15.999 31 O 0.75600083661331 0.94547018945729 0.01004725521415 15.999 32 O 0.24399916338669 0.05452981054272 0.98995274478585 15.999 33 O 0.61698987194228 0.84414565178294 0.58885974301373 15.999 34 O 0.66081787250107 0.15179324102541 0.12833396328372 15.999 35 O 0.80792159358423 0.66967959658721 0.88351513609079 15.999 36 O 0.55843928696336 0.40065597655617 0.31013355913676 15.999 37 O 0.66081787250107 0.34820675897459 0.62833396328372 15.999 38 O 0.06813106601075 0.10157853216628 0.31268532633148 15.999 39 O 0.72528320931337 0.04921106742330 0.47747314722447 15.999 40 O 0.93186893398925 0.89842146783372 0.68731467366852 15.999 41 O 0.72528320931337 0.45078893257670 0.97747314722447 15.999 42 O 0.61698987194228 0.65585434821706 0.08885974301373 15.999 43 O 0.27471679068663 0.54921106742331 0.02252685277552 15.999 44 O 0.38301012805772 0.15585434821706 0.41114025698627 15.999 45 O 0.86273172333922 0.33286451395664 0.43517660397260 15.999 46 O 0.80792159358423 0.83032040341279 0.38351513609079 15.999 47 O 0.19207840641577 0.33032040341279 0.11648486390922 15.999 48 O 0.13726827666078 0.83286451395664 0.06482339602740 15.999 49 O 0.19207840641577 0.16967959658721 0.61648486390921 15.999 50 O 0.75600083661331 0.55452981054271 0.51004725521415 15.999 51 O 0.44156071303664 0.90065597655617 0.18986644086324 15.999 52 O 0.86273172333922 0.16713548604336 0.93517660397260 15.999 53 O 0.27471679068663 0.95078893257669 0.52252685277553 15.999 54 O 0.93186893398925 0.60157853216628 0.18731467366852 15.999 55 O 0.13726827666078 0.66713548604336 0.56482339602740 15.999 56 O 0.24399916338669 0.44547018945729 0.48995274478585 15.999 57 O 0.06813106601075 0.39842146783372 0.81268532633148 15.999 58 O 0.33918212749893 0.84820675897459 0.87166603671628 15.999 59 O 0.55843928696336 0.09934402344383 0.81013355913676 15.999 60 O 0.44156071303664 0.59934402344383 0.68986644086324 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 8.092889090046015 0.000000000000000 0.000000000000000 b 0.000000000000000 10.255935230000002 0.000000000000000 c -4.123569815255770 0.000000000000000 15.623744285162658 Atomic positions (fractional): 1 Li 0.47802569956261 0.92471515024190 0.36388474793089 6.941 > 1 2 Li 0.47802569956261 0.92471515024190 0.86388474793089 6.941 > 1 3 Li 0.84914901205738 0.34799631374314 0.42380064883402 6.941 > 3 4 Li 0.84914901205738 0.34799631374314 0.92380064883402 6.941 > 3 5 Li 0.15085098794262 0.84799631374314 0.32619935116598 6.941 > 5 6 Li 0.15085098794262 0.84799631374314 0.82619935116598 6.941 > 5 7 Li 0.52197430043739 0.07528484975810 0.13611525206911 6.941 > 7 8 Li 0.52197430043739 0.07528484975810 0.63611525206911 6.941 > 7 9 Li 0.47802569956261 0.57528484975810 0.11388474793089 6.941 > 9 10 Li 0.47802569956261 0.57528484975810 0.61388474793089 6.941 > 9 11 Li 0.15085098794262 0.65200368625686 0.07619935116598 6.941 > 11 12 Li 0.15085098794262 0.65200368625686 0.57619935116598 6.941 > 11 13 Li 0.39936049179992 0.83656297483120 0.20045651252430 6.941 > 13 14 Li 0.39936049179992 0.83656297483120 0.70045651252430 6.941 > 13 15 Li 0.34328381539789 0.16210510737057 0.42079029854791 6.941 > 15 16 Li 0.34328381539789 0.16210510737057 0.92079029854791 6.941 > 15 17 Li 0.52197430043739 0.42471515024190 0.38611525206911 6.941 > 17 18 Li 0.52197430043739 0.42471515024190 0.88611525206911 6.941 > 17 19 Li 0.84914901205738 0.15200368625686 0.17380064883402 6.941 > 19 20 Li 0.84914901205738 0.15200368625686 0.67380064883402 6.941 > 19 21 Li 0.65671618460211 0.66210510737057 0.32920970145209 6.941 > 21 22 Li 0.65671618460211 0.66210510737057 0.82920970145209 6.941 > 21 23 Li 0.34328381539789 0.33789489262943 0.17079029854791 6.941 > 23 24 Li 0.34328381539789 0.33789489262943 0.67079029854791 6.941 > 23 25 Li 0.60063950820008 0.16343702516880 0.29954348747569 6.941 > 25 26 Li 0.60063950820008 0.16343702516880 0.79954348747570 6.941 > 25 27 Li 0.65671618460211 0.83789489262943 0.07920970145209 6.941 > 27 28 Li 0.65671618460211 0.83789489262943 0.57920970145209 6.941 > 27 29 Li 0.60063950820008 0.33656297483120 0.04954348747570 6.941 > 29 30 Li 0.60063950820008 0.33656297483120 0.54954348747570 6.941 > 29 31 Li 0.39936049179992 0.66343702516880 0.45045651252431 6.941 > 31 32 Li 0.39936049179992 0.66343702516880 0.95045651252430 6.941 > 31 33 Zn 0.09061525832214 0.15632981114621 0.04478909201022 65.380 > 33 34 Zn 0.09061525832214 0.15632981114621 0.54478909201022 65.380 > 33 35 Zn 0.09061525832214 0.34367018885379 0.29478909201022 65.380 > 35 36 Zn 0.09061525832214 0.34367018885379 0.79478909201022 65.380 > 35 37 Zn 0.90938474167786 0.84367018885379 0.45521090798978 65.380 > 37 38 Zn 0.90938474167786 0.84367018885379 0.95521090798978 65.380 > 37 39 Zn 0.90938474167786 0.65632981114621 0.20521090798978 65.380 > 39 40 Zn 0.90938474167786 0.65632981114621 0.70521090798978 65.380 > 39 41 P 0.76919868931142 0.90748045189569 0.26744265477974 30.974 > 41 42 P 0.76919868931142 0.90748045189569 0.76744265477974 30.974 > 41 43 P 0.23080131068858 0.09251954810431 0.23255734522026 30.974 > 43 44 P 0.23080131068858 0.09251954810431 0.73255734522026 30.974 > 43 45 P 0.70941648386110 0.09142661712393 0.48598758179430 30.974 > 45 46 P 0.70941648386110 0.09142661712393 0.98598758179430 30.974 > 45 47 P 0.29058351613890 0.59142661712393 0.26401241820570 30.974 > 47 48 P 0.29058351613890 0.59142661712393 0.76401241820570 30.974 > 47 49 P 0.76919868931142 0.59251954810431 0.01744265477974 30.974 > 49 50 P 0.76919868931142 0.59251954810431 0.51744265477974 30.974 > 49 51 P 0.70941648386110 0.40857338287607 0.23598758179430 30.974 > 51 52 P 0.70941648386110 0.40857338287607 0.73598758179430 30.974 > 51 53 P 0.29058351613890 0.90857338287607 0.01401241820570 30.974 > 53 54 P 0.29058351613890 0.90857338287607 0.51401241820570 30.974 > 53 55 P 0.23080131068858 0.40748045189569 0.48255734522026 30.974 > 55 56 P 0.23080131068858 0.40748045189569 0.98255734522026 30.974 > 55 57 O 0.38301012805772 0.34414565178294 0.45557012849314 15.999 > 57 58 O 0.38301012805772 0.34414565178294 0.95557012849314 15.999 > 57 59 O 0.33918212749893 0.65179324102541 0.18583301835814 15.999 > 59 60 O 0.33918212749893 0.65179324102541 0.68583301835814 15.999 > 59 61 O 0.75600083661331 0.94547018945729 0.00502362760708 15.999 > 61 62 O 0.75600083661331 0.94547018945729 0.50502362760708 15.999 > 61 63 O 0.24399916338669 0.05452981054272 0.49497637239292 15.999 > 63 64 O 0.24399916338669 0.05452981054272 0.99497637239292 15.999 > 63 65 O 0.61698987194228 0.84414565178294 0.29442987150686 15.999 > 65 66 O 0.61698987194228 0.84414565178294 0.79442987150686 15.999 > 65 67 O 0.66081787250107 0.15179324102541 0.06416698164186 15.999 > 67 68 O 0.66081787250107 0.15179324102541 0.56416698164186 15.999 > 67 69 O 0.80792159358423 0.66967959658721 0.44175756804539 15.999 > 69 70 O 0.80792159358423 0.66967959658721 0.94175756804539 15.999 > 69 71 O 0.55843928696336 0.40065597655617 0.15506677956838 15.999 > 71 72 O 0.55843928696336 0.40065597655617 0.65506677956838 15.999 > 71 73 O 0.66081787250107 0.34820675897459 0.31416698164186 15.999 > 73 74 O 0.66081787250107 0.34820675897459 0.81416698164186 15.999 > 73 75 O 0.06813106601075 0.10157853216628 0.15634266316574 15.999 > 75 76 O 0.06813106601075 0.10157853216628 0.65634266316574 15.999 > 75 77 O 0.72528320931337 0.04921106742330 0.23873657361224 15.999 > 77 78 O 0.72528320931337 0.04921106742330 0.73873657361224 15.999 > 77 79 O 0.93186893398925 0.89842146783372 0.34365733683426 15.999 > 79 80 O 0.93186893398925 0.89842146783372 0.84365733683426 15.999 > 79 81 O 0.72528320931337 0.45078893257670 0.48873657361224 15.999 > 81 82 O 0.72528320931337 0.45078893257670 0.98873657361224 15.999 > 81 83 O 0.61698987194228 0.65585434821706 0.04442987150686 15.999 > 83 84 O 0.61698987194228 0.65585434821706 0.54442987150686 15.999 > 83 85 O 0.27471679068663 0.54921106742331 0.01126342638776 15.999 > 85 86 O 0.27471679068663 0.54921106742331 0.51126342638776 15.999 > 85 87 O 0.38301012805772 0.15585434821706 0.20557012849314 15.999 > 87 88 O 0.38301012805772 0.15585434821706 0.70557012849314 15.999 > 87 89 O 0.86273172333922 0.33286451395664 0.21758830198630 15.999 > 89 90 O 0.86273172333922 0.33286451395664 0.71758830198630 15.999 > 89 91 O 0.80792159358423 0.83032040341279 0.19175756804539 15.999 > 91 92 O 0.80792159358423 0.83032040341279 0.69175756804539 15.999 > 91 93 O 0.19207840641577 0.33032040341279 0.05824243195461 15.999 > 93 94 O 0.19207840641577 0.33032040341279 0.55824243195461 15.999 > 93 95 O 0.13726827666078 0.83286451395664 0.03241169801370 15.999 > 95 96 O 0.13726827666078 0.83286451395664 0.53241169801370 15.999 > 95 97 O 0.19207840641577 0.16967959658721 0.30824243195461 15.999 > 97 98 O 0.19207840641577 0.16967959658721 0.80824243195461 15.999 > 97 99 O 0.75600083661331 0.55452981054271 0.25502362760708 15.999 > 99 100 O 0.75600083661331 0.55452981054271 0.75502362760708 15.999 > 99 101 O 0.44156071303664 0.90065597655617 0.09493322043162 15.999 > 101 102 O 0.44156071303664 0.90065597655617 0.59493322043162 15.999 > 101 103 O 0.86273172333922 0.16713548604336 0.46758830198630 15.999 > 103 104 O 0.86273172333922 0.16713548604336 0.96758830198630 15.999 > 103 105 O 0.27471679068663 0.95078893257669 0.26126342638776 15.999 > 105 106 O 0.27471679068663 0.95078893257669 0.76126342638776 15.999 > 105 107 O 0.93186893398925 0.60157853216628 0.09365733683426 15.999 > 107 108 O 0.93186893398925 0.60157853216628 0.59365733683426 15.999 > 107 109 O 0.13726827666078 0.66713548604336 0.28241169801370 15.999 > 109 110 O 0.13726827666078 0.66713548604336 0.78241169801370 15.999 > 109 111 O 0.24399916338669 0.44547018945729 0.24497637239292 15.999 > 111 112 O 0.24399916338669 0.44547018945729 0.74497637239292 15.999 > 111 113 O 0.06813106601075 0.39842146783372 0.40634266316574 15.999 > 113 114 O 0.06813106601075 0.39842146783372 0.90634266316574 15.999 > 113 115 O 0.33918212749893 0.84820675897459 0.43583301835814 15.999 > 115 116 O 0.33918212749893 0.84820675897459 0.93583301835814 15.999 > 115 117 O 0.55843928696336 0.09934402344383 0.40506677956838 15.999 > 117 118 O 0.55843928696336 0.09934402344383 0.90506677956838 15.999 > 117 119 O 0.44156071303664 0.59934402344383 0.34493322043162 15.999 > 119 120 O 0.44156071303664 0.59934402344383 0.84493322043162 15.999 > 119 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.6219301 0.0000000 0.0265482 0.0000000 2.6091248 0.0000000 0.0265473 0.0000000 2.6217065 -------------------------- Born effective charges -------------------------- 1 Li 1.1575879 0.0767896 -0.0312387 -0.0597561 0.9375752 -0.0164070 -0.0223054 0.0674891 1.1356938 2 Li 1.0676875 0.0189430 -0.0358845 -0.1247374 1.0899212 -0.0388625 0.0274214 -0.0517265 1.0452861 3 Li 1.0676875 -0.0189430 -0.0358845 0.1247374 1.0899212 0.0388625 0.0274214 0.0517265 1.0452861 4 Li 1.1575879 0.0767896 -0.0312387 -0.0597561 0.9375752 -0.0164070 -0.0223054 0.0674891 1.1356938 5 Li 1.1575879 -0.0767896 -0.0312387 0.0597561 0.9375752 0.0164070 -0.0223054 -0.0674891 1.1356938 6 Li 1.0676875 0.0189430 -0.0358845 -0.1247374 1.0899212 -0.0388625 0.0274214 -0.0517265 1.0452861 7 Li 0.9926747 0.0474194 0.0988598 -0.0361386 1.1329742 0.0575724 0.0036055 -0.0871040 1.0525290 8 Li 1.0234591 -0.0701810 -0.0424428 -0.0028078 1.0417682 -0.0668237 0.0686810 -0.0518030 1.0619619 9 Li 1.1575879 -0.0767896 -0.0312387 0.0597561 0.9375752 0.0164070 -0.0223054 -0.0674891 1.1356938 10 Li 1.0676875 -0.0189430 -0.0358845 0.1247374 1.0899212 0.0388625 0.0274214 0.0517265 1.0452861 11 Li 1.0234591 0.0701810 -0.0424428 0.0028078 1.0417682 0.0668237 0.0686810 0.0518030 1.0619619 12 Li 1.0234591 0.0701810 -0.0424428 0.0028078 1.0417682 0.0668237 0.0686810 0.0518030 1.0619619 13 Li 0.9926747 0.0474194 0.0988598 -0.0361386 1.1329742 0.0575724 0.0036055 -0.0871040 1.0525290 14 Li 1.0234591 -0.0701810 -0.0424428 -0.0028078 1.0417682 -0.0668237 0.0686810 -0.0518030 1.0619619 15 Li 0.9926747 -0.0474194 0.0988598 0.0361386 1.1329742 -0.0575724 0.0036055 0.0871040 1.0525290 16 Li 0.9926747 -0.0474194 0.0988598 0.0361386 1.1329742 -0.0575724 0.0036055 0.0871040 1.0525290 17 Zn 2.0646704 0.0709594 0.2157050 -0.0115586 2.0078666 0.1533714 -0.0653183 -0.2055578 1.9819563 18 Zn 2.0646704 -0.0709594 0.2157050 0.0115586 2.0078666 -0.1533714 -0.0653183 0.2055578 1.9819563 19 Zn 2.0646704 0.0709594 0.2157050 -0.0115586 2.0078666 0.1533714 -0.0653183 -0.2055578 1.9819563 20 Zn 2.0646704 -0.0709594 0.2157050 0.0115586 2.0078666 -0.1533714 -0.0653183 0.2055578 1.9819563 21 P 3.0028833 -0.0842922 -0.1901593 -0.3303469 3.0551100 0.2409424 0.2531957 -0.1369120 3.3610504 22 P 3.0028833 -0.0842922 -0.1901593 -0.3303469 3.0551100 0.2409424 0.2531957 -0.1369120 3.3610504 23 P 3.3300931 0.0256250 -0.0757496 0.0353517 3.2018233 -0.1217009 0.1606292 0.3348563 2.9221992 24 P 3.3300931 -0.0256250 -0.0757496 -0.0353517 3.2018233 0.1217009 0.1606292 -0.3348563 2.9221992 25 P 3.0028833 0.0842922 -0.1901593 0.3303469 3.0551100 -0.2409424 0.2531957 0.1369120 3.3610504 26 P 3.3300931 -0.0256250 -0.0757496 -0.0353517 3.2018233 0.1217009 0.1606292 -0.3348563 2.9221992 27 P 3.3300931 0.0256250 -0.0757496 0.0353517 3.2018233 -0.1217009 0.1606292 0.3348563 2.9221992 28 P 3.0028833 0.0842922 -0.1901593 0.3303469 3.0551100 -0.2409424 0.2531957 0.1369120 3.3610504 29 O -1.9403399 0.3299920 0.1831486 0.1590832 -1.3516067 -0.0380498 0.1390540 -0.1147854 -1.3282098 30 O -1.4705032 -0.1928702 0.4088521 -0.1632507 -1.4241877 0.2521950 0.3181114 0.3531991 -1.8093979 31 O -1.3943532 0.3539190 0.0965101 0.3629358 -2.2481952 0.0994731 0.1383237 0.0054928 -1.1110148 32 O -1.3943532 0.3539190 0.0965101 0.3629358 -2.2481952 0.0994731 0.1383237 0.0054928 -1.1110148 33 O -1.9403399 -0.3299920 0.1831486 -0.1590832 -1.3516067 0.0380498 0.1390540 0.1147854 -1.3282098 34 O -1.4705032 0.1928702 0.4088521 0.1632507 -1.4241877 -0.2521950 0.3181114 -0.3531991 -1.8093979 35 O -1.2543072 -0.4429481 0.2803528 -0.4967066 -1.7669056 0.4878037 0.1900947 0.4628797 -1.7923330 36 O -1.6411987 0.0010094 -0.4987417 -0.0678023 -1.1766608 -0.0865387 -0.4739422 0.0209362 -1.8548501 37 O -1.4705032 -0.1928702 0.4088521 -0.1632507 -1.4241877 0.2521950 0.3181114 0.3531991 -1.8093979 38 O -1.5289202 0.0536808 -0.3197014 0.0561433 -0.9562032 0.0625175 -0.4825500 0.1922132 -2.1777532 39 O -1.2315301 0.1445122 0.0224411 0.2194322 -2.1068631 0.2677119 -0.0437078 0.3567017 -1.3491687 40 O -1.5289202 0.0536808 -0.3197014 0.0561433 -0.9562032 0.0625175 -0.4825500 0.1922132 -2.1777532 41 O -1.2315301 -0.1445122 0.0224411 -0.2194322 -2.1068631 -0.2677119 -0.0437078 -0.3567017 -1.3491687 42 O -1.9403399 0.3299920 0.1831486 0.1590832 -1.3516067 -0.0380498 0.1390540 -0.1147854 -1.3282098 43 O -1.2315301 -0.1445122 0.0224411 -0.2194322 -2.1068631 -0.2677119 -0.0437078 -0.3567017 -1.3491687 44 O -1.9403399 -0.3299920 0.1831486 -0.1590832 -1.3516067 0.0380498 0.1390540 0.1147854 -1.3282098 45 O -2.1779034 0.5256764 -0.1119514 0.4199902 -1.4364165 -0.1341255 -0.2112929 -0.0750330 -1.1379491 46 O -1.2543072 0.4429481 0.2803528 0.4967066 -1.7669056 -0.4878037 0.1900947 -0.4628797 -1.7923330 47 O -1.2543072 -0.4429481 0.2803528 -0.4967066 -1.7669056 0.4878037 0.1900947 0.4628797 -1.7923330 48 O -2.1779034 -0.5256764 -0.1119514 -0.4199902 -1.4364165 0.1341255 -0.2112929 0.0750330 -1.1379491 49 O -1.2543072 0.4429481 0.2803528 0.4967066 -1.7669056 -0.4878037 0.1900947 -0.4628797 -1.7923330 50 O -1.3943532 -0.3539190 0.0965101 -0.3629358 -2.2481952 -0.0994731 0.1383237 -0.0054928 -1.1110148 51 O -1.6411987 -0.0010094 -0.4987417 0.0678023 -1.1766608 0.0865387 -0.4739422 -0.0209362 -1.8548501 52 O -2.1779034 -0.5256764 -0.1119514 -0.4199902 -1.4364165 0.1341255 -0.2112929 0.0750330 -1.1379491 53 O -1.2315301 0.1445122 0.0224411 0.2194322 -2.1068631 0.2677119 -0.0437078 0.3567017 -1.3491687 54 O -1.5289202 -0.0536808 -0.3197014 -0.0561433 -0.9562032 -0.0625175 -0.4825500 -0.1922132 -2.1777532 55 O -2.1779034 0.5256764 -0.1119514 0.4199902 -1.4364165 -0.1341255 -0.2112929 -0.0750330 -1.1379491 56 O -1.3943532 -0.3539190 0.0965101 -0.3629358 -2.2481952 -0.0994731 0.1383237 -0.0054928 -1.1110148 57 O -1.5289202 -0.0536808 -0.3197014 -0.0561433 -0.9562032 -0.0625175 -0.4825500 -0.1922132 -2.1777532 58 O -1.4705032 0.1928702 0.4088521 0.1632507 -1.4241877 -0.2521950 0.3181114 -0.3531991 -1.8093979 59 O -1.6411987 -0.0010094 -0.4987417 0.0678023 -1.1766608 0.0865387 -0.4739422 -0.0209362 -1.8548501 60 O -1.6411987 0.0010094 -0.4987417 -0.0678023 -1.1766608 -0.0865387 -0.4739422 0.0209362 -1.8548501 ---------------------------------------------------------------------------- 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] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 3, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 13, 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] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 15, 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] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 41, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 45, 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] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 57, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 59, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 61, 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] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 69, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 71, 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] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 75, 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] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 77, 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] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Computing fc3[ 89, 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] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000000 (yyy) 0.00000000 (yyy) 0.00000000 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (zx) 0.00000000 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 13:49:26]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 13:49:26]------------------------- 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 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 8.092889090046015 0.000000000000000 0.000000000000000 b 0.000000000000000 10.255935230000002 0.000000000000000 c -2.061784907627885 0.000000000000000 7.811872142581329 Atomic positions (fractional): 1 Li 0.47802569956261 0.92471515024190 0.72776949586177 6.941 2 Li 0.84914901205738 0.34799631374314 0.84760129766803 6.941 3 Li 0.15085098794262 0.84799631374314 0.65239870233197 6.941 4 Li 0.52197430043739 0.07528484975810 0.27223050413823 6.941 5 Li 0.47802569956261 0.57528484975810 0.22776949586177 6.941 6 Li 0.15085098794262 0.65200368625686 0.15239870233197 6.941 7 Li 0.39936049179992 0.83656297483120 0.40091302504861 6.941 8 Li 0.34328381539789 0.16210510737057 0.84158059709583 6.941 9 Li 0.52197430043739 0.42471515024190 0.77223050413823 6.941 10 Li 0.84914901205738 0.15200368625686 0.34760129766803 6.941 11 Li 0.65671618460211 0.66210510737057 0.65841940290417 6.941 12 Li 0.34328381539789 0.33789489262943 0.34158059709583 6.941 13 Li 0.60063950820008 0.16343702516880 0.59908697495139 6.941 14 Li 0.65671618460211 0.83789489262943 0.15841940290417 6.941 15 Li 0.60063950820008 0.33656297483120 0.09908697495139 6.941 16 Li 0.39936049179992 0.66343702516880 0.90091302504861 6.941 17 Zn 0.09061525832214 0.15632981114621 0.08957818402043 65.380 18 Zn 0.09061525832214 0.34367018885379 0.58957818402043 65.380 19 Zn 0.90938474167786 0.84367018885379 0.91042181597957 65.380 20 Zn 0.90938474167786 0.65632981114621 0.41042181597957 65.380 21 P 0.76919868931142 0.90748045189569 0.53488530955949 30.974 22 P 0.23080131068858 0.09251954810431 0.46511469044051 30.974 23 P 0.70941648386110 0.09142661712393 0.97197516358861 30.974 24 P 0.29058351613890 0.59142661712393 0.52802483641139 30.974 25 P 0.76919868931142 0.59251954810431 0.03488530955949 30.974 26 P 0.70941648386110 0.40857338287607 0.47197516358861 30.974 27 P 0.29058351613890 0.90857338287607 0.02802483641139 30.974 28 P 0.23080131068858 0.40748045189569 0.96511469044051 30.974 29 O 0.38301012805772 0.34414565178294 0.91114025698627 15.999 30 O 0.33918212749893 0.65179324102541 0.37166603671628 15.999 31 O 0.75600083661331 0.94547018945729 0.01004725521415 15.999 32 O 0.24399916338669 0.05452981054272 0.98995274478585 15.999 33 O 0.61698987194228 0.84414565178294 0.58885974301373 15.999 34 O 0.66081787250107 0.15179324102541 0.12833396328372 15.999 35 O 0.80792159358423 0.66967959658721 0.88351513609079 15.999 36 O 0.55843928696336 0.40065597655617 0.31013355913676 15.999 37 O 0.66081787250107 0.34820675897459 0.62833396328372 15.999 38 O 0.06813106601075 0.10157853216628 0.31268532633148 15.999 39 O 0.72528320931337 0.04921106742330 0.47747314722447 15.999 40 O 0.93186893398925 0.89842146783372 0.68731467366852 15.999 41 O 0.72528320931337 0.45078893257670 0.97747314722447 15.999 42 O 0.61698987194228 0.65585434821706 0.08885974301373 15.999 43 O 0.27471679068663 0.54921106742331 0.02252685277552 15.999 44 O 0.38301012805772 0.15585434821706 0.41114025698627 15.999 45 O 0.86273172333922 0.33286451395664 0.43517660397260 15.999 46 O 0.80792159358423 0.83032040341279 0.38351513609079 15.999 47 O 0.19207840641577 0.33032040341279 0.11648486390922 15.999 48 O 0.13726827666078 0.83286451395664 0.06482339602740 15.999 49 O 0.19207840641577 0.16967959658721 0.61648486390921 15.999 50 O 0.75600083661331 0.55452981054271 0.51004725521415 15.999 51 O 0.44156071303664 0.90065597655617 0.18986644086324 15.999 52 O 0.86273172333922 0.16713548604336 0.93517660397260 15.999 53 O 0.27471679068663 0.95078893257669 0.52252685277553 15.999 54 O 0.93186893398925 0.60157853216628 0.18731467366852 15.999 55 O 0.13726827666078 0.66713548604336 0.56482339602740 15.999 56 O 0.24399916338669 0.44547018945729 0.48995274478585 15.999 57 O 0.06813106601075 0.39842146783372 0.81268532633148 15.999 58 O 0.33918212749893 0.84820675897459 0.87166603671628 15.999 59 O 0.55843928696336 0.09934402344383 0.81013355913676 15.999 60 O 0.44156071303664 0.59934402344383 0.68986644086324 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 8.092889090046015 0.000000000000000 0.000000000000000 b 0.000000000000000 10.255935230000002 0.000000000000000 c -4.123569815255770 0.000000000000000 15.623744285162658 Atomic positions (fractional): 1 Li 0.47802569956261 0.92471515024190 0.36388474793089 6.941 > 1 2 Li 0.47802569956261 0.92471515024190 0.86388474793089 6.941 > 1 3 Li 0.84914901205738 0.34799631374314 0.42380064883402 6.941 > 3 4 Li 0.84914901205738 0.34799631374314 0.92380064883402 6.941 > 3 5 Li 0.15085098794262 0.84799631374314 0.32619935116598 6.941 > 5 6 Li 0.15085098794262 0.84799631374314 0.82619935116598 6.941 > 5 7 Li 0.52197430043739 0.07528484975810 0.13611525206911 6.941 > 7 8 Li 0.52197430043739 0.07528484975810 0.63611525206911 6.941 > 7 9 Li 0.47802569956261 0.57528484975810 0.11388474793089 6.941 > 9 10 Li 0.47802569956261 0.57528484975810 0.61388474793089 6.941 > 9 11 Li 0.15085098794262 0.65200368625686 0.07619935116598 6.941 > 11 12 Li 0.15085098794262 0.65200368625686 0.57619935116598 6.941 > 11 13 Li 0.39936049179992 0.83656297483120 0.20045651252430 6.941 > 13 14 Li 0.39936049179992 0.83656297483120 0.70045651252430 6.941 > 13 15 Li 0.34328381539789 0.16210510737057 0.42079029854791 6.941 > 15 16 Li 0.34328381539789 0.16210510737057 0.92079029854791 6.941 > 15 17 Li 0.52197430043739 0.42471515024190 0.38611525206911 6.941 > 17 18 Li 0.52197430043739 0.42471515024190 0.88611525206911 6.941 > 17 19 Li 0.84914901205738 0.15200368625686 0.17380064883402 6.941 > 19 20 Li 0.84914901205738 0.15200368625686 0.67380064883402 6.941 > 19 21 Li 0.65671618460211 0.66210510737057 0.32920970145209 6.941 > 21 22 Li 0.65671618460211 0.66210510737057 0.82920970145209 6.941 > 21 23 Li 0.34328381539789 0.33789489262943 0.17079029854791 6.941 > 23 24 Li 0.34328381539789 0.33789489262943 0.67079029854791 6.941 > 23 25 Li 0.60063950820008 0.16343702516880 0.29954348747569 6.941 > 25 26 Li 0.60063950820008 0.16343702516880 0.79954348747570 6.941 > 25 27 Li 0.65671618460211 0.83789489262943 0.07920970145209 6.941 > 27 28 Li 0.65671618460211 0.83789489262943 0.57920970145209 6.941 > 27 29 Li 0.60063950820008 0.33656297483120 0.04954348747570 6.941 > 29 30 Li 0.60063950820008 0.33656297483120 0.54954348747570 6.941 > 29 31 Li 0.39936049179992 0.66343702516880 0.45045651252431 6.941 > 31 32 Li 0.39936049179992 0.66343702516880 0.95045651252430 6.941 > 31 33 Zn 0.09061525832214 0.15632981114621 0.04478909201022 65.380 > 33 34 Zn 0.09061525832214 0.15632981114621 0.54478909201022 65.380 > 33 35 Zn 0.09061525832214 0.34367018885379 0.29478909201022 65.380 > 35 36 Zn 0.09061525832214 0.34367018885379 0.79478909201022 65.380 > 35 37 Zn 0.90938474167786 0.84367018885379 0.45521090798978 65.380 > 37 38 Zn 0.90938474167786 0.84367018885379 0.95521090798978 65.380 > 37 39 Zn 0.90938474167786 0.65632981114621 0.20521090798978 65.380 > 39 40 Zn 0.90938474167786 0.65632981114621 0.70521090798978 65.380 > 39 41 P 0.76919868931142 0.90748045189569 0.26744265477974 30.974 > 41 42 P 0.76919868931142 0.90748045189569 0.76744265477974 30.974 > 41 43 P 0.23080131068858 0.09251954810431 0.23255734522026 30.974 > 43 44 P 0.23080131068858 0.09251954810431 0.73255734522026 30.974 > 43 45 P 0.70941648386110 0.09142661712393 0.48598758179430 30.974 > 45 46 P 0.70941648386110 0.09142661712393 0.98598758179430 30.974 > 45 47 P 0.29058351613890 0.59142661712393 0.26401241820570 30.974 > 47 48 P 0.29058351613890 0.59142661712393 0.76401241820570 30.974 > 47 49 P 0.76919868931142 0.59251954810431 0.01744265477974 30.974 > 49 50 P 0.76919868931142 0.59251954810431 0.51744265477974 30.974 > 49 51 P 0.70941648386110 0.40857338287607 0.23598758179430 30.974 > 51 52 P 0.70941648386110 0.40857338287607 0.73598758179430 30.974 > 51 53 P 0.29058351613890 0.90857338287607 0.01401241820570 30.974 > 53 54 P 0.29058351613890 0.90857338287607 0.51401241820570 30.974 > 53 55 P 0.23080131068858 0.40748045189569 0.48255734522026 30.974 > 55 56 P 0.23080131068858 0.40748045189569 0.98255734522026 30.974 > 55 57 O 0.38301012805772 0.34414565178294 0.45557012849314 15.999 > 57 58 O 0.38301012805772 0.34414565178294 0.95557012849314 15.999 > 57 59 O 0.33918212749893 0.65179324102541 0.18583301835814 15.999 > 59 60 O 0.33918212749893 0.65179324102541 0.68583301835814 15.999 > 59 61 O 0.75600083661331 0.94547018945729 0.00502362760708 15.999 > 61 62 O 0.75600083661331 0.94547018945729 0.50502362760708 15.999 > 61 63 O 0.24399916338669 0.05452981054272 0.49497637239292 15.999 > 63 64 O 0.24399916338669 0.05452981054272 0.99497637239292 15.999 > 63 65 O 0.61698987194228 0.84414565178294 0.29442987150686 15.999 > 65 66 O 0.61698987194228 0.84414565178294 0.79442987150686 15.999 > 65 67 O 0.66081787250107 0.15179324102541 0.06416698164186 15.999 > 67 68 O 0.66081787250107 0.15179324102541 0.56416698164186 15.999 > 67 69 O 0.80792159358423 0.66967959658721 0.44175756804539 15.999 > 69 70 O 0.80792159358423 0.66967959658721 0.94175756804539 15.999 > 69 71 O 0.55843928696336 0.40065597655617 0.15506677956838 15.999 > 71 72 O 0.55843928696336 0.40065597655617 0.65506677956838 15.999 > 71 73 O 0.66081787250107 0.34820675897459 0.31416698164186 15.999 > 73 74 O 0.66081787250107 0.34820675897459 0.81416698164186 15.999 > 73 75 O 0.06813106601075 0.10157853216628 0.15634266316574 15.999 > 75 76 O 0.06813106601075 0.10157853216628 0.65634266316574 15.999 > 75 77 O 0.72528320931337 0.04921106742330 0.23873657361224 15.999 > 77 78 O 0.72528320931337 0.04921106742330 0.73873657361224 15.999 > 77 79 O 0.93186893398925 0.89842146783372 0.34365733683426 15.999 > 79 80 O 0.93186893398925 0.89842146783372 0.84365733683426 15.999 > 79 81 O 0.72528320931337 0.45078893257670 0.48873657361224 15.999 > 81 82 O 0.72528320931337 0.45078893257670 0.98873657361224 15.999 > 81 83 O 0.61698987194228 0.65585434821706 0.04442987150686 15.999 > 83 84 O 0.61698987194228 0.65585434821706 0.54442987150686 15.999 > 83 85 O 0.27471679068663 0.54921106742331 0.01126342638776 15.999 > 85 86 O 0.27471679068663 0.54921106742331 0.51126342638776 15.999 > 85 87 O 0.38301012805772 0.15585434821706 0.20557012849314 15.999 > 87 88 O 0.38301012805772 0.15585434821706 0.70557012849314 15.999 > 87 89 O 0.86273172333922 0.33286451395664 0.21758830198630 15.999 > 89 90 O 0.86273172333922 0.33286451395664 0.71758830198630 15.999 > 89 91 O 0.80792159358423 0.83032040341279 0.19175756804539 15.999 > 91 92 O 0.80792159358423 0.83032040341279 0.69175756804539 15.999 > 91 93 O 0.19207840641577 0.33032040341279 0.05824243195461 15.999 > 93 94 O 0.19207840641577 0.33032040341279 0.55824243195461 15.999 > 93 95 O 0.13726827666078 0.83286451395664 0.03241169801370 15.999 > 95 96 O 0.13726827666078 0.83286451395664 0.53241169801370 15.999 > 95 97 O 0.19207840641577 0.16967959658721 0.30824243195461 15.999 > 97 98 O 0.19207840641577 0.16967959658721 0.80824243195461 15.999 > 97 99 O 0.75600083661331 0.55452981054271 0.25502362760708 15.999 > 99 100 O 0.75600083661331 0.55452981054271 0.75502362760708 15.999 > 99 101 O 0.44156071303664 0.90065597655617 0.09493322043162 15.999 > 101 102 O 0.44156071303664 0.90065597655617 0.59493322043162 15.999 > 101 103 O 0.86273172333922 0.16713548604336 0.46758830198630 15.999 > 103 104 O 0.86273172333922 0.16713548604336 0.96758830198630 15.999 > 103 105 O 0.27471679068663 0.95078893257669 0.26126342638776 15.999 > 105 106 O 0.27471679068663 0.95078893257669 0.76126342638776 15.999 > 105 107 O 0.93186893398925 0.60157853216628 0.09365733683426 15.999 > 107 108 O 0.93186893398925 0.60157853216628 0.59365733683426 15.999 > 107 109 O 0.13726827666078 0.66713548604336 0.28241169801370 15.999 > 109 110 O 0.13726827666078 0.66713548604336 0.78241169801370 15.999 > 109 111 O 0.24399916338669 0.44547018945729 0.24497637239292 15.999 > 111 112 O 0.24399916338669 0.44547018945729 0.74497637239292 15.999 > 111 113 O 0.06813106601075 0.39842146783372 0.40634266316574 15.999 > 113 114 O 0.06813106601075 0.39842146783372 0.90634266316574 15.999 > 113 115 O 0.33918212749893 0.84820675897459 0.43583301835814 15.999 > 115 116 O 0.33918212749893 0.84820675897459 0.93583301835814 15.999 > 115 117 O 0.55843928696336 0.09934402344383 0.40506677956838 15.999 > 117 118 O 0.55843928696336 0.09934402344383 0.90506677956838 15.999 > 117 119 O 0.44156071303664 0.59934402344383 0.34493322043162 15.999 > 119 120 O 0.44156071303664 0.59934402344383 0.84493322043162 15.999 > 119 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.6219301 0.0000000 0.0265482 0.0000000 2.6091248 0.0000000 0.0265473 0.0000000 2.6217065 -------------------------- Born effective charges -------------------------- 1 Li 1.1575879 0.0767896 -0.0312387 -0.0597561 0.9375752 -0.0164070 -0.0223054 0.0674891 1.1356938 2 Li 1.0676875 0.0189430 -0.0358845 -0.1247374 1.0899212 -0.0388625 0.0274214 -0.0517265 1.0452861 3 Li 1.0676875 -0.0189430 -0.0358845 0.1247374 1.0899212 0.0388625 0.0274214 0.0517265 1.0452861 4 Li 1.1575879 0.0767896 -0.0312387 -0.0597561 0.9375752 -0.0164070 -0.0223054 0.0674891 1.1356938 5 Li 1.1575879 -0.0767896 -0.0312387 0.0597561 0.9375752 0.0164070 -0.0223054 -0.0674891 1.1356938 6 Li 1.0676875 0.0189430 -0.0358845 -0.1247374 1.0899212 -0.0388625 0.0274214 -0.0517265 1.0452861 7 Li 0.9926747 0.0474194 0.0988598 -0.0361386 1.1329742 0.0575724 0.0036055 -0.0871040 1.0525290 8 Li 1.0234591 -0.0701810 -0.0424428 -0.0028078 1.0417682 -0.0668237 0.0686810 -0.0518030 1.0619619 9 Li 1.1575879 -0.0767896 -0.0312387 0.0597561 0.9375752 0.0164070 -0.0223054 -0.0674891 1.1356938 10 Li 1.0676875 -0.0189430 -0.0358845 0.1247374 1.0899212 0.0388625 0.0274214 0.0517265 1.0452861 11 Li 1.0234591 0.0701810 -0.0424428 0.0028078 1.0417682 0.0668237 0.0686810 0.0518030 1.0619619 12 Li 1.0234591 0.0701810 -0.0424428 0.0028078 1.0417682 0.0668237 0.0686810 0.0518030 1.0619619 13 Li 0.9926747 0.0474194 0.0988598 -0.0361386 1.1329742 0.0575724 0.0036055 -0.0871040 1.0525290 14 Li 1.0234591 -0.0701810 -0.0424428 -0.0028078 1.0417682 -0.0668237 0.0686810 -0.0518030 1.0619619 15 Li 0.9926747 -0.0474194 0.0988598 0.0361386 1.1329742 -0.0575724 0.0036055 0.0871040 1.0525290 16 Li 0.9926747 -0.0474194 0.0988598 0.0361386 1.1329742 -0.0575724 0.0036055 0.0871040 1.0525290 17 Zn 2.0646704 0.0709594 0.2157050 -0.0115586 2.0078666 0.1533714 -0.0653183 -0.2055578 1.9819563 18 Zn 2.0646704 -0.0709594 0.2157050 0.0115586 2.0078666 -0.1533714 -0.0653183 0.2055578 1.9819563 19 Zn 2.0646704 0.0709594 0.2157050 -0.0115586 2.0078666 0.1533714 -0.0653183 -0.2055578 1.9819563 20 Zn 2.0646704 -0.0709594 0.2157050 0.0115586 2.0078666 -0.1533714 -0.0653183 0.2055578 1.9819563 21 P 3.0028833 -0.0842922 -0.1901593 -0.3303469 3.0551100 0.2409424 0.2531957 -0.1369120 3.3610504 22 P 3.0028833 -0.0842922 -0.1901593 -0.3303469 3.0551100 0.2409424 0.2531957 -0.1369120 3.3610504 23 P 3.3300931 0.0256250 -0.0757496 0.0353517 3.2018233 -0.1217009 0.1606292 0.3348563 2.9221992 24 P 3.3300931 -0.0256250 -0.0757496 -0.0353517 3.2018233 0.1217009 0.1606292 -0.3348563 2.9221992 25 P 3.0028833 0.0842922 -0.1901593 0.3303469 3.0551100 -0.2409424 0.2531957 0.1369120 3.3610504 26 P 3.3300931 -0.0256250 -0.0757496 -0.0353517 3.2018233 0.1217009 0.1606292 -0.3348563 2.9221992 27 P 3.3300931 0.0256250 -0.0757496 0.0353517 3.2018233 -0.1217009 0.1606292 0.3348563 2.9221992 28 P 3.0028833 0.0842922 -0.1901593 0.3303469 3.0551100 -0.2409424 0.2531957 0.1369120 3.3610504 29 O -1.9403399 0.3299920 0.1831486 0.1590832 -1.3516067 -0.0380498 0.1390540 -0.1147854 -1.3282098 30 O -1.4705032 -0.1928702 0.4088521 -0.1632507 -1.4241877 0.2521950 0.3181114 0.3531991 -1.8093979 31 O -1.3943532 0.3539190 0.0965101 0.3629358 -2.2481952 0.0994731 0.1383237 0.0054928 -1.1110148 32 O -1.3943532 0.3539190 0.0965101 0.3629358 -2.2481952 0.0994731 0.1383237 0.0054928 -1.1110148 33 O -1.9403399 -0.3299920 0.1831486 -0.1590832 -1.3516067 0.0380498 0.1390540 0.1147854 -1.3282098 34 O -1.4705032 0.1928702 0.4088521 0.1632507 -1.4241877 -0.2521950 0.3181114 -0.3531991 -1.8093979 35 O -1.2543072 -0.4429481 0.2803528 -0.4967066 -1.7669056 0.4878037 0.1900947 0.4628797 -1.7923330 36 O -1.6411987 0.0010094 -0.4987417 -0.0678023 -1.1766608 -0.0865387 -0.4739422 0.0209362 -1.8548501 37 O -1.4705032 -0.1928702 0.4088521 -0.1632507 -1.4241877 0.2521950 0.3181114 0.3531991 -1.8093979 38 O -1.5289202 0.0536808 -0.3197014 0.0561433 -0.9562032 0.0625175 -0.4825500 0.1922132 -2.1777532 39 O -1.2315301 0.1445122 0.0224411 0.2194322 -2.1068631 0.2677119 -0.0437078 0.3567017 -1.3491687 40 O -1.5289202 0.0536808 -0.3197014 0.0561433 -0.9562032 0.0625175 -0.4825500 0.1922132 -2.1777532 41 O -1.2315301 -0.1445122 0.0224411 -0.2194322 -2.1068631 -0.2677119 -0.0437078 -0.3567017 -1.3491687 42 O -1.9403399 0.3299920 0.1831486 0.1590832 -1.3516067 -0.0380498 0.1390540 -0.1147854 -1.3282098 43 O -1.2315301 -0.1445122 0.0224411 -0.2194322 -2.1068631 -0.2677119 -0.0437078 -0.3567017 -1.3491687 44 O -1.9403399 -0.3299920 0.1831486 -0.1590832 -1.3516067 0.0380498 0.1390540 0.1147854 -1.3282098 45 O -2.1779034 0.5256764 -0.1119514 0.4199902 -1.4364165 -0.1341255 -0.2112929 -0.0750330 -1.1379491 46 O -1.2543072 0.4429481 0.2803528 0.4967066 -1.7669056 -0.4878037 0.1900947 -0.4628797 -1.7923330 47 O -1.2543072 -0.4429481 0.2803528 -0.4967066 -1.7669056 0.4878037 0.1900947 0.4628797 -1.7923330 48 O -2.1779034 -0.5256764 -0.1119514 -0.4199902 -1.4364165 0.1341255 -0.2112929 0.0750330 -1.1379491 49 O -1.2543072 0.4429481 0.2803528 0.4967066 -1.7669056 -0.4878037 0.1900947 -0.4628797 -1.7923330 50 O -1.3943532 -0.3539190 0.0965101 -0.3629358 -2.2481952 -0.0994731 0.1383237 -0.0054928 -1.1110148 51 O -1.6411987 -0.0010094 -0.4987417 0.0678023 -1.1766608 0.0865387 -0.4739422 -0.0209362 -1.8548501 52 O -2.1779034 -0.5256764 -0.1119514 -0.4199902 -1.4364165 0.1341255 -0.2112929 0.0750330 -1.1379491 53 O -1.2315301 0.1445122 0.0224411 0.2194322 -2.1068631 0.2677119 -0.0437078 0.3567017 -1.3491687 54 O -1.5289202 -0.0536808 -0.3197014 -0.0561433 -0.9562032 -0.0625175 -0.4825500 -0.1922132 -2.1777532 55 O -2.1779034 0.5256764 -0.1119514 0.4199902 -1.4364165 -0.1341255 -0.2112929 -0.0750330 -1.1379491 56 O -1.3943532 -0.3539190 0.0965101 -0.3629358 -2.2481952 -0.0994731 0.1383237 -0.0054928 -1.1110148 57 O -1.5289202 -0.0536808 -0.3197014 -0.0561433 -0.9562032 -0.0625175 -0.4825500 -0.1922132 -2.1777532 58 O -1.4705032 0.1928702 0.4088521 0.1632507 -1.4241877 -0.2521950 0.3181114 -0.3531991 -1.8093979 59 O -1.6411987 -0.0010094 -0.4987417 0.0678023 -1.1766608 0.0865387 -0.4739422 -0.0209362 -1.8548501 60 O -1.6411987 0.0010094 -0.4987417 -0.0678023 -1.1766608 -0.0865387 -0.4739422 0.0209362 -1.8548501 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000000 (yyy) 0.00000000 (yyy) 0.00000000 (yyy) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): 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 ... [ 6 5 6 ] 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: 0.48, Number of G-points: 299, Lambda: 0.08 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/60) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 2.504 ( 0.000 0.000 0.000) 0.000 2.607 ( 0.000 0.000 0.000) 0.000 2.718 ( 0.000 0.000 0.000) 0.000 2.775 ( 0.000 0.000 0.000) 0.000 2.948 ( 0.000 0.000 0.000) 0.000 2.986 ( 0.000 0.000 0.000) 0.000 3.058 ( 0.000 0.000 0.000) 0.000 3.076 ( 0.000 0.000 0.000) 0.000 3.386 ( 0.000 0.000 0.000) 0.000 3.407 ( 0.000 0.000 0.000) 0.000 3.478 ( 0.000 0.000 0.000) 0.000 3.715 ( 0.000 0.000 0.000) 0.000 3.775 ( 0.000 0.000 0.000) 0.000 3.911 ( 0.000 0.000 0.000) 0.000 3.967 ( 0.000 0.000 0.000) 0.000 4.159 ( 0.000 0.000 0.000) 0.000 4.256 ( 0.000 0.000 0.000) 0.000 4.395 ( 0.000 0.000 0.000) 0.000 4.439 ( 0.000 0.000 0.000) 0.000 4.464 ( 0.000 0.000 0.000) 0.000 4.515 ( 0.000 0.000 0.000) 0.000 4.551 ( 0.000 0.000 0.000) 0.000 4.667 ( 0.000 0.000 0.000) 0.000 4.789 ( 0.000 0.000 0.000) 0.000 4.973 ( 0.000 0.000 0.000) 0.000 4.986 ( 0.000 0.000 0.000) 0.000 5.035 ( 0.000 0.000 0.000) 0.000 5.103 ( 0.000 0.000 0.000) 0.000 5.143 ( 0.000 0.000 0.000) 0.000 5.369 ( 0.000 0.000 0.000) 0.000 5.387 ( 0.000 0.000 0.000) 0.000 5.455 ( 0.000 0.000 0.000) 0.000 5.506 ( 0.000 0.000 0.000) 0.000 5.819 ( 0.000 0.000 0.000) 0.000 5.896 ( 0.000 0.000 0.000) 0.000 6.030 ( 0.000 0.000 0.000) 0.000 6.212 ( 0.000 0.000 0.000) 0.000 6.260 ( 0.000 0.000 0.000) 0.000 6.270 ( 0.000 0.000 0.000) 0.000 6.454 ( 0.000 0.000 0.000) 0.000 7.176 ( 0.000 0.000 0.000) 0.000 7.323 ( 0.000 0.000 0.000) 0.000 7.692 ( 0.000 0.000 0.000) 0.000 7.735 ( 0.000 0.000 0.000) 0.000 8.010 ( 0.000 0.000 0.000) 0.000 8.104 ( 0.000 0.000 0.000) 0.000 8.459 ( 0.000 0.000 0.000) 0.000 8.462 ( 0.000 0.000 0.000) 0.000 8.648 ( 0.000 0.000 0.000) 0.000 8.672 ( 0.000 0.000 0.000) 0.000 8.924 ( 0.000 0.000 0.000) 0.000 8.933 ( 0.000 0.000 0.000) 0.000 8.997 ( 0.000 0.000 0.000) 0.000 9.001 ( 0.000 0.000 0.000) 0.000 9.210 ( 0.000 0.000 0.000) 0.000 9.275 ( 0.000 0.000 0.000) 0.000 9.292 ( 0.000 0.000 0.000) 0.000 9.425 ( 0.000 0.000 0.000) 0.000 9.768 ( 0.000 0.000 0.000) 0.000 9.996 ( 0.000 0.000 0.000) 0.000 10.228 ( 0.000 0.000 0.000) 0.000 10.314 ( 0.000 0.000 0.000) 0.000 10.321 ( 0.000 0.000 0.000) 0.000 10.346 ( 0.000 0.000 0.000) 0.000 10.570 ( 0.000 0.000 0.000) 0.000 10.632 ( 0.000 0.000 0.000) 0.000 10.678 ( 0.000 0.000 0.000) 0.000 10.829 ( 0.000 0.000 0.000) 0.000 10.909 ( 0.000 0.000 0.000) 0.000 10.934 ( 0.000 0.000 0.000) 0.000 11.048 ( 0.000 0.000 0.000) 0.000 11.088 ( 0.000 0.000 0.000) 0.000 11.234 ( 0.000 0.000 0.000) 0.000 11.341 ( 0.000 0.000 0.000) 0.000 11.385 ( 0.000 0.000 0.000) 0.000 11.438 ( 0.000 0.000 0.000) 0.000 11.555 ( 0.000 0.000 0.000) 0.000 11.874 ( 0.000 0.000 0.000) 0.000 11.876 ( 0.000 0.000 0.000) 0.000 11.895 ( 0.000 0.000 0.000) 0.000 12.333 ( 0.000 0.000 0.000) 0.000 12.370 ( 0.000 0.000 0.000) 0.000 12.406 ( 0.000 0.000 0.000) 0.000 12.511 ( 0.000 0.000 0.000) 0.000 12.611 ( 0.000 0.000 0.000) 0.000 12.679 ( 0.000 0.000 0.000) 0.000 12.959 ( 0.000 0.000 0.000) 0.000 12.995 ( 0.000 0.000 0.000) 0.000 13.022 ( 0.000 0.000 0.000) 0.000 13.037 ( 0.000 0.000 0.000) 0.000 13.169 ( 0.000 0.000 0.000) 0.000 13.213 ( 0.000 0.000 0.000) 0.000 13.245 ( 0.000 0.000 0.000) 0.000 13.338 ( 0.000 0.000 0.000) 0.000 13.365 ( 0.000 0.000 0.000) 0.000 13.423 ( 0.000 0.000 0.000) 0.000 13.497 ( 0.000 0.000 0.000) 0.000 13.615 ( 0.000 0.000 0.000) 0.000 13.632 ( 0.000 0.000 0.000) 0.000 13.734 ( 0.000 0.000 0.000) 0.000 13.988 ( 0.000 0.000 0.000) 0.000 14.010 ( 0.000 0.000 0.000) 0.000 14.184 ( 0.000 0.000 0.000) 0.000 14.189 ( 0.000 0.000 0.000) 0.000 14.275 ( 0.000 0.000 0.000) 0.000 14.377 ( 0.000 0.000 0.000) 0.000 14.427 ( 0.000 0.000 0.000) 0.000 14.499 ( 0.000 0.000 0.000) 0.000 14.674 ( 0.000 0.000 0.000) 0.000 14.707 ( 0.000 0.000 0.000) 0.000 15.164 ( 0.000 0.000 0.000) 0.000 15.244 ( 0.000 0.000 0.000) 0.000 15.367 ( 0.000 0.000 0.000) 0.000 15.430 ( 0.000 0.000 0.000) 0.000 15.451 ( 0.000 0.000 0.000) 0.000 15.482 ( 0.000 0.000 0.000) 0.000 15.528 ( 0.000 0.000 0.000) 0.000 15.561 ( 0.000 0.000 0.000) 0.000 15.938 ( 0.000 0.000 0.000) 0.000 16.114 ( 0.000 0.000 0.000) 0.000 16.403 ( 0.000 0.000 0.000) 0.000 16.468 ( 0.000 0.000 0.000) 0.000 16.592 ( 0.000 0.000 0.000) 0.000 16.690 ( 0.000 0.000 0.000) 0.000 16.872 ( 0.000 0.000 0.000) 0.000 16.885 ( 0.000 0.000 0.000) 0.000 16.956 ( 0.000 0.000 0.000) 0.000 17.092 ( 0.000 0.000 0.000) 0.000 17.114 ( 0.000 0.000 0.000) 0.000 17.396 ( 0.000 0.000 0.000) 0.000 17.435 ( 0.000 0.000 0.000) 0.000 17.490 ( 0.000 0.000 0.000) 0.000 17.927 ( 0.000 0.000 0.000) 0.000 17.966 ( 0.000 0.000 0.000) 0.000 18.157 ( 0.000 0.000 0.000) 0.000 18.194 ( 0.000 0.000 0.000) 0.000 18.256 ( 0.000 0.000 0.000) 0.000 18.307 ( 0.000 0.000 0.000) 0.000 18.374 ( 0.000 0.000 0.000) 0.000 18.646 ( 0.000 0.000 0.000) 0.000 18.657 ( 0.000 0.000 0.000) 0.000 18.749 ( 0.000 0.000 0.000) 0.000 18.890 ( 0.000 0.000 0.000) 0.000 19.083 ( 0.000 0.000 0.000) 0.000 19.344 ( 0.000 0.000 0.000) 0.000 27.653 ( 0.000 0.000 0.000) 0.000 27.656 ( 0.000 0.000 0.000) 0.000 27.676 ( 0.000 0.000 0.000) 0.000 27.740 ( 0.000 0.000 0.000) 0.000 27.766 ( 0.000 0.000 0.000) 0.000 27.789 ( 0.000 0.000 0.000) 0.000 27.854 ( 0.000 0.000 0.000) 0.000 27.866 ( 0.000 0.000 0.000) 0.000 29.135 ( 0.000 0.000 0.000) 0.000 29.226 ( 0.000 0.000 0.000) 0.000 29.585 ( 0.000 0.000 0.000) 0.000 29.655 ( 0.000 0.000 0.000) 0.000 29.765 ( 0.000 0.000 0.000) 0.000 29.778 ( 0.000 0.000 0.000) 0.000 29.817 ( 0.000 0.000 0.000) 0.000 29.880 ( 0.000 0.000 0.000) 0.000 29.907 ( 0.000 0.000 0.000) 0.000 30.443 ( 0.000 0.000 0.000) 0.000 30.464 ( 0.000 0.000 0.000) 0.000 30.526 ( 0.000 0.000 0.000) 0.000 30.589 ( 0.000 0.000 0.000) 0.000 30.973 ( 0.000 0.000 0.000) 0.000 31.176 ( 0.000 0.000 0.000) 0.000 31.207 ( 0.000 0.000 0.000) 0.000 31.208 ( 0.000 0.000 0.000) 0.000 31.299 ( 0.000 0.000 0.000) 0.000 31.450 ( 0.000 0.000 0.000) 0.000 31.557 ( 0.000 0.000 0.000) 0.000 31.639 ( 0.000 0.000 0.000) 0.000 32.373 ( 0.000 0.000 0.000) 0.000 32.426 ( 0.000 0.000 0.000) 0.000 33.567 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/60) ======================= q-point: ( 0.17 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.260 ( 5.467 0.000 19.198) 19.962 0.442 ( 20.883 0.000 7.967) 22.351 1.359 ( 58.063 0.000 21.400) 61.881 2.529 ( 0.370 0.000 -1.156) 1.214 2.622 ( 0.840 0.000 3.768) 3.861 2.713 ( -0.649 0.000 4.480) 4.527 2.784 ( -0.480 0.000 -1.321) 1.406 3.009 ( 4.979 0.000 1.679) 5.254 3.039 ( 1.909 0.000 0.900) 2.110 3.093 ( 2.892 0.000 0.098) 2.893 3.135 ( 7.322 0.000 2.236) 7.656 3.372 ( 0.604 0.000 -3.392) 3.445 3.399 ( 2.920 0.000 -6.709) 7.317 3.588 ( 7.560 0.000 1.766) 7.763 3.732 ( 3.650 0.000 -0.089) 3.652 3.800 ( 2.856 0.000 3.168) 4.265 3.989 ( 5.294 0.000 1.805) 5.593 4.072 ( 2.782 0.000 -1.790) 3.308 4.165 ( -6.313 0.000 0.190) 6.316 4.179 ( -4.830 0.000 3.077) 5.727 4.305 ( -4.249 0.000 5.270) 6.770 4.377 ( -1.397 0.000 -1.534) 2.075 4.490 ( -1.475 0.000 -5.646) 5.836 4.503 ( 2.871 0.000 -0.463) 2.908 4.570 ( -5.679 0.000 1.039) 5.773 4.666 ( -0.604 0.000 1.251) 1.389 4.741 ( 0.801 0.000 -3.577) 3.666 4.927 ( -8.241 0.000 6.474) 10.480 5.107 ( -2.114 0.000 -2.000) 2.910 5.115 ( 6.392 0.000 6.200) 8.905 5.145 ( 2.973 0.000 1.637) 3.394 5.312 ( -7.075 0.000 1.462) 7.224 5.321 ( 4.610 0.000 -7.832) 9.088 5.443 ( 4.771 0.000 -6.648) 8.183 5.446 ( -4.151 0.000 3.517) 5.440 5.457 ( 0.247 0.000 2.320) 2.333 5.693 ( -17.479 0.000 -4.244) 17.987 5.911 ( 4.297 0.000 8.913) 9.895 5.933 ( -7.813 0.000 -1.951) 8.053 6.044 ( -15.339 0.000 -1.036) 15.374 6.253 ( 4.615 0.000 -2.500) 5.249 6.286 ( -0.162 0.000 -8.147) 8.149 6.454 ( -1.127 0.000 0.948) 1.473 7.153 ( -2.836 0.000 -0.970) 2.998 7.336 ( 1.406 0.000 0.187) 1.419 7.662 ( -6.315 0.000 2.356) 6.741 7.735 ( -0.811 0.000 0.454) 0.929 7.892 ( -8.130 0.000 -9.163) 12.250 8.116 ( 1.525 0.000 -2.286) 2.748 8.388 ( -1.597 0.000 -4.080) 4.382 8.564 ( 4.848 0.000 1.517) 5.079 8.623 ( -4.109 0.000 2.455) 4.787 8.642 ( -0.696 0.000 0.799) 1.060 8.858 ( -1.904 0.000 -1.896) 2.687 8.923 ( -3.049 0.000 -3.399) 4.566 9.031 ( -0.608 0.000 5.256) 5.291 9.161 ( -1.166 0.000 7.796) 7.882 9.165 ( -3.784 0.000 -3.999) 5.506 9.251 ( -4.833 0.000 1.130) 4.964 9.260 ( 3.685 0.000 3.693) 5.217 9.444 ( 1.692 0.000 0.721) 1.839 9.732 ( -2.493 0.000 0.280) 2.509 10.011 ( 1.895 0.000 3.596) 4.065 10.149 ( -10.173 0.000 0.657) 10.194 10.284 ( -0.978 0.000 -5.978) 6.057 10.356 ( -0.725 0.000 3.018) 3.104 10.357 ( 2.359 0.000 -0.271) 2.375 10.596 ( -0.731 0.000 0.115) 0.740 10.605 ( 1.318 0.000 6.479) 6.612 10.787 ( -4.660 0.000 1.678) 4.953 10.812 ( -1.624 0.000 -1.110) 1.967 10.906 ( 3.124 0.000 -1.522) 3.475 11.000 ( -2.884 0.000 -2.662) 3.925 11.038 ( 9.032 0.000 -0.790) 9.067 11.078 ( -3.581 0.000 4.504) 5.754 11.184 ( -3.787 0.000 -2.966) 4.810 11.272 ( -4.062 0.000 -1.508) 4.333 11.503 ( -4.164 0.000 11.626) 12.349 11.637 ( -9.054 0.000 10.900) 14.170 11.739 ( 13.688 0.000 2.537) 13.921 11.752 ( -6.343 0.000 14.492) 15.819 11.903 ( 1.463 0.000 -1.725) 2.262 11.996 ( 5.850 0.000 -6.440) 8.700 12.103 ( -11.812 0.000 -7.093) 13.778 12.413 ( -1.743 0.000 2.770) 3.273 12.441 ( 2.891 0.000 0.236) 2.901 12.589 ( -6.055 0.000 0.806) 6.108 12.646 ( -0.305 0.000 -0.236) 0.386 12.720 ( 3.468 0.000 1.256) 3.688 12.985 ( -0.372 0.000 -0.579) 0.688 13.007 ( -1.085 0.000 -0.701) 1.292 13.047 ( -0.092 0.000 -0.765) 0.770 13.072 ( -7.166 0.000 4.320) 8.368 13.135 ( -1.817 0.000 4.177) 4.555 13.209 ( -6.265 0.000 -0.133) 6.267 13.242 ( -0.469 0.000 1.734) 1.797 13.338 ( 1.702 0.000 -1.186) 2.075 13.387 ( -1.849 0.000 6.171) 6.442 13.540 ( 3.990 0.000 -3.534) 5.330 13.624 ( 3.104 0.000 -0.477) 3.140 13.682 ( 9.884 0.000 -0.308) 9.889 13.734 ( 7.973 0.000 4.291) 9.055 13.828 ( 5.265 0.000 0.941) 5.349 13.973 ( -0.283 0.000 1.861) 1.882 14.155 ( -1.040 0.000 -3.190) 3.355 14.159 ( 6.859 0.000 4.671) 8.299 14.281 ( 0.154 0.000 -2.318) 2.323 14.404 ( 3.240 0.000 -1.324) 3.501 14.475 ( 4.179 0.000 1.372) 4.399 14.525 ( 1.594 0.000 4.128) 4.425 14.624 ( 0.075 0.000 0.337) 0.345 14.712 ( 0.034 0.000 2.049) 2.049 15.082 ( -3.298 0.000 0.061) 3.298 15.127 ( -13.110 0.000 7.039) 14.880 15.211 ( -2.369 0.000 -7.547) 7.910 15.282 ( -0.617 0.000 4.739) 4.779 15.458 ( 1.307 0.000 0.241) 1.329 15.560 ( 1.237 0.000 2.507) 2.796 15.576 ( 9.371 0.000 1.156) 9.442 15.608 ( 4.345 0.000 5.362) 6.901 15.683 ( 14.077 0.000 -11.708) 18.310 15.934 ( -4.029 0.000 -1.987) 4.492 16.210 ( 5.432 0.000 0.512) 5.456 16.314 ( -3.808 0.000 -3.071) 4.892 16.559 ( 2.854 0.000 3.787) 4.742 16.598 ( -4.074 0.000 -1.051) 4.207 16.748 ( 3.477 0.000 0.977) 3.611 16.798 ( -2.983 0.000 -2.688) 4.015 17.009 ( 0.116 0.000 3.890) 3.892 17.027 ( 0.630 0.000 -4.118) 4.166 17.071 ( -1.430 0.000 1.808) 2.305 17.116 ( 0.332 0.000 -0.512) 0.610 17.454 ( 1.199 0.000 2.288) 2.583 17.543 ( 3.509 0.000 3.912) 5.255 17.683 ( 3.674 0.000 -18.531) 18.892 17.908 ( -1.502 0.000 -1.784) 2.332 17.998 ( -2.519 0.000 11.107) 11.389 18.117 ( -4.677 0.000 2.110) 5.131 18.138 ( -1.967 0.000 -3.272) 3.818 18.287 ( -1.576 0.000 -1.654) 2.285 18.427 ( 4.101 0.000 -3.198) 5.201 18.595 ( -3.827 0.000 -2.911) 4.808 18.634 ( -2.925 0.000 2.738) 4.006 18.736 ( 4.563 0.000 -12.167) 12.995 18.743 ( 0.422 0.000 -3.031) 3.060 18.946 ( 5.663 0.000 -5.005) 7.558 19.168 ( 0.654 0.000 -2.517) 2.600 19.282 ( -4.608 0.000 -3.067) 5.535 27.635 ( -0.467 0.000 0.577) 0.742 27.675 ( -0.089 0.000 0.688) 0.694 27.679 ( 0.426 0.000 0.960) 1.050 27.741 ( -0.179 0.000 0.691) 0.714 27.793 ( 0.320 0.000 -0.226) 0.391 27.797 ( 1.872 0.000 0.760) 2.021 27.854 ( -0.903 0.000 -0.785) 1.197 27.867 ( 1.103 0.000 0.056) 1.104 29.140 ( 0.252 0.000 0.324) 0.411 29.327 ( -1.302 0.000 11.435) 11.509 29.591 ( 0.681 0.000 0.041) 0.682 29.797 ( -3.038 0.000 -1.145) 3.247 29.823 ( 3.685 0.000 1.571) 4.006 29.824 ( 3.653 0.000 0.753) 3.730 29.857 ( 5.016 0.000 1.024) 5.120 30.057 ( 9.287 0.000 1.058) 9.347 30.410 ( -2.961 0.000 0.672) 3.036 30.426 ( -1.973 0.000 4.241) 4.678 30.569 ( -1.605 0.000 -1.472) 2.177 30.625 ( 6.540 0.000 0.594) 6.567 30.885 ( -3.069 0.000 -5.766) 6.531 31.039 ( -0.985 0.000 -18.994) 19.019 31.073 ( -8.123 0.000 6.103) 10.160 31.271 ( 4.599 0.000 -7.949) 9.184 31.400 ( 10.743 0.000 3.837) 11.407 31.442 ( 0.578 0.000 -4.092) 4.133 31.551 ( -2.644 0.000 5.022) 5.676 31.610 ( -1.124 0.000 -2.333) 2.590 32.386 ( -4.350 0.000 2.471) 5.003 32.417 ( 3.936 0.000 1.798) 4.328 32.538 ( -7.098 0.000 2.247) 7.445 33.517 ( -11.694 0.000 0.347) 11.699 ======================= Grid point 2 (3/60) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.404 ( -0.084 0.000 13.079) 13.080 0.932 ( 20.922 0.000 7.715) 22.299 2.335 ( -3.080 0.000 2.612) 4.038 2.609 ( 30.973 0.000 11.023) 32.876 2.710 ( -1.047 0.000 0.102) 1.052 2.727 ( 10.619 0.000 4.115) 11.388 2.789 ( 1.247 0.000 1.898) 2.271 2.975 ( -2.960 0.000 -6.858) 7.469 3.138 ( 6.093 0.000 3.940) 7.256 3.259 ( 8.158 0.000 4.678) 9.403 3.333 ( 5.729 0.000 3.593) 6.762 3.414 ( 4.780 0.000 0.534) 4.809 3.468 ( 6.968 0.000 -3.671) 7.876 3.696 ( 4.464 0.000 -8.076) 9.228 3.806 ( 1.219 0.000 -2.088) 2.418 3.953 ( 5.313 0.000 4.286) 6.826 4.028 ( -0.955 0.000 -0.116) 0.962 4.072 ( 4.116 0.000 7.782) 8.803 4.160 ( 6.290 0.000 -0.342) 6.299 4.171 ( 3.663 0.000 0.991) 3.795 4.336 ( -0.551 0.000 -2.322) 2.387 4.373 ( -3.848 0.000 3.875) 5.461 4.390 ( -4.673 0.000 -4.915) 6.782 4.434 ( 2.054 0.000 -2.835) 3.501 4.552 ( 1.962 0.000 -1.707) 2.601 4.671 ( 1.061 0.000 1.866) 2.147 4.732 ( -12.397 0.000 6.035) 13.788 4.795 ( 4.319 0.000 -3.344) 5.462 5.001 ( -4.992 0.000 -5.801) 7.653 5.071 ( -19.625 0.000 0.691) 19.637 5.147 ( -8.188 0.000 1.764) 8.375 5.191 ( -11.796 0.000 -3.217) 12.227 5.247 ( 3.065 0.000 0.817) 3.172 5.299 ( -10.640 0.000 0.660) 10.661 5.384 ( -8.100 0.000 1.829) 8.304 5.534 ( 5.447 0.000 0.593) 5.479 5.547 ( 2.847 0.000 0.451) 2.883 5.705 ( -4.206 0.000 -0.136) 4.208 5.749 ( -7.599 0.000 -1.404) 7.728 6.123 ( 8.631 0.000 0.244) 8.635 6.187 ( -5.652 0.000 -2.818) 6.316 6.374 ( 8.256 0.000 -1.792) 8.448 6.429 ( -1.217 0.000 0.107) 1.222 7.024 ( -8.291 0.000 -2.944) 8.798 7.386 ( 3.204 0.000 -0.736) 3.287 7.552 ( -5.532 0.000 5.314) 7.671 7.675 ( -5.943 0.000 -10.030) 11.659 7.697 ( -2.585 0.000 0.133) 2.588 8.126 ( 1.689 0.000 -6.391) 6.611 8.313 ( -4.155 0.000 -2.081) 4.647 8.481 ( -10.670 0.000 4.830) 11.712 8.609 ( 0.104 0.000 -0.190) 0.217 8.721 ( 6.509 0.000 -0.762) 6.554 8.831 ( -0.424 0.000 1.402) 1.464 8.879 ( 1.399 0.000 -5.010) 5.202 9.026 ( -1.143 0.000 -0.677) 1.328 9.048 ( -7.799 0.000 3.190) 8.426 9.056 ( -3.420 0.000 -1.357) 3.679 9.183 ( -2.679 0.000 1.124) 2.905 9.390 ( 3.844 0.000 1.859) 4.270 9.488 ( 0.722 0.000 3.124) 3.206 9.708 ( 0.275 0.000 -0.366) 0.458 9.942 ( -9.482 0.000 4.783) 10.620 10.144 ( 7.494 0.000 3.905) 8.450 10.246 ( 0.512 0.000 -3.590) 3.626 10.331 ( -4.423 0.000 -1.349) 4.624 10.333 ( -2.963 0.000 3.098) 4.287 10.624 ( 3.595 0.000 0.314) 3.608 10.670 ( 0.613 0.000 7.255) 7.281 10.752 ( 1.627 0.000 0.276) 1.650 10.761 ( -1.375 0.000 -2.884) 3.195 10.922 ( -2.908 0.000 -3.556) 4.594 10.971 ( 1.882 0.000 -0.799) 2.045 11.029 ( -1.289 0.000 0.720) 1.476 11.167 ( 1.516 0.000 -4.532) 4.779 11.181 ( 1.338 0.000 3.076) 3.354 11.208 ( 1.133 0.000 -1.444) 1.836 11.405 ( -8.797 0.000 8.567) 12.280 11.563 ( -0.958 0.000 4.199) 4.307 11.732 ( -1.517 0.000 3.952) 4.233 11.769 ( -8.568 0.000 -5.010) 9.925 11.907 ( -1.654 0.000 0.083) 1.656 12.053 ( 2.759 0.000 -4.258) 5.073 12.087 ( 13.461 0.000 -3.712) 13.963 12.339 ( -6.440 0.000 4.038) 7.601 12.482 ( -2.852 0.000 -1.641) 3.290 12.489 ( -0.207 0.000 -0.008) 0.207 12.556 ( -6.342 0.000 1.988) 6.647 12.803 ( 3.328 0.000 0.093) 3.329 12.899 ( -4.506 0.000 -0.230) 4.512 12.978 ( -1.407 0.000 0.071) 1.409 13.008 ( -0.045 0.000 2.166) 2.166 13.068 ( -0.131 0.000 -2.426) 2.430 13.116 ( -1.012 0.000 0.925) 1.371 13.156 ( -0.429 0.000 1.384) 1.449 13.266 ( 1.270 0.000 1.358) 1.859 13.375 ( 1.885 0.000 -0.346) 1.916 13.405 ( 1.829 0.000 0.793) 1.993 13.552 ( -1.346 0.000 -0.241) 1.368 13.666 ( 1.473 0.000 0.219) 1.490 13.880 ( 7.596 0.000 2.951) 8.149 13.887 ( 0.650 0.000 0.590) 0.878 13.944 ( 8.510 0.000 3.321) 9.135 14.005 ( 2.284 0.000 -1.701) 2.848 14.116 ( -0.750 0.000 -6.375) 6.419 14.252 ( -1.742 0.000 0.017) 1.742 14.275 ( 2.313 0.000 1.727) 2.887 14.491 ( 4.060 0.000 1.446) 4.309 14.563 ( -0.642 0.000 5.134) 5.174 14.593 ( 6.685 0.000 -2.168) 7.028 14.649 ( 2.503 0.000 -2.726) 3.701 14.738 ( 0.115 0.000 7.350) 7.350 14.929 ( -7.865 0.000 1.796) 8.068 15.082 ( 2.003 0.000 3.622) 4.139 15.108 ( -3.548 0.000 -7.418) 8.223 15.274 ( -1.468 0.000 2.516) 2.913 15.485 ( 1.302 0.000 0.057) 1.304 15.608 ( 1.843 0.000 5.218) 5.534 15.717 ( 2.868 0.000 -1.815) 3.394 15.786 ( 4.020 0.000 -2.190) 4.578 15.873 ( 9.161 0.000 -4.463) 10.190 15.877 ( 4.258 0.000 2.674) 5.028 16.242 ( -1.457 0.000 -3.857) 4.123 16.265 ( -0.571 0.000 -2.505) 2.569 16.510 ( -2.819 0.000 -2.632) 3.857 16.550 ( -3.919 0.000 3.119) 5.008 16.825 ( 5.486 0.000 -2.169) 5.899 16.834 ( 4.077 0.000 -0.043) 4.078 16.970 ( -4.958 0.000 6.668) 8.309 17.017 ( 0.019 0.000 -1.642) 1.642 17.078 ( 0.528 0.000 -0.695) 0.872 17.124 ( 0.711 0.000 -0.511) 0.876 17.507 ( 2.168 0.000 4.419) 4.922 17.646 ( 3.234 0.000 5.365) 6.264 17.648 ( 0.453 0.000 -10.446) 10.456 17.847 ( -2.815 0.000 -1.846) 3.366 18.019 ( 0.118 0.000 5.650) 5.651 18.049 ( -2.093 0.000 0.880) 2.270 18.081 ( -1.632 0.000 -4.031) 4.348 18.228 ( -2.645 0.000 -2.556) 3.678 18.472 ( 1.841 0.000 -2.779) 3.333 18.490 ( -4.842 0.000 0.120) 4.843 18.577 ( -3.370 0.000 2.107) 3.974 18.738 ( 0.371 0.000 -2.511) 2.538 18.777 ( 2.558 0.000 -1.825) 3.142 19.038 ( 4.905 0.000 -2.689) 5.594 19.159 ( -0.890 0.000 -0.406) 0.978 19.165 ( -4.109 0.000 -2.733) 4.935 27.643 ( 0.635 0.000 1.184) 1.343 27.683 ( -0.368 0.000 0.558) 0.668 27.684 ( 0.428 0.000 1.056) 1.140 27.734 ( -0.730 0.000 0.134) 0.742 27.800 ( 0.465 0.000 -0.223) 0.516 27.823 ( -0.863 0.000 -1.077) 1.381 27.847 ( 1.632 0.000 0.555) 1.723 27.891 ( 0.921 0.000 0.231) 0.950 29.145 ( 0.085 0.000 0.269) 0.282 29.368 ( 0.625 0.000 4.594) 4.636 29.615 ( 1.166 0.000 1.377) 1.804 29.736 ( -2.054 0.000 -2.014) 2.877 29.893 ( 2.471 0.000 2.781) 3.720 29.932 ( 5.173 0.000 1.398) 5.359 30.031 ( 9.977 0.000 -0.314) 9.982 30.266 ( 9.182 0.000 -0.352) 9.189 30.365 ( -1.088 0.000 1.207) 1.625 30.400 ( -1.856 0.000 1.147) 2.181 30.503 ( -4.003 0.000 -1.765) 4.375 30.744 ( 2.699 0.000 -0.867) 2.835 30.772 ( -5.445 0.000 0.504) 5.468 30.941 ( -0.467 0.000 -11.170) 11.180 30.948 ( -5.575 0.000 8.354) 10.043 31.272 ( -1.338 0.000 -6.544) 6.679 31.436 ( 0.556 0.000 -2.427) 2.490 31.513 ( 1.740 0.000 -8.449) 8.626 31.596 ( -2.265 0.000 7.644) 7.973 31.669 ( 12.544 0.000 4.289) 13.257 32.293 ( -5.181 0.000 2.619) 5.805 32.354 ( -10.366 0.000 -1.277) 10.444 32.560 ( 8.672 0.000 2.823) 9.120 33.209 ( -16.079 0.000 -3.065) 16.368 ======================= Grid point 3 (4/60) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 30 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.429 ( 0.000 0.000 0.000) 0.000 1.231 ( 0.000 0.000 0.000) 0.000 2.174 ( 0.000 0.000 -0.000) 0.000 2.697 ( 0.000 0.000 0.000) 0.000 2.790 ( 0.000 0.000 -0.000) 0.000 2.814 ( 0.000 0.000 0.000) 0.000 2.898 ( 0.000 0.000 0.000) 0.000 3.228 ( 0.000 0.000 0.000) 0.000 3.231 ( -0.000 0.000 -0.000) 0.000 3.267 ( 0.000 0.000 -0.000) 0.000 3.320 ( 0.000 0.000 0.000) 0.000 3.593 ( 0.000 0.000 0.000) 0.000 3.721 ( 0.000 0.000 -0.000) 0.000 3.744 ( -0.000 0.000 -0.000) 0.000 3.780 ( 0.000 0.000 0.000) 0.000 3.875 ( 0.000 0.000 0.000) 0.000 3.983 ( 0.000 0.000 0.000) 0.000 4.199 ( 0.000 0.000 0.000) 0.000 4.275 ( 0.000 0.000 0.000) 0.000 4.291 ( 0.000 0.000 -0.000) 0.000 4.295 ( -0.000 0.000 -0.000) 0.000 4.329 ( 0.000 0.000 0.000) 0.000 4.481 ( 0.000 0.000 0.000) 0.000 4.485 ( 0.000 0.000 0.000) 0.000 4.504 ( -0.000 0.000 0.000) 0.000 4.576 ( 0.000 0.000 -0.000) 0.000 4.651 ( -0.000 0.000 -0.000) 0.000 4.737 ( 0.000 0.000 0.000) 0.000 4.802 ( -0.000 0.000 -0.000) 0.000 4.817 ( -0.000 0.000 0.000) 0.000 5.077 ( 0.000 0.000 0.000) 0.000 5.107 ( 0.000 0.000 0.000) 0.000 5.128 ( 0.000 0.000 0.000) 0.000 5.199 ( 0.000 0.000 0.000) 0.000 5.343 ( 0.000 0.000 -0.000) 0.000 5.556 ( 0.000 0.000 -0.000) 0.000 5.595 ( -0.000 0.000 0.000) 0.000 5.666 ( 0.000 0.000 0.000) 0.000 5.773 ( 0.000 0.000 0.000) 0.000 6.059 ( 0.000 0.000 0.000) 0.000 6.251 ( 0.000 0.000 0.000) 0.000 6.410 ( 0.000 0.000 -0.000) 0.000 6.504 ( 0.000 0.000 -0.000) 0.000 6.877 ( 0.000 0.000 0.000) 0.000 7.425 ( 0.000 0.000 -0.000) 0.000 7.513 ( 0.000 0.000 0.000) 0.000 7.577 ( 0.000 0.000 -0.000) 0.000 7.664 ( 0.000 0.000 0.000) 0.000 8.129 ( 0.000 0.000 -0.000) 0.000 8.250 ( 0.000 0.000 -0.000) 0.000 8.351 ( -0.000 0.000 0.000) 0.000 8.608 ( 0.000 0.000 0.000) 0.000 8.817 ( 0.000 0.000 -0.000) 0.000 8.837 ( 0.000 0.000 0.000) 0.000 8.893 ( 0.000 0.000 0.000) 0.000 8.945 ( -0.000 0.000 0.000) 0.000 9.008 ( 0.000 0.000 -0.000) 0.000 9.015 ( -0.000 0.000 0.000) 0.000 9.156 ( 0.000 0.000 0.000) 0.000 9.436 ( 0.000 0.000 0.000) 0.000 9.500 ( 0.000 0.000 0.000) 0.000 9.718 ( 0.000 0.000 -0.000) 0.000 9.854 ( 0.000 0.000 0.000) 0.000 10.241 ( -0.000 0.000 0.000) 0.000 10.248 ( 0.000 0.000 -0.000) 0.000 10.261 ( 0.000 0.000 0.000) 0.000 10.320 ( 0.000 0.000 0.000) 0.000 10.689 ( 0.000 0.000 0.000) 0.000 10.696 ( 0.000 0.000 0.000) 0.000 10.736 ( 0.000 0.000 -0.000) 0.000 10.781 ( 0.000 0.000 -0.000) 0.000 10.874 ( 0.000 0.000 -0.000) 0.000 10.964 ( 0.000 0.000 -0.000) 0.000 11.022 ( 0.000 0.000 -0.000) 0.000 11.175 ( 0.000 0.000 -0.000) 0.000 11.214 ( 0.000 0.000 0.000) 0.000 11.218 ( 0.000 0.000 0.000) 0.000 11.323 ( 0.000 0.000 0.000) 0.000 11.584 ( 0.000 0.000 0.000) 0.000 11.637 ( 0.000 0.000 0.000) 0.000 11.727 ( 0.000 0.000 -0.000) 0.000 11.893 ( 0.000 0.000 0.000) 0.000 12.069 ( 0.000 0.000 0.000) 0.000 12.267 ( 0.000 0.000 0.000) 0.000 12.324 ( 0.000 0.000 -0.000) 0.000 12.336 ( -0.000 0.000 0.000) 0.000 12.452 ( 0.000 0.000 -0.000) 0.000 12.540 ( 0.000 0.000 -0.000) 0.000 12.842 ( 0.000 0.000 -0.000) 0.000 12.851 ( 0.000 0.000 0.000) 0.000 12.958 ( 0.000 0.000 0.000) 0.000 13.012 ( 0.000 0.000 0.000) 0.000 13.061 ( 0.000 0.000 -0.000) 0.000 13.108 ( 0.000 0.000 0.000) 0.000 13.161 ( 0.000 0.000 0.000) 0.000 13.284 ( 0.000 0.000 -0.000) 0.000 13.396 ( 0.000 0.000 -0.000) 0.000 13.446 ( 0.000 0.000 0.000) 0.000 13.517 ( 0.000 0.000 -0.000) 0.000 13.683 ( 0.000 0.000 0.000) 0.000 13.892 ( 0.000 0.000 -0.000) 0.000 14.008 ( 0.000 0.000 0.000) 0.000 14.024 ( 0.000 0.000 0.000) 0.000 14.039 ( 0.000 0.000 0.000) 0.000 14.061 ( 0.000 0.000 -0.000) 0.000 14.232 ( 0.000 0.000 0.000) 0.000 14.299 ( 0.000 0.000 0.000) 0.000 14.541 ( 0.000 0.000 -0.000) 0.000 14.568 ( 0.000 0.000 0.000) 0.000 14.670 ( 0.000 0.000 0.000) 0.000 14.680 ( -0.000 0.000 0.000) 0.000 14.758 ( 0.000 0.000 0.000) 0.000 14.854 ( 0.000 0.000 -0.000) 0.000 15.029 ( 0.000 0.000 -0.000) 0.000 15.133 ( 0.000 0.000 0.000) 0.000 15.263 ( 0.000 0.000 -0.000) 0.000 15.504 ( 0.000 0.000 0.000) 0.000 15.682 ( 0.000 0.000 -0.000) 0.000 15.693 ( 0.000 0.000 0.000) 0.000 15.757 ( 0.000 0.000 -0.000) 0.000 15.982 ( 0.000 0.000 -0.000) 0.000 16.039 ( 0.000 0.000 0.000) 0.000 16.197 ( 0.000 0.000 -0.000) 0.000 16.207 ( 0.000 0.000 -0.000) 0.000 16.473 ( 0.000 0.000 0.000) 0.000 16.512 ( 0.000 0.000 0.000) 0.000 16.881 ( 0.000 0.000 0.000) 0.000 16.909 ( -0.000 0.000 0.000) 0.000 16.915 ( 0.000 0.000 -0.000) 0.000 17.012 ( 0.000 0.000 0.000) 0.000 17.076 ( 0.000 0.000 -0.000) 0.000 17.133 ( 0.000 0.000 -0.000) 0.000 17.579 ( 0.000 0.000 0.000) 0.000 17.590 ( -0.000 0.000 -0.000) 0.000 17.701 ( 0.000 0.000 0.000) 0.000 17.807 ( 0.000 0.000 0.000) 0.000 18.038 ( 0.000 0.000 0.000) 0.000 18.043 ( 0.000 0.000 -0.000) 0.000 18.045 ( 0.000 0.000 0.000) 0.000 18.183 ( 0.000 0.000 0.000) 0.000 18.433 ( 0.000 0.000 -0.000) 0.000 18.481 ( 0.000 0.000 -0.000) 0.000 18.544 ( 0.000 0.000 -0.000) 0.000 18.732 ( 0.000 0.000 0.000) 0.000 18.801 ( 0.000 0.000 0.000) 0.000 19.098 ( 0.000 0.000 -0.000) 0.000 19.113 ( 0.000 0.000 0.000) 0.000 19.134 ( 0.000 0.000 0.000) 0.000 27.661 ( -0.000 0.000 -0.000) 0.000 27.674 ( 0.000 0.000 0.000) 0.000 27.696 ( 0.000 0.000 0.000) 0.000 27.722 ( 0.000 0.000 0.000) 0.000 27.805 ( 0.000 0.000 0.000) 0.000 27.807 ( 0.000 0.000 0.000) 0.000 27.868 ( 0.000 0.000 0.000) 0.000 27.901 ( 0.000 0.000 -0.000) 0.000 29.147 ( 0.000 0.000 0.000) 0.000 29.389 ( 0.000 0.000 0.000) 0.000 29.640 ( 0.000 0.000 0.000) 0.000 29.700 ( 0.000 0.000 0.000) 0.000 29.933 ( 0.000 0.000 0.000) 0.000 30.002 ( 0.000 0.000 0.000) 0.000 30.174 ( 0.000 0.000 0.000) 0.000 30.311 ( 0.000 0.000 0.000) 0.000 30.380 ( 0.000 0.000 -0.000) 0.000 30.422 ( 0.000 0.000 0.000) 0.000 30.437 ( 0.000 0.000 -0.000) 0.000 30.709 ( 0.000 0.000 -0.000) 0.000 30.711 ( 0.000 0.000 -0.000) 0.000 30.905 ( 0.000 0.000 -0.000) 0.000 30.963 ( 0.000 0.000 0.000) 0.000 31.206 ( 0.000 0.000 -0.000) 0.000 31.436 ( 0.000 0.000 0.000) 0.000 31.524 ( 0.000 0.000 -0.000) 0.000 31.590 ( 0.000 0.000 0.000) 0.000 31.871 ( 0.000 0.000 -0.000) 0.000 32.184 ( 0.000 0.000 0.000) 0.000 32.239 ( 0.000 0.000 0.000) 0.000 32.746 ( -0.000 0.000 -0.000) 0.000 32.937 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 7 (5/60) ======================= q-point: ( 0.00 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.604 ( 0.000 31.041 0.000) 31.041 0.715 ( 0.000 36.265 0.000) 36.265 0.993 ( 0.000 48.874 0.000) 48.874 2.308 ( 0.000 -20.846 0.000) 20.846 2.532 ( 0.000 -18.393 0.000) 18.393 2.632 ( 0.000 1.622 0.000) 1.622 2.842 ( 0.000 3.258 0.000) 3.258 2.880 ( 0.000 8.852 0.000) 8.852 3.043 ( 0.000 -2.477 0.000) 2.477 3.048 ( 0.000 0.007 0.000) 0.007 3.331 ( 0.000 14.362 0.000) 14.362 3.406 ( 0.000 -4.998 0.000) 4.998 3.441 ( 0.000 6.214 0.000) 6.214 3.513 ( 0.000 8.123 0.000) 8.123 3.744 ( 0.000 1.267 0.000) 1.267 3.894 ( 0.000 3.147 0.000) 3.147 3.898 ( 0.000 -1.412 0.000) 1.412 4.011 ( 0.000 5.205 0.000) 5.205 4.157 ( 0.000 -0.236 0.000) 0.236 4.239 ( 0.000 -2.781 0.000) 2.781 4.267 ( 0.000 -10.895 0.000) 10.895 4.415 ( 0.000 -1.050 0.000) 1.050 4.462 ( 0.000 1.528 0.000) 1.528 4.519 ( 0.000 -2.833 0.000) 2.833 4.588 ( 0.000 5.361 0.000) 5.361 4.683 ( 0.000 -1.444 0.000) 1.444 4.810 ( 0.000 0.242 0.000) 0.242 4.838 ( 0.000 -8.833 0.000) 8.833 5.011 ( 0.000 -1.861 0.000) 1.861 5.098 ( 0.000 -3.201 0.000) 3.201 5.168 ( 0.000 1.766 0.000) 1.766 5.176 ( 0.000 4.097 0.000) 4.097 5.241 ( 0.000 -4.798 0.000) 4.798 5.247 ( 0.000 -3.539 0.000) 3.539 5.471 ( 0.000 3.916 0.000) 3.916 5.599 ( 0.000 1.115 0.000) 1.115 5.784 ( 0.000 -3.512 0.000) 3.512 5.831 ( 0.000 -6.833 0.000) 6.833 6.071 ( 0.000 -4.025 0.000) 4.025 6.110 ( 0.000 -6.345 0.000) 6.345 6.230 ( 0.000 0.011 0.000) 0.011 6.346 ( 0.000 0.148 0.000) 0.148 6.536 ( 0.000 11.555 0.000) 11.555 7.175 ( 0.000 -4.454 0.000) 4.454 7.296 ( 0.000 -2.525 0.000) 2.525 7.593 ( 0.000 -8.999 0.000) 8.999 7.828 ( 0.000 7.806 0.000) 7.806 8.010 ( 0.000 -0.287 0.000) 0.287 8.070 ( 0.000 -2.436 0.000) 2.436 8.339 ( 0.000 -8.466 0.000) 8.466 8.548 ( 0.000 6.753 0.000) 6.753 8.670 ( 0.000 1.970 0.000) 1.970 8.779 ( 0.000 6.664 0.000) 6.664 8.910 ( 0.000 -3.793 0.000) 3.793 8.924 ( 0.000 1.263 0.000) 1.263 9.017 ( 0.000 6.400 0.000) 6.400 9.104 ( 0.000 3.210 0.000) 3.210 9.146 ( 0.000 -5.252 0.000) 5.252 9.285 ( 0.000 -0.485 0.000) 0.485 9.313 ( 0.000 2.242 0.000) 2.242 9.419 ( 0.000 0.277 0.000) 0.277 9.738 ( 0.000 -2.956 0.000) 2.956 10.017 ( 0.000 1.654 0.000) 1.654 10.220 ( 0.000 -0.606 0.000) 0.606 10.281 ( 0.000 -1.987 0.000) 1.987 10.315 ( 0.000 -3.644 0.000) 3.644 10.389 ( 0.000 3.221 0.000) 3.221 10.540 ( 0.000 -0.644 0.000) 0.644 10.637 ( 0.000 0.969 0.000) 0.969 10.718 ( 0.000 0.012 0.000) 0.012 10.859 ( 0.000 -2.668 0.000) 2.668 10.945 ( 0.000 2.706 0.000) 2.706 10.949 ( 0.000 0.124 0.000) 0.124 11.017 ( 0.000 0.109 0.000) 0.109 11.122 ( 0.000 3.946 0.000) 3.946 11.204 ( 0.000 -4.185 0.000) 4.185 11.350 ( 0.000 -1.004 0.000) 1.004 11.392 ( 0.000 4.794 0.000) 4.794 11.576 ( 0.000 2.227 0.000) 2.227 11.696 ( 0.000 -7.849 0.000) 7.849 11.830 ( 0.000 -2.011 0.000) 2.011 11.922 ( 0.000 0.757 0.000) 0.757 12.024 ( 0.000 8.370 0.000) 8.370 12.221 ( 0.000 -9.819 0.000) 9.819 12.413 ( 0.000 3.953 0.000) 3.953 12.431 ( 0.000 -0.134 0.000) 0.134 12.537 ( 0.000 2.175 0.000) 2.175 12.621 ( 0.000 -0.030 0.000) 0.030 12.713 ( 0.000 1.873 0.000) 1.873 12.817 ( 0.000 -12.267 0.000) 12.267 12.918 ( 0.000 -3.539 0.000) 3.539 12.994 ( 0.000 -1.804 0.000) 1.804 13.117 ( 0.000 -3.427 0.000) 3.427 13.135 ( 0.000 1.180 0.000) 1.180 13.286 ( 0.000 0.815 0.000) 0.815 13.301 ( 0.000 0.234 0.000) 0.234 13.372 ( 0.000 1.708 0.000) 1.708 13.422 ( 0.000 2.513 0.000) 2.513 13.569 ( 0.000 -2.560 0.000) 2.560 13.631 ( 0.000 0.353 0.000) 0.353 13.677 ( 0.000 11.091 0.000) 11.091 13.804 ( 0.000 5.080 0.000) 5.080 13.970 ( 0.000 -3.271 0.000) 3.271 14.031 ( 0.000 1.647 0.000) 1.647 14.075 ( 0.000 -3.014 0.000) 3.014 14.101 ( 0.000 1.115 0.000) 1.115 14.310 ( 0.000 5.210 0.000) 5.210 14.374 ( 0.000 0.077 0.000) 0.077 14.390 ( 0.000 -2.838 0.000) 2.838 14.456 ( 0.000 -2.107 0.000) 2.107 14.524 ( 0.000 3.665 0.000) 3.665 14.736 ( 0.000 5.979 0.000) 5.979 14.992 ( 0.000 -2.235 0.000) 2.235 15.159 ( 0.000 -0.191 0.000) 0.191 15.291 ( 0.000 -4.157 0.000) 4.157 15.392 ( 0.000 -2.903 0.000) 2.903 15.473 ( 0.000 1.331 0.000) 1.331 15.506 ( 0.000 1.629 0.000) 1.629 15.537 ( 0.000 0.836 0.000) 0.836 15.564 ( 0.000 0.459 0.000) 0.459 15.729 ( 0.000 -5.587 0.000) 5.587 15.884 ( 0.000 -4.971 0.000) 4.971 16.194 ( 0.000 7.321 0.000) 7.321 16.494 ( 0.000 1.919 0.000) 1.919 16.595 ( 0.000 0.418 0.000) 0.418 16.651 ( 0.000 -1.061 0.000) 1.061 16.699 ( 0.000 0.397 0.000) 0.397 16.809 ( 0.000 -5.447 0.000) 5.447 16.961 ( 0.000 0.075 0.000) 0.075 16.982 ( 0.000 -1.201 0.000) 1.201 17.094 ( 0.000 0.270 0.000) 0.270 17.114 ( 0.000 -0.064 0.000) 0.064 17.421 ( 0.000 2.168 0.000) 2.168 17.466 ( 0.000 2.372 0.000) 2.372 17.683 ( 0.000 2.552 0.000) 2.552 17.964 ( 0.000 -0.412 0.000) 0.412 18.123 ( 0.000 -4.713 0.000) 4.713 18.179 ( 0.000 1.541 0.000) 1.541 18.188 ( 0.000 -4.722 0.000) 4.722 18.302 ( 0.000 3.044 0.000) 3.044 18.302 ( 0.000 -1.036 0.000) 1.036 18.385 ( 0.000 0.543 0.000) 0.543 18.685 ( 0.000 3.071 0.000) 3.071 18.744 ( 0.000 -0.473 0.000) 0.473 18.834 ( 0.000 0.357 0.000) 0.357 18.942 ( 0.000 5.717 0.000) 5.717 19.045 ( 0.000 -3.705 0.000) 3.705 19.315 ( 0.000 -3.056 0.000) 3.056 27.648 ( 0.000 -0.496 0.000) 0.496 27.649 ( 0.000 -0.388 0.000) 0.388 27.689 ( 0.000 1.063 0.000) 1.063 27.740 ( 0.000 -0.202 0.000) 0.202 27.767 ( 0.000 0.160 0.000) 0.160 27.787 ( 0.000 -0.274 0.000) 0.274 27.858 ( 0.000 0.316 0.000) 0.316 27.867 ( 0.000 0.080 0.000) 0.080 29.149 ( 0.000 1.334 0.000) 1.334 29.224 ( 0.000 -0.312 0.000) 0.312 29.614 ( 0.000 2.740 0.000) 2.740 29.678 ( 0.000 2.204 0.000) 2.204 29.760 ( 0.000 -0.713 0.000) 0.713 29.808 ( 0.000 -0.935 0.000) 0.935 29.913 ( 0.000 3.389 0.000) 3.389 29.918 ( 0.000 1.090 0.000) 1.090 29.992 ( 0.000 -0.706 0.000) 0.706 30.320 ( 0.000 -8.408 0.000) 8.408 30.616 ( 0.000 2.687 0.000) 2.687 30.628 ( 0.000 6.504 0.000) 6.504 30.975 ( 0.000 0.084 0.000) 0.084 31.086 ( 0.000 -1.644 0.000) 1.644 31.158 ( 0.000 -3.703 0.000) 3.703 31.204 ( 0.000 0.256 0.000) 0.256 31.264 ( 0.000 0.840 0.000) 0.840 31.374 ( 0.000 -5.033 0.000) 5.033 31.512 ( 0.000 4.336 0.000) 4.336 31.728 ( 0.000 8.588 0.000) 8.588 31.925 ( 0.000 -4.712 0.000) 4.712 32.310 ( 0.000 -6.200 0.000) 6.200 33.578 ( 0.000 1.151 0.000) 1.151 33.689 ( 0.000 -1.452 0.000) 1.452 ======================= Grid point 8 (6/60) ======================= q-point: ( 0.17 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 0.822 ( 13.416 30.291 -1.462) 33.161 0.947 ( 5.093 38.400 12.794) 40.794 1.537 ( 46.975 19.170 16.667) 53.404 2.381 ( 5.040 -16.603 1.431) 17.410 2.521 ( -0.995 -15.641 7.096) 17.205 2.681 ( 2.610 2.806 2.283) 4.461 2.821 ( 0.357 2.936 -3.874) 4.874 2.902 ( -0.036 1.843 3.752) 4.180 3.061 ( 0.713 1.001 -2.757) 3.019 3.125 ( 7.240 -1.413 2.986) 7.958 3.325 ( 0.760 11.913 -1.303) 12.009 3.406 ( 2.499 -0.232 -5.379) 5.936 3.480 ( 2.914 8.725 -1.951) 9.403 3.606 ( 7.415 3.744 2.440) 8.658 3.738 ( 0.720 0.256 -1.741) 1.901 3.838 ( 2.343 3.078 1.540) 4.164 3.975 ( 4.180 -2.079 2.455) 5.275 4.070 ( 1.157 0.727 -2.538) 2.882 4.092 ( -6.770 -6.040 -2.841) 9.507 4.153 ( -1.735 -0.431 0.471) 1.849 4.292 ( -2.549 -1.340 3.628) 4.632 4.356 ( -1.605 -3.802 3.326) 5.301 4.446 ( 0.314 1.287 -0.099) 1.329 4.517 ( -1.857 0.618 1.087) 2.239 4.546 ( -0.406 -1.305 -6.133) 6.283 4.700 ( 1.093 1.558 -1.501) 2.424 4.799 ( 0.432 2.063 -2.768) 3.479 4.918 ( -4.273 -4.007 3.550) 6.850 5.041 ( 0.109 -3.064 6.735) 7.400 5.057 ( -0.586 -5.144 -2.164) 5.611 5.158 ( 2.574 -3.944 -0.840) 4.784 5.215 ( -2.096 -8.064 2.125) 8.598 5.247 ( -0.231 -0.709 8.217) 8.251 5.354 ( 6.865 1.058 -7.801) 10.445 5.443 ( -2.649 2.306 -1.420) 3.789 5.560 ( -2.012 0.945 1.380) 2.616 5.644 ( -12.692 -3.613 -1.284) 13.259 5.873 ( 3.508 -3.386 1.201) 5.021 5.959 ( -10.381 -1.606 2.603) 10.822 6.087 ( -5.833 3.240 -7.087) 9.734 6.129 ( -1.882 -5.953 0.409) 6.256 6.345 ( 0.723 -1.568 -4.317) 4.649 6.512 ( -2.528 9.306 -0.307) 9.648 7.113 ( -5.396 -4.749 -0.587) 7.212 7.280 ( 0.155 -3.389 0.291) 3.405 7.598 ( -1.874 -10.885 -2.722) 11.376 7.771 ( -4.971 8.923 2.028) 10.414 7.929 ( -4.694 2.127 -6.829) 8.555 8.066 ( 1.327 -3.546 -2.954) 4.802 8.353 ( 0.823 -7.905 -1.686) 8.124 8.530 ( -2.558 4.817 2.147) 5.862 8.644 ( -1.431 2.709 0.130) 3.066 8.781 ( -0.608 6.293 0.814) 6.375 8.869 ( -1.847 1.098 -1.688) 2.732 8.931 ( -2.133 1.753 -3.491) 4.450 9.024 ( -0.801 -0.291 3.378) 3.484 9.140 ( -0.978 -4.371 1.634) 4.767 9.161 ( -0.520 -1.148 6.415) 6.538 9.205 ( -2.328 1.930 -5.295) 6.098 9.327 ( 0.552 3.141 3.496) 4.732 9.439 ( 0.387 -0.373 2.339) 2.400 9.685 ( -2.656 -3.568 -1.242) 4.618 10.031 ( 1.873 2.035 2.902) 4.009 10.134 ( -9.565 -0.994 1.409) 9.719 10.249 ( 0.327 -3.349 -2.921) 4.456 10.349 ( 1.041 1.935 -3.514) 4.144 10.393 ( 1.636 0.159 2.578) 3.057 10.562 ( -0.607 -0.871 4.381) 4.508 10.614 ( -0.098 1.356 2.999) 3.293 10.732 ( -4.701 -4.125 2.461) 6.721 10.795 ( -1.271 -3.071 0.970) 3.462 10.929 ( 0.859 -2.352 -5.037) 5.625 10.984 ( 1.805 -2.709 -0.723) 3.334 11.043 ( 2.579 5.183 -0.843) 5.850 11.114 ( -2.195 3.564 4.400) 6.073 11.178 ( -4.390 -2.251 -6.043) 7.801 11.339 ( -4.270 4.156 4.537) 7.489 11.412 ( 7.151 -1.673 3.957) 8.342 11.594 ( -1.660 3.251 0.918) 3.764 11.765 ( 2.958 -5.112 7.405) 9.472 11.787 ( -4.587 1.622 6.501) 8.120 11.897 ( 1.299 0.905 0.343) 1.620 12.050 ( -1.382 1.288 -6.367) 6.641 12.189 ( -4.822 2.358 -4.486) 6.995 12.235 ( -1.954 -3.437 -3.378) 5.200 12.416 ( -1.249 -5.102 -0.132) 5.254 12.596 ( 2.191 2.505 -0.370) 3.349 12.647 ( -2.474 -1.227 1.063) 2.959 12.706 ( 2.276 -0.643 1.196) 2.650 12.916 ( -0.563 -6.296 -3.697) 7.323 12.980 ( 5.097 -3.882 1.007) 6.485 13.021 ( 2.306 -1.190 3.191) 4.113 13.076 ( -0.230 -2.112 -3.293) 3.919 13.139 ( -0.379 0.455 -1.375) 1.497 13.233 ( -3.476 2.671 3.908) 5.873 13.247 ( -1.706 0.521 4.529) 4.868 13.367 ( -1.896 2.773 2.292) 4.066 13.387 ( -2.688 -1.090 -6.533) 7.149 13.607 ( -3.309 6.584 3.530) 8.171 13.657 ( 5.851 -2.616 0.570) 6.435 13.731 ( 1.087 5.267 1.567) 5.602 13.885 ( 3.935 6.749 1.673) 7.989 13.918 ( 4.430 9.665 3.821) 11.297 13.969 ( -0.357 1.278 -1.507) 2.008 14.113 ( 1.967 -1.417 0.293) 2.441 14.150 ( 4.751 -3.034 2.274) 6.079 14.311 ( -2.295 2.492 -1.768) 3.822 14.403 ( 2.822 -2.273 -0.915) 3.737 14.466 ( 4.880 0.123 1.533) 5.117 14.537 ( 1.699 0.912 6.728) 6.999 14.588 ( 3.282 -2.619 3.906) 5.735 14.723 ( -0.584 3.768 2.140) 4.372 14.955 ( -5.218 -2.774 2.405) 6.380 15.106 ( -4.980 -0.602 4.985) 7.072 15.140 ( -2.084 -3.934 -1.391) 4.664 15.464 ( 2.123 -1.141 -6.612) 7.038 15.486 ( -1.176 0.105 6.284) 6.394 15.540 ( 4.126 2.690 -3.056) 5.797 15.568 ( 0.155 -0.544 1.830) 1.915 15.637 ( 4.403 1.886 4.030) 6.259 15.688 ( 11.502 1.650 -12.498) 17.066 15.938 ( -2.020 -0.816 -2.229) 3.117 16.221 ( 3.763 2.021 -0.229) 4.277 16.398 ( -5.774 4.978 -5.198) 9.228 16.562 ( -1.610 0.735 5.313) 5.600 16.614 ( -2.831 0.847 0.111) 2.957 16.741 ( 3.618 -0.530 0.709) 3.724 16.772 ( -0.430 -1.981 -1.115) 2.313 16.992 ( 0.891 -1.428 1.257) 2.101 17.007 ( 2.160 -1.589 -5.608) 6.216 17.074 ( -2.150 0.068 1.414) 2.574 17.101 ( -1.149 -1.026 2.603) 3.025 17.486 ( 1.375 2.742 2.711) 4.094 17.509 ( 4.583 -0.636 2.161) 5.106 17.699 ( 1.801 1.311 -5.505) 5.939 17.955 ( -0.017 1.468 -4.162) 4.413 17.990 ( -6.565 -0.719 4.527) 8.007 18.133 ( -3.738 0.900 2.220) 4.440 18.155 ( -3.043 2.187 0.749) 3.821 18.263 ( -0.684 -2.342 -1.419) 2.822 18.420 ( 3.107 -1.091 -3.739) 4.983 18.467 ( 4.954 -6.635 -4.374) 9.365 18.669 ( -2.804 2.006 1.386) 3.716 18.743 ( 0.940 0.064 -3.115) 3.254 18.828 ( 0.200 6.260 -9.192) 11.124 18.891 ( 2.407 -2.756 -0.141) 3.662 19.088 ( 1.204 -5.174 -0.615) 5.348 19.254 ( -4.375 -2.982 -3.278) 6.227 27.630 ( -0.592 -0.388 0.554) 0.899 27.653 ( -0.414 -1.185 0.624) 1.402 27.701 ( 0.478 1.241 1.045) 1.691 27.743 ( -0.101 0.044 0.806) 0.814 27.790 ( 1.412 -0.020 0.279) 1.440 27.803 ( 1.587 0.386 0.098) 1.636 27.856 ( -0.796 0.185 -0.717) 1.087 27.864 ( 0.766 -0.190 -0.079) 0.793 29.158 ( 0.436 1.779 0.812) 2.003 29.303 ( 0.957 -2.056 8.535) 8.831 29.631 ( 0.339 3.486 0.322) 3.517 29.767 ( 3.641 -2.683 1.762) 4.854 29.795 ( -0.897 -0.258 0.043) 0.935 29.834 ( 6.364 -0.310 -0.046) 6.372 29.877 ( 3.056 2.037 0.108) 3.674 30.085 ( 9.718 2.569 0.744) 10.080 30.187 ( 5.158 -10.002 2.302) 11.486 30.408 ( 10.676 -7.634 -3.551) 13.596 30.596 ( -1.240 2.792 0.395) 3.080 30.640 ( 0.088 5.354 2.452) 5.889 30.907 ( -4.279 1.415 -2.447) 5.128 31.008 ( -4.041 -0.949 -3.961) 5.738 31.143 ( -7.158 2.750 -0.826) 7.713 31.226 ( 5.509 -4.445 -8.175) 10.814 31.327 ( 7.024 -3.940 -1.463) 8.185 31.402 ( 1.062 -5.165 1.280) 5.426 31.546 ( -0.315 1.779 10.036) 10.197 31.697 ( 1.026 9.273 -7.781) 12.149 32.011 ( 2.666 -9.929 10.471) 14.674 32.352 ( 3.786 -6.553 1.354) 7.688 33.129 ( -27.050 20.341 -8.486) 34.892 33.502 ( -12.906 -1.562 -0.911) 13.032 ======================= Grid point 9 (7/60) ======================= q-point: ( 0.33 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.069 ( 4.816 43.009 2.187) 43.333 1.193 ( 16.521 23.584 9.656) 30.371 2.367 ( -4.186 0.765 1.025) 4.377 2.535 ( 15.711 -9.643 9.317) 20.655 2.583 ( 8.698 -4.061 3.213) 10.123 2.772 ( 12.154 3.424 6.345) 14.131 2.875 ( 9.534 3.415 -1.850) 10.295 2.986 ( 6.492 -5.673 4.764) 9.850 3.004 ( -2.834 0.752 -2.646) 3.949 3.268 ( 1.372 -7.031 2.373) 7.546 3.384 ( 4.419 8.279 1.313) 9.475 3.483 ( 6.675 1.604 -1.974) 7.143 3.520 ( 0.976 8.103 -0.047) 8.162 3.660 ( 2.324 -1.222 -7.377) 7.830 3.851 ( 3.680 -1.623 -5.110) 6.503 3.931 ( 3.138 -0.059 3.755) 4.894 4.001 ( -1.421 -2.117 0.210) 2.558 4.058 ( 6.719 -5.249 8.217) 11.841 4.073 ( -0.377 -0.093 -1.453) 1.504 4.126 ( 1.724 -1.886 0.668) 2.641 4.318 ( 2.848 0.652 -0.066) 2.922 4.385 ( 2.021 -0.970 1.878) 2.924 4.465 ( 2.523 2.561 -2.491) 4.374 4.493 ( 0.852 4.704 -3.744) 6.072 4.551 ( 1.619 1.183 -0.519) 2.071 4.658 ( -5.916 -3.666 0.501) 6.978 4.733 ( -4.673 4.073 -0.719) 6.241 4.812 ( -2.570 -1.176 0.013) 2.826 4.959 ( -5.710 -4.087 -3.525) 7.857 5.043 ( -15.471 -4.549 0.179) 16.127 5.099 ( -7.753 -3.709 2.653) 8.995 5.163 ( -3.540 -0.589 -0.384) 3.610 5.217 ( -0.140 -2.334 4.761) 5.305 5.335 ( -2.905 4.441 1.149) 5.429 5.395 ( -3.006 -2.003 -2.092) 4.174 5.481 ( -1.231 0.517 -2.784) 3.088 5.604 ( 2.802 1.586 3.922) 5.074 5.689 ( -9.472 0.441 0.794) 9.515 5.817 ( -5.246 4.383 -3.715) 7.780 6.089 ( 7.013 -3.477 -6.600) 10.239 6.110 ( -2.826 -6.379 5.667) 8.989 6.338 ( 1.113 -5.894 -3.912) 7.161 6.457 ( -0.793 5.271 -0.529) 5.356 6.958 ( -8.815 -6.293 -1.502) 10.934 7.299 ( 1.433 -5.204 0.191) 5.401 7.480 ( -6.174 -9.805 -3.619) 12.139 7.703 ( -2.252 9.503 3.093) 10.244 7.817 ( -2.472 5.313 -5.450) 8.003 8.082 ( 2.449 -3.682 -6.621) 7.962 8.312 ( -3.774 -4.148 -1.213) 5.738 8.434 ( -8.996 -0.305 3.744) 9.749 8.628 ( 0.247 -0.477 -0.587) 0.795 8.724 ( -3.101 2.301 -1.223) 4.051 8.846 ( 1.631 2.382 -1.254) 3.147 8.897 ( 0.879 1.607 -2.284) 2.928 9.009 ( -2.086 -1.400 2.410) 3.481 9.095 ( -5.148 2.156 1.705) 5.836 9.123 ( -1.913 -4.277 1.970) 5.083 9.157 ( -0.418 8.500 -3.608) 9.244 9.379 ( 1.353 -0.835 2.482) 2.948 9.461 ( 0.690 -1.684 1.934) 2.656 9.671 ( 1.141 -3.731 -0.095) 3.902 9.947 ( -8.214 0.788 4.341) 9.324 10.152 ( 6.594 0.287 5.042) 8.306 10.238 ( 0.813 -1.710 -3.351) 3.849 10.321 ( -1.979 1.653 -1.483) 2.974 10.386 ( -5.585 3.596 2.036) 6.948 10.569 ( 2.793 -5.130 0.193) 5.845 10.653 ( -0.009 -1.373 6.617) 6.758 10.708 ( 2.143 -2.435 0.379) 3.266 10.794 ( 0.603 0.536 0.058) 0.809 10.862 ( -2.444 -4.202 -7.831) 9.217 11.024 ( 1.525 -1.443 -0.771) 2.237 11.064 ( 0.146 -5.173 2.781) 5.874 11.109 ( -0.124 10.387 -1.202) 10.457 11.135 ( -0.762 -2.124 0.927) 2.440 11.294 ( -1.141 2.829 1.072) 3.233 11.438 ( -5.032 3.090 4.441) 7.389 11.569 ( -1.016 3.071 1.312) 3.491 11.726 ( -4.397 -0.721 2.789) 5.256 11.848 ( 1.146 1.709 1.915) 2.811 11.928 ( -1.737 3.170 -2.385) 4.330 11.986 ( 7.271 -3.452 -3.207) 8.664 12.124 ( -0.665 2.543 -5.119) 5.754 12.184 ( -3.696 -7.107 0.545) 8.029 12.389 ( -2.154 -5.250 0.101) 5.675 12.605 ( -0.174 5.757 2.502) 6.280 12.634 ( 0.104 1.979 -1.510) 2.492 12.748 ( 1.865 -1.989 0.609) 2.794 12.884 ( -0.378 -6.939 -2.303) 7.321 12.981 ( -0.895 1.018 -0.959) 1.660 13.034 ( -2.531 0.612 -2.666) 3.727 13.061 ( -2.087 0.215 -0.252) 2.113 13.122 ( 0.164 0.171 0.017) 0.238 13.179 ( -2.782 3.118 5.047) 6.552 13.284 ( -1.140 -4.137 0.072) 4.291 13.322 ( 2.503 4.795 1.395) 5.586 13.379 ( 0.831 -3.036 0.655) 3.215 13.591 ( 0.607 7.583 1.955) 7.854 13.748 ( 2.354 0.628 -0.145) 2.441 13.815 ( 3.523 -3.548 2.758) 5.710 13.952 ( 1.110 3.875 -0.435) 4.055 13.981 ( 3.217 1.440 0.333) 3.540 14.040 ( 3.802 4.995 2.210) 6.655 14.154 ( 2.912 1.966 -4.612) 5.798 14.213 ( -2.527 -2.001 0.491) 3.261 14.279 ( 1.461 1.100 1.738) 2.523 14.470 ( 3.726 -3.490 -2.550) 5.707 14.528 ( -0.167 -3.950 1.857) 4.368 14.553 ( -2.250 -0.244 4.399) 4.947 14.659 ( 3.584 1.407 0.121) 3.852 14.804 ( 6.006 3.418 3.887) 7.929 14.848 ( -6.307 -3.426 3.932) 8.184 15.039 ( -0.633 -2.593 0.793) 2.785 15.206 ( 3.698 7.141 0.798) 8.081 15.408 ( -1.712 7.471 -4.276) 8.777 15.501 ( 0.418 2.067 3.800) 4.346 15.588 ( 0.914 -1.904 3.899) 4.434 15.714 ( 3.381 -1.170 -5.296) 6.391 15.747 ( 6.507 -0.738 0.295) 6.555 15.836 ( 4.469 -3.420 1.026) 5.721 15.896 ( 5.840 0.745 -4.243) 7.257 16.218 ( -3.169 -0.781 -4.404) 5.482 16.298 ( -3.467 0.828 -4.133) 5.458 16.515 ( -2.025 1.293 0.036) 2.402 16.567 ( -2.456 1.096 2.412) 3.612 16.828 ( 5.311 0.359 -0.940) 5.406 16.841 ( 4.355 0.606 0.954) 4.499 16.972 ( -3.898 0.329 4.708) 6.121 17.005 ( 0.114 -1.076 -2.650) 2.863 17.059 ( 0.395 -1.819 -0.860) 2.050 17.099 ( 0.077 -2.384 0.242) 2.398 17.534 ( 1.748 2.747 3.502) 4.781 17.599 ( 2.281 -0.969 0.571) 2.543 17.701 ( 0.931 1.617 -0.994) 2.114 17.872 ( -4.104 1.273 -1.976) 4.730 17.961 ( 0.180 -2.540 0.827) 2.677 18.073 ( -2.589 -0.440 -3.018) 4.001 18.112 ( -1.069 3.483 3.294) 4.911 18.224 ( -1.833 -0.574 -2.448) 3.112 18.437 ( 0.009 -2.346 -1.778) 2.943 18.484 ( -0.364 -1.334 -1.233) 1.853 18.594 ( -4.067 1.743 1.226) 4.591 18.748 ( 0.805 0.852 -2.550) 2.806 18.818 ( 1.338 3.769 -2.120) 4.526 18.967 ( 4.449 -6.677 -2.238) 8.330 19.087 ( -0.881 -5.056 -0.063) 5.132 19.144 ( -3.555 -2.358 -2.829) 5.119 27.633 ( 0.349 -0.780 0.999) 1.314 27.649 ( -0.177 -1.562 0.546) 1.664 27.713 ( 0.132 1.242 0.976) 1.585 27.740 ( -0.506 0.323 0.320) 0.680 27.807 ( 0.471 0.631 -0.132) 0.798 27.828 ( -0.660 0.392 -0.920) 1.199 27.852 ( 1.667 0.534 0.443) 1.805 27.886 ( 1.036 -0.436 0.162) 1.135 29.168 ( 0.151 2.305 0.591) 2.384 29.353 ( 0.728 -1.645 3.980) 4.368 29.648 ( 0.851 3.025 1.873) 3.658 29.744 ( -1.761 0.688 -0.958) 2.120 29.863 ( 2.989 -1.194 1.267) 3.460 29.971 ( 6.254 2.086 1.124) 6.688 30.024 ( 8.918 -0.788 -0.177) 8.955 30.197 ( -0.432 -7.418 -0.875) 7.482 30.312 ( 9.821 3.088 0.608) 10.313 30.522 ( -0.512 4.624 0.735) 4.710 30.570 ( -1.480 4.491 0.090) 4.729 30.685 ( 2.186 -2.403 0.428) 3.277 30.805 ( -3.878 1.514 -1.429) 4.402 30.921 ( -1.769 -0.322 -4.052) 4.433 30.991 ( -6.197 2.463 2.882) 7.265 31.231 ( -1.406 -4.943 -6.628) 8.387 31.394 ( 1.236 -3.564 -1.529) 4.070 31.459 ( 4.040 -4.089 -4.795) 7.485 31.583 ( -1.184 1.008 8.736) 8.873 31.758 ( 7.384 5.841 -2.243) 9.678 32.099 ( 1.805 -6.864 8.290) 10.913 32.488 ( 8.436 -6.805 2.054) 11.031 32.626 ( -18.708 14.316 -4.921) 24.066 33.164 ( -17.265 -4.429 -3.749) 18.214 ======================= Grid point 10 (8/60) ======================= q-point: (-0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.122 ( 0.000 45.708 0.000) 45.708 1.465 ( 0.000 21.604 0.000) 21.604 2.216 ( 0.000 4.009 -0.000) 4.009 2.595 ( 0.000 -5.994 0.000) 5.994 2.675 ( 0.000 -10.113 0.000) 10.113 2.927 ( 0.000 7.395 -0.000) 7.395 2.935 ( 0.000 2.612 0.000) 2.612 3.116 ( 0.000 -15.791 0.000) 15.791 3.227 ( -0.000 -2.091 -0.000) 2.091 3.285 ( 0.000 2.389 0.000) 2.389 3.373 ( -0.000 9.875 -0.000) 9.875 3.546 ( 0.000 -4.165 0.000) 4.165 3.674 ( -0.000 0.105 -0.000) 0.105 3.741 ( -0.000 -4.002 -0.000) 4.002 3.759 ( -0.000 -3.035 0.000) 3.035 3.900 ( 0.000 -5.892 0.000) 5.892 3.960 ( 0.000 9.130 0.000) 9.130 4.101 ( 0.000 -5.372 0.000) 5.372 4.210 ( 0.000 -8.892 -0.000) 8.892 4.216 ( -0.000 1.151 0.000) 1.151 4.391 ( 0.000 0.718 0.000) 0.718 4.450 ( 0.000 1.158 -0.000) 1.158 4.481 ( 0.000 4.107 0.000) 4.107 4.506 ( 0.000 5.062 0.000) 5.062 4.526 ( 0.000 -1.227 0.000) 1.227 4.581 ( 0.000 3.100 -0.000) 3.100 4.634 ( -0.000 -2.622 -0.000) 2.622 4.719 ( 0.000 -0.939 -0.000) 0.939 4.815 ( 0.000 1.941 0.000) 1.941 4.863 ( -0.000 3.698 -0.000) 3.698 5.023 ( 0.000 -2.048 0.000) 2.048 5.136 ( 0.000 -0.157 0.000) 0.157 5.229 ( -0.000 7.590 -0.000) 7.590 5.230 ( 0.000 2.362 0.000) 2.362 5.350 ( 0.000 0.872 -0.000) 0.872 5.423 ( 0.000 -5.217 -0.000) 5.217 5.657 ( 0.000 -0.424 0.000) 0.424 5.698 ( 0.000 -0.462 0.000) 0.462 5.753 ( 0.000 2.609 0.000) 2.609 6.032 ( 0.000 -2.846 0.000) 2.846 6.187 ( 0.000 -6.116 -0.000) 6.116 6.335 ( 0.000 -7.248 0.000) 7.248 6.490 ( 0.000 -0.572 -0.000) 0.572 6.816 ( 0.000 -5.756 0.000) 5.756 7.338 ( 0.000 -5.813 0.000) 5.813 7.375 ( -0.000 -8.641 -0.000) 8.641 7.699 ( 0.000 9.311 0.000) 9.311 7.772 ( 0.000 6.310 -0.000) 6.310 8.096 ( 0.000 -3.013 -0.000) 3.013 8.271 ( 0.000 2.124 -0.000) 2.124 8.291 ( -0.000 -5.709 0.000) 5.709 8.635 ( 0.000 -2.154 0.000) 2.154 8.697 ( 0.000 -3.022 -0.000) 3.022 8.867 ( 0.000 3.173 0.000) 3.173 8.933 ( 0.000 -0.844 0.000) 0.844 8.956 ( 0.000 4.221 0.000) 4.221 9.041 ( 0.000 1.701 0.000) 1.701 9.108 ( 0.000 -3.888 0.000) 3.888 9.143 ( 0.000 9.748 0.000) 9.748 9.397 ( 0.000 -2.500 -0.000) 2.500 9.477 ( 0.000 -1.647 0.000) 1.647 9.690 ( 0.000 -3.410 -0.000) 3.410 9.875 ( 0.000 2.228 0.000) 2.228 10.254 ( 0.000 -5.660 -0.000) 5.660 10.262 ( -0.000 0.923 0.000) 0.923 10.280 ( 0.000 3.499 -0.000) 3.499 10.300 ( -0.000 3.452 0.000) 3.452 10.614 ( 0.000 -4.884 0.000) 4.884 10.676 ( 0.000 -1.578 0.000) 1.578 10.772 ( 0.000 -7.292 -0.000) 7.292 10.774 ( 0.000 -1.095 -0.000) 1.095 10.806 ( 0.000 3.379 0.000) 3.379 11.028 ( 0.000 -0.805 -0.000) 0.805 11.089 ( 0.000 -9.239 -0.000) 9.239 11.090 ( 0.000 12.710 0.000) 12.710 11.128 ( 0.000 -1.083 0.000) 1.083 11.302 ( 0.000 -3.127 0.000) 3.127 11.380 ( 0.000 8.657 -0.000) 8.657 11.536 ( 0.000 2.324 0.000) 2.324 11.682 ( 0.000 -0.950 0.000) 0.950 11.859 ( 0.000 7.071 -0.000) 7.071 11.951 ( 0.000 7.989 0.000) 7.989 12.058 ( 0.000 -2.641 0.000) 2.641 12.106 ( 0.000 -7.657 0.000) 7.657 12.125 ( 0.000 -8.344 -0.000) 8.344 12.352 ( 0.000 -3.190 -0.000) 3.190 12.620 ( 0.000 4.974 -0.000) 4.974 12.624 ( 0.000 7.284 0.000) 7.284 12.781 ( 0.000 -2.363 0.000) 2.363 12.873 ( 0.000 -7.139 0.000) 7.139 12.942 ( 0.000 7.385 -0.000) 7.385 13.003 ( 0.000 -4.114 0.000) 4.114 13.041 ( 0.000 -0.948 0.000) 0.948 13.120 ( 0.000 0.242 -0.000) 0.242 13.174 ( 0.000 1.790 0.000) 1.790 13.265 ( 0.000 -7.780 0.000) 7.780 13.363 ( 0.000 4.856 -0.000) 4.856 13.389 ( 0.000 -0.104 0.000) 0.104 13.611 ( 0.000 6.589 -0.000) 6.589 13.770 ( 0.000 1.827 -0.000) 1.827 13.856 ( 0.000 -2.994 0.000) 2.994 13.962 ( 0.000 -0.300 0.000) 0.300 14.038 ( 0.000 -0.060 0.000) 0.060 14.086 ( 0.000 2.206 0.000) 2.206 14.141 ( 0.000 6.970 -0.000) 6.970 14.192 ( 0.000 -1.984 0.000) 1.984 14.308 ( 0.000 0.841 -0.000) 0.841 14.510 ( -0.000 -7.777 0.000) 7.777 14.512 ( 0.000 -3.157 -0.000) 3.157 14.539 ( 0.000 -2.921 0.000) 2.921 14.734 ( 0.000 0.045 -0.000) 0.045 14.758 ( -0.000 0.642 0.000) 0.642 14.911 ( 0.000 4.854 0.000) 4.854 15.029 ( 0.000 -0.234 -0.000) 0.234 15.253 ( 0.000 9.374 0.000) 9.374 15.376 ( 0.000 9.402 -0.000) 9.402 15.527 ( 0.000 2.407 0.000) 2.407 15.629 ( 0.000 -4.456 0.000) 4.456 15.691 ( 0.000 -0.369 -0.000) 0.369 15.741 ( 0.000 -1.775 -0.000) 1.775 15.984 ( 0.000 0.872 0.000) 0.872 16.033 ( 0.000 -0.764 0.000) 0.764 16.131 ( -0.000 -5.413 -0.000) 5.413 16.187 ( 0.000 -2.227 -0.000) 2.227 16.496 ( 0.000 2.331 0.000) 2.331 16.550 ( 0.000 2.753 0.000) 2.753 16.895 ( 0.000 1.130 0.000) 1.130 16.911 ( -0.000 0.497 0.000) 0.497 16.922 ( 0.000 0.997 -0.000) 0.997 16.995 ( 0.000 -1.644 0.000) 1.644 17.059 ( 0.000 -1.689 -0.000) 1.689 17.102 ( 0.000 -3.103 -0.000) 3.103 17.580 ( 0.000 1.079 0.000) 1.079 17.602 ( 0.000 1.279 -0.000) 1.279 17.722 ( 0.000 1.040 -0.000) 1.040 17.815 ( 0.000 -0.029 -0.000) 0.029 17.980 ( 0.000 -1.610 0.000) 1.610 18.018 ( 0.000 -1.790 -0.000) 1.790 18.122 ( 0.000 3.597 -0.000) 3.597 18.187 ( 0.000 0.219 0.000) 0.219 18.425 ( 0.000 -0.591 -0.000) 0.591 18.473 ( 0.000 -0.873 -0.000) 0.873 18.551 ( 0.000 1.057 -0.000) 1.057 18.747 ( 0.000 1.252 0.000) 1.252 18.830 ( 0.000 2.673 0.000) 2.673 19.020 ( 0.000 -9.383 -0.000) 9.383 19.066 ( 0.000 -2.904 0.000) 2.904 19.099 ( 0.000 -2.024 0.000) 2.024 27.645 ( -0.000 -1.192 -0.000) 1.192 27.648 ( 0.000 -1.543 0.000) 1.543 27.717 ( 0.000 1.096 0.000) 1.096 27.733 ( 0.000 0.606 0.000) 0.606 27.812 ( 0.000 0.587 0.000) 0.587 27.815 ( 0.000 0.713 -0.000) 0.713 27.874 ( 0.000 0.539 0.000) 0.539 27.898 ( 0.000 -0.281 -0.000) 0.281 29.171 ( 0.000 2.454 0.000) 2.454 29.372 ( 0.000 -1.830 0.000) 1.830 29.672 ( 0.000 2.860 0.000) 2.860 29.714 ( 0.000 1.387 0.000) 1.387 29.902 ( 0.000 -1.466 0.000) 1.466 30.057 ( 0.000 3.758 -0.000) 3.758 30.123 ( -0.000 -6.255 0.000) 6.255 30.201 ( 0.000 -3.398 -0.000) 3.398 30.449 ( 0.000 3.570 0.000) 3.570 30.472 ( 0.000 5.018 0.000) 5.018 30.568 ( 0.000 9.256 0.000) 9.256 30.678 ( 0.000 -2.370 -0.000) 2.370 30.744 ( 0.000 2.437 -0.000) 2.437 30.886 ( 0.000 -1.607 -0.000) 1.607 30.976 ( 0.000 1.170 0.000) 1.170 31.163 ( 0.000 -4.765 0.000) 4.765 31.402 ( 0.000 -2.828 0.000) 2.828 31.488 ( 0.000 -3.402 -0.000) 3.402 31.594 ( 0.000 1.548 0.000) 1.548 31.855 ( 0.000 -2.227 0.000) 2.227 32.243 ( 0.000 5.399 0.000) 5.399 32.290 ( 0.000 5.631 0.000) 5.631 32.686 ( -0.000 -5.775 -0.000) 5.775 32.869 ( 0.000 -6.731 0.000) 6.731 ======================= Grid point 14 (9/60) ======================= q-point: ( 0.00 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.208 ( 0.000 30.708 0.000) 30.708 1.401 ( 0.000 33.585 0.000) 33.585 1.751 ( 0.000 -6.281 0.000) 6.281 1.864 ( 0.000 -1.185 0.000) 1.185 2.122 ( 0.000 -10.232 0.000) 10.232 2.525 ( 0.000 -18.121 0.000) 18.121 2.957 ( 0.000 0.467 0.000) 0.467 2.970 ( 0.000 5.439 0.000) 5.439 3.027 ( 0.000 -0.744 0.000) 0.744 3.050 ( 0.000 2.810 0.000) 2.810 3.375 ( 0.000 2.741 0.000) 2.741 3.466 ( 0.000 -3.763 0.000) 3.763 3.559 ( 0.000 9.797 0.000) 9.797 3.716 ( 0.000 -5.067 0.000) 5.067 3.731 ( 0.000 11.021 0.000) 11.021 3.857 ( 0.000 -2.653 0.000) 2.653 3.972 ( 0.000 3.794 0.000) 3.794 4.061 ( 0.000 -7.361 0.000) 7.361 4.161 ( 0.000 4.576 0.000) 4.576 4.182 ( 0.000 0.505 0.000) 0.505 4.228 ( 0.000 7.810 0.000) 7.810 4.374 ( 0.000 -1.434 0.000) 1.434 4.452 ( 0.000 -3.480 0.000) 3.480 4.553 ( 0.000 3.579 0.000) 3.579 4.560 ( 0.000 -14.184 0.000) 14.184 4.640 ( 0.000 -2.609 0.000) 2.609 4.710 ( 0.000 6.619 0.000) 6.619 4.819 ( 0.000 -0.764 0.000) 0.764 4.932 ( 0.000 -8.213 0.000) 8.213 4.941 ( 0.000 -4.621 0.000) 4.621 5.138 ( 0.000 0.946 0.000) 0.946 5.165 ( 0.000 -0.985 0.000) 0.985 5.320 ( 0.000 9.075 0.000) 9.075 5.406 ( 0.000 7.824 0.000) 7.824 5.522 ( 0.000 -0.258 0.000) 0.258 5.537 ( 0.000 -7.758 0.000) 7.758 5.696 ( 0.000 -3.834 0.000) 3.834 5.702 ( 0.000 -3.553 0.000) 3.553 5.955 ( 0.000 -4.335 0.000) 4.335 5.973 ( 0.000 -5.714 0.000) 5.714 6.284 ( 0.000 3.693 0.000) 3.693 6.334 ( 0.000 -1.247 0.000) 1.247 6.809 ( 0.000 14.289 0.000) 14.289 7.048 ( 0.000 -9.477 0.000) 9.477 7.279 ( 0.000 2.411 0.000) 2.411 7.400 ( 0.000 -9.259 0.000) 9.259 7.967 ( 0.000 4.301 0.000) 4.301 7.998 ( 0.000 -0.738 0.000) 0.738 8.056 ( 0.000 2.933 0.000) 2.933 8.179 ( 0.000 -7.745 0.000) 7.745 8.679 ( 0.000 5.283 0.000) 5.283 8.712 ( 0.000 1.517 0.000) 1.517 8.856 ( 0.000 0.953 0.000) 0.953 8.863 ( 0.000 -1.062 0.000) 1.062 8.962 ( 0.000 2.688 0.000) 2.688 9.037 ( 0.000 -5.092 0.000) 5.092 9.122 ( 0.000 3.041 0.000) 3.041 9.139 ( 0.000 0.643 0.000) 0.643 9.288 ( 0.000 1.165 0.000) 1.165 9.325 ( 0.000 -1.484 0.000) 1.484 9.494 ( 0.000 7.771 0.000) 7.771 9.651 ( 0.000 -6.512 0.000) 6.512 10.077 ( 0.000 4.909 0.000) 4.909 10.201 ( 0.000 -6.403 0.000) 6.403 10.216 ( 0.000 -0.363 0.000) 0.363 10.238 ( 0.000 -2.081 0.000) 2.081 10.465 ( 0.000 4.668 0.000) 4.668 10.546 ( 0.000 -1.532 0.000) 1.532 10.674 ( 0.000 -0.427 0.000) 0.427 10.693 ( 0.000 3.213 0.000) 3.213 10.786 ( 0.000 -2.184 0.000) 2.184 10.884 ( 0.000 -7.127 0.000) 7.127 10.988 ( 0.000 1.797 0.000) 1.797 11.017 ( 0.000 -1.299 0.000) 1.299 11.191 ( 0.000 3.062 0.000) 3.062 11.204 ( 0.000 2.419 0.000) 2.419 11.364 ( 0.000 2.607 0.000) 2.607 11.448 ( 0.000 -3.364 0.000) 3.364 11.631 ( 0.000 5.433 0.000) 5.433 11.662 ( 0.000 7.050 0.000) 7.050 11.767 ( 0.000 -5.261 0.000) 5.261 11.837 ( 0.000 -9.182 0.000) 9.182 12.114 ( 0.000 0.041 0.000) 0.041 12.134 ( 0.000 1.227 0.000) 1.227 12.436 ( 0.000 1.140 0.000) 1.140 12.483 ( 0.000 -0.842 0.000) 0.842 12.530 ( 0.000 0.654 0.000) 0.654 12.603 ( 0.000 -2.760 0.000) 2.760 12.705 ( 0.000 1.843 0.000) 1.843 12.730 ( 0.000 -0.089 0.000) 0.089 12.887 ( 0.000 1.328 0.000) 1.328 12.951 ( 0.000 -3.045 0.000) 3.045 13.063 ( 0.000 -1.680 0.000) 1.680 13.082 ( 0.000 -3.975 0.000) 3.975 13.288 ( 0.000 0.105 0.000) 0.105 13.298 ( 0.000 -0.761 0.000) 0.761 13.439 ( 0.000 3.282 0.000) 3.282 13.460 ( 0.000 0.766 0.000) 0.766 13.556 ( 0.000 1.657 0.000) 1.657 13.608 ( 0.000 -2.453 0.000) 2.453 13.858 ( 0.000 5.793 0.000) 5.793 13.890 ( 0.000 2.875 0.000) 2.875 13.921 ( 0.000 -1.033 0.000) 1.033 13.961 ( 0.000 -3.864 0.000) 3.864 14.130 ( 0.000 3.290 0.000) 3.290 14.136 ( 0.000 2.097 0.000) 2.097 14.329 ( 0.000 -1.717 0.000) 1.717 14.359 ( 0.000 -3.325 0.000) 3.325 14.378 ( 0.000 1.452 0.000) 1.452 14.398 ( 0.000 -1.459 0.000) 1.459 14.670 ( 0.000 10.159 0.000) 10.159 14.870 ( 0.000 -9.363 0.000) 9.363 14.902 ( 0.000 10.792 0.000) 10.792 15.112 ( 0.000 -8.395 0.000) 8.395 15.249 ( 0.000 2.352 0.000) 2.352 15.323 ( 0.000 -4.053 0.000) 4.053 15.496 ( 0.000 1.028 0.000) 1.028 15.515 ( 0.000 -0.874 0.000) 0.874 15.556 ( 0.000 1.064 0.000) 1.064 15.567 ( 0.000 0.274 0.000) 0.274 15.682 ( 0.000 1.718 0.000) 1.718 15.770 ( 0.000 -6.050 0.000) 6.050 16.363 ( 0.000 9.036 0.000) 9.036 16.496 ( 0.000 -3.182 0.000) 3.182 16.611 ( 0.000 1.092 0.000) 1.092 16.630 ( 0.000 -1.010 0.000) 1.010 16.694 ( 0.000 -0.736 0.000) 0.736 16.707 ( 0.000 -3.428 0.000) 3.428 16.958 ( 0.000 -0.177 0.000) 0.177 16.962 ( 0.000 -0.652 0.000) 0.652 17.102 ( 0.000 0.507 0.000) 0.507 17.111 ( 0.000 -0.306 0.000) 0.306 17.465 ( 0.000 2.064 0.000) 2.064 17.490 ( 0.000 -0.234 0.000) 0.234 17.778 ( 0.000 6.954 0.000) 6.954 17.915 ( 0.000 -5.654 0.000) 5.654 18.059 ( 0.000 -0.237 0.000) 0.237 18.101 ( 0.000 -3.786 0.000) 3.786 18.222 ( 0.000 2.500 0.000) 2.500 18.269 ( 0.000 -2.188 0.000) 2.188 18.356 ( 0.000 2.326 0.000) 2.326 18.386 ( 0.000 -0.680 0.000) 0.680 18.730 ( 0.000 1.016 0.000) 1.016 18.737 ( 0.000 -0.186 0.000) 0.186 18.862 ( 0.000 3.304 0.000) 3.304 18.953 ( 0.000 -5.280 0.000) 5.280 19.085 ( 0.000 7.936 0.000) 7.936 19.225 ( 0.000 -6.088 0.000) 6.088 27.641 ( 0.000 -0.172 0.000) 0.172 27.642 ( 0.000 -0.243 0.000) 0.243 27.711 ( 0.000 1.090 0.000) 1.090 27.730 ( 0.000 -0.771 0.000) 0.771 27.773 ( 0.000 0.407 0.000) 0.407 27.780 ( 0.000 -0.354 0.000) 0.354 27.864 ( 0.000 0.277 0.000) 0.277 27.868 ( 0.000 -0.075 0.000) 0.075 29.181 ( 0.000 1.735 0.000) 1.735 29.210 ( 0.000 -1.148 0.000) 1.148 29.677 ( 0.000 3.296 0.000) 3.296 29.731 ( 0.000 2.927 0.000) 2.927 29.732 ( 0.000 -2.206 0.000) 2.206 29.780 ( 0.000 -1.938 0.000) 1.938 29.945 ( 0.000 1.503 0.000) 1.503 29.972 ( 0.000 -1.191 0.000) 1.191 30.009 ( 0.000 6.245 0.000) 6.245 30.154 ( 0.000 -8.288 0.000) 8.288 30.686 ( 0.000 3.986 0.000) 3.986 30.724 ( 0.000 1.707 0.000) 1.707 30.974 ( 0.000 0.632 0.000) 0.632 31.027 ( 0.000 -3.813 0.000) 3.813 31.127 ( 0.000 2.477 0.000) 2.477 31.215 ( 0.000 -1.939 0.000) 1.939 31.262 ( 0.000 -3.160 0.000) 3.160 31.276 ( 0.000 -0.803 0.000) 0.803 31.632 ( 0.000 8.050 0.000) 8.050 31.797 ( 0.000 -8.048 0.000) 8.048 31.930 ( 0.000 11.274 0.000) 11.274 32.145 ( 0.000 -10.259 0.000) 10.259 33.610 ( 0.000 2.019 0.000) 2.019 33.652 ( 0.000 -2.206 0.000) 2.206 ======================= Grid point 15 (10/60) ======================= q-point: ( 0.17 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.419 ( 11.202 29.400 1.759) 31.511 1.555 ( 11.768 26.272 11.315) 30.931 1.945 ( 14.160 -18.855 3.997) 23.917 1.981 ( 9.895 -5.555 7.406) 13.551 2.228 ( 12.347 6.741 5.993) 15.291 2.628 ( 9.465 -14.119 1.880) 17.102 2.938 ( -4.272 7.980 -0.088) 9.052 2.960 ( -1.894 3.770 1.575) 4.503 3.045 ( 2.304 -3.471 1.504) 4.429 3.071 ( 1.624 -3.508 -1.560) 4.168 3.424 ( 4.528 3.266 -0.646) 5.620 3.480 ( 0.753 1.056 0.807) 1.528 3.589 ( 4.169 6.068 -2.916) 7.919 3.702 ( 1.658 -1.840 -5.480) 6.014 3.794 ( 4.803 7.177 1.710) 8.804 3.883 ( -5.231 2.412 -3.306) 6.642 3.902 ( 1.243 -4.207 2.272) 4.940 3.963 ( -5.330 -4.496 -2.825) 7.523 4.173 ( -2.076 1.010 -0.550) 2.373 4.183 ( 0.959 4.882 -1.690) 5.255 4.243 ( 1.212 1.695 1.630) 2.646 4.341 ( -2.368 1.179 3.068) 4.051 4.444 ( 3.096 -2.957 1.337) 4.485 4.532 ( -1.278 3.513 -1.669) 4.094 4.557 ( -1.429 -1.742 -2.415) 3.302 4.622 ( 2.469 -10.255 -1.453) 10.647 4.796 ( 4.532 1.504 -2.487) 5.384 4.820 ( -2.203 0.868 0.055) 2.369 4.909 ( -1.324 -6.587 0.443) 6.733 4.972 ( 0.485 -6.981 -0.912) 7.057 5.159 ( 0.318 3.041 5.297) 6.116 5.208 ( 0.741 0.419 1.213) 1.482 5.228 ( -6.059 4.827 8.153) 11.246 5.384 ( -6.532 -4.041 -0.631) 7.706 5.476 ( -1.638 1.928 -2.265) 3.396 5.525 ( 0.313 -1.375 -0.707) 1.577 5.642 ( -1.656 3.666 -1.446) 4.275 5.763 ( 4.068 -7.333 -3.208) 8.978 5.911 ( -6.057 -1.675 3.132) 7.021 5.952 ( -1.798 -6.597 1.852) 7.083 6.214 ( -4.908 5.691 -5.047) 9.053 6.299 ( -1.941 -3.008 -5.438) 6.510 6.745 ( -5.981 12.782 0.607) 14.125 6.970 ( -7.169 -9.720 1.046) 12.123 7.262 ( -0.787 2.354 -1.196) 2.755 7.383 ( -1.583 -9.673 -3.396) 10.374 7.952 ( -2.543 6.720 1.564) 7.353 7.965 ( -1.429 2.414 -5.764) 6.410 8.015 ( -0.676 0.049 -3.909) 3.968 8.168 ( -1.344 -9.981 0.530) 10.085 8.644 ( -4.121 4.919 0.805) 6.468 8.686 ( -2.742 0.701 -0.325) 2.849 8.869 ( 1.944 3.285 -0.991) 3.943 8.903 ( 0.916 1.483 1.980) 2.637 8.961 ( -0.879 0.280 -0.856) 1.258 9.018 ( -7.183 -1.317 0.429) 7.315 9.044 ( -1.373 -1.340 0.316) 1.945 9.109 ( -1.880 -3.879 0.209) 4.316 9.296 ( 1.972 4.438 -0.234) 4.862 9.349 ( 1.090 -1.071 3.116) 3.470 9.480 ( -1.099 5.704 0.621) 5.842 9.605 ( -2.879 -5.307 -2.006) 6.363 10.085 ( -0.086 2.867 -0.069) 2.870 10.120 ( -6.888 -0.789 0.392) 6.944 10.203 ( 0.504 0.649 0.671) 1.061 10.298 ( 4.356 -6.537 3.470) 8.588 10.447 ( -1.795 5.310 -1.158) 5.724 10.546 ( -2.773 -3.315 3.139) 5.341 10.639 ( -3.219 0.774 4.270) 5.403 10.671 ( -1.985 -1.433 1.722) 2.993 10.774 ( 0.665 3.074 0.728) 3.229 10.880 ( -0.495 -2.544 -3.093) 4.036 10.910 ( -1.518 -3.176 -2.652) 4.407 10.968 ( -2.367 -6.926 -5.823) 9.353 11.202 ( -0.648 4.590 1.928) 5.020 11.246 ( 2.425 1.994 -2.234) 3.853 11.414 ( 0.462 6.858 8.786) 11.156 11.513 ( 2.958 4.919 0.173) 5.743 11.628 ( 2.556 -4.614 3.876) 6.546 11.699 ( -0.664 6.181 0.555) 6.241 11.735 ( -2.345 -5.102 1.577) 5.832 11.873 ( 0.357 -7.644 1.429) 7.785 12.047 ( -2.920 3.888 0.198) 4.866 12.127 ( 0.077 -3.259 -0.843) 3.367 12.362 ( -1.454 4.371 -8.578) 9.737 12.406 ( -6.263 6.613 -2.772) 9.521 12.514 ( 2.804 -6.781 -4.127) 8.419 12.594 ( -0.901 -6.462 -0.042) 6.525 12.745 ( 3.505 4.092 -0.579) 5.419 12.821 ( 0.951 -3.392 -5.049) 6.156 12.932 ( 4.849 0.741 2.025) 5.307 12.984 ( -0.741 -3.237 1.242) 3.545 13.068 ( 2.966 1.827 2.345) 4.199 13.121 ( 1.251 -2.534 2.884) 4.038 13.239 ( -2.495 -0.300 0.702) 2.609 13.251 ( -2.353 -1.145 0.033) 2.617 13.403 ( -2.119 4.442 -1.789) 5.236 13.446 ( -1.595 0.590 -3.037) 3.481 13.618 ( 4.432 -0.366 1.716) 4.767 13.636 ( 1.854 -1.344 4.173) 4.761 13.855 ( -2.384 6.001 0.644) 6.489 13.955 ( 3.307 0.268 -1.577) 3.673 13.967 ( 1.616 0.750 0.693) 1.912 13.996 ( 2.719 -4.771 1.698) 5.748 14.140 ( 2.298 5.795 3.191) 7.004 14.160 ( 3.254 2.630 4.022) 5.804 14.328 ( 0.348 -1.029 -0.038) 1.087 14.357 ( 0.527 -2.277 -1.794) 2.946 14.457 ( 3.419 -0.009 2.685) 4.347 14.482 ( 5.312 -2.485 7.073) 9.188 14.681 ( -0.662 7.278 4.367) 8.513 14.781 ( -3.822 -0.837 0.131) 3.915 14.966 ( -6.248 2.887 4.395) 8.167 15.046 ( -8.947 -4.312 4.019) 10.714 15.138 ( 5.185 4.652 3.089) 7.620 15.304 ( 5.311 -10.522 1.382) 11.867 15.521 ( -0.995 2.433 0.450) 2.666 15.558 ( -0.517 -1.000 0.434) 1.206 15.597 ( 5.960 2.082 -5.413) 8.316 15.628 ( 7.469 -1.335 -4.648) 8.898 15.766 ( 7.599 5.107 -6.990) 11.519 15.873 ( 4.934 -5.310 -4.316) 8.436 16.309 ( -2.684 6.266 -2.508) 7.264 16.415 ( -4.907 -3.240 -6.184) 8.533 16.585 ( -3.751 1.345 5.761) 7.005 16.610 ( -2.681 -1.079 2.200) 3.632 16.734 ( 4.206 0.161 0.690) 4.266 16.746 ( 3.694 -0.811 0.702) 3.846 16.972 ( 1.684 -0.321 -2.765) 3.254 16.980 ( 2.215 -1.041 -3.888) 4.593 17.075 ( -2.866 0.261 2.272) 3.667 17.085 ( -3.056 -0.655 3.419) 4.632 17.519 ( 3.338 1.425 3.538) 5.069 17.533 ( 2.283 0.639 3.957) 4.612 17.759 ( -1.234 5.431 -1.659) 5.811 17.886 ( -2.891 -6.368 0.221) 6.996 18.027 ( -1.182 3.399 -2.809) 4.565 18.106 ( -1.007 -3.994 0.222) 4.125 18.199 ( -2.157 2.158 1.739) 3.512 18.231 ( -2.707 -0.877 2.066) 3.517 18.387 ( 3.111 -0.150 -4.868) 5.779 18.409 ( 2.750 -1.625 -3.476) 4.721 18.710 ( -1.830 1.918 -0.761) 2.758 18.739 ( 0.710 -0.863 -2.665) 2.890 18.861 ( 0.253 1.976 -0.327) 2.019 18.923 ( -2.364 -1.759 -0.551) 2.998 19.047 ( -1.068 4.240 -4.246) 6.095 19.166 ( -3.674 -5.884 -4.051) 8.033 27.626 ( -0.793 0.038 0.495) 0.936 27.633 ( -0.765 -0.728 0.503) 1.170 27.724 ( 0.358 1.004 1.156) 1.572 27.739 ( 0.123 -0.493 1.047) 1.163 27.795 ( 1.839 0.517 0.156) 1.917 27.805 ( 2.017 -0.298 0.060) 2.040 27.860 ( -0.468 0.157 -0.461) 0.676 27.862 ( 0.082 -0.074 -0.429) 0.443 29.204 ( 1.067 2.717 2.115) 3.605 29.257 ( 1.785 -2.608 4.535) 5.528 29.701 ( -0.398 3.069 0.967) 3.242 29.738 ( 1.363 -0.966 1.586) 2.304 29.794 ( 3.471 0.482 0.888) 3.615 29.816 ( 6.519 -1.375 -0.087) 6.663 29.938 ( 1.751 4.213 -0.718) 4.618 30.037 ( 2.767 -5.789 0.048) 6.417 30.162 ( 11.203 4.486 0.537) 12.080 30.267 ( 11.636 -6.338 -0.808) 13.275 30.673 ( -1.212 4.303 0.299) 4.481 30.720 ( -0.602 1.056 0.610) 1.360 30.928 ( -3.393 1.882 -2.451) 4.589 30.988 ( -2.759 -2.317 -1.777) 4.018 31.143 ( 0.784 -0.938 -1.403) 1.861 31.171 ( -5.366 -0.749 -1.931) 5.752 31.282 ( 5.134 -1.102 -1.652) 5.505 31.306 ( 0.855 -3.435 2.780) 4.501 31.643 ( -0.201 7.265 3.810) 8.206 31.786 ( -0.055 -5.259 -2.743) 5.932 31.970 ( 2.315 8.703 6.365) 11.028 32.179 ( 3.143 -10.638 1.530) 11.198 33.362 ( -20.165 6.770 -6.124) 22.136 33.455 ( -15.590 -3.361 -3.364) 16.299 ======================= Grid point 16 (11/60) ======================= q-point: ( 0.33 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.702 ( 15.345 27.233 3.343) 31.437 1.803 ( 6.646 29.252 7.738) 30.980 2.183 ( 9.588 -19.344 3.965) 21.951 2.252 ( 7.817 -17.644 7.040) 20.542 2.674 ( 4.357 10.393 -1.075) 11.321 2.829 ( -0.600 -1.824 -2.663) 3.283 2.893 ( 14.195 4.503 6.870) 16.401 2.961 ( 8.925 -0.763 9.336) 12.938 3.020 ( -2.363 -1.065 -5.010) 5.641 3.091 ( -0.712 -7.924 2.906) 8.470 3.523 ( 3.159 4.753 1.697) 5.954 3.548 ( 5.610 4.162 3.153) 7.664 3.651 ( 2.894 4.923 -5.581) 7.985 3.689 ( -5.215 4.395 -5.362) 8.675 3.747 ( 1.902 -5.077 -9.565) 10.995 3.849 ( -0.849 -10.957 -0.726) 11.014 3.972 ( 6.046 0.125 5.729) 8.330 3.976 ( 1.461 -0.954 3.818) 4.198 4.134 ( -0.088 4.826 0.194) 4.831 4.193 ( 0.869 6.839 1.477) 7.050 4.300 ( 3.717 -5.714 2.220) 7.169 4.343 ( 0.901 -1.492 1.399) 2.235 4.513 ( 2.023 1.162 -3.558) 4.255 4.528 ( 1.748 -0.073 -5.784) 6.043 4.599 ( 5.557 3.094 2.512) 6.839 4.630 ( -2.414 1.077 -5.154) 5.792 4.706 ( -4.960 -5.468 1.637) 7.562 4.770 ( -6.174 -4.778 -3.388) 8.510 4.864 ( -3.279 1.406 -0.716) 3.639 4.967 ( -0.182 -5.201 1.563) 5.434 5.107 ( -5.842 4.638 1.455) 7.600 5.158 ( -5.705 -0.905 1.948) 6.096 5.198 ( -0.528 1.972 7.074) 7.363 5.311 ( -2.122 -6.252 3.083) 7.287 5.435 ( -1.784 4.160 -2.923) 5.389 5.497 ( -2.491 -1.337 -1.353) 3.134 5.638 ( 2.333 5.718 -2.256) 6.575 5.736 ( -7.438 1.278 3.979) 8.532 5.840 ( 0.046 -1.508 -0.304) 1.539 5.930 ( 0.294 -9.170 -0.747) 9.205 6.093 ( -2.587 4.127 -3.148) 5.799 6.210 ( -2.775 -6.651 -6.566) 9.749 6.604 ( -6.517 9.420 -0.101) 11.455 6.798 ( -8.994 -9.697 0.108) 13.227 7.242 ( -0.421 -0.042 -0.510) 0.663 7.308 ( -3.180 -6.667 -2.519) 7.804 7.899 ( -3.014 8.676 2.945) 9.645 7.903 ( -0.789 3.915 -6.472) 7.605 8.012 ( 2.920 -1.913 -6.494) 7.372 8.144 ( -0.862 -10.468 1.092) 10.561 8.493 ( -10.565 4.204 0.838) 11.402 8.573 ( -7.442 -3.926 -0.694) 8.443 8.825 ( -3.911 6.490 0.117) 7.578 8.902 ( 1.605 1.118 -4.704) 5.094 8.932 ( -0.455 1.973 2.262) 3.036 8.977 ( 1.446 -2.033 0.223) 2.505 9.029 ( -1.332 -2.655 1.086) 3.162 9.074 ( -1.990 -4.076 0.300) 4.546 9.348 ( 2.748 8.266 -1.949) 8.926 9.395 ( 1.147 2.199 2.389) 3.444 9.453 ( -1.733 1.496 0.986) 2.493 9.566 ( 0.022 -6.878 0.139) 6.880 9.988 ( -4.985 3.841 3.123) 7.026 10.095 ( 0.082 -6.052 2.077) 6.399 10.253 ( 2.533 4.866 3.131) 6.317 10.369 ( -2.655 -0.839 1.523) 3.173 10.431 ( 0.952 -0.497 0.467) 1.171 10.443 ( -1.897 -3.796 -1.293) 4.436 10.637 ( -0.716 -0.205 4.268) 4.333 10.655 ( 0.669 -2.166 -2.675) 3.507 10.802 ( -0.690 1.785 0.014) 1.914 10.851 ( 1.867 3.230 -2.596) 4.546 10.893 ( 0.305 -7.070 -0.089) 7.077 10.951 ( 1.369 -6.265 -0.683) 6.449 11.181 ( -1.855 4.386 1.080) 4.883 11.250 ( -0.689 -1.840 -1.805) 2.669 11.416 ( -3.300 13.488 5.798) 15.047 11.536 ( -1.027 5.342 0.762) 5.493 11.633 ( -2.154 -1.266 1.464) 2.896 11.665 ( -5.218 -4.662 0.060) 6.998 11.766 ( 4.377 -2.321 3.651) 6.155 11.864 ( 2.191 -7.911 -4.308) 9.271 12.050 ( 2.320 6.365 0.942) 6.840 12.157 ( 1.463 -0.254 1.169) 1.890 12.259 ( -5.260 6.718 -3.905) 9.384 12.302 ( -2.679 0.149 -2.259) 3.508 12.542 ( 2.061 -4.537 -4.596) 6.780 12.625 ( 4.141 -7.882 -2.278) 9.191 12.778 ( -0.090 3.559 -0.785) 3.646 12.819 ( 2.032 1.070 -1.823) 2.932 12.941 ( -2.800 -0.875 2.760) 4.028 13.001 ( 1.606 -4.979 0.156) 5.234 13.084 ( -3.407 1.244 0.069) 3.628 13.102 ( -2.205 -0.778 1.587) 2.826 13.229 ( -0.798 1.229 1.409) 2.033 13.236 ( -1.616 0.002 -1.615) 2.285 13.398 ( 2.195 2.916 -0.014) 3.650 13.414 ( 1.467 1.664 -0.685) 2.322 13.698 ( 1.741 1.284 2.636) 3.410 13.712 ( 3.044 -1.807 1.323) 3.779 13.817 ( -1.384 5.219 3.038) 6.196 13.942 ( -1.490 -4.752 -0.448) 5.000 14.018 ( 2.362 1.445 0.042) 2.770 14.051 ( 1.950 -2.626 0.092) 3.272 14.219 ( 1.608 6.560 4.845) 8.312 14.260 ( 3.634 3.482 0.643) 5.073 14.330 ( 0.030 1.690 -0.371) 1.731 14.375 ( 1.842 -5.188 -1.886) 5.819 14.462 ( -3.649 -0.434 1.419) 3.939 14.525 ( -4.014 -3.819 -0.448) 5.559 14.720 ( 2.481 4.597 4.145) 6.668 14.790 ( 0.428 -2.029 3.800) 4.329 14.890 ( 1.968 3.829 3.943) 5.838 14.972 ( 0.977 -4.184 1.484) 4.546 15.349 ( 7.699 6.709 5.702) 11.697 15.454 ( 4.497 -2.658 0.011) 5.224 15.513 ( 0.821 0.130 3.657) 3.750 15.549 ( -0.041 -2.145 -0.469) 2.196 15.742 ( 8.900 2.858 -3.482) 9.975 15.776 ( 5.217 0.938 1.266) 5.449 15.782 ( -0.327 1.249 -8.369) 8.468 15.871 ( 2.715 -3.480 -5.207) 6.826 16.224 ( -5.099 1.642 -5.206) 7.469 16.274 ( -5.850 -2.730 -5.693) 8.608 16.557 ( -1.200 2.124 2.617) 3.577 16.579 ( -1.024 -0.077 2.754) 2.939 16.842 ( 5.176 0.930 1.484) 5.464 16.851 ( 4.806 0.170 2.197) 5.287 16.983 ( -0.529 0.469 -0.686) 0.985 16.987 ( 0.768 -0.432 -4.287) 4.376 17.024 ( -2.221 -0.888 1.261) 2.704 17.047 ( -1.891 -2.529 1.761) 3.616 17.597 ( 1.895 2.388 3.618) 4.731 17.605 ( 2.128 1.023 3.896) 4.556 17.725 ( -1.008 2.330 -0.593) 2.607 17.815 ( -3.333 -5.621 -0.172) 6.537 17.990 ( -0.670 3.971 -2.940) 4.986 18.057 ( -2.900 -2.019 -1.872) 3.999 18.167 ( -1.237 2.168 2.147) 3.292 18.202 ( -1.019 -1.536 -0.857) 2.033 18.411 ( 1.403 0.228 -2.152) 2.579 18.443 ( 1.365 -2.441 -1.730) 3.289 18.648 ( -3.248 3.888 -0.675) 5.111 18.734 ( 0.255 -3.678 -2.681) 4.558 18.871 ( 0.639 -0.604 -0.622) 1.077 18.884 ( -0.398 1.178 -1.555) 1.991 19.020 ( -0.207 -0.240 -1.421) 1.456 19.078 ( -2.307 -4.156 -2.826) 5.530 27.622 ( 0.007 -0.242 0.708) 0.748 27.626 ( -0.174 -0.734 0.507) 0.909 27.732 ( -0.102 0.713 0.891) 1.146 27.741 ( -0.321 -0.231 0.641) 0.753 27.821 ( 0.429 0.731 -0.137) 0.858 27.831 ( -0.033 -0.200 -0.427) 0.472 27.865 ( 1.489 0.693 0.162) 1.650 27.877 ( 1.255 -0.519 0.035) 1.358 29.229 ( 0.384 3.726 1.449) 4.016 29.302 ( 0.675 -3.435 2.694) 4.417 29.710 ( 0.296 2.832 2.669) 3.902 29.747 ( -0.573 -0.806 2.051) 2.277 29.878 ( 3.034 2.906 -1.796) 4.568 29.954 ( 5.250 -3.867 -2.041) 6.833 30.034 ( 6.450 2.076 1.192) 6.880 30.087 ( 3.796 -3.678 -0.091) 5.287 30.401 ( 10.377 5.542 0.429) 11.772 30.512 ( 9.558 -5.339 0.412) 10.956 30.642 ( -2.174 5.362 0.775) 5.838 30.708 ( -0.834 0.195 0.585) 1.037 30.834 ( -3.547 2.598 -2.199) 4.916 30.903 ( -3.759 -2.650 -3.488) 5.772 31.045 ( -5.456 3.039 1.675) 6.466 31.115 ( -2.738 -4.894 -1.989) 5.950 31.344 ( 1.865 -0.877 0.271) 2.079 31.376 ( 3.695 -3.734 -1.516) 5.468 31.658 ( -0.409 5.953 3.683) 7.012 31.776 ( 0.044 -4.661 -0.723) 4.717 32.113 ( 8.695 8.006 6.584) 13.529 32.311 ( 8.886 -10.631 3.035) 14.184 32.869 ( -22.033 10.589 -6.446) 25.282 33.045 ( -20.049 -7.602 -5.274) 22.081 ======================= Grid point 17 (12/60) ======================= q-point: (-0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.900 ( 0.000 31.223 -0.000) 31.223 1.955 ( -0.000 25.076 0.000) 25.076 2.281 ( 0.000 -0.706 -0.000) 0.706 2.376 ( 0.000 -15.845 0.000) 15.845 2.579 ( 0.000 -0.720 0.000) 0.720 2.721 ( 0.000 -18.464 0.000) 18.464 2.981 ( 0.000 0.133 -0.000) 0.133 2.990 ( -0.000 -0.622 0.000) 0.622 3.228 ( -0.000 3.150 0.000) 3.150 3.303 ( 0.000 -2.782 0.000) 2.782 3.523 ( 0.000 4.051 0.000) 4.051 3.547 ( -0.000 5.818 -0.000) 5.818 3.682 ( 0.000 -1.735 0.000) 1.735 3.686 ( -0.000 -2.443 -0.000) 2.443 3.741 ( -0.000 3.885 -0.000) 3.885 3.812 ( 0.000 -3.283 0.000) 3.283 4.006 ( -0.000 -3.361 -0.000) 3.361 4.025 ( 0.000 -6.269 -0.000) 6.269 4.144 ( 0.000 7.349 -0.000) 7.349 4.236 ( 0.000 -1.896 0.000) 1.896 4.378 ( -0.000 -0.072 0.000) 0.072 4.426 ( 0.000 -5.169 -0.000) 5.169 4.492 ( 0.000 1.540 0.000) 1.540 4.521 ( 0.000 2.344 0.000) 2.344 4.561 ( 0.000 -0.122 0.000) 0.122 4.564 ( -0.000 -3.664 -0.000) 3.664 4.661 ( 0.000 2.384 -0.000) 2.384 4.698 ( -0.000 -1.524 -0.000) 1.524 4.922 ( 0.000 6.049 -0.000) 6.049 4.929 ( -0.000 2.625 0.000) 2.625 5.014 ( -0.000 2.391 -0.000) 2.391 5.106 ( 0.000 -3.257 0.000) 3.257 5.241 ( 0.000 -1.391 0.000) 1.391 5.246 ( -0.000 -2.686 -0.000) 2.686 5.385 ( 0.000 3.064 -0.000) 3.064 5.448 ( 0.000 0.036 0.000) 0.036 5.679 ( -0.000 4.589 0.000) 4.589 5.686 ( 0.000 3.664 -0.000) 3.664 5.823 ( 0.000 1.742 -0.000) 1.742 5.935 ( 0.000 -7.645 -0.000) 7.645 6.076 ( 0.000 -2.205 0.000) 2.205 6.157 ( 0.000 -9.087 0.000) 9.087 6.532 ( 0.000 5.431 -0.000) 5.431 6.675 ( 0.000 -8.103 -0.000) 8.103 7.249 ( 0.000 -2.619 0.000) 2.619 7.253 ( -0.000 -3.280 -0.000) 3.280 7.873 ( -0.000 4.006 0.000) 4.006 7.875 ( 0.000 6.435 -0.000) 6.435 8.043 ( 0.000 -0.392 -0.000) 0.392 8.149 ( 0.000 -8.237 0.000) 8.237 8.338 ( 0.000 5.079 0.000) 5.079 8.474 ( 0.000 -8.619 0.000) 8.619 8.794 ( 0.000 7.165 0.000) 7.165 8.906 ( 0.000 -2.970 -0.000) 2.970 8.944 ( 0.000 4.149 0.000) 4.149 9.003 ( 0.000 0.858 0.000) 0.858 9.005 ( -0.000 -3.382 -0.000) 3.382 9.049 ( 0.000 -3.251 0.000) 3.251 9.364 ( 0.000 12.158 0.000) 12.158 9.402 ( 0.000 2.895 -0.000) 2.895 9.452 ( 0.000 -1.402 0.000) 1.402 9.574 ( 0.000 -8.549 0.000) 8.549 9.951 ( 0.000 5.899 0.000) 5.899 10.104 ( -0.000 -8.941 0.000) 8.941 10.295 ( 0.000 2.786 -0.000) 2.786 10.333 ( 0.000 0.596 0.000) 0.596 10.377 ( 0.000 4.288 -0.000) 4.288 10.497 ( 0.000 -7.708 0.000) 7.708 10.644 ( -0.000 -2.465 0.000) 2.465 10.651 ( 0.000 -1.288 -0.000) 1.288 10.779 ( 0.000 2.891 0.000) 2.891 10.889 ( 0.000 3.882 -0.000) 3.882 10.897 ( 0.000 -8.248 -0.000) 8.248 10.972 ( 0.000 -3.972 -0.000) 3.972 11.160 ( 0.000 3.254 0.000) 3.254 11.228 ( 0.000 -3.622 0.000) 3.622 11.385 ( 0.000 14.785 0.000) 14.785 11.528 ( 0.000 6.417 0.000) 6.417 11.581 ( 0.000 -1.655 -0.000) 1.655 11.620 ( 0.000 -4.824 0.000) 4.824 11.830 ( 0.000 -2.983 -0.000) 2.983 11.888 ( 0.000 -8.073 0.000) 8.073 12.128 ( -0.000 5.163 -0.000) 5.163 12.138 ( 0.000 5.036 0.000) 5.036 12.184 ( -0.000 8.611 0.000) 8.611 12.258 ( 0.000 -5.209 -0.000) 5.209 12.552 ( 0.000 -3.034 -0.000) 3.034 12.676 ( 0.000 -9.658 0.000) 9.658 12.771 ( 0.000 4.152 0.000) 4.152 12.844 ( 0.000 0.399 0.000) 0.399 12.909 ( -0.000 1.571 0.000) 1.571 13.036 ( 0.000 -4.439 0.000) 4.439 13.049 ( 0.000 0.717 -0.000) 0.717 13.054 ( -0.000 -1.731 0.000) 1.731 13.196 ( 0.000 1.894 -0.000) 1.894 13.215 ( 0.000 1.158 0.000) 1.158 13.430 ( 0.000 2.447 -0.000) 2.447 13.443 ( 0.000 1.808 0.000) 1.808 13.726 ( 0.000 2.973 -0.000) 2.973 13.744 ( 0.000 -1.640 0.000) 1.640 13.819 ( 0.000 1.892 0.000) 1.892 13.922 ( 0.000 -5.316 0.000) 5.316 14.047 ( 0.000 0.991 -0.000) 0.991 14.072 ( 0.000 -1.587 0.000) 1.587 14.253 ( 0.000 6.110 0.000) 6.110 14.289 ( 0.000 7.370 -0.000) 7.370 14.343 ( 0.000 1.788 -0.000) 1.788 14.386 ( 0.000 -3.716 -0.000) 3.716 14.418 ( -0.000 -6.029 0.000) 6.029 14.459 ( 0.000 -5.180 0.000) 5.180 14.760 ( 0.000 2.273 -0.000) 2.273 14.779 ( -0.000 0.725 0.000) 0.725 14.978 ( 0.000 2.011 0.000) 2.011 15.011 ( 0.000 -1.571 -0.000) 1.571 15.418 ( 0.000 6.854 0.000) 6.854 15.513 ( 0.000 -0.177 -0.000) 0.177 15.552 ( 0.000 -0.534 -0.000) 0.534 15.566 ( 0.000 0.238 0.000) 0.238 15.704 ( 0.000 2.056 0.000) 2.056 15.715 ( 0.000 0.146 0.000) 0.146 16.010 ( 0.000 -1.195 0.000) 1.195 16.021 ( 0.000 -0.417 0.000) 0.417 16.041 ( -0.000 0.398 -0.000) 0.398 16.119 ( -0.000 -4.433 -0.000) 4.433 16.552 ( 0.000 2.816 0.000) 2.816 16.582 ( 0.000 0.057 0.000) 0.057 16.917 ( 0.000 1.153 0.000) 1.153 16.932 ( 0.000 0.816 -0.000) 0.816 16.960 ( -0.000 2.595 -0.000) 2.595 16.965 ( 0.000 -0.094 0.000) 0.094 17.015 ( 0.000 -2.689 0.000) 2.689 17.024 ( -0.000 -4.351 -0.000) 4.351 17.632 ( 0.000 3.314 0.000) 3.314 17.637 ( 0.000 1.944 0.000) 1.944 17.720 ( 0.000 -0.400 -0.000) 0.400 17.771 ( 0.000 -4.229 0.000) 4.229 17.984 ( 0.000 1.393 0.000) 1.393 18.001 ( 0.000 -0.192 -0.000) 0.192 18.168 ( 0.000 1.090 -0.000) 1.090 18.182 ( 0.000 -0.681 0.000) 0.681 18.423 ( 0.000 0.651 -0.000) 0.651 18.448 ( 0.000 -1.569 -0.000) 1.569 18.605 ( 0.000 4.882 0.000) 4.882 18.728 ( 0.000 -5.635 -0.000) 5.635 18.876 ( 0.000 -1.657 0.000) 1.657 18.879 ( 0.000 1.133 -0.000) 1.133 19.015 ( 0.000 -0.934 0.000) 0.934 19.048 ( 0.000 -3.011 0.000) 3.011 27.626 ( 0.000 -0.560 -0.000) 0.560 27.626 ( 0.000 -0.539 0.000) 0.539 27.732 ( -0.000 0.476 -0.000) 0.476 27.738 ( 0.000 -0.056 0.000) 0.056 27.823 ( 0.000 0.504 0.000) 0.504 27.827 ( 0.000 0.282 -0.000) 0.282 27.885 ( 0.000 0.499 0.000) 0.499 27.892 ( 0.000 -0.304 -0.000) 0.304 29.237 ( 0.000 4.026 0.000) 4.026 29.316 ( 0.000 -3.769 0.000) 3.769 29.728 ( 0.000 2.233 0.000) 2.233 29.743 ( 0.000 0.816 0.000) 0.816 29.904 ( 0.000 2.098 0.000) 2.098 29.989 ( 0.000 -6.241 -0.000) 6.241 30.120 ( 0.000 2.595 0.000) 2.595 30.161 ( 0.000 -1.752 0.000) 1.752 30.530 ( 0.000 4.482 0.000) 4.482 30.604 ( 0.000 6.604 -0.000) 6.604 30.616 ( 0.000 -2.844 0.000) 2.844 30.691 ( 0.000 1.511 -0.000) 1.511 30.794 ( 0.000 2.280 -0.000) 2.280 30.842 ( -0.000 -3.029 -0.000) 3.029 31.003 ( 0.000 1.581 -0.000) 1.581 31.053 ( 0.000 -4.512 0.000) 4.512 31.366 ( 0.000 -0.110 -0.000) 0.110 31.409 ( 0.000 -4.007 -0.000) 4.007 31.664 ( 0.000 5.238 0.000) 5.238 31.775 ( 0.000 -5.520 0.000) 5.520 32.372 ( 0.000 7.458 -0.000) 7.458 32.447 ( 0.000 7.884 0.000) 7.884 32.554 ( -0.000 -5.215 -0.000) 5.215 32.692 ( 0.000 -10.727 0.000) 10.727 ======================= Grid point 35 (13/60) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.714 ( 8.787 0.000 33.291) 34.431 0.732 ( -0.576 0.000 33.909) 33.914 1.328 ( -0.085 0.000 58.997) 58.997 2.583 ( -1.276 0.000 6.911) 7.028 2.624 ( 1.874 0.000 -1.540) 2.425 2.631 ( 5.044 0.000 -3.391) 6.078 2.892 ( 3.627 0.000 3.738) 5.209 2.912 ( -5.049 0.000 -1.397) 5.238 3.014 ( 3.256 0.000 2.040) 3.842 3.123 ( 0.301 0.000 5.096) 5.105 3.180 ( -3.047 0.000 10.438) 10.874 3.287 ( 0.618 0.000 -5.856) 5.888 3.366 ( -5.172 0.000 -2.034) 5.557 3.557 ( -1.159 0.000 4.654) 4.796 3.759 ( -1.569 0.000 4.153) 4.439 3.768 ( 1.666 0.000 -2.331) 2.865 3.912 ( 0.328 0.000 -1.310) 1.351 3.940 ( 2.939 0.000 -2.843) 4.089 4.136 ( 2.515 0.000 -5.080) 5.669 4.140 ( 0.495 0.000 -5.111) 5.135 4.409 ( -0.741 0.000 -1.968) 2.102 4.429 ( 0.421 0.000 -0.856) 0.954 4.469 ( -1.960 0.000 -6.510) 6.798 4.585 ( 7.181 0.000 -0.463) 7.196 4.650 ( -3.128 0.000 2.158) 3.800 4.720 ( -5.714 0.000 8.669) 10.383 4.791 ( -3.474 0.000 5.059) 6.136 4.853 ( 1.853 0.000 -11.194) 11.347 4.925 ( 5.956 0.000 -8.234) 10.162 5.025 ( 9.551 0.000 -5.547) 11.045 5.081 ( 5.310 0.000 5.558) 7.687 5.162 ( -2.630 0.000 -0.040) 2.630 5.384 ( -0.417 0.000 2.034) 2.077 5.420 ( 1.118 0.000 3.955) 4.110 5.464 ( 2.387 0.000 1.005) 2.590 5.605 ( -3.747 0.000 6.293) 7.324 5.843 ( 5.287 0.000 -0.121) 5.288 5.897 ( -5.282 0.000 -1.016) 5.379 5.962 ( -1.061 0.000 -4.274) 4.404 6.207 ( 2.987 0.000 -2.643) 3.988 6.208 ( -2.203 0.000 -1.676) 2.768 6.299 ( -7.442 0.000 -0.361) 7.451 6.586 ( -3.672 0.000 9.501) 10.186 7.126 ( 0.706 0.000 -4.301) 4.358 7.343 ( 1.034 0.000 1.647) 1.944 7.667 ( 3.093 0.000 -5.194) 6.045 7.721 ( -0.197 0.000 -0.655) 0.684 7.883 ( -4.761 0.000 -11.230) 12.197 8.107 ( -1.959 0.000 0.476) 2.016 8.325 ( -2.463 0.000 -5.180) 5.735 8.480 ( 2.543 0.000 -2.557) 3.607 8.581 ( 2.574 0.000 -5.451) 6.028 8.700 ( 0.470 0.000 2.248) 2.296 8.815 ( -2.814 0.000 -4.118) 4.987 8.950 ( -2.426 0.000 -4.538) 5.146 9.099 ( 2.590 0.000 -1.206) 2.857 9.163 ( -0.779 0.000 -2.470) 2.590 9.189 ( 8.481 0.000 5.144) 9.919 9.280 ( 2.317 0.000 5.221) 5.712 9.325 ( -1.643 0.000 2.759) 3.211 9.448 ( 0.518 0.000 2.201) 2.261 9.783 ( -0.575 0.000 0.803) 0.988 10.037 ( 2.680 0.000 3.038) 4.052 10.159 ( 1.696 0.000 -4.016) 4.359 10.258 ( -2.657 0.000 -1.709) 3.159 10.408 ( 0.320 0.000 4.708) 4.719 10.414 ( -0.965 0.000 1.851) 2.087 10.586 ( -2.758 0.000 -3.332) 4.325 10.663 ( 4.182 0.000 6.356) 7.609 10.699 ( 7.121 0.000 -2.648) 7.597 10.854 ( -1.511 0.000 3.730) 4.024 10.884 ( -0.816 0.000 -0.644) 1.040 10.925 ( 2.032 0.000 -0.250) 2.047 10.954 ( -0.716 0.000 -4.888) 4.940 11.102 ( 5.953 0.000 -0.051) 5.953 11.218 ( 2.570 0.000 -7.959) 8.363 11.377 ( -10.735 0.000 -1.491) 10.838 11.495 ( 7.809 0.000 3.320) 8.486 11.607 ( -0.133 0.000 8.168) 8.169 11.643 ( 8.078 0.000 2.139) 8.356 11.809 ( 5.709 0.000 -4.606) 7.336 11.904 ( -2.827 0.000 1.363) 3.139 12.315 ( -13.673 0.000 -2.327) 13.869 12.331 ( 1.683 0.000 -0.052) 1.683 12.384 ( 3.382 0.000 0.850) 3.487 12.442 ( 1.514 0.000 1.199) 1.931 12.553 ( 3.649 0.000 2.134) 4.227 12.579 ( 4.398 0.000 -0.571) 4.435 12.677 ( 6.719 0.000 -3.468) 7.561 12.825 ( -2.074 0.000 -4.907) 5.328 12.979 ( -3.501 0.000 -3.749) 5.129 13.053 ( 1.574 0.000 3.011) 3.398 13.133 ( 4.032 0.000 -5.625) 6.921 13.206 ( 0.010 0.000 5.395) 5.395 13.216 ( 5.486 0.000 1.029) 5.582 13.244 ( 1.151 0.000 -2.971) 3.186 13.330 ( 1.672 0.000 -2.257) 2.809 13.447 ( -3.585 0.000 3.530) 5.031 13.544 ( -4.251 0.000 -0.416) 4.271 13.603 ( -1.293 0.000 6.156) 6.291 13.718 ( 2.309 0.000 4.751) 5.282 13.726 ( 5.439 0.000 -1.196) 5.569 13.847 ( -7.055 0.000 1.493) 7.211 13.915 ( 0.745 0.000 -7.330) 7.367 14.116 ( 12.718 0.000 -3.659) 13.234 14.220 ( -5.361 0.000 -1.977) 5.714 14.275 ( -0.433 0.000 5.516) 5.533 14.362 ( 0.197 0.000 1.032) 1.050 14.462 ( 0.589 0.000 2.776) 2.838 14.521 ( -1.186 0.000 0.936) 1.511 14.717 ( 6.344 0.000 3.325) 7.163 14.730 ( -0.393 0.000 0.181) 0.433 14.913 ( 10.628 0.000 -3.862) 11.308 15.007 ( 7.990 0.000 -14.673) 16.707 15.219 ( -3.632 0.000 3.111) 4.782 15.244 ( 3.597 0.000 -5.691) 6.732 15.426 ( -5.466 0.000 -1.020) 5.560 15.449 ( 0.378 0.000 0.618) 0.724 15.574 ( -1.943 0.000 6.313) 6.605 15.621 ( 2.191 0.000 4.194) 4.732 15.750 ( -9.423 0.000 8.905) 12.965 15.854 ( 0.437 0.000 -7.171) 7.184 16.151 ( 1.790 0.000 3.554) 3.980 16.407 ( -4.985 0.000 1.825) 5.309 16.546 ( 3.738 0.000 5.679) 6.799 16.649 ( -1.923 0.000 2.691) 3.308 16.738 ( -0.670 0.000 3.886) 3.943 16.851 ( -4.780 0.000 -2.248) 5.282 16.902 ( -4.012 0.000 -2.685) 4.828 16.959 ( 5.941 0.000 -0.833) 5.999 17.080 ( 3.831 0.000 -0.410) 3.853 17.110 ( -0.439 0.000 -0.909) 1.009 17.451 ( -4.878 0.000 0.912) 4.963 17.493 ( -2.792 0.000 5.150) 5.858 17.505 ( 3.066 0.000 0.742) 3.154 17.958 ( -2.263 0.000 3.050) 3.798 18.095 ( 4.087 0.000 -6.308) 7.517 18.163 ( -3.505 0.000 -0.643) 3.563 18.197 ( 6.614 0.000 -1.089) 6.703 18.301 ( -1.503 0.000 -0.734) 1.672 18.408 ( -2.858 0.000 1.711) 3.331 18.638 ( -1.498 0.000 -1.112) 1.866 18.654 ( 1.403 0.000 0.712) 1.574 18.785 ( -3.399 0.000 2.467) 4.200 18.786 ( -15.160 0.000 -1.927) 15.282 18.939 ( -12.708 0.000 2.899) 13.034 19.084 ( 2.997 0.000 -3.278) 4.442 19.299 ( -2.255 0.000 -3.940) 4.539 27.659 ( -0.895 0.000 0.581) 1.067 27.673 ( 1.818 0.000 1.161) 2.157 27.685 ( 0.330 0.000 0.875) 0.935 27.745 ( 0.644 0.000 0.364) 0.740 27.775 ( 0.721 0.000 -0.507) 0.882 27.780 ( 0.130 0.000 -0.765) 0.776 27.847 ( 0.188 0.000 -0.608) 0.637 27.866 ( -0.894 0.000 -0.113) 0.901 29.171 ( -0.006 0.000 3.239) 3.239 29.566 ( -0.480 0.000 -1.747) 1.811 29.634 ( 19.412 0.000 0.920) 19.434 29.732 ( -0.705 0.000 -2.398) 2.499 29.751 ( 2.983 0.000 -2.643) 3.986 29.853 ( -6.419 0.000 2.988) 7.081 29.860 ( -5.359 0.000 -1.690) 5.619 29.919 ( 5.612 0.000 1.143) 5.727 29.988 ( 2.005 0.000 5.266) 5.634 30.478 ( 1.135 0.000 1.440) 1.834 30.489 ( 0.982 0.000 -2.960) 3.118 30.606 ( -2.367 0.000 1.270) 2.686 30.787 ( -8.562 0.000 -1.332) 8.665 30.986 ( 5.437 0.000 -9.266) 10.743 31.051 ( -7.221 0.000 -6.992) 10.052 31.194 ( -0.049 0.000 -7.121) 7.121 31.305 ( 5.687 0.000 4.255) 7.103 31.473 ( -4.619 0.000 6.208) 7.737 31.607 ( -5.916 0.000 -1.833) 6.194 31.845 ( 0.368 0.000 19.220) 19.223 32.307 ( 2.913 0.000 -5.837) 6.523 32.527 ( -0.200 0.000 8.398) 8.401 32.866 ( -5.315 0.000 -0.923) 5.394 33.528 ( 4.144 0.000 -8.238) 9.221 ======================= Grid point 36 (14/60) ======================= q-point: ( 0.17 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.909 ( -1.855 0.000 33.410) 33.461 1.137 ( 7.936 0.000 36.050) 36.913 2.043 ( 37.493 0.000 38.181) 53.512 2.582 ( -4.301 0.000 6.092) 7.457 2.668 ( 4.212 0.000 -2.787) 5.050 2.684 ( 1.657 0.000 -2.480) 2.982 2.794 ( -2.412 0.000 -5.176) 5.710 3.017 ( -8.154 0.000 2.608) 8.561 3.071 ( 8.273 0.000 4.491) 9.413 3.224 ( 1.711 0.000 4.117) 4.459 3.234 ( 8.333 0.000 6.704) 10.695 3.296 ( 2.240 0.000 -0.645) 2.331 3.326 ( 6.122 0.000 3.909) 7.263 3.551 ( -1.792 0.000 -4.020) 4.402 3.737 ( -0.864 0.000 -0.858) 1.218 3.833 ( 5.675 0.000 -1.258) 5.812 3.968 ( 6.699 0.000 -5.241) 8.506 4.009 ( 2.019 0.000 -4.866) 5.268 4.085 ( -1.305 0.000 -5.044) 5.210 4.113 ( -0.103 0.000 -3.378) 3.379 4.346 ( -2.627 0.000 -2.211) 3.434 4.368 ( -0.974 0.000 1.174) 1.525 4.460 ( -3.731 0.000 3.128) 4.868 4.538 ( -1.668 0.000 2.761) 3.226 4.540 ( -5.995 0.000 -6.691) 8.984 4.680 ( 0.140 0.000 -0.267) 0.301 4.816 ( -0.931 0.000 9.116) 9.163 4.864 ( 3.430 0.000 -11.213) 11.726 5.031 ( -2.254 0.000 -2.574) 3.422 5.070 ( 2.024 0.000 -5.403) 5.770 5.171 ( 1.896 0.000 -2.406) 3.063 5.222 ( 3.202 0.000 2.695) 4.186 5.403 ( 2.101 0.000 -0.912) 2.290 5.411 ( -4.173 0.000 8.022) 9.042 5.501 ( -2.216 0.000 -0.096) 2.218 5.621 ( -15.835 0.000 -0.656) 15.849 5.622 ( 1.436 0.000 11.128) 11.221 5.844 ( -6.059 0.000 -5.348) 8.082 5.914 ( -0.079 0.000 -6.977) 6.977 6.051 ( -15.357 0.000 -1.335) 15.414 6.224 ( 2.071 0.000 2.200) 3.022 6.225 ( 4.405 0.000 -1.359) 4.610 6.572 ( -3.042 0.000 9.491) 9.966 7.068 ( -4.352 0.000 -5.957) 7.377 7.357 ( -0.189 0.000 2.259) 2.267 7.655 ( -1.117 0.000 -2.426) 2.671 7.684 ( -7.845 0.000 -8.524) 11.585 7.705 ( -0.186 0.000 -3.746) 3.751 8.053 ( -2.723 0.000 -2.060) 3.415 8.298 ( 0.648 0.000 -3.553) 3.612 8.536 ( 4.652 0.000 -3.451) 5.793 8.600 ( 2.023 0.000 -4.458) 4.896 8.664 ( -3.030 0.000 1.944) 3.600 8.794 ( 1.430 0.000 -3.882) 4.137 8.832 ( -5.974 0.000 -3.701) 7.028 9.047 ( -3.481 0.000 -4.027) 5.323 9.123 ( -2.029 0.000 0.473) 2.083 9.226 ( -2.459 0.000 -0.480) 2.505 9.273 ( -4.133 0.000 1.850) 4.528 9.431 ( -0.956 0.000 7.932) 7.989 9.491 ( 4.928 0.000 5.576) 7.442 9.718 ( -3.804 0.000 -2.440) 4.519 10.111 ( 2.346 0.000 2.563) 3.474 10.131 ( -3.002 0.000 -0.804) 3.108 10.216 ( 0.499 0.000 2.029) 2.089 10.409 ( -0.850 0.000 0.519) 0.996 10.432 ( -1.421 0.000 5.697) 5.872 10.546 ( 1.552 0.000 -3.167) 3.527 10.735 ( 0.421 0.000 -0.920) 1.012 10.813 ( -6.815 0.000 -0.428) 6.829 10.837 ( -2.877 0.000 7.528) 8.059 10.869 ( 5.910 0.000 -0.289) 5.917 10.896 ( -1.543 0.000 -2.475) 2.917 10.923 ( 5.048 0.000 -6.699) 8.388 11.154 ( -1.199 0.000 -8.867) 8.948 11.172 ( -7.823 0.000 3.925) 8.753 11.195 ( 1.999 0.000 2.339) 3.077 11.601 ( -4.468 0.000 -0.345) 4.482 11.654 ( -1.778 0.000 3.087) 3.563 11.697 ( 8.409 0.000 -7.376) 11.186 11.880 ( 0.355 0.000 -0.429) 0.557 11.911 ( 5.187 0.000 -1.914) 5.529 12.011 ( -10.386 0.000 -0.408) 10.394 12.163 ( -16.554 0.000 10.560) 19.636 12.447 ( -1.463 0.000 -2.358) 2.775 12.449 ( 3.102 0.000 0.071) 3.103 12.567 ( -0.225 0.000 1.278) 1.297 12.662 ( 0.695 0.000 2.500) 2.594 12.722 ( -0.352 0.000 -0.406) 0.538 12.874 ( -2.177 0.000 -8.659) 8.928 12.881 ( 6.608 0.000 -9.556) 11.618 13.047 ( -3.105 0.000 0.686) 3.180 13.115 ( -4.322 0.000 1.687) 4.639 13.195 ( 2.004 0.000 0.368) 2.037 13.269 ( -2.570 0.000 -0.844) 2.705 13.277 ( -4.612 0.000 7.035) 8.411 13.307 ( 2.702 0.000 -0.318) 2.720 13.474 ( 2.024 0.000 -0.178) 2.032 13.568 ( 4.970 0.000 -5.346) 7.300 13.632 ( -8.052 0.000 5.481) 9.740 13.697 ( 8.090 0.000 1.612) 8.249 13.848 ( 2.855 0.000 1.097) 3.059 13.858 ( 7.725 0.000 5.995) 9.778 13.961 ( 4.031 0.000 -4.737) 6.220 14.108 ( -3.976 0.000 -2.648) 4.777 14.229 ( 3.014 0.000 0.656) 3.085 14.284 ( -1.395 0.000 4.225) 4.450 14.416 ( 4.501 0.000 4.347) 6.257 14.504 ( 2.171 0.000 1.498) 2.638 14.578 ( 6.100 0.000 1.488) 6.279 14.729 ( 1.538 0.000 -2.911) 3.293 14.734 ( -4.358 0.000 5.766) 7.228 15.013 ( 0.543 0.000 -7.609) 7.628 15.089 ( -0.229 0.000 -1.971) 1.984 15.186 ( -10.272 0.000 -1.277) 10.351 15.337 ( 11.300 0.000 -2.137) 11.500 15.448 ( 10.659 0.000 -3.835) 11.328 15.458 ( 0.544 0.000 -0.982) 1.122 15.539 ( 2.511 0.000 3.241) 4.100 15.665 ( 0.873 0.000 1.130) 1.428 15.738 ( 2.751 0.000 4.938) 5.653 15.791 ( -2.419 0.000 -6.640) 7.067 16.193 ( 1.074 0.000 -0.827) 1.355 16.303 ( -5.320 0.000 1.851) 5.633 16.601 ( -4.026 0.000 1.078) 4.167 16.663 ( 2.730 0.000 5.524) 6.161 16.749 ( -2.509 0.000 -1.159) 2.763 16.780 ( 1.646 0.000 1.390) 2.154 16.858 ( 2.317 0.000 -2.806) 3.639 17.046 ( 2.676 0.000 -0.585) 2.739 17.134 ( 0.222 0.000 4.086) 4.092 17.160 ( 2.262 0.000 0.701) 2.368 17.446 ( 4.190 0.000 -2.110) 4.692 17.537 ( 1.581 0.000 4.749) 5.005 17.602 ( 5.097 0.000 0.152) 5.100 17.902 ( -4.546 0.000 0.980) 4.650 18.073 ( -2.445 0.000 -2.131) 3.243 18.103 ( -1.272 0.000 -2.176) 2.521 18.207 ( -5.305 0.000 2.216) 5.750 18.265 ( -2.129 0.000 -0.061) 2.130 18.402 ( 1.236 0.000 0.992) 1.585 18.559 ( 3.109 0.000 2.219) 3.819 18.675 ( -2.229 0.000 1.687) 2.795 18.684 ( 1.198 0.000 0.362) 1.251 18.705 ( -5.021 0.000 0.756) 5.078 18.910 ( 2.961 0.000 0.435) 2.993 19.127 ( 2.138 0.000 -2.348) 3.175 19.200 ( -4.128 0.000 -3.858) 5.650 27.658 ( 0.182 0.000 1.415) 1.427 27.694 ( 0.092 0.000 0.960) 0.965 27.703 ( 0.115 0.000 1.201) 1.207 27.748 ( -0.522 0.000 -0.170) 0.549 27.779 ( 0.366 0.000 -1.076) 1.137 27.798 ( 1.758 0.000 -0.565) 1.846 27.838 ( -1.107 0.000 -0.733) 1.328 27.869 ( 1.641 0.000 0.266) 1.662 29.186 ( -0.529 0.000 3.692) 3.730 29.531 ( -6.759 0.000 6.049) 9.070 29.565 ( 1.538 0.000 -2.708) 3.114 29.743 ( -3.367 0.000 -3.826) 5.097 29.832 ( 4.571 0.000 0.212) 4.575 29.833 ( 5.060 0.000 -0.437) 5.078 29.931 ( 4.393 0.000 4.752) 6.472 30.082 ( 8.496 0.000 0.963) 8.551 30.332 ( 16.465 0.000 -8.560) 18.557 30.415 ( -2.349 0.000 -0.234) 2.360 30.521 ( -4.582 0.000 -2.669) 5.303 30.632 ( 7.352 0.000 0.897) 7.406 30.688 ( -0.467 0.000 -1.254) 1.338 30.879 ( -6.630 0.000 -4.554) 8.043 31.040 ( 4.349 0.000 -8.405) 9.463 31.141 ( -2.007 0.000 -5.560) 5.911 31.412 ( -3.451 0.000 4.080) 5.344 31.462 ( -5.923 0.000 -3.383) 6.821 31.498 ( 10.121 0.000 4.954) 11.268 31.933 ( -2.546 0.000 20.345) 20.503 32.357 ( 3.641 0.000 -7.076) 7.958 32.508 ( -5.893 0.000 7.924) 9.875 32.650 ( -10.888 0.000 4.048) 11.616 33.394 ( -10.381 0.000 -10.135) 14.508 ======================= Grid point 37 (15/60) ======================= q-point: ( 0.33 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.957 ( -10.987 0.000 30.922) 32.815 1.492 ( 6.912 0.000 34.557) 35.242 2.414 ( -14.119 0.000 6.653) 15.608 2.687 ( 0.179 0.000 -1.421) 1.432 2.758 ( 7.874 0.000 -5.700) 9.721 2.793 ( 3.019 0.000 -3.068) 4.304 2.851 ( -5.159 0.000 -0.474) 5.181 2.953 ( 27.200 0.000 14.838) 30.984 3.225 ( 3.412 0.000 3.573) 4.940 3.238 ( -0.085 0.000 -3.044) 3.046 3.296 ( 2.574 0.000 -2.151) 3.354 3.435 ( -1.981 0.000 -11.987) 12.149 3.568 ( 14.034 0.000 4.204) 14.651 3.614 ( 11.501 0.000 13.149) 17.469 3.682 ( 4.035 0.000 -6.355) 7.527 3.920 ( 2.282 0.000 -4.499) 5.044 3.933 ( -6.714 0.000 -5.479) 8.666 4.047 ( 4.280 0.000 -8.287) 9.327 4.169 ( 11.450 0.000 0.759) 11.475 4.226 ( 9.048 0.000 4.368) 10.047 4.303 ( -0.475 0.000 -3.389) 3.422 4.333 ( -4.306 0.000 -6.262) 7.600 4.373 ( -2.781 0.000 5.734) 6.372 4.408 ( -1.511 0.000 -3.268) 3.600 4.593 ( 2.310 0.000 1.288) 2.645 4.705 ( 2.454 0.000 0.959) 2.635 4.827 ( -11.637 0.000 1.809) 11.777 4.829 ( -1.922 0.000 4.251) 4.666 4.865 ( -0.614 0.000 -4.782) 4.821 5.023 ( -25.081 0.000 -1.068) 25.103 5.097 ( -3.693 0.000 -2.301) 4.352 5.140 ( 3.042 0.000 -7.295) 7.904 5.235 ( -6.849 0.000 4.802) 8.364 5.369 ( -7.336 0.000 5.271) 9.033 5.464 ( -8.110 0.000 3.350) 8.774 5.525 ( -9.201 0.000 -6.761) 11.418 5.558 ( 1.091 0.000 0.599) 1.245 5.754 ( -1.921 0.000 2.594) 3.228 5.799 ( 3.588 0.000 9.738) 10.378 5.892 ( -1.199 0.000 -10.478) 10.547 6.350 ( 6.128 0.000 5.962) 8.550 6.383 ( 10.911 0.000 1.203) 10.977 6.534 ( -6.055 0.000 9.108) 10.937 6.895 ( -7.627 0.000 -6.750) 10.185 7.381 ( 1.705 0.000 0.915) 1.935 7.504 ( -6.022 0.000 -4.456) 7.491 7.637 ( 0.239 0.000 1.189) 1.213 7.676 ( -0.307 0.000 -4.171) 4.183 8.000 ( 0.376 0.000 -2.326) 2.356 8.270 ( -1.810 0.000 -1.230) 2.188 8.559 ( -7.308 0.000 1.738) 7.512 8.603 ( 0.919 0.000 -0.807) 1.223 8.661 ( 4.649 0.000 -3.298) 5.700 8.747 ( 2.918 0.000 -5.888) 6.571 8.798 ( 0.655 0.000 -3.562) 3.622 8.984 ( -0.640 0.000 -1.528) 1.657 9.095 ( -0.993 0.000 2.088) 2.312 9.127 ( -7.336 0.000 3.275) 8.034 9.193 ( -3.730 0.000 0.443) 3.756 9.414 ( -1.532 0.000 1.314) 2.018 9.563 ( -0.732 0.000 3.320) 3.400 9.657 ( -0.273 0.000 -4.648) 4.656 10.043 ( -7.587 0.000 4.185) 8.665 10.133 ( 1.544 0.000 -2.234) 2.716 10.320 ( -7.623 0.000 0.465) 7.637 10.329 ( 3.563 0.000 7.249) 8.078 10.366 ( -2.500 0.000 -1.306) 2.820 10.596 ( 4.482 0.000 -3.204) 5.509 10.699 ( -1.895 0.000 -1.876) 2.666 10.765 ( 1.868 0.000 1.059) 2.147 10.772 ( -3.099 0.000 -3.239) 4.482 10.908 ( -0.273 0.000 -2.089) 2.107 10.924 ( 0.293 0.000 10.128) 10.132 11.033 ( 5.332 0.000 -9.039) 10.494 11.081 ( -3.423 0.000 2.352) 4.154 11.102 ( 2.222 0.000 -6.572) 6.937 11.217 ( -0.718 0.000 -0.410) 0.827 11.521 ( -1.259 0.000 -0.556) 1.377 11.646 ( -1.850 0.000 5.743) 6.034 11.647 ( -2.741 0.000 -4.877) 5.595 11.831 ( -15.225 0.000 3.866) 15.708 11.869 ( -0.751 0.000 -1.938) 2.078 12.018 ( 3.044 0.000 0.735) 3.131 12.067 ( 9.911 0.000 0.092) 9.911 12.438 ( -2.459 0.000 -1.016) 2.661 12.465 ( -5.433 0.000 6.005) 8.098 12.504 ( 1.391 0.000 0.923) 1.669 12.601 ( -6.953 0.000 3.022) 7.582 12.759 ( 3.336 0.000 -5.226) 6.200 12.807 ( -0.432 0.000 -6.875) 6.888 12.942 ( 2.767 0.000 -2.982) 4.068 13.010 ( 0.418 0.000 -1.802) 1.849 13.064 ( -1.991 0.000 -0.139) 1.995 13.159 ( -4.154 0.000 7.801) 8.838 13.224 ( -0.960 0.000 2.308) 2.500 13.300 ( 0.678 0.000 2.487) 2.578 13.351 ( 2.048 0.000 -0.707) 2.166 13.477 ( 0.131 0.000 -0.999) 1.008 13.569 ( -3.047 0.000 4.727) 5.624 13.621 ( 2.566 0.000 -4.416) 5.107 13.874 ( 0.265 0.000 -1.752) 1.772 13.878 ( 9.368 0.000 -4.173) 10.256 14.005 ( -1.183 0.000 -0.642) 1.346 14.022 ( 3.024 0.000 1.568) 3.406 14.068 ( 4.126 0.000 1.141) 4.280 14.270 ( 0.947 0.000 -0.987) 1.368 14.274 ( -1.428 0.000 5.512) 5.694 14.522 ( 2.881 0.000 2.111) 3.571 14.557 ( 2.477 0.000 -0.455) 2.518 14.629 ( -5.552 0.000 1.281) 5.697 14.736 ( 3.935 0.000 6.982) 8.014 14.765 ( 3.233 0.000 -5.369) 6.267 14.950 ( -5.342 0.000 -3.922) 6.627 15.029 ( -2.354 0.000 5.346) 5.842 15.102 ( 1.276 0.000 -2.131) 2.484 15.324 ( -5.186 0.000 3.094) 6.039 15.471 ( 0.929 0.000 -2.069) 2.267 15.596 ( 2.747 0.000 -4.271) 5.078 15.686 ( 2.236 0.000 0.054) 2.237 15.717 ( 0.425 0.000 -7.276) 7.288 15.813 ( 15.543 0.000 -2.759) 15.786 15.877 ( 9.056 0.000 0.149) 9.058 16.167 ( -2.165 0.000 -4.307) 4.821 16.229 ( -2.498 0.000 1.992) 3.195 16.555 ( -1.904 0.000 5.102) 5.445 16.622 ( -4.920 0.000 3.257) 5.900 16.815 ( 3.648 0.000 2.473) 4.408 16.844 ( 3.413 0.000 0.936) 3.539 16.894 ( 2.633 0.000 -3.793) 4.617 17.065 ( -0.751 0.000 -0.073) 0.755 17.134 ( -2.884 0.000 7.370) 7.914 17.190 ( 0.190 0.000 2.885) 2.891 17.489 ( 1.295 0.000 -4.513) 4.695 17.620 ( 4.036 0.000 5.220) 6.599 17.663 ( 1.146 0.000 -4.051) 4.210 17.793 ( -3.682 0.000 -4.087) 5.501 18.061 ( -1.610 0.000 -0.429) 1.666 18.079 ( 1.517 0.000 6.110) 6.295 18.118 ( -4.230 0.000 1.562) 4.509 18.231 ( -1.267 0.000 2.857) 3.125 18.444 ( 2.450 0.000 0.127) 2.453 18.537 ( -6.137 0.000 4.597) 7.668 18.597 ( -5.048 0.000 -0.370) 5.062 18.715 ( 1.708 0.000 0.515) 1.784 18.723 ( 5.358 0.000 -3.713) 6.519 19.003 ( 4.949 0.000 0.173) 4.952 19.126 ( -1.489 0.000 -0.547) 1.587 19.141 ( 0.321 0.000 -1.662) 1.692 27.671 ( 0.014 0.000 1.184) 1.185 27.695 ( -1.140 0.000 0.640) 1.307 27.698 ( -0.217 0.000 -0.022) 0.219 27.726 ( -0.911 0.000 -0.652) 1.121 27.789 ( 0.882 0.000 -0.729) 1.145 27.799 ( -0.145 0.000 -1.080) 1.090 27.850 ( 1.395 0.000 -0.230) 1.414 27.898 ( 0.769 0.000 0.398) 0.866 29.189 ( -1.079 0.000 3.601) 3.760 29.464 ( -3.707 0.000 3.908) 5.387 29.583 ( 1.289 0.000 -4.467) 4.649 29.680 ( -0.351 0.000 -2.968) 2.989 29.920 ( 2.301 0.000 -1.196) 2.593 29.944 ( 4.927 0.000 -0.246) 4.933 30.071 ( 7.150 0.000 4.512) 8.455 30.248 ( 6.093 0.000 -1.196) 6.210 30.398 ( 1.510 0.000 1.424) 2.075 30.410 ( -2.298 0.000 0.549) 2.363 30.509 ( 1.340 0.000 0.875) 1.600 30.669 ( -1.545 0.000 -9.039) 9.170 30.736 ( 0.909 0.000 0.552) 1.063 30.788 ( 2.970 0.000 -1.608) 3.377 31.000 ( -5.779 0.000 -4.470) 7.306 31.106 ( 3.510 0.000 -9.121) 9.773 31.385 ( 1.565 0.000 -5.010) 5.248 31.395 ( -0.528 0.000 7.483) 7.501 31.755 ( 11.433 0.000 4.138) 12.159 31.961 ( -5.362 0.000 20.177) 20.877 32.244 ( -9.226 0.000 -9.033) 12.912 32.389 ( -8.348 0.000 5.684) 10.099 32.633 ( 6.829 0.000 2.998) 7.458 33.069 ( -14.470 0.000 -9.263) 17.181 ======================= Grid point 38 (16/60) ======================= q-point: (-0.50 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.828 ( -15.443 0.000 27.881) 31.872 1.608 ( -16.498 0.000 29.203) 33.541 2.299 ( 2.774 0.000 9.867) 10.250 2.673 ( -0.787 0.000 -3.070) 3.170 2.724 ( -5.763 0.000 -3.688) 6.842 2.813 ( -0.695 0.000 0.779) 1.044 2.891 ( 5.470 0.000 -2.854) 6.170 3.095 ( -7.940 0.000 -5.294) 9.543 3.167 ( -4.332 0.000 -6.991) 8.224 3.332 ( 0.051 0.000 -3.951) 3.952 3.356 ( 3.377 0.000 1.444) 3.673 3.478 ( 6.244 0.000 -2.581) 6.757 3.538 ( -11.831 0.000 -8.699) 14.685 3.692 ( -2.189 0.000 -4.390) 4.906 3.729 ( 3.393 0.000 -6.370) 7.218 3.977 ( 1.386 0.000 3.424) 3.694 4.072 ( 1.015 0.000 -7.895) 7.960 4.081 ( 5.571 0.000 9.077) 10.650 4.207 ( -0.926 0.000 -4.394) 4.491 4.225 ( -3.142 0.000 -1.804) 3.623 4.370 ( -6.516 0.000 2.750) 7.072 4.391 ( -4.711 0.000 1.421) 4.920 4.445 ( 7.549 0.000 -3.697) 8.405 4.464 ( 1.229 0.000 1.441) 1.894 4.528 ( 1.476 0.000 0.118) 1.481 4.638 ( -7.565 0.000 2.363) 7.926 4.682 ( 7.845 0.000 2.756) 8.315 4.743 ( -5.627 0.000 -0.721) 5.673 4.782 ( 8.725 0.000 -0.119) 8.726 4.852 ( 6.942 0.000 3.421) 7.739 5.027 ( -5.314 0.000 -3.635) 6.439 5.157 ( 6.633 0.000 -1.652) 6.836 5.168 ( -4.718 0.000 6.990) 8.433 5.226 ( -0.689 0.000 -9.048) 9.074 5.238 ( -4.837 0.000 4.908) 6.891 5.593 ( 4.299 0.000 1.131) 4.445 5.627 ( 5.434 0.000 1.789) 5.721 5.704 ( -5.925 0.000 3.849) 7.065 5.739 ( -4.881 0.000 -4.905) 6.920 6.010 ( 6.725 0.000 4.314) 7.990 6.418 ( -8.003 0.000 7.201) 10.766 6.481 ( 2.117 0.000 7.518) 7.811 6.574 ( -1.180 0.000 6.323) 6.432 6.801 ( 7.404 0.000 -6.049) 9.561 7.409 ( -0.368 0.000 -3.050) 3.072 7.414 ( 0.617 0.000 -0.772) 0.989 7.663 ( 1.069 0.000 -1.469) 1.817 7.687 ( 3.736 0.000 2.243) 4.357 8.092 ( 8.577 0.000 0.092) 8.578 8.261 ( 1.911 0.000 1.949) 2.730 8.401 ( -7.109 0.000 2.107) 7.415 8.604 ( 0.357 0.000 -0.553) 0.658 8.736 ( 2.506 0.000 -5.945) 6.451 8.776 ( -0.508 0.000 -4.266) 4.297 8.829 ( 5.602 0.000 -4.068) 6.923 8.998 ( 2.078 0.000 0.589) 2.160 9.004 ( -4.777 0.000 3.777) 6.090 9.108 ( 0.667 0.000 1.515) 1.655 9.147 ( -0.907 0.000 2.984) 3.119 9.397 ( -0.025 0.000 -2.270) 2.270 9.511 ( -4.805 0.000 -0.333) 4.816 9.639 ( 1.684 0.000 -6.596) 6.807 9.869 ( -7.101 0.000 1.332) 7.225 10.177 ( 2.631 0.000 -1.430) 2.995 10.284 ( 2.251 0.000 1.816) 2.892 10.290 ( -2.924 0.000 -3.465) 4.534 10.345 ( -4.039 0.000 4.016) 5.696 10.627 ( -3.154 0.000 -3.889) 5.008 10.647 ( 0.507 0.000 -5.118) 5.143 10.766 ( 2.587 0.000 1.646) 3.066 10.778 ( -1.176 0.000 -0.413) 1.247 10.841 ( -0.981 0.000 -7.478) 7.542 10.951 ( -2.457 0.000 4.951) 5.527 11.057 ( -0.145 0.000 2.602) 2.606 11.104 ( 5.484 0.000 -7.283) 9.116 11.168 ( -1.942 0.000 -1.568) 2.496 11.174 ( 6.214 0.000 -0.957) 6.287 11.479 ( -7.888 0.000 8.710) 11.751 11.544 ( -7.970 0.000 -2.758) 8.433 11.683 ( 5.647 0.000 1.925) 5.966 11.701 ( 2.594 0.000 1.186) 2.852 11.855 ( 0.790 0.000 -1.370) 1.582 12.096 ( 3.423 0.000 1.703) 3.823 12.262 ( 8.560 0.000 -3.758) 9.349 12.325 ( -4.367 0.000 3.987) 5.913 12.434 ( -8.085 0.000 6.366) 10.291 12.475 ( 0.355 0.000 2.731) 2.754 12.530 ( -0.877 0.000 -0.840) 1.214 12.779 ( 1.583 0.000 -6.490) 6.680 12.793 ( 2.008 0.000 -4.084) 4.551 12.953 ( -0.953 0.000 0.189) 0.972 13.030 ( 2.098 0.000 -1.666) 2.679 13.041 ( 0.974 0.000 -1.198) 1.544 13.128 ( -3.250 0.000 7.327) 8.015 13.242 ( -0.520 0.000 5.702) 5.726 13.306 ( -1.240 0.000 2.252) 2.571 13.371 ( 0.206 0.000 -1.291) 1.307 13.457 ( -1.046 0.000 -4.954) 5.063 13.557 ( -0.530 0.000 6.761) 6.782 13.626 ( 0.616 0.000 -5.187) 5.223 13.860 ( -0.117 0.000 -2.739) 2.742 13.935 ( -3.126 0.000 -2.084) 3.757 14.047 ( 8.889 0.000 -7.745) 11.790 14.076 ( -3.343 0.000 1.344) 3.603 14.094 ( 1.777 0.000 4.908) 5.219 14.258 ( -1.136 0.000 -3.729) 3.898 14.293 ( -2.225 0.000 9.348) 9.609 14.497 ( -4.952 0.000 -3.735) 6.203 14.561 ( -0.958 0.000 1.066) 1.433 14.587 ( 0.868 0.000 -4.360) 4.446 14.760 ( -1.083 0.000 -1.859) 2.151 14.810 ( -1.078 0.000 9.092) 9.155 14.838 ( -3.340 0.000 -1.482) 3.654 15.066 ( -2.763 0.000 -4.270) 5.086 15.105 ( 5.459 0.000 5.106) 7.475 15.232 ( -3.557 0.000 -3.473) 4.971 15.478 ( 0.754 0.000 -2.094) 2.225 15.541 ( -2.185 0.000 -6.772) 7.116 15.733 ( 4.117 0.000 -6.324) 7.546 15.742 ( 0.822 0.000 -0.634) 1.039 15.946 ( -4.759 0.000 -1.183) 4.904 16.040 ( 3.647 0.000 4.965) 6.160 16.175 ( 7.408 0.000 -3.021) 8.000 16.249 ( 4.243 0.000 1.746) 4.588 16.548 ( -3.781 0.000 3.033) 4.847 16.577 ( 0.691 0.000 7.995) 8.025 16.846 ( -1.242 0.000 1.068) 1.638 16.891 ( -0.041 0.000 0.930) 0.931 16.924 ( 2.024 0.000 -3.066) 3.674 17.000 ( -5.629 0.000 1.285) 5.773 17.126 ( -1.161 0.000 4.802) 4.940 17.201 ( -0.810 0.000 2.905) 3.016 17.470 ( -0.558 0.000 -3.790) 3.830 17.606 ( -2.787 0.000 -6.712) 7.267 17.727 ( 2.824 0.000 2.853) 4.014 17.766 ( 3.060 0.000 -3.776) 4.861 18.039 ( -0.642 0.000 0.828) 1.048 18.058 ( -2.381 0.000 3.628) 4.339 18.151 ( 0.918 0.000 7.809) 7.863 18.250 ( 1.105 0.000 3.909) 4.062 18.456 ( -2.218 0.000 2.339) 3.224 18.499 ( 0.246 0.000 -0.006) 0.246 18.525 ( 1.006 0.000 0.073) 1.009 18.765 ( 2.015 0.000 2.839) 3.481 18.782 ( 1.943 0.000 -2.121) 2.877 19.078 ( 1.279 0.000 -0.950) 1.593 19.134 ( 1.894 0.000 1.654) 2.514 19.139 ( 1.196 0.000 -0.168) 1.208 27.653 ( -1.588 0.000 -0.530) 1.674 27.679 ( -0.891 0.000 -1.198) 1.493 27.680 ( -0.493 0.000 0.172) 0.522 27.717 ( 0.196 0.000 -0.673) 0.701 27.800 ( 0.388 0.000 -0.287) 0.483 27.813 ( 1.381 0.000 0.585) 1.500 27.859 ( -0.405 0.000 -0.783) 0.882 27.903 ( -0.389 0.000 -0.003) 0.389 29.185 ( -1.084 0.000 3.548) 3.710 29.393 ( -4.386 0.000 0.267) 4.394 29.565 ( 0.338 0.000 -5.060) 5.072 29.695 ( 2.304 0.000 -2.127) 3.136 29.910 ( -1.656 0.000 -1.255) 2.078 29.984 ( -1.419 0.000 -1.458) 2.034 30.185 ( -1.339 0.000 0.341) 1.382 30.303 ( 1.785 0.000 -0.476) 1.848 30.393 ( -1.406 0.000 1.706) 2.211 30.457 ( -2.059 0.000 1.508) 2.552 30.493 ( 0.782 0.000 5.598) 5.652 30.650 ( 3.498 0.000 -3.670) 5.070 30.701 ( 0.667 0.000 -2.686) 2.768 30.846 ( -5.712 0.000 -5.140) 7.684 30.911 ( 7.917 0.000 -0.651) 7.944 31.149 ( 5.057 0.000 -7.015) 8.648 31.412 ( 3.043 0.000 -4.271) 5.244 31.496 ( 3.778 0.000 10.218) 10.894 31.831 ( -9.644 0.000 -4.988) 10.858 31.931 ( -7.933 0.000 18.809) 20.413 32.147 ( 9.046 0.000 -1.763) 9.216 32.277 ( -3.492 0.000 3.298) 4.803 32.709 ( -10.674 0.000 -4.292) 11.504 32.899 ( 12.470 0.000 -2.948) 12.814 ======================= Grid point 39 (17/60) ======================= q-point: (-0.33 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.678 ( -12.983 0.000 27.796) 30.678 1.320 ( -23.169 0.000 34.312) 41.402 2.203 ( -33.253 0.000 -5.850) 33.763 2.595 ( -1.895 0.000 2.684) 3.286 2.620 ( -1.550 0.000 -5.875) 6.076 2.702 ( -9.905 0.000 5.183) 11.179 2.810 ( 0.345 0.000 1.831) 1.863 3.026 ( -0.197 0.000 -3.978) 3.983 3.054 ( -3.366 0.000 -3.419) 4.798 3.209 ( -2.381 0.000 2.892) 3.746 3.232 ( -5.290 0.000 -5.514) 7.641 3.464 ( -2.704 0.000 3.492) 4.417 3.567 ( -0.178 0.000 2.677) 2.683 3.702 ( -6.169 0.000 -6.479) 8.946 3.770 ( 10.331 0.000 -3.623) 10.948 3.827 ( -6.054 0.000 -4.591) 7.598 3.990 ( -11.989 0.000 -1.657) 12.103 3.997 ( -4.708 0.000 4.109) 6.249 4.087 ( -2.658 0.000 -6.606) 7.120 4.139 ( -2.838 0.000 -2.428) 3.735 4.341 ( 0.865 0.000 0.980) 1.307 4.344 ( 3.426 0.000 -2.351) 4.155 4.465 ( -4.381 0.000 0.285) 4.390 4.514 ( 2.549 0.000 4.592) 5.253 4.592 ( 9.100 0.000 -7.130) 11.561 4.594 ( -5.599 0.000 -1.629) 5.831 4.661 ( 4.245 0.000 4.679) 6.317 4.945 ( -1.042 0.000 4.909) 5.018 5.021 ( 3.812 0.000 -6.818) 7.812 5.069 ( 8.587 0.000 6.335) 10.671 5.078 ( -2.875 0.000 -8.450) 8.926 5.120 ( 5.425 0.000 -1.748) 5.699 5.193 ( 15.111 0.000 -1.495) 15.184 5.332 ( 13.597 0.000 3.232) 13.976 5.380 ( 10.783 0.000 -1.515) 10.889 5.555 ( -7.565 0.000 1.433) 7.699 5.644 ( 0.956 0.000 -1.391) 1.688 5.678 ( 0.686 0.000 4.023) 4.081 5.791 ( 7.668 0.000 3.205) 8.310 6.025 ( -5.407 0.000 0.008) 5.407 6.409 ( 2.500 0.000 10.722) 11.009 6.473 ( -8.343 0.000 6.585) 10.628 6.519 ( -1.952 0.000 6.819) 7.093 6.997 ( 9.702 0.000 -4.700) 10.780 7.374 ( -3.117 0.000 -2.174) 3.800 7.460 ( 5.803 0.000 -2.741) 6.418 7.711 ( 2.840 0.000 0.958) 2.998 7.816 ( 7.933 0.000 0.172) 7.935 8.202 ( -2.980 0.000 1.628) 3.396 8.358 ( 4.585 0.000 2.575) 5.258 8.385 ( 8.520 0.000 -3.720) 9.297 8.615 ( -0.129 0.000 0.813) 0.823 8.653 ( -5.696 0.000 -6.339) 8.522 8.759 ( 2.921 0.000 -4.309) 5.206 8.887 ( 1.858 0.000 -2.315) 2.968 9.016 ( 3.376 0.000 0.248) 3.385 9.053 ( 1.075 0.000 2.559) 2.776 9.126 ( 2.077 0.000 -4.084) 4.581 9.193 ( 1.862 0.000 9.226) 9.412 9.349 ( -5.729 0.000 -1.244) 5.863 9.412 ( -0.711 0.000 -4.302) 4.360 9.672 ( 3.617 0.000 -4.056) 5.434 9.883 ( 9.095 0.000 -0.050) 9.095 10.086 ( -7.606 0.000 -0.736) 7.642 10.287 ( 2.667 0.000 -1.061) 2.871 10.359 ( 2.504 0.000 4.852) 5.461 10.360 ( 3.085 0.000 0.774) 3.181 10.551 ( -2.161 0.000 -3.838) 4.405 10.552 ( -3.782 0.000 -6.610) 7.616 10.744 ( -2.216 0.000 -0.682) 2.318 10.821 ( 3.127 0.000 -10.228) 10.696 10.823 ( 1.110 0.000 2.764) 2.979 10.917 ( -0.567 0.000 -0.968) 1.122 11.052 ( -0.830 0.000 -1.570) 1.776 11.089 ( -3.323 0.000 -7.739) 8.422 11.183 ( 2.409 0.000 5.461) 5.969 11.320 ( -5.033 0.000 4.390) 6.678 11.345 ( 4.062 0.000 0.739) 4.128 11.460 ( 1.273 0.000 0.449) 1.350 11.745 ( -0.916 0.000 3.256) 3.383 11.759 ( 0.274 0.000 -6.376) 6.382 11.941 ( 6.162 0.000 5.708) 8.400 12.165 ( 1.301 0.000 6.018) 6.157 12.218 ( -7.876 0.000 6.394) 10.145 12.338 ( 2.894 0.000 2.709) 3.964 12.483 ( 0.216 0.000 -3.109) 3.117 12.501 ( 1.128 0.000 1.188) 1.638 12.515 ( 7.085 0.000 0.631) 7.113 12.750 ( -1.170 0.000 -5.617) 5.737 12.828 ( 3.389 0.000 -4.456) 5.598 12.928 ( -0.808 0.000 -2.144) 2.291 13.051 ( -0.514 0.000 0.277) 0.584 13.088 ( 3.747 0.000 -0.445) 3.774 13.118 ( 0.096 0.000 3.815) 3.816 13.249 ( -2.447 0.000 10.657) 10.934 13.263 ( -4.665 0.000 2.693) 5.387 13.348 ( -1.164 0.000 -2.729) 2.967 13.423 ( 0.441 0.000 -2.048) 2.094 13.594 ( 0.693 0.000 4.735) 4.785 13.600 ( -0.099 0.000 -4.957) 4.958 13.839 ( -0.540 0.000 -3.644) 3.684 13.845 ( -5.499 0.000 1.443) 5.686 13.925 ( -9.086 0.000 -1.449) 9.200 14.116 ( -4.101 0.000 7.535) 8.579 14.165 ( -4.796 0.000 -8.549) 9.802 14.214 ( 7.209 0.000 -2.666) 7.686 14.269 ( -2.743 0.000 6.746) 7.282 14.387 ( -2.032 0.000 -5.780) 6.127 14.530 ( -2.247 0.000 0.524) 2.307 14.542 ( -2.625 0.000 -3.154) 4.104 14.727 ( -2.565 0.000 4.429) 5.118 14.777 ( -6.420 0.000 6.754) 9.318 14.807 ( 3.015 0.000 -8.198) 8.734 15.025 ( 2.010 0.000 -0.313) 2.035 15.134 ( -2.140 0.000 -12.103) 12.291 15.247 ( 4.696 0.000 3.482) 5.846 15.480 ( 0.228 0.000 -0.410) 0.469 15.483 ( 0.170 0.000 -5.818) 5.820 15.674 ( -5.904 0.000 -1.140) 6.013 15.699 ( -6.036 0.000 -6.055) 8.549 15.862 ( 0.540 0.000 0.462) 0.711 16.093 ( -3.132 0.000 10.893) 11.335 16.254 ( 0.170 0.000 -2.378) 2.384 16.361 ( 2.317 0.000 5.589) 6.050 16.505 ( -0.148 0.000 -0.813) 0.827 16.660 ( 1.852 0.000 9.400) 9.580 16.826 ( -0.137 0.000 -2.040) 2.045 16.850 ( -4.087 0.000 1.642) 4.404 16.897 ( -2.518 0.000 0.170) 2.524 16.943 ( 1.304 0.000 -2.888) 3.169 17.102 ( -3.259 0.000 1.388) 3.542 17.188 ( -1.542 0.000 1.531) 2.173 17.441 ( -0.408 0.000 -1.999) 2.040 17.521 ( -1.826 0.000 -5.256) 5.564 17.742 ( -0.916 0.000 -2.505) 2.667 17.846 ( 5.703 0.000 -2.576) 6.258 18.036 ( -0.257 0.000 0.755) 0.798 18.058 ( -1.071 0.000 7.168) 7.247 18.196 ( -0.112 0.000 5.923) 5.924 18.301 ( 1.193 0.000 3.742) 3.927 18.487 ( 0.759 0.000 -2.927) 3.024 18.499 ( 4.919 0.000 0.391) 4.935 18.584 ( 1.194 0.000 4.070) 4.242 18.802 ( 1.712 0.000 -0.144) 1.718 18.809 ( 0.227 0.000 3.980) 3.986 19.053 ( -1.640 0.000 -1.983) 2.574 19.192 ( 2.615 0.000 2.271) 3.463 19.217 ( 4.796 0.000 1.543) 5.038 27.626 ( -0.475 0.000 -0.379) 0.608 27.662 ( -0.042 0.000 -0.741) 0.742 27.671 ( -0.242 0.000 -0.475) 0.533 27.720 ( 0.445 0.000 -1.052) 1.142 27.800 ( -0.278 0.000 -0.157) 0.319 27.826 ( -1.784 0.000 -0.985) 2.038 27.849 ( 1.141 0.000 1.171) 1.635 27.886 ( -1.030 0.000 -0.351) 1.088 29.183 ( -1.091 0.000 3.621) 3.782 29.297 ( -4.053 0.000 -1.303) 4.258 29.561 ( 1.400 0.000 -2.825) 3.153 29.733 ( 2.609 0.000 -2.923) 3.918 29.871 ( -1.716 0.000 1.242) 2.118 29.886 ( -5.747 0.000 -2.496) 6.266 30.032 ( -10.007 0.000 -0.586) 10.024 30.277 ( -11.712 0.000 0.907) 11.747 30.348 ( 1.882 0.000 -0.409) 1.926 30.366 ( -1.803 0.000 -1.745) 2.509 30.584 ( 1.922 0.000 5.482) 5.809 30.709 ( -4.925 0.000 -4.415) 6.614 30.757 ( 7.549 0.000 -0.303) 7.555 30.797 ( 7.670 0.000 -5.817) 9.626 31.080 ( 7.860 0.000 1.155) 7.944 31.216 ( 4.004 0.000 -6.560) 7.686 31.463 ( 3.016 0.000 0.230) 3.025 31.536 ( -12.512 0.000 -8.501) 15.127 31.607 ( 1.359 0.000 10.514) 10.601 31.845 ( -8.558 0.000 14.365) 16.721 32.308 ( 3.861 0.000 4.468) 5.905 32.380 ( 10.596 0.000 -0.130) 10.597 32.486 ( -6.326 0.000 -2.826) 6.929 33.192 ( 15.143 0.000 -4.145) 15.700 ======================= Grid point 40 (18/60) ======================= q-point: (-0.17 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.625 ( -7.139 0.000 31.666) 32.461 1.021 ( -31.476 0.000 21.884) 38.336 1.345 ( -33.958 0.000 33.741) 47.871 2.577 ( 1.255 0.000 -5.103) 5.255 2.578 ( -0.261 0.000 -0.308) 0.404 2.628 ( -4.218 0.000 7.439) 8.551 2.842 ( 1.518 0.000 0.791) 1.712 2.990 ( 0.036 0.000 -1.815) 1.815 2.990 ( -2.799 0.000 1.150) 3.027 3.131 ( -2.752 0.000 1.265) 3.029 3.211 ( -3.657 0.000 7.938) 8.740 3.391 ( -7.764 0.000 -8.485) 11.501 3.439 ( -1.752 0.000 3.217) 3.664 3.599 ( -4.744 0.000 4.786) 6.739 3.746 ( -4.457 0.000 1.079) 4.586 3.762 ( -0.625 0.000 -0.620) 0.880 3.973 ( -4.071 0.000 0.821) 4.153 4.008 ( -0.644 0.000 -7.961) 7.987 4.094 ( 3.861 0.000 -3.862) 5.461 4.115 ( 11.712 0.000 1.557) 11.815 4.187 ( -1.609 0.000 -2.453) 2.934 4.394 ( 2.229 0.000 -2.999) 3.737 4.486 ( -3.510 0.000 -1.019) 3.655 4.563 ( 4.357 0.000 -1.196) 4.518 4.614 ( 3.721 0.000 3.018) 4.791 4.738 ( -2.185 0.000 10.200) 10.431 4.769 ( 12.259 0.000 -6.786) 14.012 4.891 ( -4.269 0.000 6.970) 8.173 4.942 ( -3.502 0.000 -10.902) 11.451 5.030 ( 0.935 0.000 -12.639) 12.673 5.047 ( -4.556 0.000 0.351) 4.570 5.293 ( -3.514 0.000 -7.137) 7.955 5.306 ( 7.553 0.000 1.201) 7.648 5.425 ( -3.845 0.000 2.686) 4.690 5.438 ( -0.869 0.000 1.380) 1.630 5.654 ( -3.737 0.000 6.784) 7.745 5.761 ( 3.589 0.000 -2.298) 4.261 5.763 ( 16.546 0.000 1.591) 16.622 5.933 ( 4.706 0.000 -0.528) 4.736 6.049 ( 10.241 0.000 -0.632) 10.261 6.328 ( -8.120 0.000 2.817) 8.595 6.432 ( -5.571 0.000 2.720) 6.199 6.559 ( 1.486 0.000 10.373) 10.478 7.108 ( 3.671 0.000 -4.447) 5.767 7.318 ( -0.464 0.000 -0.567) 0.733 7.578 ( 7.175 0.000 -4.748) 8.604 7.739 ( -1.205 0.000 1.263) 1.746 7.948 ( 3.948 0.000 -6.048) 7.223 8.130 ( -2.265 0.000 1.127) 2.530 8.437 ( 2.756 0.000 -0.524) 2.805 8.465 ( -7.105 0.000 -5.988) 9.292 8.531 ( 5.931 0.000 -5.090) 7.815 8.641 ( 2.107 0.000 1.458) 2.562 8.852 ( 4.587 0.000 -1.895) 4.963 8.916 ( 3.178 0.000 0.216) 3.185 9.055 ( -1.491 0.000 2.427) 2.849 9.057 ( 0.168 0.000 -0.420) 0.453 9.154 ( 2.517 0.000 -3.315) 4.163 9.249 ( -1.133 0.000 1.879) 2.195 9.295 ( 2.387 0.000 5.933) 6.395 9.415 ( 1.915 0.000 -1.671) 2.541 9.743 ( 3.917 0.000 0.261) 3.926 9.995 ( -0.972 0.000 1.639) 1.905 10.106 ( 7.845 0.000 -2.221) 8.153 10.305 ( -0.718 0.000 -0.777) 1.057 10.378 ( -0.621 0.000 -0.242) 0.666 10.430 ( -0.868 0.000 4.647) 4.727 10.522 ( 4.596 0.000 -0.526) 4.626 10.538 ( 4.023 0.000 0.803) 4.102 10.700 ( -0.748 0.000 -4.963) 5.019 10.851 ( -0.109 0.000 3.742) 3.744 10.852 ( 3.616 0.000 -2.446) 4.366 10.938 ( -5.158 0.000 -5.021) 7.198 10.939 ( 3.992 0.000 -4.384) 5.929 11.032 ( 0.450 0.000 -2.196) 2.242 11.182 ( -4.061 0.000 -2.235) 4.636 11.300 ( 5.833 0.000 5.223) 7.830 11.442 ( 3.237 0.000 6.268) 7.054 11.601 ( 5.451 0.000 4.086) 6.813 11.639 ( -8.281 0.000 -5.590) 9.991 11.710 ( -0.556 0.000 -0.152) 0.577 11.978 ( -5.365 0.000 5.311) 7.549 12.223 ( 0.216 0.000 10.970) 10.972 12.253 ( 6.743 0.000 6.192) 9.155 12.409 ( 2.350 0.000 2.462) 3.404 12.443 ( -1.466 0.000 -0.201) 1.480 12.513 ( -0.413 0.000 -3.835) 3.857 12.611 ( -1.392 0.000 -2.753) 3.084 12.685 ( -1.995 0.000 -2.210) 2.977 12.897 ( -0.615 0.000 -5.001) 5.039 12.928 ( 9.526 0.000 -5.297) 10.900 13.032 ( -0.555 0.000 1.291) 1.405 13.127 ( -2.469 0.000 -6.337) 6.801 13.145 ( 1.677 0.000 -1.463) 2.226 13.172 ( -2.711 0.000 8.017) 8.463 13.290 ( -1.183 0.000 10.020) 10.090 13.315 ( 0.432 0.000 -4.157) 4.180 13.445 ( 1.143 0.000 2.900) 3.117 13.581 ( 0.414 0.000 -2.584) 2.617 13.689 ( 6.858 0.000 7.115) 9.882 13.724 ( -9.725 0.000 2.347) 10.004 13.734 ( -5.716 0.000 4.073) 7.019 13.783 ( -2.192 0.000 -2.002) 2.968 13.970 ( -6.155 0.000 -3.175) 6.926 14.050 ( -4.656 0.000 -1.564) 4.912 14.251 ( -0.457 0.000 4.922) 4.943 14.307 ( -0.251 0.000 -0.839) 0.875 14.352 ( 0.197 0.000 -2.705) 2.713 14.467 ( -3.124 0.000 2.235) 3.841 14.498 ( -0.616 0.000 1.628) 1.741 14.686 ( -3.962 0.000 4.224) 5.792 14.727 ( -0.216 0.000 3.470) 3.477 14.871 ( 9.762 0.000 -14.618) 17.578 14.996 ( -3.154 0.000 -18.645) 18.910 15.138 ( 6.471 0.000 4.589) 7.933 15.283 ( -2.007 0.000 -1.738) 2.654 15.478 ( 1.129 0.000 -4.532) 4.670 15.480 ( -1.265 0.000 0.843) 1.520 15.560 ( -3.958 0.000 2.696) 4.789 15.579 ( -2.062 0.000 4.226) 4.702 15.880 ( 1.336 0.000 -5.673) 5.828 15.970 ( -13.793 0.000 10.695) 17.454 16.181 ( -4.752 0.000 -0.463) 4.774 16.418 ( 1.430 0.000 6.052) 6.218 16.512 ( -0.924 0.000 -0.103) 0.930 16.709 ( -2.739 0.000 7.486) 7.971 16.766 ( -4.196 0.000 2.807) 5.049 16.840 ( 3.772 0.000 0.718) 3.840 16.920 ( 2.155 0.000 -4.144) 4.671 16.943 ( 0.564 0.000 -4.098) 4.136 17.033 ( -1.443 0.000 -1.123) 1.829 17.156 ( -1.791 0.000 -0.615) 1.894 17.440 ( 0.695 0.000 0.766) 1.034 17.480 ( -0.134 0.000 -1.925) 1.930 17.668 ( -5.288 0.000 -4.413) 6.888 17.945 ( 3.425 0.000 0.317) 3.440 18.041 ( 2.017 0.000 -2.939) 3.565 18.093 ( 1.783 0.000 4.779) 5.101 18.207 ( -1.431 0.000 3.028) 3.349 18.323 ( -0.575 0.000 1.510) 1.616 18.468 ( -2.146 0.000 -0.798) 2.290 18.594 ( 3.842 0.000 -1.069) 3.988 18.620 ( 1.025 0.000 2.384) 2.595 18.817 ( -1.442 0.000 3.693) 3.964 18.866 ( 2.445 0.000 -0.468) 2.489 19.026 ( 1.355 0.000 -2.392) 2.750 19.247 ( -0.230 0.000 -1.899) 1.913 19.307 ( 2.790 0.000 -0.942) 2.945 27.634 ( 1.225 0.000 0.459) 1.308 27.668 ( 0.060 0.000 -0.034) 0.069 27.670 ( 0.731 0.000 0.286) 0.785 27.727 ( 0.790 0.000 -0.449) 0.908 27.781 ( -1.590 0.000 -0.503) 1.668 27.789 ( -0.511 0.000 -0.577) 0.771 27.861 ( -0.983 0.000 -0.521) 1.112 27.871 ( 0.242 0.000 0.765) 0.803 29.168 ( -1.583 0.000 2.078) 2.612 29.273 ( 2.990 0.000 6.442) 7.102 29.580 ( 0.592 0.000 -0.654) 0.882 29.748 ( -0.329 0.000 -5.472) 5.482 29.809 ( 1.921 0.000 0.397) 1.962 29.842 ( -6.876 0.000 -1.121) 6.967 29.861 ( -1.017 0.000 4.689) 4.798 30.043 ( -10.117 0.000 -0.391) 10.124 30.249 ( -8.827 0.000 -7.864) 11.822 30.395 ( 2.989 0.000 -0.598) 3.048 30.588 ( -4.903 0.000 -2.642) 5.570 30.620 ( -0.470 0.000 3.413) 3.445 30.886 ( 3.062 0.000 -1.555) 3.434 30.910 ( 6.802 0.000 -8.430) 10.832 31.216 ( 4.408 0.000 -1.311) 4.599 31.226 ( 1.136 0.000 -7.872) 7.954 31.262 ( -9.300 0.000 -8.220) 12.412 31.509 ( -1.174 0.000 5.202) 5.333 31.683 ( 0.180 0.000 6.714) 6.716 31.763 ( -4.896 0.000 13.543) 14.401 32.336 ( -2.216 0.000 -7.631) 7.946 32.436 ( 4.367 0.000 6.976) 8.230 32.679 ( 13.778 0.000 8.933) 16.421 33.419 ( 8.940 0.000 -6.487) 11.046 ======================= Grid point 41 (19/60) ======================= q-point: ( 0.00 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 0.896 ( 2.208 22.503 20.337) 30.411 1.025 ( 6.959 19.938 28.376) 35.372 1.627 ( -1.308 26.752 43.963) 51.479 2.345 ( 2.152 -19.612 1.616) 19.796 2.500 ( 7.076 -13.178 2.335) 15.139 2.704 ( -2.208 1.669 2.218) 3.547 2.870 ( -1.416 1.950 2.568) 3.522 2.951 ( 1.454 5.146 5.044) 7.351 3.086 ( -0.539 1.979 2.859) 3.519 3.116 ( -0.376 -0.425 6.235) 6.261 3.243 ( -0.994 6.443 -7.078) 9.623 3.403 ( -2.863 6.400 2.581) 7.472 3.432 ( -3.138 9.069 -2.387) 9.889 3.578 ( 1.718 2.221 5.849) 6.488 3.772 ( -2.836 0.442 3.032) 4.175 3.804 ( 1.155 2.696 -4.496) 5.369 3.884 ( 0.433 -1.900 -2.393) 3.087 3.976 ( -0.428 3.925 -3.077) 5.005 4.076 ( 1.692 -2.577 -5.348) 6.173 4.159 ( -1.159 -0.081 -3.798) 3.972 4.280 ( 3.832 -9.537 -2.327) 10.538 4.419 ( -2.724 -0.041 -1.604) 3.161 4.471 ( 5.562 -1.457 -1.357) 5.907 4.555 ( -4.094 -0.550 1.218) 4.306 4.632 ( -2.629 -2.666 0.762) 3.821 4.732 ( -3.118 0.745 7.937) 8.560 4.756 ( -1.583 -5.682 -3.737) 6.983 4.845 ( 5.616 -1.119 0.590) 5.757 4.883 ( 3.132 -0.175 -8.721) 9.268 5.066 ( 8.168 3.257 -2.883) 9.253 5.134 ( -1.644 -2.437 -1.315) 3.220 5.179 ( 2.111 2.546 -0.724) 3.386 5.204 ( 2.355 -6.086 4.231) 7.777 5.426 ( -3.640 -0.357 6.511) 7.468 5.554 ( -1.462 -3.468 1.039) 3.904 5.566 ( 1.576 2.939 3.220) 4.635 5.760 ( 3.075 -5.336 0.363) 6.169 5.870 ( -5.988 -3.134 1.019) 6.835 5.969 ( 0.929 0.054 -5.606) 5.682 6.187 ( -0.728 1.209 -2.337) 2.730 6.216 ( -3.400 -5.601 2.744) 7.104 6.327 ( -3.646 1.484 -3.160) 5.048 6.566 ( -1.301 2.768 4.875) 5.755 7.098 ( 1.363 -3.905 -5.464) 6.853 7.316 ( 0.611 -1.592 2.066) 2.679 7.600 ( -3.366 -8.525 -0.050) 9.165 7.750 ( 3.331 6.708 -6.064) 9.636 7.909 ( -3.432 0.698 -9.354) 9.988 8.076 ( -3.216 -2.287 0.346) 3.961 8.266 ( 0.782 -5.432 -4.116) 6.860 8.544 ( 1.041 5.685 -1.829) 6.062 8.652 ( 0.276 3.269 -3.345) 4.685 8.761 ( 1.235 6.618 -0.932) 6.796 8.824 ( -1.356 0.931 -5.192) 5.446 8.909 ( 1.368 -1.709 -1.517) 2.663 9.053 ( 1.245 -1.844 0.398) 2.260 9.088 ( 1.078 -4.738 -2.297) 5.375 9.225 ( 2.570 -3.358 6.343) 7.623 9.238 ( -0.183 2.000 -2.247) 3.013 9.374 ( 0.982 2.461 4.854) 5.530 9.455 ( 2.076 0.783 2.210) 3.131 9.739 ( -2.284 -3.846 0.187) 4.477 10.036 ( 2.058 0.265 1.427) 2.518 10.157 ( 1.318 0.350 -2.801) 3.116 10.271 ( -2.476 0.209 -1.727) 3.026 10.329 ( -1.353 -5.712 1.029) 5.959 10.446 ( -0.144 3.052 4.752) 5.649 10.598 ( 0.534 1.291 -1.909) 2.366 10.638 ( 3.176 -1.123 5.836) 6.738 10.768 ( 7.366 1.478 -1.199) 7.608 10.850 ( 0.008 -2.467 0.724) 2.571 10.915 ( -5.744 4.197 -1.050) 7.191 10.928 ( -0.784 -1.012 1.521) 1.988 11.008 ( 0.436 4.227 -2.040) 4.714 11.078 ( 3.520 -1.147 -1.198) 3.892 11.156 ( 7.747 1.850 -2.840) 8.456 11.341 ( -10.480 -4.959 2.812) 11.931 11.548 ( 1.125 6.333 0.746) 6.475 11.618 ( -2.197 0.795 7.040) 7.418 11.697 ( 7.470 -5.788 -0.660) 9.474 11.783 ( 5.285 2.310 -2.650) 6.347 11.929 ( 2.436 2.942 2.344) 4.482 12.176 ( -3.857 -4.411 5.052) 7.736 12.252 ( -4.338 -6.540 0.458) 7.862 12.391 ( -12.767 -1.272 -0.614) 12.845 12.469 ( -2.220 -3.020 -2.589) 4.555 12.489 ( 1.484 0.263 2.557) 2.968 12.544 ( 8.125 -0.890 -5.258) 9.718 12.685 ( 7.911 -0.213 -3.307) 8.577 12.740 ( -3.190 -2.667 -2.030) 4.627 12.970 ( 0.735 -10.177 1.211) 10.275 13.063 ( 1.726 -4.260 -1.890) 4.970 13.122 ( -1.872 0.607 1.325) 2.372 13.140 ( -1.599 4.107 -2.440) 5.038 13.227 ( 1.099 -1.995 1.954) 3.001 13.237 ( 3.563 0.580 -1.726) 4.001 13.382 ( 0.047 3.782 0.660) 3.840 13.453 ( -3.027 1.264 1.714) 3.701 13.544 ( -0.082 -0.320 -1.387) 1.425 13.635 ( 2.866 1.356 -0.188) 3.176 13.728 ( -2.314 6.001 4.238) 7.702 13.817 ( 2.168 4.182 2.272) 5.230 13.922 ( 0.794 0.975 -4.244) 4.426 13.997 ( 1.661 9.100 -1.349) 9.348 14.078 ( 3.622 -2.875 0.941) 4.719 14.216 ( -2.024 -2.333 3.195) 4.444 14.296 ( -0.788 2.874 -1.221) 3.220 14.359 ( 1.363 -0.269 -0.102) 1.393 14.411 ( 2.703 -2.157 0.177) 3.462 14.577 ( -0.647 3.149 3.470) 4.731 14.617 ( 6.207 -3.429 13.419) 15.178 14.753 ( 4.879 3.039 1.796) 6.022 14.932 ( 7.712 -2.988 -7.202) 10.967 15.128 ( 0.071 5.526 -15.818) 16.756 15.182 ( 7.637 -4.271 -5.235) 10.196 15.218 ( 3.038 0.169 1.290) 3.305 15.412 ( -6.755 0.581 -1.441) 6.931 15.437 ( -0.337 0.089 -0.750) 0.827 15.562 ( -4.619 1.530 3.650) 6.082 15.682 ( -5.621 -1.460 4.305) 7.229 15.780 ( -4.234 -0.616 -3.242) 5.368 15.904 ( 0.521 2.163 3.619) 4.248 16.137 ( 0.794 2.517 -0.966) 2.810 16.435 ( -3.492 0.421 -1.598) 3.864 16.625 ( 1.239 3.974 3.031) 5.149 16.661 ( 1.512 2.203 2.037) 3.360 16.746 ( -0.999 0.455 4.317) 4.454 16.831 ( -0.534 -4.381 -0.837) 4.492 16.894 ( -3.135 2.810 -0.568) 4.248 16.990 ( 0.600 1.774 -3.164) 3.677 17.073 ( 4.077 -0.501 -1.284) 4.304 17.097 ( 0.056 -1.465 -0.235) 1.485 17.436 ( -1.102 0.076 2.047) 2.326 17.502 ( 1.987 2.150 3.008) 4.197 17.572 ( -0.712 4.511 -2.007) 4.989 17.967 ( -1.023 0.135 2.524) 2.726 18.067 ( 1.222 -3.465 -5.590) 6.690 18.144 ( 0.339 0.448 -1.251) 1.372 18.198 ( 3.489 -1.726 -1.395) 4.135 18.272 ( -0.642 -2.398 -0.606) 2.555 18.426 ( -3.057 1.410 2.232) 4.039 18.536 ( -7.470 -6.833 7.879) 12.829 18.675 ( -0.187 3.012 -1.028) 3.188 18.769 ( -4.839 -0.741 1.789) 5.213 18.805 ( -2.344 1.162 -1.332) 2.936 18.959 ( -9.470 2.695 1.414) 9.946 19.024 ( 3.105 -4.299 -2.299) 5.780 19.270 ( -2.530 -2.997 -3.859) 5.502 27.654 ( -0.572 -0.344 0.707) 0.972 27.664 ( 0.980 -0.623 1.053) 1.567 27.698 ( 1.043 0.952 0.824) 1.635 27.747 ( 0.918 -0.060 0.564) 1.079 27.768 ( 0.620 -0.277 -0.300) 0.742 27.778 ( -0.068 -0.170 -0.716) 0.739 27.850 ( -0.040 0.319 -0.609) 0.689 27.866 ( -0.790 0.030 -0.145) 0.804 29.189 ( 0.297 1.717 3.503) 3.913 29.454 ( 9.414 -11.555 9.391) 17.616 29.595 ( -0.880 2.702 -1.880) 3.408 29.678 ( -0.307 1.394 0.152) 1.435 29.764 ( 1.850 -0.450 -0.532) 1.977 29.845 ( 1.152 -1.588 2.765) 3.391 29.890 ( -5.980 2.933 -1.575) 6.845 29.942 ( 4.045 2.020 1.712) 4.835 30.017 ( 2.216 0.628 2.898) 3.702 30.325 ( -4.286 -9.761 0.062) 10.661 30.556 ( 4.252 5.508 -3.263) 7.685 30.626 ( -0.794 1.138 0.841) 1.623 30.902 ( -2.431 3.439 -5.350) 6.809 30.940 ( -0.084 0.382 -7.606) 7.616 31.061 ( -2.486 0.049 -5.312) 5.866 31.183 ( 1.199 -1.205 -5.503) 5.759 31.340 ( 3.341 1.470 3.359) 4.960 31.435 ( -4.439 -2.631 7.711) 9.278 31.625 ( -4.519 3.237 -2.428) 6.066 31.805 ( 1.310 -2.163 17.600) 17.781 32.225 ( 1.492 -5.921 10.614) 12.245 32.320 ( 0.608 -7.070 6.135) 9.380 33.265 ( -5.318 15.817 -19.578) 25.724 33.525 ( 2.971 -0.412 -9.429) 9.895 ======================= Grid point 42 (20/60) ======================= q-point: ( 0.17 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.075 ( 4.186 18.676 23.302) 30.155 1.445 ( 9.120 23.171 26.469) 36.341 2.155 ( 29.574 11.799 35.477) 47.670 2.431 ( 3.678 -15.283 2.883) 15.982 2.624 ( 1.730 -10.338 1.842) 10.642 2.712 ( 3.742 4.765 -1.170) 6.171 2.810 ( -4.310 3.417 0.450) 5.518 3.003 ( -2.897 -1.043 0.107) 3.081 3.073 ( -0.118 2.106 10.838) 11.041 3.235 ( 6.618 2.224 2.682) 7.479 3.267 ( 5.311 1.878 0.470) 5.653 3.321 ( 0.000 4.663 -2.552) 5.316 3.465 ( 4.123 9.766 2.418) 10.873 3.573 ( -3.360 2.159 -4.575) 6.073 3.739 ( -0.897 -4.097 -0.570) 4.233 3.855 ( 4.890 1.546 -0.862) 5.200 3.919 ( 4.146 -0.707 -6.046) 7.365 3.996 ( 3.354 0.375 -3.956) 5.200 4.062 ( -3.581 -1.007 -7.042) 7.964 4.112 ( 2.096 -0.629 3.505) 4.132 4.331 ( 0.879 -4.092 0.529) 4.218 4.341 ( -0.003 -0.028 -4.658) 4.658 4.455 ( -4.720 1.491 1.643) 5.215 4.489 ( -1.198 -4.848 -0.040) 4.994 4.557 ( -2.316 1.015 -0.144) 2.533 4.687 ( -2.251 -2.225 -3.416) 4.657 4.764 ( -0.125 -3.077 5.852) 6.613 4.892 ( 1.490 0.172 -9.912) 10.025 4.986 ( -0.470 -3.068 1.590) 3.487 5.091 ( 2.511 0.049 -4.943) 5.544 5.174 ( -1.381 -3.270 3.606) 5.060 5.187 ( 3.089 0.194 0.436) 3.125 5.307 ( 2.454 -3.465 1.367) 4.461 5.432 ( -1.161 1.182 9.055) 9.205 5.496 ( -7.261 -5.845 1.694) 9.474 5.575 ( -8.767 4.317 -1.813) 9.939 5.660 ( -1.078 -0.671 4.930) 5.090 5.824 ( 1.867 -5.656 -4.287) 7.338 5.879 ( -4.115 0.892 -6.269) 7.552 6.028 ( -14.031 -0.369 -0.973) 14.070 6.199 ( 1.630 -2.006 2.054) 3.302 6.282 ( 0.598 -0.581 -1.619) 1.821 6.553 ( -3.120 2.250 5.466) 6.683 7.040 ( -4.476 -3.243 -4.922) 7.401 7.317 ( -1.071 -2.677 2.905) 4.093 7.523 ( -3.778 -10.002 -3.636) 11.293 7.734 ( -2.441 5.574 -4.244) 7.418 7.788 ( -1.522 4.200 -7.101) 8.389 7.997 ( -3.016 -4.139 -1.860) 5.449 8.286 ( 1.922 -3.750 -3.351) 5.384 8.536 ( -0.584 3.411 -1.955) 3.975 8.625 ( -0.952 1.308 -2.257) 2.777 8.741 ( -0.309 3.486 -3.819) 5.180 8.824 ( 1.897 4.016 -3.345) 5.560 8.851 ( -5.316 3.518 -2.092) 6.709 9.062 ( -1.704 -5.141 0.055) 5.416 9.079 ( 0.861 3.221 -3.566) 4.881 9.170 ( -2.302 -4.412 -0.320) 4.987 9.270 ( -3.040 -1.295 2.697) 4.265 9.436 ( -0.719 -0.271 6.055) 6.103 9.497 ( 1.085 0.823 3.865) 4.098 9.662 ( -2.932 -4.786 -1.972) 5.949 10.083 ( 0.893 -1.182 0.827) 1.697 10.174 ( 0.713 1.926 -0.919) 2.250 10.204 ( -1.721 -0.762 3.446) 3.927 10.332 ( 0.232 -2.270 1.042) 2.508 10.479 ( 0.174 0.519 4.420) 4.453 10.565 ( -1.662 1.410 -2.201) 3.097 10.710 ( -3.884 -0.903 -1.680) 4.327 10.766 ( -1.203 -2.415 4.132) 4.935 10.826 ( -1.487 -2.693 -1.086) 3.263 10.863 ( -2.438 -1.200 0.926) 2.871 10.913 ( 4.129 0.186 -1.483) 4.391 11.014 ( 0.708 6.304 -0.428) 6.358 11.107 ( -1.459 -2.310 -0.450) 2.769 11.187 ( -3.612 0.964 1.759) 4.132 11.279 ( 3.655 6.837 -3.777) 8.623 11.596 ( 0.022 2.586 -1.321) 2.904 11.612 ( -1.104 -1.723 8.261) 8.510 11.742 ( 1.035 -2.536 -6.285) 6.856 11.810 ( -0.279 -1.723 -1.325) 2.192 11.986 ( -2.226 3.376 1.134) 4.200 12.018 ( -3.101 5.815 -2.423) 7.021 12.143 ( -11.281 -1.991 6.242) 13.046 12.272 ( 0.384 -11.666 4.019) 12.344 12.398 ( -1.279 -4.739 -1.906) 5.266 12.563 ( 4.299 -5.901 -2.257) 7.642 12.639 ( 1.139 0.038 -1.292) 1.723 12.710 ( 1.624 -0.202 -1.054) 1.947 12.799 ( 2.734 -2.697 -4.589) 5.984 12.960 ( -2.492 0.837 -0.684) 2.717 13.025 ( -1.390 -6.266 -1.780) 6.660 13.076 ( -0.143 -0.022 -3.858) 3.861 13.163 ( 1.445 -0.657 0.798) 1.776 13.261 ( -0.604 -3.039 2.518) 3.993 13.286 ( 3.818 1.064 -0.932) 4.071 13.312 ( -5.055 2.634 3.397) 6.636 13.436 ( -1.160 -1.854 2.984) 3.700 13.610 ( 4.452 3.965 -2.264) 6.377 13.682 ( 1.393 8.880 -1.907) 9.189 13.791 ( 3.419 -0.942 4.107) 5.426 13.906 ( 2.807 1.732 0.191) 3.304 13.916 ( 4.422 1.720 -1.403) 4.948 13.992 ( -0.692 8.881 1.129) 8.979 14.109 ( -1.708 -0.228 -2.088) 2.708 14.230 ( 3.440 1.367 3.386) 5.017 14.303 ( -0.332 1.871 1.204) 2.249 14.404 ( 2.617 -2.719 0.886) 3.876 14.490 ( 4.783 -0.326 0.814) 4.863 14.622 ( 2.702 4.523 2.596) 5.874 14.720 ( -2.850 -2.796 5.778) 7.023 14.782 ( -1.773 4.044 1.102) 4.551 14.996 ( 0.964 -0.739 -3.514) 3.719 15.036 ( -1.470 -2.574 -1.676) 3.405 15.177 ( -5.937 1.116 -0.607) 6.072 15.357 ( 8.526 -0.632 -1.592) 8.696 15.430 ( 10.827 -0.938 -5.378) 12.126 15.484 ( 2.577 1.057 -1.100) 2.995 15.540 ( 6.307 0.789 -0.429) 6.371 15.635 ( -1.215 -3.131 1.470) 3.666 15.729 ( -1.147 0.098 -0.243) 1.176 15.867 ( -2.835 3.173 -0.653) 4.305 16.184 ( 2.061 -0.254 -1.731) 2.703 16.318 ( -5.890 0.181 -1.305) 6.035 16.622 ( -4.201 2.575 0.383) 4.942 16.689 ( -0.159 2.459 5.760) 6.265 16.753 ( 0.473 0.712 0.863) 1.215 16.787 ( 1.333 0.379 2.042) 2.468 16.872 ( 1.141 1.265 -2.233) 2.809 17.006 ( 1.792 -3.447 -0.827) 3.972 17.125 ( 0.286 -0.380 2.650) 2.692 17.155 ( 2.270 -0.786 1.309) 2.735 17.480 ( 4.202 3.078 -1.855) 5.529 17.553 ( 1.386 2.541 3.188) 4.306 17.626 ( 4.407 1.402 -0.752) 4.685 17.928 ( -4.797 2.425 -0.234) 5.381 18.006 ( -1.793 -5.776 -0.380) 6.060 18.116 ( -2.068 1.308 -1.683) 2.970 18.225 ( -1.744 -0.405 -2.011) 2.692 18.276 ( -2.185 2.123 1.650) 3.465 18.401 ( -0.764 -0.448 2.056) 2.239 18.447 ( 2.451 -7.955 4.983) 9.701 18.678 ( -0.199 0.741 -0.944) 1.217 18.698 ( -2.904 -0.262 -0.867) 3.042 18.752 ( -1.836 4.265 0.574) 4.679 18.905 ( 1.284 0.128 1.461) 1.950 19.065 ( 1.856 -4.997 -1.726) 5.603 19.172 ( -3.827 -2.920 -3.605) 6.014 27.650 ( -0.165 -0.578 1.217) 1.357 27.670 ( -0.538 -1.369 0.875) 1.712 27.725 ( 0.416 1.264 1.088) 1.719 27.753 ( -0.344 0.298 0.015) 0.455 27.783 ( 1.022 0.400 -0.788) 1.351 27.802 ( 1.912 0.256 -0.424) 1.975 27.840 ( -0.895 0.208 -0.769) 1.199 27.864 ( 1.232 -0.461 0.149) 1.324 29.210 ( -0.399 2.385 3.767) 4.476 29.471 ( -3.792 -4.688 4.991) 7.827 29.614 ( 1.467 3.443 -1.747) 4.130 29.762 ( -3.076 1.569 -3.600) 4.988 29.781 ( 5.682 -2.436 -0.127) 6.184 29.843 ( 5.020 0.058 1.080) 5.135 29.933 ( 4.591 0.235 4.494) 6.429 30.100 ( 8.298 1.286 0.404) 8.407 30.229 ( 3.376 -8.903 1.211) 9.598 30.315 ( 12.070 -2.451 -4.139) 12.993 30.604 ( -1.551 2.789 0.170) 3.196 30.638 ( 3.979 1.389 -0.291) 4.224 30.798 ( -2.490 6.603 -5.542) 8.973 30.857 ( -4.397 -1.193 -6.130) 7.638 31.053 ( 3.098 1.545 -5.484) 6.486 31.159 ( -0.609 1.566 -6.647) 6.856 31.356 ( -4.351 -4.966 8.060) 10.419 31.411 ( -2.250 -2.461 -0.855) 3.442 31.600 ( 5.488 7.543 0.594) 9.347 31.900 ( -1.847 -2.440 18.484) 18.736 32.282 ( -0.965 -5.232 6.867) 8.687 32.383 ( 2.456 -6.778 5.437) 9.030 32.907 ( -17.267 14.931 -9.468) 24.712 33.363 ( -11.411 -3.078 -10.614) 15.885 ======================= Grid point 43 (21/60) ======================= q-point: ( 0.33 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.262 ( 0.012 25.506 18.903) 31.747 1.723 ( 4.638 20.968 29.577) 36.551 2.421 ( -9.523 -0.997 5.365) 10.976 2.605 ( -1.350 -4.439 -0.288) 4.649 2.699 ( 0.994 -8.077 2.923) 8.646 2.796 ( 7.226 3.000 -7.727) 10.996 2.901 ( 0.866 -0.903 -0.667) 1.418 2.985 ( 16.301 2.265 9.331) 18.919 3.192 ( 4.240 -1.793 8.145) 9.356 3.262 ( 2.146 2.611 -2.072) 3.965 3.337 ( 4.019 4.971 -4.860) 8.030 3.404 ( -3.669 -0.986 -7.104) 8.056 3.560 ( 9.133 0.949 3.283) 9.752 3.664 ( 6.383 -2.174 -2.281) 7.118 3.687 ( 5.822 0.577 4.536) 7.403 3.885 ( -6.290 -5.870 -6.597) 10.842 3.911 ( 0.059 2.901 -5.252) 6.001 3.988 ( 6.279 1.338 -6.430) 9.086 4.170 ( 8.825 -0.234 2.854) 9.278 4.225 ( 6.033 -0.963 3.813) 7.202 4.321 ( 1.193 2.111 -3.513) 4.268 4.341 ( -0.013 0.181 0.144) 0.232 4.398 ( -0.597 0.967 -1.689) 2.035 4.519 ( -0.525 8.477 -0.546) 8.511 4.533 ( 2.746 -6.197 1.743) 6.999 4.636 ( 0.041 -4.891 -2.147) 5.342 4.760 ( -3.470 -3.355 4.567) 6.645 4.794 ( -6.772 -5.363 -5.267) 10.117 4.918 ( -5.765 2.917 1.102) 6.554 5.042 ( -16.498 -1.686 1.203) 16.628 5.131 ( -1.629 2.984 -1.790) 3.842 5.149 ( -1.846 0.826 -3.213) 3.797 5.207 ( -2.758 -0.855 3.100) 4.236 5.372 ( -7.285 0.125 3.290) 7.995 5.419 ( -2.471 -2.736 -2.656) 4.544 5.482 ( -4.868 2.118 4.159) 6.744 5.672 ( -3.186 3.691 -5.652) 7.465 5.747 ( -1.498 -0.755 6.244) 6.466 5.792 ( -3.883 0.830 4.833) 6.255 5.874 ( 3.068 -1.629 -6.096) 7.016 6.279 ( 5.839 -6.607 2.221) 9.093 6.352 ( 4.012 -6.138 4.584) 8.648 6.498 ( -4.040 0.672 5.475) 6.838 6.875 ( -8.062 -2.663 -4.318) 9.525 7.332 ( 1.260 -3.729 2.756) 4.805 7.408 ( -4.929 -7.279 -2.077) 9.033 7.665 ( -0.874 3.158 -5.339) 6.264 7.762 ( 1.047 5.405 -3.902) 6.748 7.963 ( 1.537 -2.557 -0.615) 3.046 8.276 ( -1.389 -1.184 -1.451) 2.332 8.499 ( -4.869 -3.226 1.623) 6.061 8.590 ( 0.073 -2.287 -2.679) 3.523 8.713 ( -4.087 5.554 0.234) 6.899 8.753 ( 3.421 1.378 -5.063) 6.264 8.843 ( 1.407 3.694 -3.574) 5.329 9.045 ( 0.391 -3.283 0.184) 3.311 9.077 ( 0.435 7.061 -2.532) 7.514 9.123 ( -2.941 -1.832 0.220) 3.472 9.182 ( -5.789 -0.625 3.578) 6.834 9.409 ( -1.850 -0.530 0.916) 2.131 9.520 ( -1.018 -2.842 2.937) 4.212 9.629 ( 0.601 -2.898 -3.832) 4.842 10.034 ( -6.750 -0.501 2.995) 7.402 10.167 ( 0.536 1.530 -2.422) 2.915 10.244 ( -1.191 -3.598 0.824) 3.879 10.322 ( 0.398 0.180 2.784) 2.819 10.418 ( -6.415 3.077 -0.133) 7.116 10.552 ( 3.925 -3.911 -1.340) 5.701 10.644 ( -0.689 -4.807 -3.032) 5.725 10.772 ( -0.729 -0.890 -0.858) 1.435 10.802 ( -0.156 1.438 -0.624) 1.575 10.883 ( 1.320 -1.605 9.411) 9.638 10.983 ( 2.556 -3.340 -3.197) 5.283 11.028 ( 0.307 9.768 -2.127) 10.002 11.059 ( -0.526 -1.980 -0.431) 2.094 11.133 ( -2.759 1.256 -2.537) 3.953 11.298 ( 0.053 6.685 0.596) 6.712 11.537 ( -6.511 -3.251 -0.070) 7.278 11.575 ( -0.570 2.753 -0.244) 2.822 11.745 ( -2.942 -0.469 0.678) 3.056 11.751 ( -0.492 1.322 -3.461) 3.737 11.945 ( -2.139 1.957 -0.989) 3.064 12.001 ( 1.951 2.906 3.853) 5.205 12.101 ( 3.791 2.797 1.427) 4.923 12.245 ( -4.303 -10.353 4.843) 12.213 12.394 ( -0.275 -4.929 0.139) 4.939 12.610 ( 0.218 -3.998 -0.849) 4.093 12.643 ( 0.800 3.557 0.798) 3.732 12.721 ( 0.079 -0.888 -2.629) 2.776 12.799 ( 1.894 -2.478 -7.525) 8.146 12.918 ( -0.740 1.547 0.488) 1.783 12.994 ( -1.002 -0.091 0.028) 1.006 13.080 ( 0.519 -0.682 -2.815) 2.942 13.167 ( -1.064 -0.331 2.007) 2.296 13.222 ( -3.707 -0.169 2.978) 4.758 13.251 ( -0.575 -6.528 -1.380) 6.697 13.362 ( 1.674 4.437 2.434) 5.331 13.440 ( -0.270 -3.944 3.445) 5.244 13.618 ( -0.630 10.128 -1.311) 10.232 13.736 ( 3.524 5.901 -2.002) 7.159 13.849 ( 0.657 -1.791 0.212) 1.919 13.955 ( 1.823 -3.141 0.430) 3.657 13.997 ( 2.793 7.199 -0.429) 7.734 14.042 ( 3.631 0.936 -0.045) 3.750 14.067 ( -0.585 0.618 -3.695) 3.792 14.280 ( 0.391 1.365 -0.162) 1.429 14.304 ( -0.517 2.844 4.947) 5.730 14.456 ( 1.843 -5.427 1.137) 5.843 14.562 ( -0.656 -1.829 -2.563) 3.217 14.614 ( -2.815 -1.968 4.084) 5.336 14.672 ( 0.836 -0.711 3.942) 4.092 14.820 ( -1.131 0.377 -2.210) 2.511 14.952 ( -1.607 2.291 -1.944) 3.407 15.012 ( 0.587 -0.894 4.435) 4.562 15.177 ( 2.960 6.262 -3.903) 7.950 15.380 ( -2.213 4.111 0.813) 4.739 15.524 ( 2.455 3.669 -2.078) 4.879 15.591 ( 1.877 -0.860 -3.645) 4.189 15.645 ( 2.594 -1.961 -0.946) 3.386 15.684 ( 0.944 -2.566 -3.693) 4.595 15.810 ( 15.312 -0.767 -1.697) 15.425 15.900 ( 6.598 1.002 0.591) 6.700 16.140 ( -4.624 -1.655 -2.321) 5.432 16.221 ( -2.820 -1.564 -0.748) 3.310 16.569 ( -1.745 2.183 3.954) 4.842 16.650 ( -4.185 2.138 4.609) 6.582 16.844 ( 3.970 2.713 2.882) 5.606 16.859 ( 3.716 1.334 0.969) 4.066 16.894 ( 2.112 0.303 -3.006) 3.686 17.024 ( -0.046 -3.716 -0.636) 3.771 17.119 ( -2.675 -1.003 5.792) 6.458 17.186 ( -0.553 -1.095 4.815) 4.969 17.524 ( 1.203 3.181 -3.924) 5.192 17.598 ( 1.605 -0.306 1.344) 2.115 17.686 ( 2.081 0.539 -2.498) 3.295 17.796 ( -4.269 -0.225 -5.138) 6.684 18.031 ( 0.006 -1.901 4.171) 4.584 18.066 ( -0.926 -0.519 3.965) 4.105 18.161 ( -2.944 2.811 -0.611) 4.116 18.249 ( -1.294 1.819 4.354) 4.893 18.419 ( 1.640 -2.581 0.503) 3.099 18.497 ( -2.053 -3.509 3.074) 5.097 18.605 ( -4.787 0.578 -0.452) 4.843 18.688 ( 3.515 -1.309 -3.620) 5.213 18.772 ( 2.501 3.215 -0.907) 4.173 18.972 ( 3.584 -2.710 2.098) 4.959 19.078 ( 0.028 -4.925 -1.005) 5.027 19.108 ( -1.063 -1.850 -0.213) 2.144 27.654 ( -0.340 -1.241 0.661) 1.447 27.661 ( -0.622 -1.630 0.547) 1.828 27.726 ( -0.684 1.029 -0.027) 1.236 27.736 ( -0.746 0.600 -0.445) 1.056 27.798 ( 0.596 0.923 -0.497) 1.206 27.810 ( 0.216 0.936 -0.738) 1.212 27.854 ( 1.539 0.350 -0.301) 1.607 27.891 ( 0.868 -0.704 0.264) 1.148 29.212 ( -1.180 2.321 3.321) 4.220 29.430 ( -2.802 -2.983 2.790) 4.953 29.624 ( 0.308 3.356 -4.342) 5.496 29.700 ( -0.353 1.875 -2.546) 3.181 29.883 ( 3.047 -1.912 -0.468) 3.627 29.970 ( 6.059 0.733 -0.337) 6.113 30.074 ( 6.417 0.166 4.463) 7.818 30.181 ( 0.542 -6.176 -0.505) 6.221 30.327 ( 7.677 1.698 0.633) 7.888 30.527 ( 4.052 1.078 -1.349) 4.404 30.575 ( 0.749 6.551 0.275) 6.600 30.664 ( -3.107 -0.153 -1.782) 3.585 30.744 ( -0.416 0.893 -3.820) 3.945 30.787 ( 2.724 0.250 -2.495) 3.702 31.017 ( -5.673 1.841 -4.345) 7.379 31.130 ( 2.850 2.458 -8.037) 8.875 31.326 ( -1.674 -6.077 7.758) 9.996 31.367 ( 1.348 -1.974 -5.098) 5.631 31.791 ( 9.033 3.259 4.123) 10.451 31.927 ( -4.968 -2.384 17.570) 18.414 32.256 ( -3.146 0.266 3.350) 4.603 32.439 ( -6.238 2.952 -2.955) 7.507 32.603 ( -0.645 -0.925 1.724) 2.060 33.017 ( -15.338 -5.165 -9.292) 18.662 ======================= Grid point 44 (22/60) ======================= q-point: (-0.50 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.236 ( -9.913 32.134 13.526) 36.247 1.812 ( -16.025 18.973 25.057) 35.279 2.315 ( 3.092 1.349 7.815) 8.512 2.558 ( -4.741 -6.629 -2.466) 8.515 2.682 ( -1.304 -9.082 0.756) 9.207 2.878 ( 0.899 7.859 -3.042) 8.475 2.926 ( 3.043 3.283 -1.970) 4.891 3.075 ( -3.324 -8.834 -4.221) 10.340 3.150 ( -10.557 2.681 -6.304) 12.585 3.264 ( 0.403 -4.996 1.263) 5.169 3.416 ( -0.152 3.995 -5.934) 7.155 3.442 ( 4.048 -2.340 -8.169) 9.412 3.551 ( -4.246 2.018 0.584) 4.738 3.673 ( 1.496 -1.062 -6.172) 6.439 3.778 ( 2.915 0.922 -5.466) 6.263 3.913 ( 2.993 -5.234 -2.572) 6.555 3.955 ( 1.928 -0.179 2.799) 3.403 4.091 ( 4.806 -1.398 3.849) 6.314 4.205 ( -7.432 1.585 0.879) 7.650 4.259 ( -9.247 -2.754 0.506) 9.662 4.364 ( 1.874 -2.696 -3.441) 4.756 4.391 ( 3.139 2.019 -1.011) 3.867 4.466 ( -2.338 0.292 -3.333) 4.082 4.493 ( 3.709 -0.860 0.532) 3.844 4.562 ( 3.624 5.078 4.111) 7.471 4.623 ( 2.612 0.631 -0.046) 2.688 4.697 ( -4.019 0.041 4.182) 5.801 4.741 ( 1.481 -1.306 1.379) 2.409 4.813 ( 8.476 1.640 -1.425) 8.750 4.835 ( -2.580 1.308 1.678) 3.344 5.055 ( -3.653 1.238 -1.569) 4.163 5.136 ( -4.791 -0.543 0.846) 4.895 5.156 ( 0.515 -2.006 -4.432) 4.892 5.259 ( 3.188 6.878 -0.168) 7.583 5.319 ( -3.749 3.820 2.742) 6.013 5.492 ( 4.032 -4.612 2.339) 6.557 5.668 ( -0.621 0.475 -4.723) 4.788 5.680 ( -4.065 -1.692 4.078) 6.002 5.807 ( 0.661 5.249 1.940) 5.635 5.964 ( 4.616 -3.917 3.878) 7.189 6.347 ( -4.778 -6.809 6.854) 10.777 6.419 ( 2.059 -6.044 7.982) 10.222 6.543 ( 0.597 -2.611 4.428) 5.175 6.754 ( 3.484 -4.202 -4.498) 7.074 7.327 ( -1.860 -4.621 0.230) 4.986 7.404 ( 4.467 -4.666 2.114) 6.797 7.629 ( -0.205 3.616 -4.733) 5.960 7.796 ( 4.090 4.191 -2.841) 6.508 8.072 ( 7.537 -1.088 2.320) 7.960 8.276 ( 2.839 1.195 1.659) 3.498 8.357 ( -7.269 -4.113 2.638) 8.759 8.614 ( 1.675 -5.002 -1.917) 5.612 8.690 ( 1.160 2.735 -1.127) 3.178 8.798 ( 0.928 3.007 -3.562) 4.753 8.867 ( 4.281 2.545 -4.962) 7.030 9.008 ( -4.020 0.710 3.202) 5.188 9.068 ( -0.074 -0.067 -2.077) 2.079 9.117 ( 2.399 5.690 -2.043) 6.504 9.124 ( -1.156 -2.009 4.861) 5.385 9.384 ( -0.910 -0.452 -0.842) 1.320 9.485 ( -3.189 -1.637 0.004) 3.585 9.625 ( 1.560 -2.126 -5.513) 6.111 9.871 ( -6.412 0.580 0.005) 6.439 10.187 ( -0.769 -7.337 -5.595) 9.259 10.201 ( 1.390 1.906 -2.014) 3.102 10.325 ( -0.151 1.950 2.372) 3.074 10.361 ( -1.277 1.897 2.840) 3.646 10.582 ( -1.366 -2.263 -3.837) 4.659 10.607 ( -1.033 -5.302 -2.714) 6.045 10.759 ( -0.932 -2.271 0.004) 2.455 10.791 ( -0.128 1.202 -1.777) 2.149 10.948 ( -0.028 6.601 -2.326) 6.999 10.971 ( 1.095 -0.920 2.148) 2.581 11.037 ( -0.286 1.164 0.371) 1.254 11.065 ( 0.565 -0.216 -3.907) 3.953 11.095 ( 0.900 -2.712 3.783) 4.741 11.302 ( 1.077 6.632 0.168) 6.721 11.434 ( -5.326 -3.641 1.632) 6.655 11.559 ( -1.062 3.895 0.428) 4.060 11.657 ( -0.057 0.630 1.425) 1.559 11.777 ( 0.565 -0.996 -4.919) 5.050 11.946 ( 3.080 10.305 1.130) 10.814 12.111 ( 5.640 1.441 2.785) 6.453 12.146 ( -2.364 -3.664 2.317) 4.938 12.217 ( -0.758 -8.037 7.350) 10.918 12.370 ( -1.023 -5.599 0.842) 5.754 12.590 ( -1.071 3.143 -1.125) 3.506 12.651 ( -0.600 7.320 0.783) 7.387 12.733 ( 2.296 -1.600 -3.979) 4.865 12.804 ( 3.275 -1.839 -8.347) 9.153 12.914 ( -0.411 0.132 0.172) 0.465 12.981 ( -0.056 -1.443 0.206) 1.459 13.083 ( 1.001 0.936 0.858) 1.617 13.157 ( -1.768 -0.981 5.704) 6.052 13.177 ( -1.887 -4.494 0.101) 4.875 13.250 ( 1.492 -6.591 -2.010) 7.050 13.380 ( -1.214 5.219 2.947) 6.116 13.442 ( -1.814 -2.402 3.513) 4.627 13.592 ( -1.270 9.280 -2.783) 9.772 13.776 ( 0.870 5.678 -0.247) 5.749 13.838 ( -1.016 -1.799 -1.086) 2.334 13.952 ( -1.583 1.987 -2.483) 3.552 14.036 ( 0.121 -3.709 -2.415) 4.428 14.069 ( 4.020 1.322 -2.867) 5.112 14.081 ( -0.248 0.689 3.631) 3.704 14.259 ( -1.519 0.366 -3.263) 3.618 14.319 ( -1.406 2.139 5.672) 6.223 14.485 ( -2.308 -1.510 -4.798) 5.534 14.497 ( 0.678 -3.641 0.065) 3.705 14.605 ( -1.603 -6.220 4.660) 7.936 14.703 ( -2.068 1.262 -1.099) 2.660 14.753 ( -1.375 -1.092 1.393) 2.241 14.887 ( -3.694 0.758 -1.761) 4.162 15.015 ( -2.407 -2.129 -2.530) 4.090 15.207 ( 1.098 6.735 -2.362) 7.221 15.345 ( 0.747 6.794 -4.107) 7.974 15.518 ( -3.290 2.001 -2.491) 4.586 15.562 ( 0.876 4.576 -0.065) 4.660 15.680 ( 4.369 -3.019 -5.917) 7.951 15.760 ( 2.287 0.427 -0.765) 2.449 15.937 ( -6.758 -0.622 -0.077) 6.787 16.035 ( 3.191 -0.778 3.383) 4.715 16.138 ( 8.932 -2.729 -0.838) 9.377 16.234 ( 5.298 -1.634 1.977) 5.886 16.573 ( -1.442 1.829 3.023) 3.816 16.594 ( -2.709 1.667 6.788) 7.497 16.876 ( -1.839 2.942 1.760) 3.890 16.907 ( 0.517 0.803 -0.661) 1.161 16.930 ( 1.510 1.554 -0.724) 2.284 16.979 ( -4.071 -1.705 1.078) 4.543 17.105 ( -1.247 -2.068 4.041) 4.707 17.193 ( -1.323 -1.415 4.717) 5.099 17.502 ( -0.820 3.086 -3.765) 4.937 17.586 ( -2.082 -1.395 -5.004) 5.596 17.701 ( 0.930 -1.950 -0.699) 2.271 17.763 ( 3.050 -1.118 -4.378) 5.452 18.026 ( -0.301 0.163 4.220) 4.234 18.098 ( -1.535 1.113 0.781) 2.051 18.137 ( 0.500 0.296 7.367) 7.389 18.268 ( 0.367 1.225 4.762) 4.931 18.437 ( -0.979 -1.524 1.365) 2.268 18.488 ( 1.159 -1.223 0.661) 1.810 18.538 ( 0.161 1.371 -0.428) 1.445 18.751 ( 3.082 -1.329 -1.184) 3.559 18.814 ( 1.526 2.420 0.113) 2.863 19.054 ( 0.748 -6.761 1.823) 7.042 19.057 ( 0.753 -1.698 0.062) 1.859 19.124 ( 1.953 -1.486 1.893) 3.099 27.637 ( -1.073 -1.131 -0.459) 1.626 27.649 ( -0.689 -1.461 -0.212) 1.629 27.706 ( -0.642 1.042 -0.788) 1.456 27.726 ( -0.087 0.400 -0.759) 0.863 27.806 ( 0.423 0.785 -0.080) 0.895 27.824 ( 0.911 0.835 0.522) 1.341 27.864 ( -0.322 0.517 -0.810) 1.013 27.897 ( -0.285 -0.536 -0.188) 0.635 29.203 ( -1.252 1.815 2.990) 3.715 29.372 ( -3.632 -2.066 0.016) 4.179 29.593 ( 0.098 2.492 -5.189) 5.757 29.701 ( 1.086 0.269 -3.074) 3.271 29.902 ( -0.509 0.281 0.598) 0.834 30.033 ( -1.092 3.739 -1.813) 4.297 30.157 ( -0.747 -5.025 2.031) 5.471 30.205 ( 0.204 -3.073 0.215) 3.087 30.458 ( 2.533 2.556 0.698) 3.666 30.505 ( -1.455 5.202 1.858) 5.712 30.544 ( -4.060 3.467 0.315) 5.348 30.654 ( 2.575 0.457 -2.894) 3.900 30.757 ( 3.465 3.931 0.583) 5.272 30.846 ( -5.103 0.640 -6.294) 8.128 30.890 ( 6.166 -0.908 -0.559) 6.257 31.168 ( 4.694 1.626 -6.906) 8.507 31.369 ( 1.108 -7.992 5.306) 9.657 31.400 ( 3.237 -4.452 -2.788) 6.170 31.833 ( -8.496 -0.045 7.033) 11.029 31.956 ( -1.088 -0.097 11.443) 11.495 32.133 ( -9.168 2.912 -3.613) 10.275 32.374 ( 8.906 7.443 3.534) 12.133 32.647 ( -11.238 -6.041 -4.061) 13.389 32.845 ( 13.323 -5.328 -1.979) 14.485 ======================= Grid point 45 (23/60) ======================= q-point: (-0.33 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.063 ( -12.126 28.804 11.604) 33.337 1.528 ( -20.902 18.800 26.038) 38.319 2.254 ( -21.929 0.676 -5.007) 22.504 2.478 ( -10.895 -3.313 -3.039) 11.786 2.542 ( -9.104 -11.566 4.344) 15.347 2.705 ( -4.901 4.626 0.439) 6.754 2.894 ( -1.042 1.247 0.477) 1.694 2.921 ( -4.195 -2.591 -0.527) 4.958 3.071 ( 3.369 1.633 0.105) 3.745 3.219 ( -4.994 -1.534 -3.730) 6.419 3.325 ( 1.807 7.069 -1.303) 7.412 3.512 ( 1.091 -1.651 1.589) 2.538 3.587 ( -0.371 5.839 2.651) 6.423 3.718 ( 3.201 1.058 -1.410) 3.654 3.749 ( -5.342 2.081 -8.604) 10.340 3.900 ( 1.865 3.633 -4.845) 6.336 3.919 ( -3.013 -4.583 3.284) 6.393 3.985 ( -8.423 -1.869 -3.497) 9.310 4.100 ( -2.694 0.435 2.123) 3.457 4.124 ( -2.174 1.767 -1.487) 3.172 4.299 ( -1.916 -2.859 -2.694) 4.371 4.363 ( -3.886 -1.460 0.888) 4.245 4.480 ( -3.909 0.657 -1.720) 4.321 4.510 ( -0.890 0.312 1.203) 1.529 4.581 ( 9.960 1.619 -4.581) 11.082 4.669 ( 1.197 2.786 5.436) 6.225 4.713 ( 0.337 6.336 -1.037) 6.429 4.916 ( -0.845 -5.687 6.185) 8.445 4.949 ( 6.036 -5.136 -4.398) 9.064 4.989 ( 5.278 -3.910 -4.867) 8.175 5.056 ( 5.152 -7.000 -3.253) 9.280 5.102 ( 2.402 -3.155 -3.216) 5.105 5.145 ( 6.310 1.220 0.596) 6.455 5.311 ( 1.983 1.102 1.541) 2.743 5.468 ( 11.260 3.706 1.681) 11.973 5.567 ( 3.076 -0.383 0.482) 3.137 5.621 ( -0.241 -1.216 3.073) 3.313 5.677 ( 0.454 1.892 2.735) 3.356 5.858 ( 3.328 3.467 -0.207) 4.810 5.994 ( -0.852 -1.057 1.463) 1.996 6.325 ( -2.945 -7.091 11.051) 13.456 6.468 ( -1.220 -4.103 6.257) 7.581 6.516 ( -1.181 2.724 4.768) 5.617 6.916 ( 9.489 -7.314 -4.460) 12.784 7.318 ( -0.711 -3.212 1.380) 3.567 7.532 ( 6.412 -1.357 0.043) 6.554 7.624 ( 2.646 1.111 -2.870) 4.058 7.887 ( 5.822 3.405 -2.381) 7.152 8.173 ( -2.898 -2.313 3.008) 4.775 8.303 ( 3.194 -6.605 -1.625) 7.514 8.408 ( 6.811 3.408 1.945) 7.860 8.621 ( 0.095 -1.271 -1.614) 2.057 8.705 ( 1.416 5.619 -3.218) 6.628 8.787 ( 1.848 3.025 -4.340) 5.604 8.910 ( 1.420 2.109 -2.575) 3.618 8.993 ( 1.489 -1.333 0.858) 2.175 9.077 ( 2.007 -2.991 -2.678) 4.488 9.104 ( -2.593 -0.109 3.285) 4.186 9.196 ( 4.071 3.224 0.270) 5.200 9.352 ( -2.379 0.370 0.946) 2.587 9.411 ( -1.826 0.458 -2.791) 3.367 9.645 ( 2.655 -2.936 -2.526) 4.695 9.883 ( 8.255 0.475 -1.144) 8.348 10.079 ( -4.808 -0.583 -1.403) 5.042 10.245 ( 2.803 -4.074 -1.984) 5.329 10.374 ( 2.850 2.576 1.184) 4.020 10.402 ( 2.662 1.904 4.061) 5.216 10.509 ( -4.086 -3.789 -5.637) 7.926 10.536 ( -0.723 -1.364 -3.584) 3.902 10.704 ( -3.194 -1.848 -1.795) 4.104 10.801 ( 0.395 -1.831 0.631) 1.976 10.918 ( 0.063 0.971 -7.711) 7.772 10.978 ( 1.264 7.182 -2.943) 7.864 11.050 ( 0.749 -1.528 -2.050) 2.665 11.081 ( -0.242 2.954 4.227) 5.163 11.125 ( -0.449 -2.534 5.120) 5.730 11.309 ( -1.873 -1.926 0.485) 2.730 11.418 ( 4.724 7.369 0.927) 8.802 11.535 ( -0.810 6.535 1.494) 6.752 11.691 ( 0.834 -4.751 -5.000) 6.947 11.741 ( -1.451 -1.644 -0.005) 2.193 12.047 ( 1.576 7.918 6.168) 10.160 12.094 ( -2.241 -2.363 5.570) 6.453 12.212 ( -0.849 -10.716 3.834) 11.413 12.245 ( 4.819 1.764 3.800) 6.385 12.415 ( 3.497 -4.003 2.021) 5.687 12.553 ( -1.367 5.689 -2.374) 6.314 12.641 ( -0.083 2.626 -2.235) 3.450 12.726 ( -2.202 1.518 0.239) 2.685 12.845 ( 4.468 -0.995 -9.751) 10.772 12.920 ( 2.357 -1.199 -3.449) 4.347 13.001 ( 1.809 -0.598 -0.380) 1.943 13.123 ( 0.890 0.141 4.318) 4.411 13.145 ( -1.266 -6.012 0.572) 6.171 13.174 ( 1.156 1.382 4.551) 4.895 13.272 ( -0.322 -3.387 -1.225) 3.616 13.369 ( 0.337 4.400 5.372) 6.952 13.381 ( -5.132 -2.895 1.082) 5.991 13.549 ( -0.606 8.142 -2.469) 8.529 13.752 ( -3.474 1.206 -0.145) 3.681 13.796 ( -3.281 -2.114 2.023) 4.396 13.921 ( 0.067 7.832 -2.936) 8.364 13.962 ( -4.869 2.806 -1.001) 5.708 14.085 ( -1.381 -3.039 4.804) 5.849 14.137 ( -0.394 -3.372 -5.717) 6.649 14.190 ( -1.592 -0.496 -1.744) 2.413 14.319 ( -0.307 3.958 3.918) 5.578 14.405 ( -1.031 1.667 -7.409) 7.664 14.486 ( -2.120 -2.640 0.080) 3.387 14.557 ( -6.118 -1.354 -6.022) 8.691 14.605 ( -3.562 -7.818 7.443) 11.367 14.738 ( 0.619 -3.085 -6.016) 6.789 14.845 ( -2.552 2.637 4.590) 5.876 14.965 ( 2.037 -3.573 -3.337) 5.296 15.161 ( -2.431 3.462 -5.528) 6.961 15.341 ( -0.886 1.915 -6.707) 7.031 15.462 ( 0.912 1.021 -3.751) 3.993 15.605 ( 1.195 8.338 4.767) 9.679 15.674 ( -3.111 -0.082 -3.938) 5.019 15.695 ( -5.827 0.418 -2.157) 6.228 15.850 ( 0.449 0.213 1.212) 1.310 16.093 ( -2.038 -0.516 8.792) 9.040 16.258 ( 1.560 0.841 -0.343) 1.805 16.379 ( 5.688 0.576 3.138) 6.522 16.506 ( -3.440 0.742 0.335) 3.535 16.644 ( 1.703 -1.639 6.994) 7.382 16.829 ( -3.194 0.891 1.139) 3.506 16.852 ( -5.349 -0.909 1.034) 5.524 16.912 ( 0.850 2.612 -1.135) 2.972 16.967 ( 0.842 1.886 -0.613) 2.154 17.083 ( -2.634 -1.785 1.168) 3.389 17.179 ( -1.935 -1.305 2.828) 3.667 17.467 ( -0.589 2.293 -2.549) 3.479 17.511 ( -1.965 -0.634 -4.412) 4.871 17.704 ( -0.368 -2.649 -2.210) 3.469 17.831 ( 5.570 -1.871 -3.708) 6.948 18.057 ( 0.401 1.352 4.069) 4.306 18.071 ( -1.546 1.554 2.182) 3.093 18.182 ( 0.260 -0.892 5.371) 5.450 18.296 ( -0.221 -0.872 3.719) 3.826 18.470 ( 3.222 -1.754 1.018) 3.807 18.494 ( 0.568 -0.049 -1.312) 1.431 18.597 ( 2.821 1.450 2.293) 3.914 18.796 ( 1.630 -0.665 0.979) 2.014 18.836 ( 0.729 1.894 0.574) 2.109 19.011 ( -2.249 -4.031 -0.816) 4.688 19.127 ( 1.962 -4.184 4.410) 6.387 19.203 ( 4.269 -1.644 1.946) 4.971 27.618 ( -0.234 -0.592 -0.340) 0.721 27.638 ( 0.021 -1.327 -0.389) 1.383 27.692 ( -0.256 1.072 -0.808) 1.367 27.723 ( 0.248 0.128 -1.078) 1.114 27.805 ( -0.545 0.581 -0.217) 0.826 27.834 ( -1.588 0.615 -0.699) 1.841 27.852 ( 0.849 0.250 0.900) 1.262 27.881 ( -0.905 -0.426 -0.379) 1.069 29.194 ( -1.254 1.113 2.953) 3.396 29.289 ( -3.546 -0.817 -1.176) 3.824 29.587 ( 1.557 2.248 -3.168) 4.185 29.706 ( 1.435 -2.017 -3.819) 4.551 29.881 ( -3.305 1.675 2.066) 4.242 29.931 ( -4.778 3.357 -1.828) 6.119 30.031 ( -9.560 -0.384 -0.288) 9.572 30.214 ( -0.575 -6.701 0.789) 6.772 30.311 ( -11.523 3.115 0.579) 11.951 30.498 ( 0.469 6.731 -1.991) 7.035 30.584 ( 2.642 0.435 1.427) 3.034 30.632 ( -5.947 -5.374 -2.637) 8.438 30.793 ( 5.158 2.212 -2.813) 6.278 30.877 ( 6.748 5.849 -2.295) 9.221 31.040 ( 6.598 -1.741 0.907) 6.884 31.228 ( 3.935 -0.027 -6.382) 7.498 31.386 ( -3.370 -10.401 0.759) 10.960 31.437 ( 2.275 -3.314 -1.202) 4.196 31.680 ( -6.988 3.756 7.858) 11.167 31.892 ( -8.669 5.178 6.916) 12.239 32.050 ( -0.243 -10.688 6.890) 12.719 32.422 ( -7.137 -5.986 -3.621) 9.994 32.696 ( 19.174 15.481 0.871) 24.659 33.164 ( 16.396 -2.880 -3.506) 17.013 ======================= Grid point 46 (24/60) ======================= q-point: (-0.17 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 0.917 ( -8.741 23.794 16.020) 29.986 1.170 ( -28.305 14.234 15.661) 35.342 1.650 ( -23.204 26.997 28.510) 45.608 2.345 ( -1.033 -16.888 -3.468) 17.272 2.428 ( -3.058 -16.652 1.919) 17.039 2.708 ( 0.017 5.318 3.937) 6.617 2.880 ( -1.516 0.444 2.267) 2.763 2.916 ( 0.822 2.757 2.568) 3.856 3.098 ( -0.245 3.517 -0.283) 3.537 3.111 ( -2.772 -0.673 1.596) 3.269 3.365 ( -3.290 10.311 0.969) 10.867 3.431 ( -5.450 3.815 -3.852) 7.687 3.523 ( -0.340 0.099 4.735) 4.749 3.577 ( -7.475 6.090 0.884) 9.682 3.769 ( -0.202 1.875 -0.345) 1.918 3.822 ( -2.163 4.519 -0.378) 5.024 3.928 ( -0.360 -3.377 -1.770) 3.830 4.055 ( -1.519 3.172 -4.924) 6.051 4.076 ( 4.472 0.060 -4.881) 6.620 4.108 ( 6.223 0.097 1.927) 6.515 4.233 ( -2.602 2.530 -1.673) 3.997 4.290 ( 2.846 -8.860 -1.710) 9.462 4.464 ( 0.202 -0.234 0.784) 0.843 4.541 ( 1.827 -1.432 2.817) 3.650 4.684 ( 0.505 4.100 -1.186) 4.298 4.731 ( -1.512 -0.664 6.218) 6.434 4.762 ( 5.569 -2.322 -4.902) 7.774 4.869 ( -4.418 -7.754 -6.967) 11.322 4.904 ( 2.770 2.285 0.457) 3.620 4.993 ( -1.078 -1.973 -9.284) 9.552 5.061 ( 1.637 -2.508 -0.692) 3.073 5.199 ( -1.172 -4.569 0.880) 4.799 5.205 ( 1.025 -1.931 0.770) 2.318 5.466 ( 8.851 -3.307 -3.017) 9.918 5.508 ( -5.621 3.390 3.064) 7.245 5.591 ( -4.175 -4.524 8.029) 10.117 5.684 ( 3.864 -1.342 2.710) 4.907 5.825 ( 8.844 2.548 -1.416) 9.312 5.904 ( 4.964 -2.772 -2.633) 6.266 6.103 ( 7.958 3.676 -0.088) 8.766 6.287 ( -5.111 -5.133 6.360) 9.640 6.430 ( -4.665 -1.330 2.214) 5.332 6.551 ( 0.517 3.004 4.566) 5.490 7.049 ( 6.101 -6.529 -5.396) 10.439 7.298 ( -0.997 -0.563 1.719) 2.066 7.637 ( 2.243 -3.733 0.007) 4.355 7.683 ( 4.341 3.931 -4.496) 7.383 7.970 ( 2.626 0.760 -6.129) 6.711 8.105 ( -2.240 -1.663 1.967) 3.413 8.313 ( -1.667 -9.093 -3.717) 9.963 8.511 ( 2.859 5.368 -0.068) 6.082 8.630 ( 2.433 3.474 -2.152) 4.756 8.727 ( 2.192 8.490 -2.438) 9.101 8.836 ( 3.762 0.180 -3.625) 5.227 8.908 ( -0.751 -1.420 -4.726) 4.992 9.030 ( -0.150 -1.906 2.864) 3.444 9.073 ( 0.810 0.020 -1.171) 1.424 9.122 ( 3.522 -2.529 1.069) 4.466 9.248 ( 1.168 1.179 -2.508) 3.008 9.336 ( -0.090 2.912 5.501) 6.225 9.405 ( 1.682 -0.218 -0.646) 1.815 9.718 ( 3.733 -2.520 0.886) 4.590 10.002 ( 0.470 0.852 0.092) 0.977 10.107 ( 7.051 0.848 -0.882) 7.156 10.283 ( 0.610 -1.805 0.660) 2.016 10.362 ( -1.959 -5.532 -0.464) 5.887 10.448 ( -1.039 3.590 0.515) 3.772 10.511 ( 4.738 -0.307 2.470) 5.352 10.575 ( 7.081 1.395 1.432) 7.358 10.633 ( -1.340 -2.587 -4.461) 5.328 10.817 ( 0.888 -3.641 1.769) 4.144 10.903 ( 2.582 -1.197 -4.969) 5.726 11.003 ( 2.195 10.394 -3.181) 11.089 11.029 ( -3.173 5.776 -3.470) 7.448 11.060 ( -0.759 2.580 2.150) 3.443 11.100 ( -2.552 -3.684 -1.710) 4.797 11.400 ( 8.767 1.411 6.455) 10.978 11.473 ( 1.081 2.864 4.375) 5.339 11.594 ( -4.900 -2.093 -5.415) 7.597 11.617 ( 3.413 2.807 2.914) 5.294 11.716 ( -0.594 0.952 -0.797) 1.377 11.960 ( -6.281 -2.066 4.835) 8.191 12.209 ( -1.035 -8.144 4.642) 9.431 12.235 ( 4.832 -0.195 4.195) 6.402 12.364 ( 5.769 2.699 3.000) 7.041 12.448 ( -2.084 1.799 3.638) 4.562 12.570 ( 5.160 -1.644 -3.669) 6.541 12.597 ( -2.888 1.301 -5.787) 6.597 12.639 ( -7.224 1.004 1.016) 7.363 12.835 ( -1.497 -2.470 -8.360) 8.844 12.945 ( 1.139 -5.613 -1.994) 6.065 13.066 ( 4.450 2.537 -4.715) 6.962 13.106 ( -2.334 -5.779 4.065) 7.441 13.160 ( 0.452 1.025 2.256) 2.519 13.194 ( -2.810 4.360 0.863) 5.258 13.216 ( -0.867 -5.898 2.769) 6.573 13.329 ( 1.758 3.978 -0.107) 4.351 13.487 ( 2.632 1.671 1.719) 3.560 13.566 ( 4.130 1.976 -0.155) 4.580 13.636 ( -6.186 -2.322 -0.751) 6.650 13.783 ( 1.887 4.505 5.374) 7.262 13.843 ( -4.420 5.073 -2.613) 7.217 13.901 ( -5.414 8.528 2.756) 10.470 13.991 ( -2.825 2.496 -2.935) 4.778 14.057 ( -2.865 1.538 0.027) 3.252 14.191 ( 0.234 -7.223 2.898) 7.786 14.340 ( 0.546 -0.614 -1.584) 1.785 14.371 ( -0.416 4.749 -4.212) 6.362 14.403 ( -3.847 -3.397 -0.070) 5.133 14.477 ( 0.677 -2.039 2.936) 3.638 14.588 ( -1.713 -5.816 4.674) 7.656 14.741 ( -2.621 4.154 2.123) 5.351 14.809 ( 5.906 -2.180 -9.946) 11.771 15.069 ( 6.412 -4.033 0.224) 7.579 15.119 ( 2.699 0.827 -3.780) 4.718 15.233 ( -3.312 -2.067 -11.048) 11.718 15.474 ( 0.661 1.183 -4.848) 5.034 15.538 ( -5.829 2.109 1.613) 6.406 15.602 ( -2.628 2.853 1.410) 4.127 15.703 ( 2.163 4.860 7.141) 8.905 15.869 ( 0.485 2.675 -5.649) 6.269 15.982 ( -11.804 0.610 8.817) 14.746 16.194 ( -5.180 1.712 -1.042) 5.554 16.473 ( 0.318 1.671 0.083) 1.703 16.515 ( 4.572 2.651 3.227) 6.193 16.689 ( -1.929 -2.030 5.202) 5.908 16.767 ( -3.236 -0.014 3.567) 4.816 16.794 ( 0.432 -3.139 0.650) 3.234 16.946 ( 1.745 3.156 -2.365) 4.312 16.977 ( 1.020 1.594 -2.746) 3.335 17.025 ( -1.102 -0.680 -1.423) 1.924 17.147 ( -2.367 -1.362 0.917) 2.881 17.457 ( 0.148 -0.054 -1.507) 1.515 17.466 ( -0.832 0.520 0.959) 1.371 17.655 ( -2.984 0.168 -3.960) 4.961 17.930 ( 4.544 -2.066 -1.458) 5.200 18.054 ( 0.326 0.966 -1.620) 1.914 18.094 ( 1.533 0.275 2.691) 3.109 18.201 ( -0.787 -0.492 2.404) 2.577 18.294 ( -1.247 -2.798 1.246) 3.307 18.479 ( -1.975 0.557 0.142) 2.057 18.538 ( 1.651 -3.966 2.969) 5.222 18.657 ( 2.129 3.033 0.632) 3.760 18.809 ( -1.361 -0.643 2.852) 3.225 18.865 ( 0.293 -0.872 -1.583) 1.831 18.978 ( 0.941 -3.822 -1.380) 4.171 19.150 ( -4.087 -4.277 3.533) 6.891 19.285 ( 2.372 -2.253 -0.637) 3.333 27.629 ( 1.266 -0.382 0.487) 1.409 27.648 ( 0.806 -1.046 0.287) 1.351 27.687 ( 0.057 0.913 -0.150) 0.927 27.727 ( 0.660 -0.141 -0.491) 0.834 27.779 ( -1.371 0.165 -0.572) 1.495 27.799 ( -1.287 0.492 -0.413) 1.438 27.860 ( -0.523 -0.052 -0.374) 0.645 27.872 ( 0.111 0.044 0.583) 0.595 29.179 ( -1.264 1.044 2.249) 2.783 29.259 ( 1.346 -1.094 4.924) 5.221 29.614 ( 1.386 3.040 -0.806) 3.437 29.712 ( -0.295 -2.082 -3.700) 4.256 29.787 ( -1.318 -1.213 -0.702) 1.924 29.843 ( -7.085 -0.440 0.183) 7.101 29.901 ( -0.642 3.141 3.005) 4.394 30.075 ( -10.174 2.907 -0.317) 10.586 30.145 ( -7.518 -5.777 -1.392) 9.583 30.453 ( -8.195 -9.301 0.560) 12.409 30.512 ( 2.019 7.103 -5.244) 9.057 30.624 ( 0.524 0.342 1.391) 1.525 30.883 ( 4.336 0.504 -4.140) 6.016 30.976 ( 3.121 3.800 -4.647) 6.765 31.127 ( 1.689 -3.335 -3.203) 4.922 31.222 ( -3.516 -2.084 -3.074) 5.114 31.289 ( 0.603 0.390 -5.922) 5.966 31.470 ( -1.753 -3.645 6.173) 7.380 31.684 ( 0.414 -0.422 15.383) 15.395 31.748 ( -6.883 1.860 0.780) 7.172 32.121 ( 1.189 -8.271 13.964) 16.273 32.318 ( -2.090 -5.383 -0.712) 5.818 33.130 ( 22.628 18.950 -7.980) 30.575 33.417 ( 9.864 -0.224 -6.700) 11.926 ======================= Grid point 47 (25/60) ======================= q-point: ( 0.00 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.413 ( 0.075 26.407 10.279) 28.337 1.477 ( 9.314 27.203 17.258) 33.535 1.904 ( 1.389 -24.340 7.081) 25.387 1.989 ( 6.224 -15.768 11.585) 20.532 2.303 ( 0.194 17.684 20.047) 26.733 2.667 ( -1.685 -9.776 8.636) 13.153 2.919 ( 0.611 2.197 -0.363) 2.309 2.977 ( 0.761 -2.758 -1.020) 3.037 3.114 ( -1.197 2.287 8.365) 8.755 3.150 ( -0.936 1.461 5.435) 5.705 3.383 ( -2.093 7.926 -1.566) 8.346 3.492 ( -2.404 3.351 -2.044) 4.603 3.563 ( 0.834 -0.103 5.156) 5.224 3.653 ( -1.414 1.674 -4.298) 4.824 3.745 ( -0.230 1.589 0.466) 1.672 3.825 ( -0.208 -1.061 -2.910) 3.104 3.908 ( -1.699 3.471 -3.324) 5.097 4.001 ( -0.625 -5.484 -4.698) 7.248 4.105 ( -0.109 6.748 -4.255) 7.978 4.159 ( 3.544 -1.202 -3.423) 5.072 4.171 ( -1.807 3.244 -2.402) 4.422 4.349 ( -1.837 -8.352 -6.036) 10.467 4.490 ( -0.076 1.939 6.268) 6.562 4.543 ( 2.957 -3.301 -0.240) 4.438 4.598 ( -0.312 0.933 -0.623) 1.165 4.646 ( -4.375 0.565 3.779) 5.808 4.730 ( 0.263 -0.766 1.576) 1.772 4.810 ( 0.067 -2.671 0.000) 2.672 4.888 ( 1.501 -0.280 -3.349) 3.681 4.954 ( 0.267 -9.274 1.529) 9.403 5.139 ( 2.785 3.406 0.258) 4.407 5.188 ( 2.558 -1.497 0.680) 3.041 5.231 ( 4.538 6.190 -4.232) 8.765 5.405 ( 4.360 -9.089 -6.989) 12.266 5.502 ( -2.919 4.495 5.359) 7.579 5.579 ( -0.207 -1.339 2.705) 3.026 5.719 ( -2.183 1.086 4.095) 4.765 5.787 ( -5.238 -4.765 3.048) 7.709 5.976 ( 1.203 1.839 1.442) 2.628 6.072 ( -1.015 -7.590 5.662) 9.524 6.234 ( -3.821 3.286 -3.982) 6.423 6.294 ( -4.545 -2.709 -3.406) 6.293 6.733 ( 2.482 11.489 -5.007) 12.776 6.955 ( 3.478 -10.327 -6.807) 12.849 7.330 ( -2.545 3.640 3.849) 5.877 7.443 ( -4.929 -7.276 2.905) 9.256 7.868 ( 2.398 4.296 -7.490) 8.961 7.908 ( -1.576 -0.605 -7.976) 8.153 8.057 ( -2.966 1.400 -0.917) 3.405 8.142 ( 1.052 -6.387 -2.850) 7.072 8.647 ( 1.439 4.090 -2.349) 4.931 8.685 ( 0.050 0.246 -2.614) 2.626 8.835 ( -0.782 2.107 -2.044) 3.038 8.885 ( 3.377 -2.322 -0.315) 4.111 8.929 ( -0.240 7.310 -3.634) 8.167 9.015 ( 1.452 -2.342 -3.657) 4.579 9.034 ( 1.104 0.422 -2.929) 3.159 9.119 ( 0.798 -6.324 1.578) 6.567 9.324 ( -0.278 5.032 1.277) 5.199 9.383 ( 1.377 -1.118 3.636) 4.045 9.508 ( 0.427 4.870 1.371) 5.077 9.637 ( -2.547 -6.757 -1.196) 7.320 10.064 ( 1.168 2.896 -1.136) 3.323 10.137 ( 0.094 -3.460 -3.521) 4.938 10.242 ( -0.539 -0.270 2.171) 2.253 10.269 ( 1.077 -1.979 1.998) 3.011 10.525 ( -0.916 5.363 4.466) 7.039 10.621 ( 1.533 -2.286 4.262) 5.074 10.659 ( 3.396 4.532 0.860) 5.729 10.724 ( 4.112 -2.809 0.213) 4.984 10.780 ( 2.498 -2.860 -0.594) 3.844 10.836 ( 0.285 -6.503 -1.174) 6.614 10.993 ( -8.709 2.527 0.700) 9.095 11.032 ( -4.391 -1.287 0.401) 4.593 11.151 ( 0.685 6.974 -1.225) 7.114 11.258 ( -4.944 -3.633 3.106) 6.877 11.318 ( 6.925 10.424 -0.944) 12.550 11.519 ( 6.092 -9.594 1.955) 11.532 11.664 ( 1.414 5.871 2.487) 6.531 11.712 ( -1.354 7.898 4.078) 8.991 11.768 ( 2.707 -3.645 -0.113) 4.542 11.896 ( 2.179 -8.528 5.229) 10.239 12.118 ( 0.487 2.149 0.452) 2.249 12.211 ( -3.367 -4.367 3.148) 6.350 12.346 ( -9.768 1.441 -7.859) 12.620 12.422 ( -6.678 -3.692 -6.940) 10.314 12.506 ( -2.563 2.926 1.560) 4.191 12.547 ( 4.194 -0.614 -3.378) 5.420 12.677 ( 0.960 2.093 -2.560) 3.443 12.754 ( -2.186 -2.607 2.141) 4.020 12.818 ( 1.727 1.117 -4.273) 4.743 12.941 ( 3.344 -7.487 -1.759) 8.386 13.118 ( -0.837 0.450 3.415) 3.545 13.159 ( 0.918 -3.613 3.390) 5.039 13.223 ( -0.649 2.123 -3.157) 3.859 13.242 ( 1.874 -0.227 -1.819) 2.621 13.439 ( -1.701 1.840 -1.506) 2.924 13.464 ( -2.973 -0.710 -0.467) 3.092 13.574 ( 3.647 4.050 1.660) 5.698 13.640 ( 4.523 -1.467 2.187) 5.234 13.831 ( -1.648 3.372 0.056) 3.754 13.872 ( -0.022 -0.007 0.037) 0.044 13.970 ( 0.554 3.413 1.531) 3.781 14.018 ( 0.974 -2.376 2.741) 3.756 14.129 ( 2.501 4.834 -1.767) 5.722 14.208 ( 1.374 -1.479 3.611) 4.137 14.312 ( 0.727 2.615 0.671) 2.796 14.369 ( 0.034 -0.281 2.263) 2.280 14.404 ( 2.537 1.788 -0.702) 3.182 14.499 ( 2.904 -6.798 9.432) 11.984 14.691 ( 1.302 5.832 2.928) 6.655 14.783 ( 2.371 -2.379 -3.147) 4.603 14.923 ( 9.465 4.763 -1.646) 10.723 15.060 ( 9.144 -7.043 -5.845) 12.938 15.188 ( 2.931 0.881 -2.939) 4.243 15.207 ( 6.066 -1.242 -4.668) 7.754 15.460 ( -8.719 3.529 -1.435) 9.514 15.476 ( -7.021 2.656 -0.806) 7.549 15.567 ( -3.474 -0.468 1.558) 3.836 15.614 ( -2.730 -4.669 -2.027) 5.776 15.786 ( -5.100 2.302 4.685) 7.298 15.858 ( -3.455 -4.357 7.797) 9.577 16.262 ( -0.374 7.901 -6.652) 10.335 16.394 ( -2.421 -4.798 -5.677) 7.817 16.665 ( 0.600 2.028 2.839) 3.540 16.719 ( -0.352 0.488 2.403) 2.477 16.720 ( 3.121 -1.097 4.153) 5.309 16.763 ( -1.198 -1.999 4.697) 5.244 16.950 ( -3.952 2.543 0.876) 4.781 16.995 ( -3.749 -1.692 0.666) 4.167 17.066 ( 4.439 0.052 -2.580) 5.135 17.073 ( 3.789 -0.598 -2.524) 4.592 17.471 ( 2.504 2.632 0.611) 3.684 17.512 ( 3.201 -1.142 1.514) 3.721 17.710 ( -0.481 9.091 -3.064) 9.606 17.888 ( 0.641 -8.144 -1.878) 8.382 18.048 ( -1.733 2.204 -0.419) 2.835 18.119 ( 0.724 -4.567 0.208) 4.629 18.180 ( 0.814 2.312 -2.259) 3.334 18.228 ( 1.553 -2.304 -1.844) 3.335 18.451 ( -3.696 1.068 4.210) 5.703 18.470 ( -5.209 -1.147 6.557) 8.453 18.725 ( -1.507 1.750 -0.333) 2.333 18.751 ( -3.143 -1.097 0.962) 3.465 18.845 ( 0.864 3.252 -1.368) 3.633 18.928 ( 1.321 -4.801 -2.248) 5.463 19.059 ( -5.757 6.368 -1.726) 8.756 19.183 ( -3.624 -5.756 -3.449) 7.626 27.650 ( -0.176 -0.051 0.822) 0.843 27.653 ( 0.354 -0.394 0.947) 1.085 27.718 ( 1.430 1.026 0.603) 1.860 27.737 ( 1.472 -0.861 0.550) 1.791 27.770 ( 0.124 0.287 -0.292) 0.428 27.775 ( -0.104 -0.183 -0.484) 0.528 27.858 ( -0.330 0.413 -0.512) 0.736 27.865 ( -0.586 -0.225 -0.307) 0.699 29.235 ( 1.282 2.966 4.527) 5.562 29.307 ( 3.386 -4.785 6.939) 9.083 29.657 ( -1.107 3.213 -1.877) 3.882 29.700 ( -1.338 -0.466 -1.313) 1.932 29.761 ( 4.462 1.135 0.889) 4.689 29.803 ( 3.719 -2.454 1.939) 4.860 29.959 ( -4.871 2.968 0.240) 5.709 29.986 ( 0.861 1.159 0.464) 1.517 30.026 ( 1.823 2.615 2.889) 4.302 30.149 ( -2.403 -8.182 -0.279) 8.532 30.642 ( 2.289 2.387 -4.499) 5.584 30.649 ( 0.790 0.972 -2.212) 2.542 30.912 ( -0.828 1.392 -4.906) 5.167 30.957 ( -1.517 -1.828 -6.477) 6.899 31.092 ( 0.062 3.346 -2.803) 4.365 31.155 ( 1.143 -2.086 -3.668) 4.372 31.349 ( -1.993 0.726 6.924) 7.242 31.386 ( -2.195 -2.536 6.670) 7.466 31.719 ( -0.374 4.974 -0.460) 5.009 31.779 ( 1.622 -1.236 7.827) 8.088 32.149 ( 0.006 -1.219 13.931) 13.984 32.196 ( 0.094 -5.452 6.108) 8.188 33.442 ( -2.950 4.834 -14.588) 15.649 33.504 ( 0.076 -1.966 -11.500) 11.667 ======================= Grid point 48 (26/60) ======================= q-point: ( 0.17 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.543 ( 7.011 26.534 11.178) 29.634 1.877 ( 13.636 20.665 17.547) 30.346 2.042 ( 7.746 -23.353 5.851) 25.290 2.266 ( 10.549 -16.929 14.147) 24.454 2.522 ( 10.547 15.683 19.784) 27.360 2.759 ( 4.317 -3.867 5.828) 8.219 2.899 ( -0.897 4.888 -2.297) 5.475 2.970 ( -0.574 -2.380 -2.637) 3.598 3.131 ( -2.382 3.120 11.463) 12.117 3.208 ( 0.883 -4.224 8.266) 9.324 3.348 ( 1.523 6.114 -6.473) 9.033 3.449 ( 1.344 2.312 -3.612) 4.495 3.561 ( -0.979 -1.778 -1.785) 2.703 3.585 ( -1.395 0.797 -1.452) 2.165 3.732 ( -1.600 8.368 -4.587) 9.676 3.849 ( 2.403 -3.325 -3.610) 5.464 3.927 ( 3.908 1.480 2.135) 4.693 4.005 ( 0.747 -5.755 2.040) 6.151 4.112 ( 1.352 5.067 -2.844) 5.966 4.129 ( 2.406 8.294 -3.077) 9.168 4.230 ( 4.852 -4.998 -1.325) 7.091 4.316 ( 3.282 -7.304 -7.894) 11.244 4.421 ( -5.914 2.473 3.192) 7.161 4.504 ( -3.240 4.531 -3.870) 6.783 4.553 ( -2.512 -9.387 -0.541) 9.732 4.595 ( -2.573 -1.004 2.758) 3.904 4.751 ( 0.903 3.573 0.162) 3.688 4.850 ( -2.066 -0.984 0.336) 2.313 4.915 ( 0.705 -4.885 2.050) 5.345 4.973 ( 1.775 -8.701 1.632) 9.029 5.195 ( 2.830 3.294 -2.311) 4.919 5.216 ( -1.560 3.356 0.205) 3.707 5.298 ( 3.358 0.580 -2.062) 3.983 5.385 ( -6.774 -5.055 -0.410) 8.462 5.498 ( 0.677 4.488 6.181) 7.668 5.600 ( 0.406 -4.594 4.864) 6.703 5.645 ( -6.902 1.804 0.734) 7.171 5.699 ( 0.468 -4.594 -0.616) 4.658 5.938 ( -4.816 4.021 -3.294) 7.086 6.009 ( -7.415 -2.463 -0.965) 7.873 6.161 ( -0.886 -0.913 1.337) 1.845 6.196 ( -2.891 -4.262 -1.281) 5.307 6.707 ( -3.266 11.013 -2.485) 11.753 6.919 ( -4.047 -9.450 -4.278) 11.134 7.292 ( -2.443 0.839 3.018) 3.973 7.358 ( -3.894 -5.991 1.197) 7.245 7.804 ( -3.066 2.532 -7.999) 8.933 7.851 ( -0.541 -1.096 -8.157) 8.248 7.988 ( -1.891 6.068 -0.535) 6.379 8.151 ( 0.910 -8.846 -1.780) 9.069 8.618 ( -2.991 3.006 -3.147) 5.281 8.641 ( -2.432 0.190 -3.557) 4.313 8.815 ( -0.880 5.528 -3.820) 6.777 8.905 ( 1.575 4.811 -4.210) 6.584 8.940 ( -3.296 -5.609 -2.995) 7.162 8.974 ( -0.028 3.022 2.304) 3.801 9.053 ( 1.005 -2.716 -0.431) 2.928 9.124 ( -0.343 -3.667 2.170) 4.275 9.296 ( -2.350 6.120 -0.685) 6.591 9.406 ( -1.307 -3.398 1.387) 3.896 9.511 ( -0.645 1.015 1.952) 2.293 9.567 ( -1.785 -4.443 -1.292) 4.959 10.081 ( 0.207 1.117 0.132) 1.143 10.126 ( -0.844 -3.488 -0.524) 3.626 10.254 ( 1.624 4.083 3.387) 5.548 10.329 ( 4.084 -1.911 0.816) 4.582 10.494 ( -5.427 4.105 3.745) 7.768 10.577 ( -5.138 -1.036 -1.156) 5.367 10.694 ( -8.322 -1.454 -1.010) 8.508 10.735 ( 0.133 -4.801 3.701) 6.064 10.795 ( 2.225 2.536 -0.076) 3.374 10.825 ( -0.221 1.704 1.800) 2.489 10.880 ( -1.813 -2.601 1.299) 3.427 10.937 ( 0.579 -8.353 2.229) 8.664 11.190 ( 1.301 4.717 -1.604) 5.149 11.221 ( -1.771 1.232 -0.469) 2.207 11.463 ( 5.476 10.131 -2.572) 11.800 11.607 ( -1.265 -1.697 1.895) 2.841 11.661 ( 0.995 2.076 2.319) 3.268 11.707 ( -1.919 3.084 0.061) 3.632 11.801 ( -1.711 -0.151 3.181) 3.615 11.916 ( -4.350 -9.325 4.017) 11.046 12.115 ( -3.373 -0.635 -1.996) 3.970 12.145 ( 3.078 -2.611 0.018) 4.036 12.178 ( -0.772 9.231 -0.680) 9.288 12.338 ( -1.539 -3.689 -3.204) 5.123 12.442 ( -1.391 -0.442 -0.344) 1.500 12.579 ( -1.200 -8.321 -2.196) 8.689 12.709 ( 1.666 -2.177 -3.973) 4.827 12.716 ( 3.312 -0.866 -2.829) 4.441 12.911 ( 5.382 2.149 -2.467) 6.298 12.981 ( 0.631 -2.940 0.061) 3.007 13.138 ( -0.012 2.714 -3.937) 4.782 13.155 ( -1.335 1.015 -1.850) 2.497 13.210 ( -0.510 -2.053 3.710) 4.271 13.239 ( 0.477 -4.182 1.850) 4.598 13.389 ( -1.965 3.592 0.893) 4.191 13.425 ( -1.238 -0.422 0.499) 1.400 13.680 ( 4.683 3.942 2.957) 6.798 13.754 ( 3.416 -2.193 4.413) 5.996 13.839 ( 1.417 4.538 -1.874) 5.110 13.907 ( 2.494 -1.779 -1.403) 3.370 13.966 ( 0.704 4.303 -1.206) 4.524 14.041 ( -0.118 -2.987 1.750) 3.464 14.158 ( 1.632 5.202 -2.312) 5.922 14.260 ( 3.335 -3.410 -1.581) 5.025 14.340 ( -0.068 3.181 4.531) 5.537 14.369 ( -0.867 0.686 2.068) 2.345 14.505 ( 4.855 2.534 1.636) 5.716 14.609 ( -0.094 -6.736 4.317) 8.001 14.735 ( 3.151 5.559 1.965) 6.685 14.817 ( -0.416 -1.739 1.948) 2.644 15.006 ( -8.147 2.046 1.069) 8.468 15.030 ( -4.743 0.251 -2.655) 5.441 15.212 ( 4.283 2.512 -1.378) 5.153 15.297 ( 9.840 -5.072 0.301) 11.074 15.440 ( 9.025 2.437 -5.083) 10.641 15.485 ( 5.591 -1.207 -2.547) 6.261 15.558 ( 3.274 1.007 -0.007) 3.425 15.586 ( 0.587 -1.844 1.402) 2.390 15.753 ( -2.004 3.242 0.494) 3.844 15.844 ( -2.014 -4.635 1.881) 5.392 16.212 ( -1.127 3.103 -4.425) 5.521 16.281 ( -4.668 -3.379 -4.868) 7.543 16.682 ( -2.014 3.024 2.433) 4.372 16.725 ( -4.323 -0.401 5.753) 7.207 16.772 ( 4.475 1.239 2.685) 5.363 16.789 ( 2.787 -0.217 3.162) 4.221 16.902 ( -0.213 1.804 -1.142) 2.145 16.943 ( -0.316 -2.559 -1.135) 2.817 17.123 ( 0.620 0.179 1.763) 1.878 17.134 ( 1.412 -0.985 1.205) 2.101 17.549 ( 4.010 3.504 -1.213) 5.461 17.598 ( 3.385 -0.762 1.057) 3.627 17.684 ( -0.217 6.983 -2.555) 7.439 17.850 ( -3.048 -8.705 -3.127) 9.739 18.012 ( -1.353 4.898 2.432) 5.633 18.110 ( -2.025 -3.793 0.315) 4.311 18.214 ( 2.194 1.835 -1.767) 3.362 18.283 ( 4.878 -4.100 -2.487) 6.840 18.357 ( -7.302 1.887 6.625) 10.038 18.395 ( -2.500 -1.301 2.652) 3.870 18.689 ( -1.660 0.301 -1.618) 2.338 18.693 ( -2.540 -0.213 -1.243) 2.836 18.836 ( -0.623 4.161 -1.300) 4.404 18.910 ( -1.054 -2.064 -0.548) 2.381 19.001 ( 0.433 1.470 -0.463) 1.601 19.090 ( -2.692 -5.269 -2.390) 6.382 27.642 ( -0.646 -0.104 0.952) 1.155 27.648 ( -0.827 -0.745 0.815) 1.379 27.747 ( 0.182 0.809 0.818) 1.164 27.755 ( -0.119 -0.109 0.326) 0.364 27.793 ( 1.933 0.578 -0.367) 2.051 27.803 ( 2.281 -0.276 -0.304) 2.318 27.846 ( -0.364 0.381 -0.651) 0.837 27.854 ( 0.322 -0.471 -0.247) 0.622 29.276 ( -0.144 4.206 4.127) 5.894 29.370 ( -0.722 -5.285 4.825) 7.193 29.684 ( 3.017 3.399 -2.431) 5.154 29.737 ( 4.379 -2.016 -1.752) 5.129 29.810 ( -1.567 2.314 -0.470) 2.834 29.840 ( 2.604 -0.610 1.988) 3.332 29.952 ( 4.350 2.394 2.414) 5.520 30.039 ( 1.727 -6.146 0.081) 6.385 30.186 ( 10.407 3.026 1.538) 10.946 30.256 ( 12.606 -3.567 -0.270) 13.104 30.649 ( 0.427 1.863 -1.631) 2.513 30.665 ( 1.845 0.635 -2.640) 3.283 30.837 ( -3.218 1.027 -4.888) 5.942 30.870 ( -3.026 -0.708 -6.699) 7.385 31.108 ( 2.190 3.938 -2.989) 5.407 31.175 ( 2.799 -1.495 -6.577) 7.303 31.296 ( -6.377 0.558 8.837) 10.912 31.353 ( -3.649 -3.599 2.343) 5.636 31.755 ( 3.601 7.339 1.810) 8.373 31.854 ( 0.229 -2.836 10.746) 11.116 32.207 ( -1.044 -1.524 12.323) 12.461 32.252 ( 2.172 -5.756 6.779) 9.154 33.139 ( -16.810 9.043 -12.965) 23.075 33.278 ( -13.905 -5.612 -11.877) 19.129 ======================= Grid point 49 (27/60) ======================= q-point: ( 0.33 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.791 ( 9.158 26.851 9.297) 29.854 2.156 ( 4.529 20.177 18.926) 28.032 2.246 ( 7.583 -17.867 5.113) 20.072 2.470 ( 2.334 -12.408 8.927) 15.463 2.633 ( -8.926 4.086 -0.746) 9.845 2.760 ( -1.981 -8.151 -2.298) 8.698 2.909 ( 1.406 7.293 -6.067) 9.591 3.022 ( 3.078 -1.623 1.502) 3.790 3.187 ( 2.499 0.497 4.601) 5.260 3.232 ( 1.449 -4.301 4.527) 6.410 3.423 ( 9.622 6.099 -3.008) 11.783 3.515 ( 4.338 1.658 -3.035) 5.548 3.584 ( 0.625 3.569 -4.439) 5.730 3.620 ( -0.011 4.091 1.184) 4.259 3.691 ( 6.312 -1.523 4.207) 7.737 3.745 ( -6.384 -7.521 -7.299) 12.272 4.039 ( 4.599 3.137 -0.650) 5.605 4.061 ( 4.434 5.072 -2.675) 7.249 4.155 ( -0.433 1.358 4.587) 4.803 4.225 ( 6.117 4.721 1.082) 7.802 4.313 ( -1.081 -7.890 -0.687) 7.994 4.361 ( 3.960 -2.828 -4.509) 6.634 4.370 ( 2.939 0.372 -0.770) 3.061 4.464 ( 0.803 -0.629 0.654) 1.212 4.496 ( 1.873 -1.493 -4.374) 4.987 4.616 ( 0.931 -8.946 -1.932) 9.200 4.719 ( -4.736 4.231 1.425) 6.509 4.760 ( -3.035 1.247 0.855) 3.391 4.850 ( -6.057 0.695 0.145) 6.098 5.031 ( 0.833 -8.695 3.770) 9.514 5.134 ( -6.781 4.900 1.251) 8.459 5.193 ( -2.983 0.051 0.922) 3.123 5.242 ( -3.174 3.197 -1.794) 4.849 5.301 ( -2.899 -3.229 -0.217) 4.345 5.510 ( -4.904 5.206 2.504) 7.578 5.522 ( -5.048 1.817 1.950) 5.708 5.639 ( 1.972 -1.171 1.786) 2.907 5.737 ( 0.743 -4.709 -5.321) 7.145 5.845 ( -4.841 2.242 1.256) 5.480 5.855 ( 0.921 1.563 2.641) 3.204 6.146 ( 0.412 -3.803 0.198) 3.830 6.198 ( 0.464 -7.184 6.426) 9.650 6.594 ( -5.698 7.972 0.229) 9.801 6.767 ( -7.997 -8.330 -1.742) 11.678 7.276 ( -0.641 -1.296 2.760) 3.116 7.296 ( -2.765 -3.411 1.870) 4.772 7.730 ( 0.800 3.394 -8.586) 9.267 7.796 ( 0.876 -2.616 -8.956) 9.371 7.999 ( 2.457 7.358 3.000) 8.317 8.172 ( 1.568 -8.617 0.970) 8.812 8.491 ( -7.972 1.695 -0.927) 8.203 8.536 ( -5.728 -2.720 -2.285) 6.740 8.801 ( 2.620 3.451 -4.130) 5.986 8.831 ( -2.642 3.318 -0.324) 4.254 8.926 ( 0.888 4.735 -2.593) 5.472 8.993 ( 0.352 0.386 2.032) 2.098 9.039 ( -1.212 -4.598 -2.175) 5.229 9.099 ( -4.413 -6.205 4.324) 8.757 9.282 ( 2.410 9.460 -3.638) 10.418 9.397 ( 1.459 -1.536 -1.965) 2.890 9.497 ( -2.014 0.394 2.174) 2.989 9.548 ( -0.034 -4.755 -1.714) 5.055 10.039 ( -5.165 1.391 0.982) 5.438 10.100 ( -1.798 -4.770 -1.937) 5.453 10.291 ( -1.848 5.297 -0.124) 5.612 10.369 ( -0.078 4.217 0.108) 4.219 10.416 ( -5.093 -4.880 -1.581) 7.228 10.461 ( 1.767 -4.392 0.968) 4.832 10.600 ( -0.942 2.575 -1.325) 3.045 10.718 ( -1.549 -7.556 1.187) 7.804 10.791 ( -0.108 2.913 0.678) 2.993 10.879 ( 1.148 -4.589 0.100) 4.732 10.919 ( 2.601 2.732 5.988) 7.077 10.997 ( 1.406 -4.110 4.300) 6.112 11.163 ( -2.449 2.405 -2.399) 4.188 11.184 ( 0.185 1.524 -2.314) 2.776 11.438 ( -4.536 9.716 -2.756) 11.071 11.570 ( -1.311 1.743 -2.508) 3.323 11.597 ( -4.990 0.852 -2.991) 5.880 11.693 ( -3.430 -5.672 1.736) 6.852 11.771 ( 1.001 4.675 3.900) 6.170 11.924 ( 2.117 -7.511 6.691) 10.279 12.110 ( 1.459 6.311 0.565) 6.502 12.179 ( 1.325 1.356 -2.842) 3.416 12.196 ( 0.233 7.909 2.958) 8.447 12.302 ( -2.309 -2.857 1.605) 4.009 12.453 ( 2.432 -6.520 -1.553) 7.130 12.553 ( 2.108 -10.842 -3.608) 11.619 12.753 ( 3.333 0.783 -3.389) 4.817 12.762 ( 2.104 0.974 -2.645) 3.518 12.973 ( 2.813 -0.408 -3.576) 4.568 12.986 ( -0.401 0.019 1.631) 1.679 13.070 ( -2.383 2.676 -1.355) 3.831 13.139 ( 0.513 -2.745 -6.599) 7.165 13.183 ( -3.174 -0.414 2.775) 4.237 13.206 ( -5.172 -1.414 2.561) 5.942 13.421 ( 2.681 1.671 2.203) 3.852 13.429 ( 0.829 0.654 2.507) 2.720 13.768 ( 1.355 3.563 3.551) 5.209 13.810 ( 0.148 -0.214 3.963) 3.972 13.836 ( -0.559 4.021 -1.575) 4.355 13.924 ( 0.302 -2.673 -0.894) 2.834 14.025 ( 3.811 1.304 -0.492) 4.058 14.061 ( 2.053 -0.545 -1.235) 2.458 14.160 ( -0.421 6.801 -3.338) 7.588 14.290 ( 0.761 -4.603 -4.714) 6.632 14.339 ( -1.196 1.755 0.220) 2.135 14.383 ( 1.360 -0.888 1.696) 2.348 14.503 ( -5.060 -0.873 2.631) 5.769 14.551 ( -4.656 -3.693 4.608) 7.520 14.729 ( -0.168 4.837 0.291) 4.848 14.807 ( -1.727 -2.181 -1.089) 2.988 14.987 ( -0.047 0.966 0.624) 1.151 15.001 ( 1.688 -0.504 3.479) 3.899 15.304 ( 4.095 6.222 -7.085) 10.280 15.405 ( 2.373 -3.144 -6.820) 7.875 15.565 ( 4.384 0.222 -1.978) 4.815 15.575 ( 3.527 0.873 3.005) 4.715 15.644 ( 1.270 0.382 -1.794) 2.231 15.670 ( 1.584 1.048 -1.311) 2.307 15.799 ( 13.350 1.669 1.549) 13.543 15.878 ( 7.122 -3.666 1.997) 8.255 16.128 ( -5.863 0.680 -2.056) 6.250 16.168 ( -4.536 -3.104 -2.133) 5.896 16.637 ( -2.843 3.697 3.972) 6.126 16.676 ( -3.686 -0.040 5.383) 6.524 16.886 ( 4.211 1.656 -0.670) 4.575 16.900 ( 5.239 2.009 3.150) 6.435 16.915 ( 2.159 1.351 0.252) 2.559 16.947 ( 0.962 -3.423 -1.859) 4.012 17.107 ( -3.609 0.250 5.191) 6.327 17.142 ( -2.295 -2.877 5.790) 6.861 17.592 ( 1.402 3.436 -3.246) 4.930 17.632 ( -0.524 2.026 -0.845) 2.257 17.674 ( 0.977 0.034 -4.040) 4.156 17.752 ( -3.326 -4.501 -4.865) 7.415 18.027 ( 0.134 1.613 5.011) 5.266 18.058 ( -2.420 -0.852 2.317) 3.457 18.215 ( -1.673 3.097 1.638) 3.882 18.276 ( -3.479 -1.189 7.092) 7.989 18.368 ( 3.828 -0.215 -1.557) 4.139 18.421 ( 2.569 -3.928 0.206) 4.698 18.622 ( -3.035 1.310 -1.735) 3.733 18.656 ( 0.658 -1.975 -3.933) 4.450 18.838 ( 1.234 3.551 -0.419) 3.782 18.911 ( 0.744 -3.691 1.441) 4.032 19.019 ( 0.672 0.074 1.281) 1.448 19.059 ( -0.212 -2.926 1.022) 3.107 27.635 ( -0.583 -0.488 0.394) 0.856 27.637 ( -0.527 -0.681 0.546) 1.019 27.739 ( -0.811 0.420 -0.298) 0.960 27.743 ( -0.828 0.053 -0.400) 0.921 27.818 ( 0.600 0.864 -0.080) 1.055 27.825 ( 0.439 0.287 -0.261) 0.586 27.862 ( 1.588 0.514 -0.395) 1.715 27.875 ( 1.194 -0.803 -0.122) 1.444 29.275 ( -1.457 3.976 2.719) 5.033 29.357 ( -1.969 -4.213 2.327) 5.200 29.692 ( -0.603 3.262 -4.642) 5.705 29.729 ( -0.978 0.058 -3.406) 3.544 29.873 ( 4.317 1.483 0.474) 4.589 29.937 ( 5.228 -3.921 0.740) 6.577 30.080 ( 4.885 0.701 2.806) 5.677 30.102 ( 4.414 -1.800 1.660) 5.048 30.400 ( 8.761 4.988 -0.663) 10.103 30.498 ( 8.921 -4.212 -2.304) 10.131 30.657 ( 0.646 3.053 0.311) 3.136 30.682 ( -0.475 0.922 0.399) 1.111 30.753 ( -0.873 0.684 -5.202) 5.319 30.789 ( -0.798 -1.409 -4.162) 4.466 31.085 ( -4.476 5.092 -1.219) 6.888 31.189 ( 2.161 -2.016 -7.278) 7.855 31.212 ( -4.700 0.634 6.624) 8.147 31.304 ( 0.373 -4.541 -3.772) 5.915 31.855 ( 2.039 2.657 7.106) 7.856 31.891 ( -2.746 -1.402 12.331) 12.710 32.278 ( 4.242 3.095 7.818) 9.418 32.382 ( 7.851 -6.480 3.692) 10.828 32.704 ( -17.870 8.985 -7.838) 21.482 32.880 ( -17.389 -8.467 -9.328) 21.473 ======================= Grid point 50 (28/60) ======================= q-point: (-0.50 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.843 ( -9.015 27.751 2.784) 29.312 2.193 ( -13.631 9.724 10.449) 19.737 2.296 ( -7.802 -4.249 2.679) 9.280 2.398 ( -3.693 -4.913 4.834) 7.819 2.595 ( 7.154 1.221 1.607) 7.433 2.776 ( 2.394 -14.680 3.594) 15.302 2.978 ( 5.284 2.208 0.577) 5.756 3.023 ( 1.583 0.248 1.022) 1.900 3.179 ( -8.925 0.636 -5.229) 10.363 3.204 ( -7.839 -0.292 -3.664) 8.658 3.427 ( 2.167 1.338 -9.457) 9.794 3.462 ( -4.904 -0.167 -11.856) 12.831 3.606 ( 4.405 2.465 -0.273) 5.055 3.645 ( 3.294 -1.283 -4.431) 5.668 3.791 ( 5.857 3.253 1.922) 6.970 3.860 ( 4.840 -2.329 0.706) 5.417 4.032 ( -4.809 4.885 2.070) 7.160 4.096 ( 1.719 3.180 1.670) 3.982 4.152 ( -8.356 -5.043 2.902) 10.182 4.210 ( -0.944 -4.092 0.274) 4.208 4.335 ( 2.548 0.729 -2.465) 3.619 4.391 ( -0.468 -3.218 -2.964) 4.400 4.442 ( -5.510 0.761 -2.070) 5.935 4.511 ( -0.650 -3.745 0.089) 3.802 4.533 ( 10.088 2.944 0.080) 10.509 4.618 ( 8.893 -4.939 1.583) 10.295 4.708 ( -1.952 0.350 0.704) 2.104 4.717 ( 1.336 -0.192 3.198) 3.471 4.869 ( 4.872 4.811 -2.378) 7.248 4.916 ( -9.332 2.404 -1.661) 9.779 5.080 ( 0.618 3.622 4.130) 5.528 5.126 ( -4.727 0.193 -4.415) 6.471 5.145 ( -5.047 -0.018 -0.253) 5.053 5.252 ( 0.715 -7.181 1.787) 7.435 5.456 ( 0.090 7.294 2.425) 7.687 5.492 ( 3.026 3.529 1.105) 4.778 5.630 ( -2.718 -2.043 1.707) 3.805 5.660 ( -2.128 -2.369 -5.812) 6.627 5.877 ( 1.534 3.013 8.726) 9.358 5.948 ( 2.872 1.104 3.337) 4.539 6.189 ( 0.547 -5.450 5.852) 8.016 6.266 ( 2.527 -8.756 6.684) 11.302 6.540 ( 0.599 3.446 1.185) 3.693 6.649 ( 0.067 -6.354 -1.187) 6.465 7.269 ( -0.548 -0.602 2.585) 2.710 7.306 ( 1.733 -4.075 4.040) 5.995 7.737 ( 3.563 5.600 -7.920) 10.334 7.816 ( 5.412 -2.040 -7.757) 9.675 8.097 ( 3.228 4.335 5.379) 7.626 8.219 ( -0.372 -6.880 3.773) 7.856 8.348 ( -1.491 3.975 0.869) 4.334 8.465 ( 0.910 -7.694 -0.528) 7.765 8.811 ( 0.376 6.708 0.363) 6.728 8.863 ( 2.171 2.151 -1.402) 3.362 8.923 ( 1.887 3.550 -4.524) 6.052 9.003 ( -0.277 -3.568 -2.755) 4.516 9.010 ( -1.030 -1.063 1.249) 1.937 9.048 ( -1.311 -4.979 2.537) 5.740 9.307 ( 1.864 10.607 -3.378) 11.287 9.409 ( -0.348 1.887 -1.466) 2.415 9.464 ( -1.798 -0.549 1.366) 2.324 9.538 ( 0.380 -6.480 -2.695) 7.028 9.913 ( -4.013 4.110 -3.011) 6.486 10.035 ( -1.012 -7.856 -5.707) 9.762 10.238 ( -1.694 3.026 -3.597) 4.996 10.337 ( -1.680 -5.378 -1.865) 5.935 10.390 ( 1.032 4.592 1.412) 4.914 10.487 ( -0.216 -5.470 -0.134) 5.476 10.598 ( 0.312 4.343 -1.035) 4.475 10.707 ( -0.108 -4.989 -0.396) 5.006 10.797 ( -0.283 2.057 0.308) 2.099 10.882 ( -0.787 -5.643 -0.913) 5.771 10.964 ( -0.928 1.381 7.134) 7.326 11.010 ( -1.807 -2.932 1.655) 3.821 11.140 ( 1.244 4.122 1.112) 4.447 11.198 ( 1.923 1.008 -1.519) 2.649 11.348 ( -2.271 7.974 -2.699) 8.720 11.511 ( -1.095 -0.733 -2.394) 2.733 11.542 ( 0.774 0.894 -3.123) 3.340 11.655 ( -0.540 -5.154 2.854) 5.916 11.795 ( -1.639 8.604 2.554) 9.124 11.997 ( 0.143 -9.786 6.201) 11.586 12.137 ( -1.525 3.688 1.647) 4.317 12.198 ( 1.053 4.468 1.941) 4.984 12.218 ( 0.096 7.464 2.379) 7.834 12.259 ( 1.277 -3.712 0.839) 4.014 12.518 ( 4.165 -3.519 -1.389) 5.627 12.627 ( 5.996 -10.089 -4.153) 12.450 12.764 ( -0.539 3.471 -1.355) 3.765 12.789 ( 2.011 0.592 -4.529) 4.991 12.960 ( -3.513 1.858 3.624) 5.378 13.005 ( 2.441 0.828 -4.116) 4.856 13.058 ( 0.923 -0.551 -2.205) 2.453 13.095 ( -1.445 -1.421 -2.076) 2.901 13.129 ( -2.694 -0.806 2.783) 3.956 13.159 ( 1.341 -3.693 -1.533) 4.217 13.453 ( -0.511 2.419 2.862) 3.782 13.466 ( 0.139 1.446 2.841) 3.191 13.772 ( -1.490 8.090 0.272) 8.230 13.802 ( -2.809 0.128 1.855) 3.368 13.807 ( -2.478 -1.210 2.276) 3.575 13.920 ( -0.280 -6.133 -0.532) 6.162 14.047 ( 0.000 3.734 -2.941) 4.753 14.088 ( 0.775 -0.439 -1.124) 1.434 14.145 ( -0.044 6.574 0.470) 6.591 14.270 ( -0.373 -1.975 -2.556) 3.252 14.317 ( -0.018 -0.742 -1.511) 1.684 14.399 ( -0.122 -6.336 -3.401) 7.192 14.473 ( -0.194 0.811 5.822) 5.881 14.501 ( -1.140 -1.331 -0.761) 1.911 14.735 ( -1.918 0.514 1.786) 2.671 14.757 ( -2.891 -0.038 -1.063) 3.080 14.901 ( -5.383 2.296 -5.857) 8.280 14.967 ( -3.488 -3.256 -4.922) 6.855 15.327 ( 0.636 5.182 -4.555) 6.929 15.394 ( 0.588 -1.195 -6.186) 6.328 15.549 ( -2.979 1.855 -2.162) 4.121 15.602 ( 1.141 -2.850 -0.404) 3.096 15.720 ( 5.922 6.367 0.351) 8.703 15.773 ( 2.656 0.515 0.609) 2.774 15.938 ( -6.638 1.163 0.377) 6.750 15.992 ( -0.041 -3.572 0.726) 3.645 16.120 ( 10.658 1.585 3.244) 11.253 16.181 ( 8.392 -3.643 3.259) 9.711 16.608 ( -2.285 1.586 3.716) 4.642 16.621 ( -4.333 0.513 4.239) 6.084 16.909 ( -0.578 0.520 -0.604) 0.984 16.928 ( -1.865 -1.036 -0.355) 2.163 16.963 ( -0.711 3.802 0.955) 3.984 17.004 ( 2.529 3.518 2.900) 5.214 17.055 ( -3.277 -1.996 4.463) 5.886 17.127 ( -1.860 -5.132 6.677) 8.624 17.566 ( -1.896 2.350 -4.713) 5.597 17.581 ( -2.416 0.836 -3.929) 4.688 17.669 ( 1.131 -0.226 -3.463) 3.650 17.716 ( 2.323 -3.435 -4.411) 6.054 18.045 ( 0.445 1.480 4.115) 4.396 18.076 ( 0.706 -1.685 4.108) 4.496 18.193 ( -1.664 3.939 3.997) 5.853 18.263 ( -1.711 -2.378 5.591) 6.312 18.423 ( 1.266 0.674 0.067) 1.436 18.454 ( 1.207 -2.029 0.510) 2.415 18.587 ( 1.459 3.934 -1.387) 4.419 18.686 ( 3.583 -5.316 -3.290) 7.205 18.866 ( 0.895 3.005 0.925) 3.269 18.938 ( 0.308 -4.520 1.893) 4.910 19.044 ( 0.949 0.938 3.058) 3.336 19.084 ( 1.588 -2.467 2.890) 4.119 27.622 ( -0.712 -0.283 -0.293) 0.820 27.627 ( -0.634 -0.771 -0.159) 1.011 27.720 ( -0.494 0.523 -0.861) 1.122 27.727 ( -0.277 -0.190 -0.846) 0.911 27.825 ( 0.185 0.929 0.232) 0.975 27.835 ( 0.395 0.053 0.474) 0.619 27.875 ( -0.131 0.544 -0.809) 0.984 27.885 ( -0.062 -0.551 -0.607) 0.822 29.253 ( -1.727 3.163 1.675) 3.974 29.318 ( -2.523 -3.266 0.409) 4.147 29.648 ( -0.310 2.812 -5.450) 6.141 29.691 ( -0.420 -1.401 -4.897) 5.111 29.938 ( 1.186 3.428 2.638) 4.485 30.029 ( 2.141 -5.648 2.795) 6.655 30.113 ( -2.321 3.354 -0.733) 4.144 30.169 ( -1.401 -2.145 0.231) 2.572 30.517 ( 2.724 3.404 -0.927) 4.457 30.570 ( 0.334 -1.199 -2.759) 3.027 30.615 ( -3.415 5.254 1.043) 6.353 30.670 ( -1.312 0.335 -1.283) 1.865 30.775 ( 1.974 0.117 -1.893) 2.737 30.817 ( 5.223 -3.092 -2.357) 6.511 30.993 ( -0.581 8.674 0.450) 8.705 31.170 ( -0.898 -9.864 2.978) 10.343 31.217 ( 2.653 3.718 -4.548) 6.446 31.315 ( 2.550 -5.380 -5.357) 8.009 31.845 ( -6.274 1.776 10.495) 12.356 31.903 ( -2.590 -3.737 9.084) 10.158 32.282 ( -13.573 10.267 -3.649) 17.406 32.480 ( -8.133 -7.993 -2.467) 11.667 32.542 ( 10.682 6.864 1.543) 12.791 32.707 ( 15.071 -8.363 0.397) 17.241 ======================= Grid point 51 (29/60) ======================= q-point: (-0.33 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.593 ( -12.584 24.563 0.980) 27.616 1.903 ( -18.367 13.463 7.219) 23.890 2.047 ( -10.687 -13.327 -1.210) 17.126 2.266 ( -14.539 -15.749 3.854) 21.778 2.673 ( -19.775 15.779 1.310) 25.332 2.782 ( -4.878 3.109 -0.629) 5.818 2.869 ( 4.997 -1.669 0.305) 5.277 2.920 ( -4.604 -2.078 1.358) 5.230 3.110 ( 1.926 0.424 2.973) 3.568 3.135 ( -0.874 -5.174 3.726) 6.435 3.429 ( 3.688 3.271 -4.920) 6.965 3.464 ( 2.701 -1.429 -3.366) 4.546 3.702 ( 2.332 4.162 -0.748) 4.829 3.729 ( 7.500 0.580 -1.357) 7.644 3.844 ( -4.727 3.232 -5.430) 7.891 3.865 ( 0.377 0.049 1.680) 1.723 3.911 ( -4.564 0.124 -1.309) 4.750 3.956 ( -6.472 -2.095 3.804) 7.794 4.138 ( -1.203 1.168 -0.459) 1.739 4.184 ( 0.225 2.138 1.323) 2.524 4.252 ( -5.225 0.947 -2.246) 5.766 4.327 ( -0.487 -0.530 -0.484) 0.867 4.441 ( -2.699 -1.084 -4.951) 5.742 4.550 ( 2.973 -5.080 -0.761) 5.935 4.600 ( -1.900 1.760 -0.586) 2.655 4.703 ( 0.319 -4.072 -0.017) 4.084 4.711 ( 1.570 2.090 2.376) 3.532 4.823 ( 3.999 -6.870 2.276) 8.268 4.882 ( 4.571 4.324 1.679) 6.512 4.967 ( 6.528 -3.863 0.885) 7.637 4.976 ( -3.096 3.675 -8.294) 9.586 5.042 ( -0.456 -2.194 -5.966) 6.373 5.176 ( 2.752 2.588 1.895) 4.226 5.280 ( -0.773 -6.305 1.033) 6.435 5.520 ( 2.566 4.738 3.419) 6.381 5.584 ( 0.362 -0.578 1.963) 2.078 5.619 ( 5.959 2.376 -1.649) 6.624 5.693 ( 5.374 -2.516 0.819) 5.990 5.886 ( -3.312 3.421 5.875) 7.562 5.999 ( 0.635 -3.900 5.330) 6.636 6.231 ( 0.940 1.974 6.939) 7.275 6.353 ( 2.132 -7.287 5.086) 9.139 6.602 ( 4.261 6.164 0.475) 7.508 6.751 ( 7.674 -8.711 -3.047) 12.002 7.298 ( 1.212 1.914 4.041) 4.633 7.394 ( 3.914 -7.352 4.980) 9.704 7.776 ( 4.568 9.037 -8.200) 13.030 7.903 ( 6.041 -2.672 -7.285) 9.834 8.135 ( -2.569 -0.851 5.210) 5.871 8.173 ( -2.377 -5.108 2.607) 6.208 8.479 ( 8.637 3.888 0.467) 9.483 8.560 ( 6.966 -4.227 -1.484) 8.283 8.833 ( 1.963 6.210 0.382) 6.524 8.868 ( 1.612 4.324 -4.114) 6.182 8.957 ( 1.185 0.929 -1.864) 2.396 8.963 ( -2.501 -0.443 0.079) 2.542 9.001 ( 1.456 -3.271 -3.147) 4.767 9.036 ( -1.194 -5.521 -0.487) 5.670 9.325 ( 0.691 6.368 -2.896) 7.030 9.370 ( -2.418 0.734 0.105) 2.529 9.448 ( 0.471 3.858 0.329) 3.901 9.558 ( 3.061 -5.781 -0.418) 6.555 9.926 ( 7.035 4.454 -2.470) 8.685 10.042 ( 3.872 -5.179 -2.118) 6.805 10.177 ( -1.301 0.415 -3.841) 4.076 10.284 ( -2.227 -8.789 -4.962) 10.336 10.445 ( 3.376 2.636 0.663) 4.335 10.487 ( 0.275 -1.638 1.780) 2.435 10.572 ( -1.787 6.301 -0.851) 6.604 10.682 ( -2.415 -3.149 0.773) 4.043 10.781 ( -0.454 1.588 -2.081) 2.657 10.851 ( -0.233 -4.445 -3.907) 5.922 10.996 ( 0.791 -1.989 5.591) 5.987 11.002 ( 0.061 -2.266 3.570) 4.229 11.172 ( 0.196 5.433 2.786) 6.109 11.240 ( 2.507 1.036 0.369) 2.737 11.309 ( 0.082 8.365 -3.362) 9.016 11.502 ( 1.050 -7.437 -5.161) 9.113 11.583 ( 3.299 5.118 0.944) 6.162 11.695 ( 1.789 -4.458 2.353) 5.349 11.731 ( -4.684 11.092 1.684) 12.158 11.969 ( -5.338 -11.775 4.298) 13.624 12.094 ( -2.063 2.484 3.677) 4.894 12.173 ( -1.856 -3.002 2.613) 4.391 12.300 ( 5.622 7.733 0.919) 9.605 12.379 ( 6.409 -0.027 2.408) 6.847 12.581 ( 1.652 -0.012 -0.960) 1.911 12.659 ( -3.042 -4.838 0.372) 5.727 12.777 ( 2.373 1.164 -2.375) 3.554 12.793 ( 1.823 2.373 -4.122) 5.094 12.911 ( -2.484 0.650 0.785) 2.685 13.005 ( -2.288 -7.327 0.632) 7.702 13.050 ( 3.965 3.430 -8.116) 9.662 13.112 ( 1.266 -3.901 -0.501) 4.132 13.138 ( 1.254 1.439 2.509) 3.152 13.188 ( 1.979 -3.477 -2.432) 4.682 13.437 ( -2.299 4.735 3.660) 6.411 13.472 ( -0.655 1.919 5.116) 5.503 13.694 ( -4.583 4.792 -2.742) 7.175 13.732 ( -5.456 -1.380 0.677) 5.669 13.787 ( 0.444 3.241 3.879) 5.074 13.928 ( 1.910 -8.081 -1.122) 8.379 14.045 ( -1.894 2.364 1.909) 3.580 14.071 ( -2.048 1.300 1.658) 2.938 14.128 ( -1.091 6.540 -3.459) 7.479 14.221 ( -3.197 2.461 -2.349) 4.668 14.317 ( 0.049 -4.387 -1.940) 4.797 14.364 ( -0.909 -7.812 -3.202) 8.492 14.474 ( -1.073 2.857 -4.657) 5.568 14.509 ( 1.407 1.384 2.369) 3.083 14.577 ( -8.964 1.883 -3.535) 9.818 14.676 ( -1.313 -5.049 -5.420) 7.523 14.868 ( 2.321 1.540 1.333) 3.088 14.915 ( 1.212 -2.410 -2.869) 3.938 15.233 ( -7.154 4.005 -4.563) 9.383 15.314 ( -5.422 -3.708 -6.933) 9.551 15.523 ( 1.189 4.925 -1.062) 5.177 15.621 ( 0.178 -4.198 2.019) 4.661 15.694 ( -5.091 1.971 -2.064) 5.837 15.723 ( -4.569 -0.283 -0.403) 4.596 15.945 ( 4.204 7.746 4.210) 9.767 16.058 ( 1.380 -3.475 6.056) 7.117 16.291 ( 2.633 2.495 1.515) 3.931 16.350 ( 5.151 -3.061 1.072) 6.087 16.547 ( -2.849 2.920 2.224) 4.647 16.602 ( 0.150 -2.544 3.817) 4.590 16.841 ( -5.612 0.056 1.072) 5.714 16.844 ( -4.848 0.192 1.867) 5.199 16.974 ( 1.412 3.156 -0.369) 3.477 17.015 ( -1.769 1.626 2.592) 3.534 17.045 ( -0.294 -0.151 1.228) 1.271 17.122 ( -1.969 -4.447 4.675) 6.746 17.498 ( -1.687 0.977 -4.512) 4.915 17.513 ( -1.973 0.001 -3.120) 3.691 17.692 ( 2.346 2.294 -3.048) 4.479 17.769 ( 4.641 -4.320 -3.631) 7.306 18.080 ( 0.251 1.161 3.706) 3.891 18.094 ( -0.429 0.103 1.135) 1.218 18.191 ( -0.570 2.242 3.550) 4.237 18.253 ( -1.680 -3.368 3.149) 4.907 18.452 ( 1.385 0.271 1.794) 2.283 18.476 ( 0.503 -1.660 1.026) 2.015 18.655 ( 4.326 4.478 0.055) 6.227 18.751 ( 3.611 -4.404 -0.939) 5.773 18.869 ( -0.977 2.109 0.432) 2.364 18.928 ( -1.648 -3.791 0.347) 4.148 19.102 ( 2.135 1.673 5.447) 6.085 19.156 ( 3.353 -3.000 3.487) 5.692 27.610 ( 0.012 -0.055 -0.263) 0.269 27.617 ( 0.072 -0.763 -0.252) 0.807 27.709 ( -0.133 0.715 -0.971) 1.213 27.720 ( 0.060 -0.373 -1.060) 1.125 27.821 ( -0.908 0.921 -0.174) 1.305 27.837 ( -1.054 -0.508 -0.100) 1.174 27.861 ( -0.147 0.675 -0.001) 0.691 27.873 ( -0.523 -0.454 -0.286) 0.750 29.225 ( -1.701 1.970 1.365) 2.939 29.263 ( -2.528 -1.772 -0.274) 3.099 29.632 ( 1.439 2.163 -3.943) 4.722 29.669 ( 0.962 -1.751 -4.349) 4.786 29.933 ( -4.800 3.391 2.414) 6.354 29.987 ( -6.759 -0.133 0.659) 6.792 30.020 ( -5.537 1.617 -0.307) 5.776 30.098 ( -2.267 -5.095 0.967) 5.660 30.395 ( -11.065 5.229 0.049) 12.238 30.505 ( -9.346 -5.683 -0.215) 10.940 30.605 ( 1.923 1.995 -2.129) 3.494 30.614 ( 1.320 1.709 -5.604) 6.006 30.847 ( 5.146 4.003 -1.322) 6.653 30.921 ( 4.687 -1.810 -1.090) 5.142 31.085 ( 5.899 4.483 1.258) 7.515 31.176 ( 1.342 -6.476 -2.159) 6.957 31.247 ( 0.647 1.028 0.361) 1.267 31.342 ( 1.863 -6.188 -1.069) 6.551 31.757 ( -6.218 4.722 8.037) 11.205 31.869 ( -4.693 -6.645 4.081) 9.101 32.066 ( -5.889 9.775 4.448) 12.248 32.264 ( -6.858 -9.728 -0.844) 11.933 32.936 ( 21.614 9.472 -0.608) 23.606 33.081 ( 19.287 -5.675 -2.078) 20.212 ======================= Grid point 52 (30/60) ======================= q-point: (-0.17 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.416 ( -5.147 25.912 3.780) 26.688 1.526 ( -18.753 20.705 9.319) 29.448 1.911 ( -1.852 -19.074 -0.025) 19.164 1.977 ( -12.328 -20.826 6.740) 25.122 2.318 ( -11.918 23.164 14.316) 29.724 2.703 ( -4.937 -10.253 6.163) 12.942 2.912 ( 0.166 2.542 0.256) 2.561 2.956 ( 2.223 -0.114 -0.418) 2.265 3.103 ( -1.693 2.018 6.115) 6.658 3.155 ( -0.739 0.215 2.889) 2.989 3.445 ( -3.591 1.335 1.930) 4.290 3.487 ( 2.003 -0.792 2.441) 3.255 3.584 ( -4.671 8.345 -4.225) 10.455 3.722 ( -3.037 -1.149 -5.049) 6.002 3.786 ( -4.496 3.941 2.606) 6.522 3.860 ( -2.025 -1.172 0.526) 2.398 3.927 ( 3.755 3.605 -1.960) 5.562 4.019 ( 4.984 -6.279 0.277) 8.021 4.104 ( -0.042 2.969 -5.009) 5.823 4.158 ( -1.259 -0.273 -5.844) 5.984 4.245 ( 0.083 9.407 2.767) 9.806 4.282 ( 2.282 3.322 -0.589) 4.073 4.406 ( 2.948 -4.894 -0.280) 5.720 4.550 ( -2.844 -15.312 -1.513) 15.647 4.578 ( 0.184 3.964 1.050) 4.105 4.674 ( -0.921 -4.015 2.739) 4.947 4.790 ( -0.126 1.859 -2.691) 3.273 4.809 ( -2.043 6.458 -1.830) 7.016 4.885 ( 0.821 -5.145 -1.027) 5.310 4.959 ( 0.118 -5.720 -1.044) 5.816 5.058 ( 6.496 6.086 -3.375) 9.520 5.138 ( 1.439 -2.971 1.567) 3.654 5.202 ( 0.395 1.292 -0.704) 1.523 5.314 ( 6.932 -8.935 -5.286) 12.483 5.534 ( -2.223 2.476 3.414) 4.768 5.581 ( -1.233 -0.119 2.733) 3.000 5.714 ( 0.983 2.891 3.718) 4.812 5.788 ( 2.326 -4.305 0.347) 4.905 5.912 ( 3.733 3.605 3.489) 6.253 6.045 ( -0.117 -8.748 7.191) 11.325 6.281 ( 0.502 5.221 1.167) 5.373 6.376 ( -2.012 -3.787 1.222) 4.459 6.683 ( 4.207 8.993 -3.703) 10.596 6.876 ( 6.843 -10.224 -6.146) 13.752 7.337 ( -0.247 4.898 4.698) 6.791 7.479 ( 0.439 -8.877 4.682) 10.045 7.834 ( 4.987 7.959 -8.582) 12.722 7.951 ( 2.111 -3.282 -8.054) 8.949 8.092 ( -2.142 0.691 2.148) 3.111 8.155 ( -0.942 -6.203 0.003) 6.274 8.605 ( 3.942 3.986 -1.893) 5.917 8.658 ( 3.442 -0.941 -2.296) 4.243 8.865 ( 0.070 3.650 -3.453) 5.025 8.888 ( -2.318 1.542 0.010) 2.784 8.910 ( 3.153 5.548 -3.773) 7.413 8.994 ( 2.183 -1.175 -0.849) 2.621 9.015 ( 1.546 -4.320 -4.075) 6.136 9.055 ( 4.207 -4.529 -0.698) 6.221 9.314 ( 0.192 3.169 -0.237) 3.183 9.347 ( -0.305 -0.907 3.224) 3.363 9.479 ( 1.675 7.672 0.448) 7.866 9.635 ( 2.838 -6.518 0.426) 7.121 10.053 ( 1.928 5.114 -2.237) 5.906 10.144 ( 5.202 2.842 0.757) 5.976 10.199 ( 2.121 -8.583 -3.219) 9.409 10.221 ( 1.435 -5.172 1.710) 5.633 10.501 ( 1.144 1.833 1.831) 2.832 10.537 ( 4.782 -2.079 1.446) 5.411 10.561 ( 1.707 5.206 0.375) 5.492 10.657 ( 0.837 -1.753 0.240) 1.958 10.757 ( -0.430 0.966 -1.685) 1.990 10.838 ( 0.785 -4.787 -4.062) 6.327 11.028 ( 0.672 -0.148 3.197) 3.270 11.048 ( 1.480 -1.614 0.263) 2.206 11.192 ( 0.287 8.136 3.681) 8.935 11.267 ( -1.390 11.541 -4.687) 12.534 11.331 ( 1.540 -5.690 7.356) 9.427 11.457 ( -2.863 -7.004 -3.930) 8.526 11.605 ( -0.180 6.085 0.973) 6.165 11.714 ( 2.334 1.528 0.428) 2.823 11.730 ( 0.098 1.981 2.842) 3.465 11.878 ( -3.411 -7.665 2.003) 8.626 12.098 ( 0.056 1.575 3.586) 3.917 12.190 ( 1.463 -5.238 3.606) 6.525 12.419 ( 5.257 3.687 0.785) 6.469 12.502 ( 3.767 -3.580 -0.754) 5.251 12.535 ( -4.839 3.730 -0.492) 6.130 12.601 ( -2.963 -1.596 -3.236) 4.669 12.736 ( -3.963 7.688 1.502) 8.778 12.813 ( -4.765 0.634 -6.099) 7.765 12.844 ( 1.412 -3.354 -3.965) 5.381 12.941 ( -3.579 -8.803 -0.040) 9.503 13.105 ( 3.139 0.229 -2.333) 3.918 13.127 ( 0.151 -2.647 3.247) 4.192 13.178 ( 2.300 1.553 1.816) 3.317 13.214 ( 1.778 -1.850 -1.633) 3.042 13.434 ( 1.268 6.153 1.144) 6.386 13.514 ( 0.639 -1.103 2.608) 2.903 13.591 ( -3.809 0.728 -1.980) 4.355 13.608 ( -4.676 -0.762 -0.249) 4.744 13.865 ( 4.057 3.939 2.598) 6.223 13.928 ( -4.159 1.588 -1.348) 4.651 13.965 ( -6.487 -0.471 -0.308) 6.512 14.000 ( -0.251 -3.665 1.182) 3.859 14.124 ( 0.022 4.222 0.554) 4.258 14.133 ( -0.314 3.974 1.132) 4.144 14.310 ( 0.390 -1.206 -2.127) 2.476 14.351 ( 1.198 -3.483 -1.969) 4.176 14.414 ( -2.071 1.231 -0.267) 2.424 14.458 ( -3.184 -2.248 5.807) 6.994 14.589 ( 6.163 6.086 -1.742) 8.835 14.717 ( 7.801 -5.653 -8.389) 12.774 14.868 ( -3.013 6.139 -0.709) 6.875 14.978 ( 3.592 -5.184 -1.301) 6.439 15.101 ( 0.183 0.995 -1.044) 1.454 15.175 ( -1.349 -4.931 -7.728) 9.266 15.542 ( 0.632 5.300 -3.286) 6.268 15.589 ( -4.662 2.867 3.954) 6.752 15.627 ( -2.148 -0.830 -0.173) 2.309 15.664 ( -1.109 -4.741 1.709) 5.160 15.956 ( -7.990 2.939 2.397) 8.845 15.986 ( -10.548 -0.453 7.609) 13.014 16.278 ( 0.281 6.942 -3.647) 7.846 16.417 ( 2.482 -5.911 -4.025) 7.570 16.598 ( 5.044 3.255 4.433) 7.462 16.645 ( 0.717 -2.165 3.863) 4.486 16.749 ( -3.713 0.391 2.173) 4.320 16.773 ( -2.945 -1.062 3.509) 4.702 16.996 ( 1.510 0.699 -3.110) 3.527 17.007 ( 1.658 0.129 -2.287) 2.828 17.022 ( -2.591 2.936 1.901) 4.353 17.094 ( -3.131 -3.701 3.232) 5.826 17.457 ( -0.549 0.910 -1.625) 1.942 17.477 ( -0.139 -0.586 -0.615) 0.860 17.719 ( 1.541 6.071 -3.317) 7.087 17.849 ( 4.157 -6.146 -2.695) 7.894 18.076 ( -1.207 1.468 0.468) 1.957 18.099 ( 0.671 -0.340 0.205) 0.780 18.196 ( -0.604 0.339 0.790) 1.051 18.228 ( -1.391 -3.086 0.924) 3.509 18.478 ( -0.732 -0.072 2.599) 2.701 18.490 ( -0.365 -1.084 3.989) 4.149 18.729 ( 1.796 3.958 1.021) 4.465 18.792 ( -0.823 -1.965 2.086) 2.981 18.846 ( -0.668 0.847 -1.527) 1.870 18.904 ( 1.017 -4.011 -2.482) 4.825 19.148 ( -1.420 3.024 3.161) 4.599 19.223 ( 1.015 -3.906 0.608) 4.082 27.625 ( 1.304 0.012 0.461) 1.383 27.631 ( 1.154 -0.637 0.385) 1.373 27.705 ( 0.113 0.855 -0.451) 0.973 27.719 ( 0.347 -0.594 -0.561) 0.888 27.788 ( -1.553 0.668 -0.471) 1.755 27.800 ( -1.774 -0.390 -0.409) 1.862 27.863 ( -0.015 0.368 -0.071) 0.375 27.870 ( 0.018 -0.253 0.269) 0.370 29.206 ( -0.716 1.593 2.407) 2.974 29.236 ( -0.104 -1.369 3.034) 3.330 29.669 ( 3.489 1.920 -1.464) 4.243 29.690 ( 2.577 -0.587 -2.523) 3.654 29.782 ( -6.627 1.194 -0.960) 6.802 29.820 ( -7.735 -1.923 -0.246) 7.974 29.971 ( -1.314 3.877 2.473) 4.782 30.048 ( -3.733 -4.035 1.188) 5.624 30.159 ( -10.868 5.116 0.042) 12.012 30.283 ( -10.137 -7.624 0.494) 12.693 30.621 ( 2.167 3.101 -5.131) 6.375 30.637 ( 1.776 0.640 -2.655) 3.258 30.916 ( 2.478 2.898 -3.237) 5.002 30.981 ( 2.021 -2.696 -3.492) 4.852 31.123 ( -0.654 2.030 -2.586) 3.352 31.185 ( -1.077 -2.768 -4.206) 5.149 31.291 ( 3.236 2.440 5.155) 6.557 31.380 ( -0.100 -5.237 6.012) 7.974 31.717 ( -1.610 3.546 8.328) 9.193 31.777 ( -3.573 -1.061 -1.390) 3.978 32.070 ( 0.102 2.751 11.851) 12.166 32.186 ( -1.875 -7.478 2.909) 8.240 33.346 ( 17.802 5.467 -7.852) 20.211 33.404 ( 12.802 -1.367 -7.086) 14.696 ======================= Grid point 65 (31/60) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.411 ( 7.688 0.000 31.736) 32.654 1.433 ( 0.437 0.000 31.269) 31.272 2.378 ( -2.622 0.000 21.545) 21.704 2.506 ( 2.787 0.000 3.767) 4.685 2.516 ( 0.740 0.000 -13.443) 13.463 2.790 ( -1.058 0.000 13.055) 13.098 2.792 ( -2.110 0.000 -1.335) 2.497 2.996 ( 2.718 0.000 3.115) 4.133 3.062 ( 6.734 0.000 2.010) 7.028 3.219 ( 0.912 0.000 2.404) 2.571 3.293 ( -7.275 0.000 -3.577) 8.107 3.312 ( 5.799 0.000 7.282) 9.309 3.490 ( -0.012 0.000 14.189) 14.189 3.600 ( -5.407 0.000 -5.524) 7.730 3.708 ( 4.310 0.000 1.124) 4.454 3.794 ( -1.592 0.000 -6.666) 6.853 3.844 ( -4.114 0.000 -2.093) 4.616 3.914 ( -3.419 0.000 5.650) 6.604 4.068 ( -3.220 0.000 -2.207) 3.904 4.086 ( 0.711 0.000 0.295) 0.770 4.350 ( 1.745 0.000 -4.217) 4.563 4.364 ( 0.602 0.000 -0.119) 0.614 4.407 ( 3.039 0.000 -3.649) 4.749 4.466 ( -1.776 0.000 -7.017) 7.238 4.606 ( 4.470 0.000 -8.882) 9.944 4.678 ( -1.402 0.000 0.664) 1.551 4.766 ( 7.964 0.000 -4.972) 9.388 4.819 ( -11.926 0.000 3.578) 12.451 4.981 ( 11.984 0.000 1.153) 12.040 5.006 ( -1.484 0.000 7.234) 7.384 5.132 ( -2.131 0.000 -2.386) 3.198 5.162 ( 5.803 0.000 4.489) 7.336 5.419 ( -2.670 0.000 -0.196) 2.677 5.454 ( -0.716 0.000 -8.946) 8.975 5.513 ( 5.502 0.000 3.953) 6.775 5.760 ( -1.339 0.000 6.058) 6.204 5.777 ( 2.676 0.000 -3.692) 4.560 5.833 ( -6.086 0.000 2.906) 6.745 5.966 ( -6.468 0.000 2.793) 7.045 6.118 ( -0.428 0.000 -6.247) 6.262 6.146 ( 3.868 0.000 -3.514) 5.226 6.230 ( -4.176 0.000 -6.408) 7.649 6.823 ( -4.252 0.000 10.721) 11.533 7.034 ( 0.707 0.000 -3.277) 3.352 7.388 ( 2.066 0.000 2.707) 3.405 7.523 ( 2.218 0.000 -7.008) 7.351 7.680 ( -3.540 0.000 -3.161) 4.746 7.701 ( -0.591 0.000 -4.185) 4.227 8.128 ( -3.473 0.000 1.384) 3.739 8.231 ( -0.517 0.000 -4.065) 4.098 8.409 ( 1.791 0.000 -2.913) 3.419 8.459 ( 1.537 0.000 -5.162) 5.386 8.694 ( 2.542 0.000 -1.656) 3.034 8.824 ( -1.097 0.000 -5.662) 5.767 8.824 ( -5.392 0.000 2.844) 6.096 9.005 ( 0.569 0.000 -5.321) 5.351 9.159 ( -1.192 0.000 0.417) 1.263 9.177 ( 3.250 0.000 -1.410) 3.543 9.407 ( -3.884 0.000 4.344) 5.827 9.476 ( 5.331 0.000 5.041) 7.337 9.519 ( 6.409 0.000 6.901) 9.418 9.775 ( -3.631 0.000 -2.068) 4.179 10.075 ( 1.189 0.000 -0.215) 1.208 10.093 ( 2.850 0.000 -2.338) 3.686 10.270 ( -0.597 0.000 3.028) 3.086 10.426 ( -1.821 0.000 0.239) 1.837 10.445 ( 3.606 0.000 -1.324) 3.841 10.509 ( -4.567 0.000 -4.979) 6.757 10.652 ( 4.851 0.000 2.160) 5.310 10.710 ( 0.150 0.000 -0.688) 0.704 10.833 ( 4.686 0.000 -6.445) 7.968 10.865 ( -2.710 0.000 -3.990) 4.823 10.970 ( -1.819 0.000 5.883) 6.158 11.058 ( 3.762 0.000 10.303) 10.969 11.115 ( 7.700 0.000 3.900) 8.631 11.134 ( -5.409 0.000 0.862) 5.477 11.344 ( -0.910 0.000 -1.978) 2.177 11.493 ( -1.666 0.000 -2.096) 2.677 11.580 ( 0.802 0.000 -8.183) 8.222 11.676 ( 3.183 0.000 -2.507) 4.052 11.881 ( 2.363 0.000 10.606) 10.866 11.975 ( -7.249 0.000 5.031) 8.824 12.273 ( -13.761 0.000 -0.777) 13.783 12.289 ( 6.519 0.000 -3.686) 7.489 12.361 ( 2.703 0.000 -3.740) 4.615 12.418 ( 0.014 0.000 -3.757) 3.757 12.485 ( 4.343 0.000 -6.433) 7.762 12.559 ( 4.523 0.000 -3.062) 5.462 12.702 ( -3.919 0.000 8.547) 9.403 12.857 ( -3.877 0.000 4.058) 5.613 12.903 ( -5.914 0.000 -0.750) 5.961 13.033 ( 10.050 0.000 -4.590) 11.048 13.091 ( 4.435 0.000 2.149) 4.928 13.143 ( 3.987 0.000 -4.117) 5.732 13.205 ( 4.393 0.000 -6.212) 7.608 13.272 ( -7.516 0.000 -1.371) 7.640 13.321 ( -3.375 0.000 5.763) 6.679 13.537 ( -2.986 0.000 3.600) 4.678 13.557 ( -1.388 0.000 1.154) 1.805 13.649 ( 8.968 0.000 -6.719) 11.206 13.779 ( -3.207 0.000 7.819) 8.451 13.785 ( -0.553 0.000 -1.348) 1.457 13.816 ( 2.080 0.000 4.769) 5.203 13.898 ( -5.751 0.000 2.185) 6.152 14.077 ( 10.257 0.000 0.548) 10.271 14.158 ( -5.778 0.000 -2.454) 6.278 14.355 ( 3.343 0.000 -3.202) 4.629 14.398 ( -2.600 0.000 -0.895) 2.750 14.513 ( -0.440 0.000 0.564) 0.715 14.530 ( -1.121 0.000 0.378) 1.183 14.634 ( 4.187 0.000 0.146) 4.189 14.772 ( 5.289 0.000 2.084) 5.684 14.861 ( 3.633 0.000 -1.298) 3.858 14.876 ( 4.384 0.000 0.050) 4.384 15.149 ( -0.271 0.000 -2.960) 2.972 15.213 ( -2.721 0.000 -4.363) 5.142 15.427 ( -0.991 0.000 1.144) 1.513 15.464 ( -1.582 0.000 0.711) 1.735 15.655 ( 2.421 0.000 -1.968) 3.120 15.665 ( -1.973 0.000 -0.404) 2.014 15.752 ( 2.134 0.000 1.834) 2.814 15.841 ( -5.618 0.000 0.516) 5.641 16.269 ( 0.654 0.000 6.963) 6.994 16.462 ( -5.669 0.000 1.249) 5.805 16.674 ( 2.925 0.000 5.741) 6.443 16.721 ( -5.378 0.000 3.683) 6.518 16.803 ( -1.843 0.000 0.678) 1.964 16.824 ( -2.502 0.000 0.511) 2.554 16.880 ( -2.259 0.000 1.175) 2.546 16.905 ( 5.891 0.000 -3.690) 6.951 17.082 ( -0.446 0.000 -1.066) 1.156 17.088 ( 5.570 0.000 0.692) 5.613 17.461 ( -2.137 0.000 0.006) 2.137 17.498 ( 3.542 0.000 -1.364) 3.795 17.631 ( -1.234 0.000 7.215) 7.320 17.941 ( 1.698 0.000 -7.185) 7.383 18.055 ( -0.227 0.000 4.828) 4.833 18.158 ( -4.854 0.000 0.410) 4.871 18.167 ( 4.487 0.000 -1.628) 4.773 18.268 ( -2.353 0.000 -2.451) 3.398 18.436 ( -0.245 0.000 1.620) 1.638 18.585 ( -2.901 0.000 -3.733) 4.728 18.702 ( -1.082 0.000 3.473) 3.638 18.773 ( 0.509 0.000 0.495) 0.710 18.829 ( -4.410 0.000 1.437) 4.639 18.950 ( -0.359 0.000 -3.720) 3.737 19.042 ( -1.668 0.000 1.565) 2.287 19.199 ( -2.181 0.000 -4.886) 5.351 27.680 ( -0.217 0.000 1.327) 1.344 27.704 ( 2.034 0.000 1.679) 2.637 27.709 ( 0.253 0.000 1.262) 1.287 27.743 ( 0.139 0.000 -0.917) 0.928 27.760 ( 0.406 0.000 -0.872) 0.961 27.763 ( -0.320 0.000 -0.684) 0.755 27.835 ( 1.381 0.000 -0.235) 1.401 27.858 ( -1.760 0.000 -0.600) 1.860 29.265 ( 0.067 0.000 5.279) 5.280 29.503 ( -1.174 0.000 -4.367) 4.522 29.671 ( 12.693 0.000 2.468) 12.931 29.684 ( -2.472 0.000 -1.824) 3.072 29.685 ( 4.259 0.000 -2.581) 4.980 29.809 ( -7.195 0.000 -3.036) 7.809 29.918 ( -6.676 0.000 2.600) 7.165 29.947 ( 6.305 0.000 1.134) 6.407 30.137 ( 2.699 0.000 8.374) 8.799 30.422 ( 0.705 0.000 -3.230) 3.306 30.525 ( 3.735 0.000 2.562) 4.529 30.616 ( -6.213 0.000 -0.977) 6.289 30.773 ( -4.142 0.000 0.753) 4.210 30.828 ( 4.655 0.000 -5.302) 7.056 30.910 ( -5.632 0.000 -5.799) 8.084 31.005 ( 1.453 0.000 -8.812) 8.931 31.385 ( 8.541 0.000 3.476) 9.221 31.527 ( -7.718 0.000 -2.433) 8.092 31.693 ( -5.724 0.000 10.128) 11.634 32.142 ( 4.282 0.000 -9.292) 10.231 32.272 ( 1.440 0.000 19.528) 19.581 32.739 ( -1.131 0.000 10.941) 10.999 32.810 ( -3.184 0.000 -4.888) 5.834 33.289 ( 1.646 0.000 -13.449) 13.549 ======================= Grid point 66 (32/60) ======================= q-point: ( 0.17 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.609 ( -2.201 0.000 31.307) 31.384 1.821 ( 11.487 0.000 28.176) 30.428 2.395 ( 6.474 0.000 -15.075) 16.406 2.457 ( 6.409 0.000 -19.919) 20.924 2.675 ( 0.710 0.000 7.836) 7.868 2.717 ( -3.984 0.000 0.441) 4.009 2.887 ( 4.711 0.000 22.994) 23.472 3.092 ( -6.699 0.000 -0.611) 6.727 3.151 ( 7.863 0.000 0.216) 7.866 3.211 ( -0.178 0.000 1.388) 1.400 3.303 ( 0.690 0.000 0.147) 0.705 3.401 ( 4.142 0.000 6.982) 8.119 3.460 ( -7.907 0.000 -4.529) 9.112 3.619 ( 4.800 0.000 5.960) 7.653 3.673 ( -4.735 0.000 7.514) 8.882 3.755 ( 3.498 0.000 -8.513) 9.204 3.871 ( 6.310 0.000 3.800) 7.366 3.881 ( 1.290 0.000 -4.443) 4.627 4.014 ( 0.913 0.000 -1.207) 1.513 4.143 ( 5.401 0.000 2.255) 5.853 4.293 ( -1.594 0.000 -8.912) 9.053 4.309 ( -3.374 0.000 -0.581) 3.423 4.401 ( -4.806 0.000 -1.663) 5.085 4.502 ( 3.817 0.000 -4.430) 5.847 4.591 ( -9.100 0.000 4.314) 10.071 4.667 ( 0.130 0.000 -0.795) 0.806 4.693 ( 6.809 0.000 -1.235) 6.920 4.902 ( 6.931 0.000 -6.761) 9.682 4.976 ( -4.207 0.000 3.710) 5.609 5.006 ( -5.889 0.000 -1.713) 6.133 5.189 ( 1.441 0.000 2.493) 2.879 5.284 ( 0.378 0.000 -9.289) 9.296 5.331 ( -1.466 0.000 -0.897) 1.719 5.371 ( -0.317 0.000 -2.556) 2.575 5.599 ( -1.399 0.000 6.953) 7.092 5.702 ( -16.225 0.000 3.937) 16.696 5.725 ( -0.292 0.000 -9.950) 9.955 5.816 ( 0.135 0.000 7.145) 7.147 5.851 ( 1.792 0.000 10.054) 10.213 5.989 ( -15.674 0.000 -3.656) 16.095 6.149 ( 6.718 0.000 -5.760) 8.850 6.245 ( 7.063 0.000 -1.611) 7.244 6.797 ( -3.960 0.000 9.840) 10.607 6.987 ( -4.474 0.000 -0.402) 4.492 7.426 ( -0.194 0.000 3.919) 3.924 7.503 ( -0.289 0.000 -5.835) 5.842 7.577 ( -2.846 0.000 -7.009) 7.564 7.662 ( -2.361 0.000 0.804) 2.494 8.057 ( -3.520 0.000 2.279) 4.193 8.234 ( 1.810 0.000 -2.576) 3.148 8.466 ( 4.994 0.000 -2.186) 5.452 8.491 ( 4.338 0.000 -4.537) 6.277 8.696 ( -3.104 0.000 -1.269) 3.353 8.746 ( -3.876 0.000 -4.587) 6.005 8.751 ( -1.219 0.000 2.983) 3.222 8.976 ( -0.724 0.000 -2.085) 2.207 9.129 ( -1.490 0.000 -0.147) 1.497 9.201 ( 0.073 0.000 -1.123) 1.126 9.322 ( -5.987 0.000 2.542) 6.505 9.534 ( -0.538 0.000 2.691) 2.744 9.623 ( -5.882 0.000 -6.175) 8.528 9.652 ( -0.622 0.000 7.063) 7.090 10.073 ( 0.301 0.000 -4.171) 4.181 10.139 ( 1.258 0.000 1.162) 1.713 10.358 ( 5.111 0.000 7.888) 9.400 10.377 ( -2.878 0.000 -1.442) 3.219 10.451 ( 1.819 0.000 -6.577) 6.824 10.533 ( 0.757 0.000 2.247) 2.371 10.684 ( -0.486 0.000 -2.429) 2.478 10.718 ( -0.955 0.000 -4.308) 4.413 10.764 ( -3.944 0.000 -5.719) 6.947 10.810 ( -1.668 0.000 -0.737) 1.824 10.951 ( -3.379 0.000 -7.413) 8.146 11.005 ( -0.346 0.000 7.040) 7.048 11.148 ( -0.433 0.000 14.092) 14.099 11.204 ( -5.188 0.000 -1.590) 5.426 11.283 ( -3.254 0.000 5.560) 6.442 11.483 ( 4.653 0.000 -10.019) 11.047 11.488 ( -2.756 0.000 -7.792) 8.265 11.697 ( 0.942 0.000 -2.789) 2.944 11.921 ( -1.256 0.000 5.134) 5.285 11.977 ( 1.197 0.000 8.554) 8.638 12.033 ( -5.910 0.000 0.637) 5.944 12.266 ( -10.379 0.000 -0.901) 10.418 12.392 ( 2.003 0.000 -0.588) 2.087 12.430 ( 4.592 0.000 -1.658) 4.882 12.612 ( 2.267 0.000 1.498) 2.717 12.626 ( 3.911 0.000 -8.534) 9.387 12.645 ( -1.493 0.000 -3.209) 3.539 12.786 ( -5.535 0.000 3.144) 6.365 12.848 ( 2.413 0.000 4.561) 5.160 13.070 ( -3.474 0.000 1.790) 3.908 13.142 ( -3.007 0.000 -0.366) 3.029 13.175 ( 2.701 0.000 -2.901) 3.964 13.197 ( 1.808 0.000 -4.270) 4.637 13.291 ( 3.522 0.000 2.343) 4.231 13.383 ( 8.419 0.000 -6.940) 10.911 13.473 ( -2.991 0.000 0.019) 2.991 13.500 ( -4.847 0.000 6.228) 7.892 13.703 ( -2.651 0.000 0.992) 2.830 13.745 ( -1.610 0.000 2.467) 2.946 13.817 ( 4.416 0.000 -4.250) 6.129 13.896 ( 4.166 0.000 1.048) 4.296 13.966 ( 7.860 0.000 3.760) 8.713 14.037 ( -3.504 0.000 -3.032) 4.634 14.243 ( 2.512 0.000 1.054) 2.724 14.348 ( -0.244 0.000 -2.304) 2.317 14.454 ( 7.607 0.000 -2.022) 7.871 14.539 ( 1.751 0.000 1.628) 2.390 14.624 ( 9.455 0.000 1.764) 9.619 14.660 ( -0.930 0.000 0.168) 0.945 14.750 ( -6.267 0.000 -3.931) 7.398 14.929 ( 1.539 0.000 0.991) 1.831 14.981 ( 5.921 0.000 -5.600) 8.150 15.160 ( 0.276 0.000 -1.714) 1.736 15.228 ( 6.560 0.000 -4.631) 8.030 15.434 ( -1.135 0.000 -1.882) 2.197 15.434 ( 4.452 0.000 1.530) 4.708 15.630 ( -0.616 0.000 -3.949) 3.997 15.684 ( -1.956 0.000 5.083) 5.446 15.758 ( 0.040 0.000 3.942) 3.943 15.790 ( -0.805 0.000 -0.111) 0.813 16.243 ( -6.243 0.000 6.262) 8.842 16.340 ( -5.171 0.000 0.421) 5.188 16.662 ( -1.953 0.000 3.286) 3.823 16.766 ( -0.950 0.000 3.784) 3.902 16.784 ( 1.962 0.000 4.358) 4.779 16.794 ( 1.488 0.000 -0.768) 1.674 16.858 ( -0.349 0.000 2.298) 2.325 17.009 ( 5.097 0.000 -2.766) 5.799 17.142 ( 5.445 0.000 -2.026) 5.810 17.206 ( 4.195 0.000 1.871) 4.594 17.425 ( -0.711 0.000 -0.888) 1.137 17.553 ( 2.371 0.000 -3.537) 4.259 17.658 ( -0.007 0.000 5.914) 5.914 17.845 ( -6.416 0.000 -5.749) 8.615 18.064 ( -0.491 0.000 -0.156) 0.515 18.151 ( 2.469 0.000 7.083) 7.501 18.185 ( -2.515 0.000 -2.549) 3.581 18.270 ( 2.455 0.000 0.463) 2.498 18.447 ( -0.354 0.000 2.981) 3.002 18.539 ( 2.611 0.000 -3.486) 4.356 18.690 ( -1.881 0.000 1.263) 2.265 18.735 ( -4.243 0.000 1.199) 4.409 18.753 ( -4.908 0.000 3.253) 5.889 18.947 ( 2.829 0.000 1.905) 3.411 19.079 ( 2.228 0.000 -0.886) 2.398 19.141 ( -1.054 0.000 -1.501) 1.834 27.691 ( 0.291 0.000 1.618) 1.644 27.707 ( -0.853 0.000 -0.142) 0.865 27.725 ( -0.509 0.000 0.624) 0.805 27.735 ( -1.099 0.000 -1.034) 1.509 27.753 ( 1.110 0.000 -0.849) 1.398 27.780 ( 0.761 0.000 -0.996) 1.253 27.822 ( -0.207 0.000 -0.672) 0.703 27.878 ( 1.864 0.000 0.493) 1.928 29.289 ( -0.857 0.000 5.773) 5.837 29.477 ( 0.812 0.000 -5.321) 5.383 29.603 ( -3.574 0.000 1.195) 3.769 29.647 ( -3.425 0.000 -4.838) 5.928 29.810 ( 6.090 0.000 -1.412) 6.252 29.844 ( 0.809 0.000 0.708) 1.075 30.000 ( 12.032 0.000 1.227) 12.094 30.093 ( 7.325 0.000 0.237) 7.328 30.260 ( 6.268 0.000 1.664) 6.485 30.388 ( -0.956 0.000 -3.358) 3.491 30.482 ( -4.392 0.000 -0.440) 4.414 30.675 ( 6.682 0.000 2.672) 7.196 30.716 ( -3.255 0.000 2.008) 3.825 30.783 ( -3.720 0.000 -3.189) 4.900 30.893 ( 4.342 0.000 -4.333) 6.134 30.993 ( 0.786 0.000 -5.407) 5.464 31.348 ( -6.983 0.000 -5.061) 8.624 31.598 ( 10.144 0.000 4.191) 10.976 31.635 ( -4.958 0.000 11.929) 12.918 32.161 ( 1.105 0.000 -10.633) 10.690 32.367 ( -2.650 0.000 18.964) 19.148 32.656 ( -6.326 0.000 -3.791) 7.375 32.695 ( -8.419 0.000 9.590) 12.761 33.139 ( -8.366 0.000 -12.934) 15.404 ======================= Grid point 67 (33/60) ======================= q-point: ( 0.33 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.606 ( -13.284 0.000 28.482) 31.428 2.121 ( 5.683 0.000 16.669) 17.612 2.537 ( 10.310 0.000 -5.616) 11.741 2.595 ( -7.243 0.000 4.677) 8.622 2.597 ( 6.697 0.000 -7.860) 10.326 2.709 ( 9.094 0.000 -3.335) 9.687 2.905 ( -8.981 0.000 4.915) 10.238 3.030 ( -0.192 0.000 -3.725) 3.730 3.103 ( -6.690 0.000 -13.089) 14.700 3.221 ( -7.230 0.000 -5.149) 8.876 3.254 ( 1.133 0.000 -1.587) 1.950 3.384 ( 6.172 0.000 3.194) 6.949 3.513 ( -0.795 0.000 -1.277) 1.504 3.587 ( 5.771 0.000 1.422) 5.944 3.811 ( -2.572 0.000 1.334) 2.898 3.851 ( 5.789 0.000 -6.289) 8.548 3.936 ( 3.770 0.000 2.300) 4.416 4.066 ( 15.907 0.000 13.249) 20.702 4.179 ( 10.801 0.000 -1.883) 10.964 4.205 ( -2.875 0.000 -4.595) 5.421 4.234 ( -0.625 0.000 -0.067) 0.628 4.265 ( -1.257 0.000 -5.087) 5.240 4.341 ( 6.792 0.000 5.033) 8.453 4.490 ( -2.044 0.000 -8.445) 8.689 4.521 ( -0.489 0.000 5.635) 5.656 4.681 ( 1.775 0.000 -3.804) 4.198 4.769 ( -1.176 0.000 -4.318) 4.475 4.861 ( -6.413 0.000 1.284) 6.541 4.889 ( -5.303 0.000 0.944) 5.387 4.984 ( 3.365 0.000 -5.649) 6.576 5.054 ( -14.602 0.000 2.348) 14.790 5.107 ( -6.100 0.000 1.935) 6.400 5.360 ( -7.064 0.000 -7.136) 10.041 5.389 ( -5.484 0.000 0.954) 5.566 5.400 ( -4.743 0.000 4.728) 6.697 5.496 ( -13.788 0.000 -0.614) 13.802 5.594 ( -0.785 0.000 2.250) 2.383 5.694 ( -0.418 0.000 -7.643) 7.655 5.876 ( -0.670 0.000 9.555) 9.579 6.037 ( 6.129 0.000 11.143) 12.718 6.355 ( 14.755 0.000 -2.760) 15.011 6.416 ( 8.814 0.000 0.598) 8.834 6.730 ( -7.516 0.000 7.749) 10.795 6.872 ( -6.813 0.000 4.121) 7.962 7.423 ( -1.666 0.000 2.382) 2.907 7.435 ( -3.740 0.000 -3.188) 4.915 7.530 ( 2.700 0.000 -6.809) 7.324 7.639 ( 0.129 0.000 0.054) 0.140 8.052 ( 1.600 0.000 5.668) 5.890 8.260 ( 1.684 0.000 -0.394) 1.730 8.547 ( -1.066 0.000 -2.326) 2.559 8.569 ( 5.104 0.000 -3.070) 5.956 8.616 ( -2.986 0.000 0.596) 3.045 8.654 ( 0.786 0.000 -2.730) 2.841 8.752 ( -0.578 0.000 0.706) 0.912 8.972 ( 0.960 0.000 0.481) 1.074 9.090 ( -1.828 0.000 -3.385) 3.848 9.165 ( -3.622 0.000 0.425) 3.647 9.234 ( -2.188 0.000 3.370) 4.018 9.468 ( -6.734 0.000 2.982) 7.365 9.522 ( -0.983 0.000 -7.188) 7.255 9.602 ( -4.707 0.000 0.259) 4.715 10.080 ( 2.994 0.000 -4.207) 5.163 10.113 ( -8.115 0.000 2.482) 8.486 10.272 ( -4.061 0.000 -3.661) 5.467 10.345 ( -8.481 0.000 1.435) 8.602 10.475 ( 3.605 0.000 -8.648) 9.369 10.481 ( -0.793 0.000 5.194) 5.255 10.621 ( -3.357 0.000 -5.397) 6.356 10.730 ( 2.810 0.000 -0.024) 2.810 10.755 ( 3.140 0.000 -8.045) 8.636 10.809 ( -1.270 0.000 0.583) 1.397 10.878 ( 1.584 0.000 -4.335) 4.615 11.039 ( -4.922 0.000 -5.178) 7.144 11.085 ( 4.200 0.000 4.783) 6.365 11.200 ( -2.107 0.000 12.402) 12.579 11.243 ( -3.120 0.000 3.853) 4.958 11.440 ( 1.513 0.000 -5.918) 6.108 11.544 ( 5.060 0.000 -5.359) 7.370 11.692 ( 0.064 0.000 -2.038) 2.039 11.906 ( -2.125 0.000 5.792) 6.170 11.974 ( -14.266 0.000 9.005) 16.870 12.056 ( 0.341 0.000 3.709) 3.724 12.061 ( 5.483 0.000 -0.407) 5.498 12.424 ( 0.408 0.000 -1.329) 1.390 12.503 ( 1.739 0.000 -1.478) 2.283 12.565 ( -2.212 0.000 1.082) 2.462 12.622 ( 0.662 0.000 -5.125) 5.168 12.645 ( 0.121 0.000 -1.117) 1.124 12.708 ( -3.523 0.000 1.959) 4.031 12.942 ( 3.221 0.000 2.876) 4.318 13.016 ( -1.801 0.000 2.013) 2.701 13.103 ( -3.134 0.000 2.880) 4.256 13.193 ( 1.011 0.000 -3.456) 3.601 13.210 ( 3.465 0.000 -4.249) 5.483 13.350 ( 0.404 0.000 2.557) 2.588 13.431 ( 0.057 0.000 -1.674) 1.675 13.441 ( -0.786 0.000 0.293) 0.839 13.518 ( 2.107 0.000 3.471) 4.060 13.664 ( -1.686 0.000 2.225) 2.792 13.746 ( 3.147 0.000 -5.935) 6.718 13.827 ( -0.548 0.000 -1.297) 1.408 13.958 ( -2.076 0.000 -3.299) 3.898 14.023 ( 6.380 0.000 -1.703) 6.603 14.135 ( 3.608 0.000 5.087) 6.237 14.237 ( -1.246 0.000 -2.729) 2.999 14.385 ( 3.885 0.000 1.596) 4.200 14.563 ( 2.754 0.000 0.754) 2.855 14.564 ( -0.491 0.000 0.928) 1.050 14.573 ( -6.700 0.000 -6.155) 9.098 14.652 ( 1.724 0.000 -3.998) 4.354 14.844 ( 7.966 0.000 2.707) 8.413 14.937 ( -1.963 0.000 4.872) 5.252 15.050 ( 2.529 0.000 -2.284) 3.407 15.126 ( -2.016 0.000 1.742) 2.664 15.243 ( -2.351 0.000 -12.443) 12.663 15.406 ( -0.226 0.000 -2.123) 2.135 15.512 ( -3.741 0.000 -4.486) 5.841 15.642 ( 8.246 0.000 -3.299) 8.882 15.649 ( -2.954 0.000 5.453) 6.202 15.841 ( 7.998 0.000 -2.777) 8.467 15.889 ( 9.143 0.000 7.138) 11.600 16.133 ( -6.047 0.000 1.653) 6.269 16.280 ( -1.763 0.000 2.208) 2.825 16.680 ( 1.168 0.000 4.701) 4.844 16.714 ( -4.605 0.000 5.466) 7.148 16.842 ( 3.104 0.000 -1.180) 3.321 16.890 ( 1.737 0.000 2.706) 3.215 16.894 ( 3.860 0.000 3.354) 5.113 17.053 ( -0.302 0.000 -1.172) 1.210 17.222 ( 2.482 0.000 0.071) 2.483 17.264 ( -0.340 0.000 3.686) 3.702 17.415 ( 0.424 0.000 -2.769) 2.801 17.542 ( -0.965 0.000 -6.029) 6.105 17.689 ( -4.058 0.000 -4.236) 5.866 17.695 ( 1.306 0.000 1.640) 2.097 18.060 ( 0.117 0.000 0.898) 0.905 18.129 ( -1.214 0.000 0.045) 1.215 18.272 ( 2.747 0.000 10.005) 10.375 18.294 ( -0.309 0.000 2.726) 2.743 18.458 ( 2.134 0.000 0.537) 2.201 18.583 ( -6.661 0.000 -0.161) 6.663 18.590 ( 0.145 0.000 -4.532) 4.534 18.673 ( -1.233 0.000 3.038) 3.279 18.755 ( 3.056 0.000 3.203) 4.427 19.040 ( 4.375 0.000 2.061) 4.836 19.092 ( -0.340 0.000 -1.934) 1.964 19.139 ( 0.465 0.000 1.502) 1.572 27.680 ( -1.100 0.000 -1.307) 1.708 27.684 ( -1.696 0.000 -0.114) 1.700 27.704 ( -1.455 0.000 0.012) 1.455 27.708 ( -0.773 0.000 -1.200) 1.427 27.778 ( 1.293 0.000 -0.053) 1.294 27.785 ( 1.533 0.000 -0.070) 1.534 27.843 ( 0.996 0.000 -0.199) 1.016 27.903 ( 0.394 0.000 -0.001) 0.394 29.293 ( -1.671 0.000 6.064) 6.290 29.462 ( 0.755 0.000 -6.054) 6.101 29.521 ( -5.546 0.000 1.245) 5.684 29.595 ( 0.830 0.000 -5.114) 5.181 29.878 ( 2.163 0.000 -2.011) 2.954 29.928 ( 4.859 0.000 -0.854) 4.933 30.179 ( 3.696 0.000 4.896) 6.135 30.232 ( 4.901 0.000 -0.406) 4.918 30.376 ( 3.064 0.000 -4.302) 5.281 30.409 ( 7.454 0.000 -3.223) 8.121 30.481 ( 2.975 0.000 1.300) 3.246 30.623 ( -4.068 0.000 1.581) 4.364 30.749 ( -1.584 0.000 0.293) 1.611 30.765 ( 1.785 0.000 0.730) 1.929 30.918 ( -3.759 0.000 -2.550) 4.543 30.990 ( 2.936 0.000 0.640) 3.005 31.237 ( 1.211 0.000 -7.847) 7.940 31.653 ( 0.312 0.000 13.473) 13.476 31.836 ( 9.096 0.000 2.920) 9.553 32.009 ( -7.688 0.000 -12.110) 14.344 32.376 ( -5.385 0.000 16.759) 17.603 32.520 ( -12.151 0.000 7.310) 14.180 32.627 ( 6.000 0.000 -4.722) 7.635 32.854 ( -12.024 0.000 -9.840) 15.537 ======================= Grid point 68 (34/60) ======================= q-point: (-0.50 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( -15.834 0.000 28.692) 32.771 2.207 ( -8.744 0.000 19.646) 21.504 2.427 ( -5.994 0.000 -0.718) 6.036 2.590 ( -1.525 0.000 -3.176) 3.523 2.653 ( -2.036 0.000 -3.887) 4.387 2.830 ( -1.648 0.000 -0.701) 1.791 2.891 ( 3.600 0.000 8.485) 9.217 2.970 ( -2.325 0.000 -6.336) 6.749 2.989 ( 2.356 0.000 -10.238) 10.506 3.144 ( 2.283 0.000 -7.115) 7.472 3.205 ( 0.702 0.000 -6.728) 6.765 3.487 ( 3.687 0.000 -4.552) 5.858 3.550 ( 0.402 0.000 2.668) 2.698 3.656 ( 1.539 0.000 1.054) 1.865 3.691 ( -6.610 0.000 5.462) 8.574 3.864 ( -0.795 0.000 -2.615) 2.733 4.063 ( 4.802 0.000 -3.095) 5.713 4.130 ( -3.273 0.000 -2.660) 4.218 4.185 ( -6.659 0.000 -0.945) 6.726 4.216 ( 1.677 0.000 -2.440) 2.961 4.285 ( -9.117 0.000 -1.601) 9.257 4.344 ( 5.269 0.000 -0.603) 5.304 4.452 ( -5.441 0.000 2.864) 6.148 4.519 ( 12.472 0.000 -0.385) 12.478 4.553 ( 1.324 0.000 2.180) 2.551 4.626 ( -6.638 0.000 -3.690) 7.595 4.692 ( -1.760 0.000 -2.840) 3.341 4.808 ( 1.871 0.000 8.350) 8.557 4.822 ( 4.217 0.000 -0.957) 4.324 4.906 ( 2.532 0.000 2.060) 3.264 4.943 ( 0.567 0.000 -2.646) 2.706 5.037 ( -5.565 0.000 -4.762) 7.324 5.117 ( 6.188 0.000 -1.649) 6.404 5.247 ( -5.419 0.000 -1.748) 5.694 5.399 ( -2.480 0.000 8.770) 9.114 5.536 ( 5.667 0.000 -4.506) 7.240 5.598 ( 0.138 0.000 -4.192) 4.194 5.665 ( 1.169 0.000 -2.523) 2.781 5.902 ( -2.068 0.000 14.304) 14.453 6.164 ( -0.671 0.000 6.161) 6.198 6.580 ( 2.904 0.000 9.153) 9.602 6.619 ( -3.173 0.000 3.656) 4.841 6.651 ( 12.737 0.000 -2.574) 12.994 6.761 ( -6.111 0.000 4.694) 7.706 7.370 ( 0.164 0.000 -1.701) 1.709 7.381 ( -2.452 0.000 -2.750) 3.684 7.604 ( 5.970 0.000 -2.422) 6.442 7.651 ( 1.937 0.000 -3.690) 4.167 8.173 ( 6.133 0.000 6.207) 8.726 8.316 ( 3.189 0.000 1.173) 3.397 8.411 ( -8.024 0.000 -0.488) 8.039 8.562 ( 0.998 0.000 -5.582) 5.670 8.646 ( 0.806 0.000 2.334) 2.470 8.720 ( -2.659 0.000 -0.452) 2.698 8.756 ( 6.639 0.000 -2.562) 7.116 9.020 ( 2.372 0.000 -2.315) 3.314 9.040 ( 0.815 0.000 -1.551) 1.753 9.074 ( -4.533 0.000 2.373) 5.116 9.283 ( 3.641 0.000 5.618) 6.695 9.366 ( -3.053 0.000 -0.845) 3.168 9.468 ( -6.910 0.000 -3.071) 7.561 9.486 ( 1.753 0.000 -6.201) 6.444 9.901 ( -7.877 0.000 1.741) 8.067 10.142 ( 5.691 0.000 -6.389) 8.556 10.201 ( -2.896 0.000 0.325) 2.914 10.330 ( 1.980 0.000 2.624) 3.287 10.408 ( -3.907 0.000 2.219) 4.493 10.474 ( 0.056 0.000 -9.979) 9.979 10.542 ( -1.998 0.000 -3.912) 4.393 10.660 ( -2.102 0.000 -7.663) 7.946 10.791 ( -2.104 0.000 0.497) 2.162 10.806 ( 2.962 0.000 1.408) 3.280 10.956 ( 4.652 0.000 -3.654) 5.916 10.967 ( -1.323 0.000 -2.323) 2.673 11.145 ( -6.271 0.000 6.603) 9.106 11.218 ( 6.384 0.000 3.168) 7.127 11.254 ( -0.142 0.000 6.218) 6.220 11.416 ( -2.733 0.000 -5.144) 5.825 11.615 ( 3.720 0.000 -5.319) 6.491 11.674 ( -4.409 0.000 2.009) 4.845 11.769 ( -4.041 0.000 6.915) 8.009 11.951 ( 3.455 0.000 7.633) 8.379 12.161 ( 5.821 0.000 5.146) 7.769 12.185 ( 7.190 0.000 -2.762) 7.702 12.384 ( -2.616 0.000 -0.175) 2.622 12.452 ( -3.376 0.000 -4.670) 5.762 12.554 ( -1.344 0.000 4.296) 4.501 12.586 ( -4.598 0.000 4.915) 6.731 12.643 ( 1.117 0.000 -4.248) 4.393 12.708 ( 3.221 0.000 -3.792) 4.975 12.996 ( -0.672 0.000 3.722) 3.783 13.017 ( 0.841 0.000 0.841) 1.189 13.055 ( -1.059 0.000 1.634) 1.947 13.181 ( -0.574 0.000 -2.921) 2.977 13.281 ( 4.577 0.000 -4.874) 6.686 13.334 ( -2.045 0.000 -1.572) 2.580 13.423 ( -1.974 0.000 3.581) 4.089 13.432 ( -0.906 0.000 5.595) 5.668 13.548 ( -0.340 0.000 2.735) 2.756 13.656 ( -0.165 0.000 1.476) 1.485 13.803 ( -1.051 0.000 -1.471) 1.808 13.829 ( 7.896 0.000 -7.258) 10.725 13.914 ( -0.814 0.000 -1.612) 1.805 14.061 ( -1.503 0.000 -8.854) 8.981 14.162 ( -2.424 0.000 4.238) 4.882 14.233 ( 2.621 0.000 1.384) 2.964 14.427 ( -5.447 0.000 -1.992) 5.800 14.433 ( -2.448 0.000 1.300) 2.772 14.567 ( -0.510 0.000 3.261) 3.300 14.583 ( -0.765 0.000 0.934) 1.207 14.661 ( 1.836 0.000 -3.044) 3.555 14.901 ( -4.154 0.000 5.241) 6.688 14.949 ( 0.360 0.000 0.651) 0.744 15.004 ( -5.893 0.000 -1.752) 6.148 15.095 ( -3.673 0.000 -7.387) 8.250 15.141 ( 3.832 0.000 -2.183) 4.410 15.412 ( 2.105 0.000 -3.019) 3.680 15.416 ( -1.665 0.000 -4.218) 4.535 15.632 ( -0.193 0.000 0.536) 0.570 15.731 ( 1.093 0.000 -0.329) 1.142 15.973 ( -6.960 0.000 0.658) 6.991 16.078 ( 13.758 0.000 -2.554) 13.993 16.148 ( 7.819 0.000 2.777) 8.298 16.269 ( 0.012 0.000 0.691) 0.691 16.640 ( -5.395 0.000 5.420) 7.647 16.750 ( 2.721 0.000 5.717) 6.332 16.896 ( 2.270 0.000 0.455) 2.315 16.927 ( -0.195 0.000 2.347) 2.355 16.928 ( -3.908 0.000 4.281) 5.796 16.993 ( -3.545 0.000 -1.312) 3.780 17.230 ( -4.419 0.000 4.020) 5.974 17.245 ( -0.748 0.000 1.499) 1.675 17.407 ( 0.232 0.000 -2.089) 2.102 17.468 ( -1.902 0.000 -5.621) 5.934 17.676 ( 3.945 0.000 -3.720) 5.423 17.705 ( -0.026 0.000 -3.135) 3.136 18.077 ( 0.148 0.000 2.739) 2.743 18.148 ( 0.905 0.000 2.441) 2.603 18.314 ( 1.837 0.000 2.402) 3.024 18.322 ( -1.309 0.000 7.048) 7.168 18.460 ( -3.977 0.000 -1.655) 4.308 18.517 ( -3.705 0.000 2.378) 4.403 18.572 ( 6.042 0.000 2.587) 6.573 18.706 ( 2.606 0.000 -4.632) 5.315 18.846 ( 2.929 0.000 4.671) 5.513 19.048 ( -2.298 0.000 -2.887) 3.690 19.137 ( 4.086 0.000 0.803) 4.164 19.164 ( 1.461 0.000 0.859) 1.695 27.642 ( -1.537 0.000 -0.387) 1.585 27.655 ( -0.521 0.000 -0.948) 1.082 27.679 ( -0.960 0.000 -0.202) 0.981 27.695 ( 0.132 0.000 -1.170) 1.177 27.798 ( 0.449 0.000 0.125) 0.466 27.822 ( 1.039 0.000 -0.405) 1.115 27.850 ( 0.273 0.000 0.695) 0.746 27.897 ( -0.737 0.000 -0.614) 0.959 29.291 ( -1.791 0.000 5.989) 6.251 29.399 ( -5.874 0.000 0.505) 5.895 29.462 ( 2.385 0.000 -4.149) 4.786 29.602 ( 2.377 0.000 -6.102) 6.549 29.904 ( 0.939 0.000 0.662) 1.149 29.950 ( -2.575 0.000 -1.524) 2.992 30.189 ( -4.939 0.000 0.677) 4.986 30.288 ( 2.664 0.000 -1.503) 3.058 30.429 ( -4.248 0.000 0.960) 4.355 30.464 ( 3.361 0.000 -1.404) 3.642 30.579 ( 8.825 0.000 0.666) 8.851 30.626 ( -6.957 0.000 -1.811) 7.189 30.677 ( 2.095 0.000 8.054) 8.323 30.776 ( -6.719 0.000 -2.251) 7.086 30.863 ( 8.658 0.000 -3.290) 9.262 31.059 ( 3.078 0.000 -3.921) 4.985 31.325 ( 8.845 0.000 -0.598) 8.865 31.653 ( -13.574 0.000 -10.467) 17.141 31.759 ( 1.536 0.000 12.525) 12.618 32.120 ( 11.494 0.000 -2.332) 11.728 32.297 ( -12.538 0.000 12.731) 17.869 32.378 ( -1.320 0.000 7.921) 8.031 32.570 ( -8.660 0.000 -7.404) 11.394 32.811 ( 12.533 0.000 -5.886) 13.846 ======================= Grid point 69 (35/60) ======================= q-point: (-0.33 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.313 ( -11.746 0.000 30.059) 32.272 1.956 ( -28.138 0.000 16.413) 32.575 2.259 ( -8.736 0.000 14.654) 17.060 2.543 ( -1.498 0.000 -0.316) 1.531 2.605 ( -2.671 0.000 0.093) 2.673 2.785 ( -0.447 0.000 -4.410) 4.433 2.861 ( -3.441 0.000 -7.150) 7.934 2.926 ( -2.212 0.000 8.708) 8.985 3.012 ( 3.404 0.000 -1.068) 3.568 3.126 ( -1.172 0.000 -2.975) 3.197 3.274 ( 4.711 0.000 2.112) 5.163 3.515 ( -9.206 0.000 -8.962) 12.848 3.535 ( 2.316 0.000 -5.226) 5.716 3.566 ( 0.153 0.000 5.639) 5.641 3.758 ( 9.505 0.000 3.641) 10.178 3.892 ( -0.276 0.000 6.923) 6.929 3.897 ( -11.650 0.000 -5.065) 12.704 4.050 ( -6.285 0.000 3.100) 7.008 4.070 ( -3.537 0.000 -2.846) 4.540 4.089 ( -4.776 0.000 1.194) 4.923 4.266 ( 1.894 0.000 -1.353) 2.328 4.385 ( -7.797 0.000 1.537) 7.947 4.433 ( 5.944 0.000 -5.770) 8.284 4.475 ( 1.364 0.000 1.279) 1.870 4.535 ( -4.575 0.000 -2.673) 5.299 4.601 ( 3.984 0.000 3.910) 5.582 4.753 ( -0.369 0.000 -17.364) 17.368 4.776 ( 6.980 0.000 3.937) 8.013 4.925 ( -4.016 0.000 -3.176) 5.120 4.990 ( 2.826 0.000 1.115) 3.038 5.095 ( 3.931 0.000 -0.151) 3.934 5.168 ( 6.824 0.000 -1.651) 7.021 5.234 ( 9.149 0.000 5.029) 10.440 5.332 ( 14.401 0.000 -1.791) 14.512 5.426 ( 6.951 0.000 5.143) 8.647 5.544 ( -2.290 0.000 -2.824) 3.636 5.590 ( 3.424 0.000 -1.677) 3.813 5.718 ( 3.889 0.000 -2.473) 4.609 5.950 ( -1.055 0.000 11.949) 11.995 6.073 ( -7.771 0.000 2.478) 8.156 6.544 ( -4.544 0.000 -1.785) 4.882 6.562 ( -11.386 0.000 -0.871) 11.420 6.722 ( 2.721 0.000 13.217) 13.494 6.895 ( 9.558 0.000 -3.309) 10.114 7.317 ( -1.304 0.000 -2.043) 2.424 7.408 ( 3.151 0.000 -2.519) 4.034 7.698 ( 5.646 0.000 -8.261) 10.006 7.707 ( 4.147 0.000 -1.532) 4.421 8.250 ( -6.277 0.000 2.293) 6.683 8.344 ( 6.720 0.000 0.958) 6.788 8.350 ( 0.742 0.000 -4.810) 4.867 8.522 ( -3.980 0.000 -4.296) 5.856 8.651 ( -2.519 0.000 -1.236) 2.806 8.742 ( 7.516 0.000 7.357) 10.517 8.839 ( 2.744 0.000 -2.571) 3.760 9.003 ( 0.955 0.000 -7.730) 7.788 9.033 ( -0.863 0.000 0.288) 0.910 9.113 ( 2.451 0.000 2.722) 3.663 9.326 ( 0.242 0.000 -2.767) 2.777 9.345 ( -3.006 0.000 0.757) 3.100 9.394 ( 2.144 0.000 8.111) 8.390 9.579 ( 8.676 0.000 -2.705) 9.088 9.895 ( 7.136 0.000 0.559) 7.158 10.111 ( -5.324 0.000 3.302) 6.265 10.254 ( 6.394 0.000 -2.935) 7.036 10.356 ( -1.620 0.000 -2.047) 2.610 10.424 ( 3.938 0.000 1.153) 4.103 10.430 ( 3.239 0.000 -2.094) 3.857 10.501 ( -1.060 0.000 -0.004) 1.060 10.647 ( 2.256 0.000 -4.628) 5.148 10.740 ( -1.273 0.000 -1.017) 1.629 10.847 ( 0.826 0.000 -0.020) 0.826 10.941 ( 0.006 0.000 -1.093) 1.093 10.969 ( -2.060 0.000 -2.930) 3.581 11.059 ( -4.981 0.000 6.112) 7.885 11.280 ( -6.998 0.000 -2.144) 7.319 11.285 ( 1.174 0.000 2.047) 2.360 11.373 ( 7.360 0.000 0.103) 7.361 11.598 ( -2.668 0.000 5.788) 6.373 11.621 ( -0.570 0.000 -4.479) 4.515 11.804 ( 1.070 0.000 2.460) 2.683 12.092 ( 4.233 0.000 6.853) 8.055 12.299 ( 2.519 0.000 0.723) 2.620 12.305 ( 3.063 0.000 5.934) 6.678 12.365 ( 2.460 0.000 -2.315) 3.379 12.388 ( 0.970 0.000 -5.359) 5.446 12.527 ( -2.826 0.000 0.632) 2.896 12.543 ( 1.040 0.000 1.255) 1.630 12.643 ( 0.538 0.000 -0.876) 1.029 12.737 ( 1.466 0.000 -3.713) 3.992 12.957 ( -3.742 0.000 4.225) 5.644 13.033 ( -0.340 0.000 -0.105) 0.356 13.081 ( 1.707 0.000 -0.118) 1.711 13.141 ( -1.781 0.000 -2.354) 2.951 13.261 ( -3.123 0.000 -3.676) 4.823 13.329 ( 3.370 0.000 -4.739) 5.815 13.388 ( -3.021 0.000 4.519) 5.436 13.498 ( 2.426 0.000 9.420) 9.727 13.555 ( -0.382 0.000 2.693) 2.720 13.671 ( 1.716 0.000 -0.043) 1.717 13.751 ( -3.341 0.000 -4.364) 5.496 13.886 ( -3.485 0.000 -0.290) 3.497 13.901 ( -1.490 0.000 2.088) 2.565 13.944 ( -2.950 0.000 -8.289) 8.798 14.160 ( 4.893 0.000 -2.411) 5.455 14.274 ( -4.548 0.000 4.306) 6.263 14.314 ( -2.482 0.000 -0.733) 2.588 14.351 ( -3.835 0.000 1.947) 4.301 14.562 ( -0.784 0.000 1.326) 1.540 14.566 ( -1.147 0.000 2.838) 3.061 14.676 ( -1.895 0.000 0.932) 2.112 14.793 ( -4.816 0.000 -11.216) 12.206 14.842 ( -3.294 0.000 4.828) 5.844 14.915 ( -7.830 0.000 2.533) 8.229 15.083 ( 3.869 0.000 3.661) 5.327 15.223 ( 4.218 0.000 -4.105) 5.886 15.391 ( 0.415 0.000 -2.651) 2.683 15.447 ( 2.481 0.000 -2.373) 3.433 15.639 ( 0.799 0.000 -1.533) 1.729 15.707 ( -3.016 0.000 2.830) 4.136 15.814 ( -6.773 0.000 -3.605) 7.673 16.200 ( -2.271 0.000 -1.894) 2.957 16.249 ( 0.373 0.000 2.549) 2.576 16.385 ( 11.458 0.000 -3.954) 12.121 16.561 ( -4.502 0.000 5.892) 7.415 16.830 ( 1.480 0.000 3.837) 4.112 16.831 ( -4.193 0.000 1.712) 4.529 16.900 ( -3.265 0.000 2.883) 4.355 16.915 ( -4.299 0.000 1.630) 4.598 16.934 ( 0.160 0.000 2.148) 2.154 17.140 ( -5.814 0.000 2.431) 6.302 17.205 ( -3.550 0.000 1.273) 3.771 17.418 ( 1.649 0.000 -0.124) 1.654 17.429 ( 0.514 0.000 -3.491) 3.528 17.682 ( -0.441 0.000 -2.319) 2.360 17.766 ( 6.207 0.000 -3.747) 7.250 18.078 ( -1.409 0.000 2.573) 2.934 18.140 ( -1.698 0.000 0.238) 1.714 18.318 ( -2.515 0.000 5.020) 5.614 18.381 ( 0.381 0.000 3.587) 3.607 18.420 ( 0.836 0.000 -2.349) 2.493 18.495 ( 1.609 0.000 -0.851) 1.820 18.673 ( 1.827 0.000 3.567) 4.008 18.747 ( 4.829 0.000 -4.884) 6.869 18.900 ( -0.267 0.000 4.381) 4.389 18.973 ( -2.621 0.000 -5.163) 5.790 19.206 ( 1.947 0.000 -0.855) 2.126 19.214 ( 3.254 0.000 -1.858) 3.747 27.629 ( 0.223 0.000 0.683) 0.719 27.656 ( 0.910 0.000 0.195) 0.930 27.667 ( -0.051 0.000 0.150) 0.159 27.701 ( 0.883 0.000 -0.480) 1.005 27.794 ( -0.749 0.000 -0.322) 0.815 27.804 ( -1.508 0.000 -1.006) 1.813 27.873 ( -1.090 0.000 -0.897) 1.412 27.876 ( 0.843 0.000 1.180) 1.450 29.262 ( -3.256 0.000 3.236) 4.590 29.341 ( -0.588 0.000 5.251) 5.284 29.518 ( 4.048 0.000 -1.051) 4.182 29.614 ( 2.071 0.000 -7.335) 7.622 29.849 ( -4.774 0.000 -0.853) 4.849 29.919 ( -1.177 0.000 1.488) 1.897 30.039 ( -7.771 0.000 3.079) 8.359 30.298 ( -11.835 0.000 0.581) 11.849 30.329 ( -6.036 0.000 -1.703) 6.271 30.339 ( 0.360 0.000 -0.564) 0.669 30.628 ( -1.487 0.000 -2.326) 2.761 30.663 ( 3.317 0.000 -6.028) 6.881 30.716 ( -0.492 0.000 4.849) 4.874 30.777 ( 6.900 0.000 3.569) 7.769 31.038 ( 8.805 0.000 -3.218) 9.375 31.066 ( 1.180 0.000 -8.460) 8.542 31.336 ( -11.129 0.000 -9.544) 14.661 31.538 ( 8.302 0.000 7.239) 11.015 31.801 ( -2.689 0.000 6.374) 6.918 32.138 ( -8.648 0.000 13.594) 16.112 32.210 ( -0.477 0.000 -11.962) 11.971 32.469 ( 4.913 0.000 9.487) 10.684 32.533 ( 8.092 0.000 2.919) 8.602 33.048 ( 13.378 0.000 -9.402) 16.352 ======================= Grid point 70 (36/60) ======================= q-point: (-0.17 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.305 ( -5.074 0.000 31.108) 31.519 1.422 ( -24.848 0.000 22.398) 33.453 2.271 ( -6.193 0.000 39.454) 39.938 2.526 ( 0.251 0.000 -0.869) 0.904 2.546 ( -1.838 0.000 -4.952) 5.282 2.769 ( -2.838 0.000 3.100) 4.203 2.785 ( 2.882 0.000 -5.032) 5.799 2.958 ( 2.055 0.000 2.435) 3.186 3.049 ( -4.071 0.000 0.813) 4.152 3.142 ( 6.523 0.000 0.380) 6.534 3.274 ( -7.692 0.000 0.725) 7.726 3.390 ( 4.226 0.000 4.853) 6.436 3.498 ( -10.607 0.000 3.524) 11.177 3.607 ( 5.180 0.000 -5.233) 7.363 3.786 ( 3.591 0.000 -1.023) 3.734 3.794 ( -10.140 0.000 4.273) 11.004 3.891 ( 0.559 0.000 1.513) 1.613 3.940 ( -4.270 0.000 -3.772) 5.698 4.099 ( 0.446 0.000 2.823) 2.858 4.156 ( 9.838 0.000 1.325) 9.927 4.181 ( -5.098 0.000 3.581) 6.230 4.298 ( 2.961 0.000 -3.481) 4.570 4.454 ( -2.263 0.000 -2.961) 3.726 4.510 ( 3.547 0.000 -3.849) 5.234 4.626 ( 1.515 0.000 -15.791) 15.864 4.652 ( 7.744 0.000 -6.889) 10.364 4.688 ( 0.528 0.000 4.117) 4.151 4.831 ( -2.306 0.000 -0.702) 2.411 4.929 ( 3.626 0.000 -0.841) 3.722 4.975 ( -0.848 0.000 8.198) 8.242 5.095 ( -3.783 0.000 3.211) 4.962 5.186 ( -1.266 0.000 -4.482) 4.657 5.355 ( 5.894 0.000 3.104) 6.662 5.468 ( -0.759 0.000 0.962) 1.225 5.499 ( -1.335 0.000 -0.425) 1.401 5.679 ( 4.670 0.000 -0.274) 4.678 5.788 ( 13.880 0.000 3.436) 14.299 5.800 ( 0.573 0.000 1.231) 1.358 5.970 ( -0.994 0.000 4.868) 4.968 6.017 ( 6.028 0.000 -2.158) 6.403 6.292 ( -11.337 0.000 -6.944) 13.295 6.386 ( -7.022 0.000 -7.364) 10.175 6.821 ( -0.688 0.000 12.192) 12.212 7.012 ( 3.559 0.000 -3.584) 5.051 7.327 ( 1.939 0.000 1.857) 2.685 7.470 ( 5.039 0.000 -4.735) 6.914 7.735 ( 2.002 0.000 -10.153) 10.348 7.736 ( -0.357 0.000 -2.019) 2.051 8.175 ( -2.588 0.000 2.286) 3.454 8.300 ( -2.019 0.000 -7.854) 8.110 8.424 ( -2.527 0.000 -0.978) 2.710 8.446 ( 2.884 0.000 -2.302) 3.690 8.644 ( 2.352 0.000 -1.179) 2.631 8.853 ( 0.974 0.000 -5.784) 5.865 8.892 ( -0.768 0.000 4.872) 4.932 8.996 ( 2.535 0.000 -6.332) 6.821 9.063 ( 6.198 0.000 0.374) 6.209 9.159 ( 0.761 0.000 1.718) 1.879 9.333 ( 1.555 0.000 5.645) 5.855 9.394 ( 5.538 0.000 -0.442) 5.556 9.435 ( -1.706 0.000 6.467) 6.688 9.738 ( 6.346 0.000 0.165) 6.349 10.054 ( 4.372 0.000 -3.077) 5.346 10.058 ( -1.577 0.000 4.115) 4.407 10.296 ( -0.830 0.000 -0.958) 1.268 10.384 ( 4.468 0.000 -0.716) 4.525 10.470 ( -2.669 0.000 1.860) 3.253 10.518 ( 4.343 0.000 1.902) 4.741 10.601 ( 9.804 0.000 3.107) 10.285 10.649 ( -0.656 0.000 -2.110) 2.210 10.766 ( 2.801 0.000 -6.989) 7.529 10.875 ( 2.943 0.000 -1.877) 3.491 10.917 ( 2.136 0.000 5.337) 5.748 10.949 ( 1.917 0.000 -4.348) 4.751 11.023 ( -2.009 0.000 10.585) 10.774 11.159 ( -3.217 0.000 1.188) 3.430 11.328 ( 2.867 0.000 -2.577) 3.855 11.503 ( 5.954 0.000 -2.379) 6.412 11.558 ( -3.351 0.000 -1.458) 3.655 11.624 ( 2.905 0.000 -1.011) 3.076 11.816 ( -1.536 0.000 8.255) 8.397 12.107 ( -6.279 0.000 6.024) 8.701 12.303 ( -2.920 0.000 -5.217) 5.978 12.322 ( 0.774 0.000 -1.665) 1.837 12.409 ( 3.257 0.000 -1.644) 3.648 12.414 ( 1.149 0.000 -0.643) 1.317 12.471 ( 0.169 0.000 -3.033) 3.038 12.592 ( -4.128 0.000 0.790) 4.203 12.685 ( 1.314 0.000 6.421) 6.554 12.801 ( 11.121 0.000 -6.334) 12.798 12.908 ( -3.421 0.000 4.739) 5.845 12.999 ( -1.441 0.000 -2.459) 2.850 13.069 ( -4.108 0.000 0.663) 4.161 13.105 ( 1.315 0.000 -1.732) 2.175 13.195 ( -0.103 0.000 -5.682) 5.683 13.363 ( -3.153 0.000 7.721) 8.340 13.378 ( 1.214 0.000 -2.220) 2.530 13.534 ( -1.254 0.000 3.702) 3.908 13.559 ( -0.108 0.000 0.848) 0.855 13.625 ( -3.908 0.000 -5.547) 6.785 13.760 ( 5.590 0.000 -4.674) 7.286 13.776 ( -3.844 0.000 2.429) 4.548 13.860 ( -4.631 0.000 6.560) 8.030 13.909 ( 2.264 0.000 1.690) 2.825 14.092 ( -10.688 0.000 1.393) 10.778 14.245 ( 0.039 0.000 -3.006) 3.006 14.321 ( 1.416 0.000 -1.581) 2.122 14.368 ( 4.033 0.000 5.702) 6.984 14.559 ( 1.837 0.000 -3.651) 4.087 14.583 ( -5.410 0.000 -1.545) 5.626 14.585 ( -0.092 0.000 2.737) 2.738 14.676 ( -0.444 0.000 -7.465) 7.479 14.823 ( -2.417 0.000 8.974) 9.293 14.830 ( -0.852 0.000 4.487) 4.567 15.212 ( -2.834 0.000 -3.326) 4.370 15.212 ( 5.415 0.000 0.125) 5.416 15.407 ( 2.322 0.000 -1.932) 3.020 15.483 ( 0.800 0.000 0.556) 0.975 15.644 ( -1.516 0.000 4.225) 4.489 15.682 ( -1.243 0.000 4.106) 4.290 15.691 ( 1.164 0.000 -10.206) 10.272 16.039 ( -10.332 0.000 -3.930) 11.054 16.236 ( -1.773 0.000 4.505) 4.841 16.515 ( 0.281 0.000 0.947) 0.988 16.581 ( 3.461 0.000 5.598) 6.581 16.822 ( 2.745 0.000 -1.853) 3.312 16.826 ( -5.406 0.000 3.748) 6.578 16.836 ( -2.061 0.000 1.437) 2.513 16.859 ( -0.820 0.000 -0.374) 0.901 16.922 ( -2.133 0.000 1.488) 2.600 17.045 ( -3.129 0.000 1.867) 3.643 17.136 ( -3.307 0.000 0.403) 3.332 17.444 ( 2.243 0.000 -1.708) 2.819 17.463 ( 1.754 0.000 1.074) 2.057 17.653 ( -2.531 0.000 2.022) 3.239 17.876 ( 6.322 0.000 -4.862) 7.976 18.059 ( -1.674 0.000 2.795) 3.258 18.120 ( 0.606 0.000 -1.065) 1.225 18.263 ( -4.789 0.000 2.003) 5.190 18.339 ( -3.577 0.000 -0.419) 3.601 18.433 ( 0.717 0.000 -1.026) 1.252 18.568 ( 4.603 0.000 -1.453) 4.827 18.700 ( -0.686 0.000 4.083) 4.140 18.811 ( 0.329 0.000 -3.736) 3.750 18.890 ( -2.508 0.000 2.877) 3.817 18.915 ( 2.434 0.000 -6.926) 7.341 19.167 ( -5.330 0.000 -2.842) 6.040 19.245 ( 0.800 0.000 -4.512) 4.583 27.654 ( 1.569 0.000 1.317) 2.048 27.676 ( 0.363 0.000 0.845) 0.919 27.687 ( 1.251 0.000 1.178) 1.718 27.726 ( 1.572 0.000 0.362) 1.613 27.769 ( -1.033 0.000 -0.642) 1.216 27.771 ( -0.842 0.000 -0.966) 1.281 27.844 ( -1.099 0.000 -1.070) 1.534 27.884 ( -0.540 0.000 0.379) 0.660 29.241 ( -0.750 0.000 4.574) 4.635 29.421 ( 6.084 0.000 6.227) 8.706 29.565 ( -1.583 0.000 -2.407) 2.881 29.615 ( 3.793 0.000 -4.822) 6.135 29.808 ( -6.797 0.000 -1.547) 6.971 29.825 ( 3.049 0.000 1.112) 3.246 30.009 ( -1.106 0.000 8.073) 8.149 30.031 ( -11.961 0.000 -0.841) 11.990 30.155 ( -8.564 0.000 -1.229) 8.652 30.374 ( 2.871 0.000 -1.755) 3.365 30.543 ( -3.330 0.000 -1.040) 3.488 30.701 ( -3.005 0.000 3.449) 4.575 30.753 ( 5.697 0.000 -5.787) 8.120 30.853 ( -1.098 0.000 -1.314) 1.713 31.033 ( 0.823 0.000 -9.651) 9.686 31.078 ( -6.929 0.000 -6.803) 9.710 31.211 ( 6.791 0.000 -0.188) 6.794 31.651 ( -2.989 0.000 5.959) 6.667 31.746 ( -3.678 0.000 3.494) 5.073 32.133 ( 1.051 0.000 -10.721) 10.773 32.135 ( 0.152 0.000 18.006) 18.007 32.636 ( 4.729 0.000 10.692) 11.691 32.759 ( 9.385 0.000 -0.468) 9.396 33.230 ( 9.514 0.000 -11.617) 15.015 ======================= Grid point 71 (37/60) ======================= q-point: ( 0.00 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.441 ( 2.520 8.721 27.925) 29.364 1.644 ( 4.862 14.553 28.408) 32.287 2.328 ( 3.034 -9.519 -3.647) 10.636 2.497 ( 1.432 1.520 23.506) 23.599 2.559 ( -0.296 2.275 -0.054) 2.294 2.692 ( -0.713 0.715 1.112) 1.502 2.910 ( -1.891 3.495 5.528) 6.808 3.071 ( 1.345 -0.852 4.338) 4.621 3.109 ( 4.634 3.791 -0.996) 6.070 3.154 ( 3.317 -0.240 1.976) 3.869 3.269 ( 2.971 1.418 4.741) 5.772 3.352 ( -7.352 4.343 -2.689) 8.952 3.555 ( -0.565 4.973 8.282) 9.677 3.620 ( -3.966 1.636 -6.765) 8.011 3.727 ( 2.935 0.318 -1.392) 3.264 3.790 ( 0.325 0.290 -2.774) 2.808 3.862 ( -4.025 -4.008 2.790) 6.329 3.890 ( -5.288 3.151 -3.458) 7.060 4.022 ( 4.899 -3.881 0.323) 6.258 4.093 ( -4.917 1.629 -1.193) 5.316 4.267 ( 4.451 -6.093 0.767) 7.585 4.346 ( -3.243 -1.672 -3.356) 4.957 4.439 ( 1.798 2.375 1.684) 3.422 4.482 ( -0.579 2.033 -5.859) 6.228 4.627 ( 3.806 0.359 -7.055) 8.025 4.720 ( 1.536 2.668 -0.189) 3.085 4.748 ( -1.788 -0.359 3.278) 3.751 4.813 ( -3.396 0.188 0.059) 3.402 4.926 ( 4.726 -1.382 4.016) 6.354 5.077 ( -1.385 -4.073 -1.430) 4.533 5.112 ( 3.478 4.055 0.605) 5.376 5.174 ( 5.162 0.442 3.785) 6.416 5.305 ( -0.075 -7.280 2.049) 7.563 5.441 ( 2.235 -2.988 -2.459) 4.469 5.583 ( 1.480 3.225 0.324) 3.563 5.652 ( -1.999 -7.117 -1.593) 7.562 5.772 ( -5.142 1.436 -2.024) 5.709 5.835 ( -2.463 -1.229 4.907) 5.626 5.936 ( -2.431 -2.606 2.195) 4.185 6.118 ( 0.645 1.179 -4.440) 4.639 6.177 ( -5.514 -3.071 -7.610) 9.886 6.208 ( 2.410 1.938 -4.736) 5.656 6.750 ( -3.555 -5.507 9.883) 11.859 6.990 ( 2.203 -5.178 -3.931) 6.864 7.367 ( -0.100 -0.295 2.795) 2.813 7.565 ( -1.465 0.399 -4.334) 4.592 7.634 ( 1.000 0.360 -2.078) 2.335 7.726 ( -1.097 0.557 -6.649) 6.762 8.080 ( -4.660 -3.961 0.237) 6.121 8.182 ( 1.910 -4.833 -3.923) 6.512 8.478 ( 1.097 5.899 -3.207) 6.803 8.536 ( 0.695 5.662 -5.720) 8.079 8.714 ( 2.202 2.087 -2.920) 4.211 8.756 ( -3.256 -1.268 -2.727) 4.432 8.894 ( -0.694 2.844 1.270) 3.191 8.991 ( 2.934 -1.722 -2.913) 4.479 9.100 ( -1.095 -4.918 0.918) 5.121 9.168 ( -0.301 0.092 -3.007) 3.024 9.367 ( -0.738 -3.295 5.754) 6.672 9.488 ( 3.634 -1.554 1.291) 4.157 9.512 ( 5.120 1.470 6.397) 8.325 9.722 ( -4.561 -4.966 -2.208) 7.095 10.050 ( 1.828 -1.556 -0.170) 2.406 10.104 ( 1.901 -0.309 -2.720) 3.333 10.275 ( -0.654 0.726 2.320) 2.517 10.351 ( -1.159 -2.468 0.970) 2.894 10.485 ( 0.968 2.398 -0.769) 2.698 10.594 ( -1.909 4.867 -1.761) 5.516 10.682 ( 3.838 0.393 0.050) 3.859 10.710 ( 1.061 0.005 0.679) 1.259 10.828 ( 1.536 1.633 -3.180) 3.891 10.922 ( -0.982 5.537 -1.357) 5.785 11.010 ( -3.773 0.712 3.403) 5.130 11.050 ( 4.642 -1.670 3.144) 5.850 11.077 ( 7.249 -2.335 4.624) 8.909 11.172 ( -3.366 5.471 6.462) 9.111 11.398 ( -7.158 -0.797 3.245) 7.900 11.477 ( 2.960 5.752 -7.422) 9.845 11.603 ( 1.926 -0.475 -5.959) 6.281 11.675 ( 2.199 0.523 -4.401) 4.947 11.866 ( 0.433 -1.553 10.239) 10.365 12.002 ( -3.607 2.340 3.361) 5.458 12.197 ( -0.668 -3.490 -1.344) 3.799 12.252 ( -1.777 -6.319 -0.002) 6.564 12.337 ( -9.001 -3.980 -4.107) 10.664 12.366 ( 2.440 -4.455 -5.471) 7.465 12.440 ( 4.855 -0.221 -3.191) 5.814 12.561 ( 5.364 -1.661 -6.415) 8.525 12.624 ( -6.597 -3.280 7.152) 10.268 12.807 ( 1.810 -1.921 5.113) 5.754 12.911 ( 1.299 -7.469 -3.485) 8.344 13.012 ( -1.345 3.688 -1.766) 4.304 13.076 ( 1.479 1.002 -0.212) 1.799 13.135 ( -0.818 -4.465 -2.839) 5.354 13.227 ( 2.699 1.350 -0.277) 3.030 13.300 ( -3.964 -0.507 0.199) 4.001 13.369 ( 2.756 3.575 1.395) 4.724 13.515 ( -3.058 -2.115 2.881) 4.704 13.530 ( 1.904 -1.008 -0.355) 2.184 13.621 ( 2.717 2.196 -0.829) 3.591 13.803 ( -1.725 5.725 1.077) 6.076 13.851 ( 0.742 2.221 0.460) 2.387 13.900 ( -0.512 3.739 4.303) 5.723 13.968 ( 1.398 5.614 -1.472) 5.969 14.084 ( 4.834 0.670 0.674) 4.927 14.224 ( -4.762 3.205 -0.591) 5.771 14.288 ( 1.311 -2.642 -4.162) 5.101 14.384 ( 3.676 -1.692 5.237) 6.618 14.414 ( -0.751 -2.059 -3.695) 4.296 14.628 ( -1.963 5.514 0.158) 5.855 14.757 ( 7.625 0.500 -0.729) 7.676 14.799 ( 1.900 3.829 2.582) 4.994 14.836 ( 2.509 3.892 4.194) 6.247 14.939 ( 5.484 4.145 -1.875) 7.125 15.095 ( 2.206 -2.958 -2.625) 4.528 15.232 ( 0.008 -0.281 -3.157) 3.169 15.401 ( -3.421 -2.031 0.409) 3.999 15.452 ( -2.162 -0.966 1.127) 2.623 15.619 ( 1.880 -1.624 -1.371) 2.837 15.683 ( -0.264 -0.752 2.217) 2.355 15.745 ( -6.320 1.952 -0.763) 6.659 15.904 ( -1.384 3.819 -2.762) 4.912 16.208 ( -0.606 -4.494 5.928) 7.463 16.425 ( -4.087 -4.703 -1.490) 6.406 16.703 ( 0.240 1.217 3.961) 4.151 16.722 ( -1.257 2.343 3.359) 4.284 16.814 ( 0.544 -1.670 1.438) 2.270 16.829 ( -1.521 2.275 0.821) 2.857 16.902 ( -0.168 2.288 -1.433) 2.705 16.931 ( -0.563 2.127 0.134) 2.204 17.047 ( 3.032 -2.092 -0.678) 3.745 17.091 ( 1.363 -0.838 -0.357) 1.639 17.471 ( 0.725 0.829 0.968) 1.466 17.542 ( 0.603 4.775 -1.117) 4.941 17.615 ( 0.084 -1.610 6.512) 6.708 17.922 ( 1.681 -2.456 -7.134) 7.730 18.055 ( -0.336 0.205 4.767) 4.783 18.133 ( -1.155 -1.276 0.209) 1.734 18.159 ( 1.040 -1.360 -1.863) 2.530 18.245 ( -1.713 -2.150 -2.092) 3.454 18.464 ( -0.676 2.634 1.942) 3.342 18.617 ( -4.529 2.790 -3.339) 6.281 18.658 ( -0.436 -3.100 4.070) 5.134 18.792 ( 1.838 1.164 -0.042) 2.176 18.813 ( -4.881 -1.502 1.630) 5.360 18.930 ( 1.678 -2.170 -4.052) 4.893 19.021 ( -3.959 -0.984 2.365) 4.716 19.173 ( -2.391 -2.624 -4.724) 5.909 27.676 ( -0.305 -0.277 1.296) 1.360 27.690 ( 0.823 -0.767 1.311) 1.728 27.721 ( 1.373 0.528 1.057) 1.811 27.752 ( -0.206 0.687 -0.593) 0.931 27.753 ( 0.702 -0.553 -0.915) 1.279 27.766 ( 0.324 0.222 -0.141) 0.418 27.838 ( 0.654 0.266 -0.341) 0.784 27.859 ( -1.435 -0.052 -0.611) 1.560 29.287 ( 0.244 2.223 5.416) 5.860 29.521 ( -1.181 0.666 -4.015) 4.238 29.574 ( 5.829 -4.936 2.565) 8.057 29.680 ( -1.965 -0.292 -1.037) 2.241 29.732 ( 7.521 2.099 -0.539) 7.827 29.841 ( -6.785 3.113 -2.802) 7.973 29.912 ( 0.689 -1.164 3.078) 3.362 29.972 ( 1.875 1.888 0.740) 2.762 30.118 ( 2.898 -1.267 5.850) 6.650 30.309 ( -4.139 -8.863 -1.720) 9.931 30.544 ( 4.505 2.695 1.777) 5.542 30.645 ( -1.744 0.030 0.336) 1.776 30.807 ( -0.361 1.555 -2.790) 3.215 30.815 ( -1.993 1.043 -3.396) 4.074 30.951 ( -2.303 2.792 -4.889) 6.083 31.016 ( 0.582 1.100 -8.604) 8.694 31.413 ( 7.145 2.562 3.523) 8.369 31.540 ( -6.248 1.116 -1.123) 6.445 31.680 ( -5.422 -0.365 9.608) 11.038 32.055 ( 3.934 -6.867 -1.150) 7.998 32.329 ( 1.420 3.548 12.851) 13.407 32.604 ( -0.655 -7.538 12.212) 14.366 32.961 ( -3.407 8.664 -9.745) 13.477 33.267 ( 0.931 -2.173 -14.138) 14.335 ======================= Grid point 72 (38/60) ======================= q-point: ( 0.17 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.642 ( 1.568 6.474 27.152) 27.957 1.991 ( 10.636 13.004 23.544) 28.924 2.391 ( 8.161 -2.493 -13.309) 15.810 2.512 ( 4.624 1.267 -12.354) 13.252 2.613 ( -2.899 2.085 4.900) 6.063 2.776 ( 1.225 0.562 2.094) 2.490 2.881 ( -0.985 -0.384 16.885) 16.918 3.080 ( -1.103 -3.450 2.416) 4.354 3.174 ( -2.146 2.691 -5.391) 6.396 3.224 ( 3.539 5.154 0.995) 6.331 3.313 ( 0.275 -3.533 4.534) 5.755 3.412 ( 6.350 3.209 6.015) 9.316 3.443 ( -6.005 1.493 -7.418) 9.660 3.654 ( 5.558 0.873 8.398) 10.108 3.661 ( -7.177 -4.010 0.650) 8.247 3.762 ( 4.575 3.990 -5.839) 8.423 3.832 ( 1.363 2.671 -2.370) 3.822 3.935 ( -5.816 -5.406 -0.761) 7.977 3.982 ( 9.386 3.529 1.441) 10.130 4.152 ( 5.261 1.897 0.633) 5.628 4.250 ( 0.097 0.619 -3.729) 3.782 4.336 ( -4.050 -5.649 -1.730) 7.163 4.451 ( 4.073 -4.844 -1.033) 6.413 4.488 ( 0.887 8.966 -0.202) 9.012 4.567 ( -7.828 -1.082 4.514) 9.101 4.686 ( -3.171 3.595 -1.571) 5.045 4.699 ( 0.132 -2.267 -3.307) 4.012 4.870 ( 3.267 -3.355 0.258) 4.690 4.974 ( -0.874 0.646 -0.028) 1.087 5.012 ( -1.035 0.171 -1.016) 1.460 5.201 ( -1.177 0.439 -1.814) 2.206 5.247 ( 2.024 -2.416 0.467) 3.187 5.352 ( 3.038 -2.111 1.986) 4.199 5.411 ( -2.460 5.586 -10.699) 12.317 5.562 ( -12.313 -8.828 7.192) 16.771 5.622 ( -1.507 -0.023 5.565) 5.765 5.639 ( -0.088 -3.356 -4.805) 5.862 5.796 ( -3.969 -3.307 0.344) 5.178 5.891 ( 0.047 1.130 7.543) 7.627 5.995 ( -6.860 0.016 -0.898) 6.919 6.163 ( 0.167 0.172 -4.875) 4.880 6.228 ( 6.175 -1.116 -3.710) 7.290 6.731 ( -3.685 -4.477 9.045) 10.744 6.967 ( -3.175 -3.020 -1.261) 4.559 7.370 ( -0.486 -3.122 1.896) 3.685 7.496 ( -3.756 -2.113 1.637) 4.610 7.604 ( -2.424 1.621 -8.471) 8.959 7.670 ( -0.712 1.728 -2.123) 2.829 8.004 ( -2.158 -3.912 2.238) 4.997 8.220 ( 2.878 -2.947 -2.704) 4.928 8.477 ( 1.095 2.802 -2.847) 4.142 8.550 ( 2.860 2.700 -3.487) 5.257 8.666 ( -3.139 -0.344 -2.971) 4.336 8.749 ( 1.252 2.303 -2.331) 3.508 8.847 ( -3.794 6.948 0.927) 7.970 9.003 ( 0.103 0.996 -2.447) 2.644 9.082 ( -0.932 -2.236 0.694) 2.520 9.150 ( -0.312 -4.918 -1.167) 5.064 9.321 ( -4.580 -0.346 2.479) 5.220 9.526 ( -1.625 -2.339 1.549) 3.241 9.563 ( -4.337 -4.252 -2.853) 6.710 9.625 ( -1.112 -2.681 3.370) 4.447 10.076 ( 0.619 -0.023 -2.313) 2.394 10.124 ( 1.013 -1.628 -1.804) 2.633 10.311 ( 2.279 -1.625 2.939) 4.058 10.367 ( 0.941 0.102 3.037) 3.181 10.493 ( -4.480 2.128 -3.342) 5.981 10.538 ( 2.157 -1.200 -0.387) 2.498 10.669 ( -7.285 0.680 -1.372) 7.444 10.740 ( -1.969 0.045 -2.205) 2.957 10.775 ( -3.199 0.055 -3.363) 4.642 10.821 ( 1.752 2.459 -0.140) 3.022 10.999 ( 1.783 3.705 -5.222) 6.646 11.075 ( -3.481 6.479 5.262) 9.044 11.131 ( -3.289 -3.899 6.649) 8.380 11.200 ( -2.103 0.560 3.064) 3.758 11.333 ( 1.332 2.455 7.759) 8.247 11.474 ( 1.456 5.039 -8.751) 10.203 11.563 ( -2.491 2.985 -8.980) 9.786 11.674 ( 1.289 -0.632 -2.525) 2.904 11.881 ( -2.349 -2.695 6.771) 7.657 12.025 ( 2.617 2.653 3.682) 5.239 12.036 ( -5.679 1.343 2.778) 6.463 12.181 ( -6.417 -5.755 -1.788) 8.803 12.346 ( 2.761 -6.158 1.270) 6.867 12.369 ( -0.115 -3.411 -0.091) 3.414 12.538 ( 0.046 -4.783 -1.014) 4.890 12.577 ( 4.003 -3.772 -2.730) 6.141 12.640 ( 4.717 -0.773 -4.253) 6.398 12.791 ( -4.409 -0.612 2.537) 5.123 12.946 ( 2.016 2.797 -0.348) 3.465 12.973 ( 1.032 -8.441 -1.149) 8.581 13.070 ( -2.201 -0.122 1.608) 2.728 13.100 ( -1.010 -2.279 -3.289) 4.127 13.256 ( -0.646 -1.054 -1.385) 1.857 13.305 ( 3.577 1.600 0.673) 3.976 13.436 ( -0.443 -0.142 -1.321) 1.401 13.478 ( 0.572 0.300 6.962) 6.992 13.556 ( 1.391 6.412 -2.223) 6.928 13.642 ( 0.095 3.697 -1.030) 3.839 13.825 ( 3.221 1.938 -2.981) 4.798 13.864 ( 1.771 -0.925 3.347) 3.898 13.976 ( -1.117 10.975 -2.486) 11.308 13.990 ( 4.965 0.420 2.836) 5.733 14.056 ( -3.969 1.294 -1.210) 4.347 14.224 ( 3.021 -1.701 -1.112) 3.641 14.324 ( 3.692 -3.516 -7.586) 9.140 14.396 ( 1.209 -1.547 1.772) 2.645 14.514 ( 3.770 -0.666 2.998) 4.862 14.664 ( 6.191 3.999 -0.591) 7.394 14.740 ( -5.501 0.202 -2.189) 5.924 14.795 ( -1.809 5.922 -0.298) 6.199 14.920 ( 2.383 2.872 1.781) 4.135 15.049 ( 3.576 2.683 -0.862) 4.553 15.122 ( -0.716 -1.109 -3.198) 3.460 15.269 ( 6.592 1.545 -5.734) 8.872 15.383 ( 5.134 -2.443 0.168) 5.688 15.455 ( 1.805 0.242 -1.840) 2.589 15.638 ( -1.910 1.276 2.043) 3.074 15.665 ( -2.338 -1.127 2.866) 3.866 15.703 ( 2.127 -3.035 3.519) 5.111 15.852 ( -1.390 2.970 -2.296) 4.003 16.206 ( -3.163 -2.748 4.227) 5.952 16.321 ( -4.571 -2.880 0.470) 5.423 16.665 ( -2.188 1.242 3.073) 3.971 16.785 ( -1.236 2.230 2.305) 3.437 16.801 ( 3.306 1.606 2.609) 4.507 16.833 ( 0.890 1.967 2.175) 3.064 16.872 ( -1.346 1.762 1.975) 2.970 16.971 ( 3.046 -3.272 -1.866) 4.844 17.129 ( 5.390 -0.883 -1.726) 5.729 17.189 ( 5.292 -1.690 0.805) 5.614 17.471 ( -0.479 3.811 -0.125) 3.843 17.562 ( 1.335 1.607 -2.630) 3.358 17.655 ( 0.316 -0.643 4.560) 4.616 17.831 ( -5.775 -1.800 -6.274) 8.715 18.070 ( -0.651 0.695 0.152) 0.964 18.137 ( 2.453 -0.974 6.539) 7.052 18.178 ( -1.180 -0.688 -2.263) 2.644 18.267 ( 4.064 -0.604 -0.669) 4.163 18.459 ( -1.289 1.113 3.509) 3.900 18.525 ( -1.085 -1.354 -0.150) 1.742 18.665 ( -1.004 -1.581 0.367) 1.909 18.708 ( -6.090 -1.700 1.687) 6.544 18.782 ( -2.477 1.732 1.379) 3.322 18.941 ( 2.566 -0.950 0.647) 2.812 19.039 ( 1.877 -2.891 0.793) 3.537 19.123 ( -0.512 -1.825 -0.872) 2.087 27.676 ( -0.405 -1.024 1.049) 1.521 27.684 ( -1.127 -1.406 0.274) 1.822 27.738 ( -0.688 0.779 -0.405) 1.115 27.746 ( -0.357 0.503 -0.249) 0.665 27.764 ( 1.274 1.057 -0.694) 1.795 27.786 ( 1.358 0.455 -0.849) 1.665 27.825 ( -0.290 0.370 -0.506) 0.690 27.871 ( 1.600 -0.650 0.470) 1.790 29.310 ( -1.059 2.158 5.488) 5.991 29.485 ( -0.425 0.071 -3.507) 3.534 29.589 ( -1.888 -0.794 -0.347) 2.077 29.667 ( -2.533 1.412 -4.662) 5.490 29.772 ( 4.663 -1.715 -0.698) 5.017 29.869 ( 2.525 1.303 1.015) 3.017 30.011 ( 9.617 0.493 2.019) 9.839 30.100 ( 6.425 -0.141 -0.268) 6.432 30.224 ( 2.586 -4.536 -1.270) 5.374 30.282 ( 5.582 -2.474 1.256) 6.233 30.593 ( -1.834 3.956 -1.387) 4.576 30.660 ( 4.045 -1.211 0.138) 4.225 30.745 ( -2.921 2.298 0.730) 3.788 30.776 ( -1.576 0.832 0.010) 1.782 30.937 ( 2.914 3.507 -5.002) 6.769 30.996 ( 0.743 0.345 -5.958) 6.014 31.359 ( -7.158 1.288 -3.443) 8.047 31.564 ( -1.298 -3.905 8.390) 9.345 31.676 ( 4.810 5.127 6.307) 9.445 32.119 ( 2.777 -4.495 -4.237) 6.773 32.397 ( -2.420 2.372 14.314) 14.710 32.586 ( -5.219 -4.693 6.900) 9.842 32.761 ( -10.769 4.759 -3.081) 12.170 33.101 ( -8.966 -3.774 -13.038) 16.268 ======================= Grid point 73 (39/60) ======================= q-point: ( 0.33 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.750 ( -6.135 13.516 23.890) 28.126 2.247 ( 5.763 10.730 11.317) 16.626 2.545 ( 3.000 -2.592 -0.419) 3.987 2.571 ( -4.956 -0.144 2.426) 5.520 2.603 ( 10.145 2.843 -5.432) 11.854 2.708 ( 2.751 -0.633 -0.790) 2.931 2.906 ( -3.122 -5.771 -0.750) 6.604 3.025 ( -5.923 2.744 -1.078) 6.616 3.110 ( 0.321 1.330 -11.803) 11.882 3.204 ( -0.689 -1.834 -7.508) 7.760 3.302 ( -7.998 4.000 -1.800) 9.122 3.341 ( 3.264 -2.956 2.137) 4.894 3.545 ( 2.315 -0.786 -3.361) 4.156 3.570 ( 1.054 2.355 1.740) 3.112 3.752 ( -0.714 -7.203 -4.467) 8.506 3.842 ( -0.196 2.850 -0.595) 2.918 3.888 ( 6.193 -1.245 2.901) 6.952 4.026 ( 11.981 -0.873 9.185) 15.122 4.204 ( 8.664 0.130 -2.957) 9.156 4.226 ( 2.227 1.810 0.616) 2.935 4.252 ( 1.235 2.495 -2.347) 3.642 4.297 ( 3.998 1.575 1.127) 4.442 4.487 ( 0.787 -0.506 -8.091) 8.145 4.492 ( -2.860 -1.460 3.503) 4.753 4.530 ( 1.847 12.387 4.792) 13.409 4.607 ( -1.942 -7.622 -0.731) 7.899 4.676 ( 1.708 -4.318 -2.011) 5.061 4.870 ( -4.063 -3.001 3.226) 5.994 4.912 ( -5.261 0.293 -1.677) 5.530 5.013 ( -0.460 2.884 -4.693) 5.527 5.066 ( -10.478 0.990 0.411) 10.533 5.156 ( -7.756 3.754 1.689) 8.781 5.285 ( -10.729 -3.772 -2.746) 11.700 5.336 ( -1.701 0.052 -4.262) 4.589 5.433 ( 0.816 -1.104 4.824) 5.015 5.537 ( -9.787 1.710 -0.140) 9.936 5.584 ( -2.417 2.371 -0.712) 3.460 5.742 ( 1.563 1.034 -0.473) 1.933 5.893 ( -3.738 2.351 6.367) 7.748 6.009 ( 5.062 -2.500 10.444) 11.873 6.287 ( 12.526 -6.358 -0.874) 14.074 6.360 ( 7.570 -5.463 -1.565) 9.466 6.669 ( -6.820 -4.014 7.958) 11.223 6.865 ( -6.550 -2.025 2.841) 7.422 7.369 ( -0.872 -3.615 0.394) 3.740 7.435 ( -2.759 -0.658 3.788) 4.732 7.520 ( -0.215 -0.475 -7.207) 7.226 7.651 ( 0.648 0.446 -4.072) 4.147 8.046 ( 3.862 -0.222 6.162) 7.276 8.261 ( 2.087 -0.539 -0.040) 2.156 8.491 ( -1.036 -3.572 -2.484) 4.473 8.556 ( -0.752 -2.616 0.472) 2.762 8.644 ( 2.493 3.404 -3.999) 5.813 8.704 ( -1.851 4.311 -1.593) 4.954 8.808 ( -0.829 6.007 0.732) 6.108 9.007 ( 1.926 0.003 -1.523) 2.456 9.050 ( -2.267 -1.315 -2.756) 3.803 9.119 ( -2.172 -2.655 0.018) 3.430 9.259 ( -2.322 1.417 3.371) 4.332 9.435 ( -4.626 -4.388 -0.090) 6.377 9.507 ( -1.517 -0.442 -3.256) 3.619 9.580 ( -3.600 -2.015 0.128) 4.128 10.050 ( -2.215 -2.084 -3.594) 4.708 10.086 ( -4.915 -3.555 -2.995) 6.765 10.256 ( -8.746 0.065 1.253) 8.836 10.370 ( 1.940 -3.276 -0.461) 3.835 10.398 ( -4.109 2.423 -1.702) 5.064 10.499 ( 0.700 -2.117 -3.273) 3.960 10.587 ( -1.280 -2.128 -1.526) 2.915 10.719 ( 1.078 -1.255 -2.237) 2.783 10.775 ( 1.334 1.257 -3.650) 4.084 10.879 ( 2.822 1.755 -0.901) 3.443 10.923 ( -2.885 8.080 -4.347) 9.618 11.031 ( -2.558 -0.707 -4.272) 5.029 11.136 ( 1.299 4.210 6.566) 7.907 11.197 ( -0.753 -1.104 10.319) 10.405 11.372 ( -2.656 11.353 5.542) 12.910 11.476 ( -0.759 -2.105 -4.691) 5.197 11.484 ( 2.534 -1.880 -4.882) 5.813 11.689 ( 1.660 0.895 -3.042) 3.579 11.848 ( -5.432 -0.669 6.792) 8.723 11.971 ( -2.175 -0.158 1.812) 2.836 12.092 ( 1.234 2.289 1.366) 2.937 12.115 ( 0.989 3.338 5.282) 6.326 12.355 ( -0.812 -7.146 4.295) 8.377 12.393 ( 1.236 -3.909 -1.160) 4.261 12.565 ( 2.183 -5.080 -2.418) 6.035 12.609 ( 1.264 0.013 -7.539) 7.644 12.634 ( -1.142 -2.786 -0.636) 3.077 12.730 ( -2.603 1.910 1.162) 3.431 12.963 ( -0.663 -3.361 2.038) 3.986 13.034 ( -2.237 1.877 1.938) 3.505 13.039 ( 3.638 -1.591 0.585) 4.014 13.087 ( 2.347 -5.048 -4.100) 6.914 13.220 ( -1.732 -2.201 -0.657) 2.877 13.322 ( -1.744 -2.316 0.710) 2.985 13.446 ( 1.332 2.780 3.519) 4.678 13.524 ( -0.479 -1.216 5.641) 5.790 13.567 ( 0.508 9.895 -2.472) 10.212 13.666 ( 3.320 6.237 -3.655) 7.955 13.828 ( -0.569 0.619 -0.973) 1.286 13.911 ( -1.310 8.436 -4.149) 9.492 13.944 ( 1.326 -1.756 -1.733) 2.801 14.018 ( 2.422 0.370 -0.057) 2.451 14.136 ( 4.451 0.032 5.857) 7.356 14.228 ( -1.073 -0.514 -3.690) 3.877 14.356 ( 3.044 -3.089 -2.875) 5.203 14.430 ( 1.033 -7.132 -1.928) 7.459 14.506 ( -4.705 -1.935 -3.342) 6.088 14.642 ( -1.118 3.095 -2.197) 3.957 14.773 ( 2.191 -4.557 3.303) 6.039 14.789 ( 1.531 5.337 -0.869) 5.620 14.928 ( -2.416 1.556 2.895) 4.079 15.076 ( -3.623 -3.340 -0.163) 4.930 15.124 ( 3.278 4.425 -0.676) 5.548 15.279 ( 0.328 1.297 -10.181) 10.268 15.427 ( 1.891 2.005 -4.312) 5.118 15.546 ( -4.382 2.856 -3.535) 6.314 15.624 ( 7.828 -1.329 -0.715) 7.972 15.648 ( 0.129 0.373 3.984) 4.004 15.859 ( 9.698 1.347 2.198) 10.035 15.895 ( 6.954 0.914 2.525) 7.455 16.128 ( -5.617 -0.210 1.890) 5.930 16.261 ( -2.245 -2.054 2.867) 4.180 16.673 ( 0.091 0.557 5.073) 5.104 16.756 ( -2.588 2.802 4.105) 5.604 16.860 ( 1.554 1.510 -0.802) 2.310 16.894 ( 2.121 0.696 2.552) 3.391 16.917 ( 4.363 2.062 2.761) 5.560 17.000 ( 0.197 -4.623 -1.323) 4.813 17.204 ( 1.425 -1.061 1.746) 2.491 17.276 ( 1.525 -0.207 2.295) 2.764 17.453 ( -0.246 3.549 -2.720) 4.478 17.543 ( -1.407 0.599 -4.449) 4.704 17.675 ( -0.100 -1.912 -0.426) 1.962 17.683 ( -3.803 -0.917 -3.185) 5.045 18.063 ( 0.198 0.455 1.091) 1.198 18.135 ( -0.878 0.044 -0.488) 1.005 18.264 ( 2.793 0.030 9.696) 10.090 18.313 ( 0.619 1.704 2.020) 2.714 18.446 ( 0.837 -1.195 1.499) 2.092 18.563 ( -2.828 -2.641 -1.321) 4.089 18.588 ( -1.158 -0.326 -3.502) 3.703 18.617 ( -2.034 -3.623 3.535) 5.455 18.792 ( 2.381 2.631 2.224) 4.188 19.014 ( 3.462 -3.649 -0.455) 5.051 19.067 ( 0.247 -0.750 2.086) 2.231 19.131 ( 0.564 -0.912 1.891) 2.174 27.656 ( -1.305 -1.403 -0.376) 1.953 27.664 ( -1.151 -1.381 -0.420) 1.846 27.714 ( -1.172 0.664 -0.790) 1.561 27.723 ( -1.007 0.599 -0.814) 1.427 27.793 ( 0.847 1.309 0.007) 1.559 27.798 ( 1.659 1.065 -0.240) 1.986 27.845 ( 1.058 0.231 -0.292) 1.121 27.895 ( 0.386 -0.853 0.005) 0.937 29.307 ( -1.948 1.422 5.527) 6.030 29.454 ( -1.591 -1.554 -1.678) 2.786 29.520 ( -2.806 1.049 -3.533) 4.632 29.615 ( -0.300 1.230 -5.281) 5.431 29.859 ( 4.016 -0.600 -1.166) 4.225 29.963 ( 5.173 2.102 -0.441) 5.602 30.170 ( 2.934 -3.478 2.039) 4.986 30.177 ( 2.795 -2.144 1.621) 3.878 30.336 ( 7.562 1.128 0.108) 7.646 30.445 ( 8.964 0.664 -4.099) 9.879 30.566 ( -0.141 4.874 -1.424) 5.079 30.637 ( -1.769 1.046 -1.251) 2.405 30.738 ( -1.987 -0.490 2.176) 2.987 30.785 ( 1.885 2.126 1.492) 3.209 30.936 ( -5.240 1.329 -1.630) 5.646 30.992 ( 3.723 0.773 -2.662) 4.641 31.242 ( 0.058 0.609 -5.982) 6.013 31.551 ( -3.028 -8.312 9.882) 13.263 31.875 ( 8.791 3.853 2.965) 10.046 32.068 ( -4.708 3.354 -6.046) 8.364 32.386 ( -4.886 1.476 13.319) 14.263 32.510 ( -11.191 -0.669 7.203) 13.326 32.592 ( 4.007 -3.141 -4.037) 6.498 32.808 ( -12.326 -4.515 -9.039) 15.938 ======================= Grid point 74 (40/60) ======================= q-point: (-0.50 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.649 ( -14.416 18.102 22.833) 32.509 2.315 ( -13.648 8.458 18.672) 24.626 2.413 ( -4.099 -0.802 -0.617) 4.222 2.537 ( 1.560 -1.144 -2.719) 3.337 2.709 ( -2.676 -8.747 2.844) 9.579 2.785 ( 1.321 7.753 -6.892) 10.457 2.916 ( -1.640 0.269 -0.483) 1.731 2.950 ( 5.197 0.285 -1.004) 5.300 3.032 ( -6.115 2.321 -6.643) 9.323 3.147 ( -0.050 0.139 -8.648) 8.649 3.198 ( 3.979 -0.404 -6.615) 7.730 3.427 ( 4.107 -6.495 1.682) 7.867 3.551 ( 3.187 -2.894 -1.563) 4.580 3.627 ( 2.814 3.179 1.060) 4.375 3.727 ( -7.370 1.638 0.027) 7.550 3.777 ( 3.962 -5.992 -4.038) 8.241 3.999 ( 2.482 -0.510 0.457) 2.574 4.125 ( -7.900 -2.613 -6.576) 10.605 4.216 ( -0.107 0.212 1.794) 1.810 4.268 ( -5.280 3.383 -3.890) 7.379 4.280 ( -0.914 0.670 0.992) 1.506 4.367 ( -0.081 2.255 0.254) 2.271 4.463 ( -0.408 -3.378 3.428) 4.830 4.510 ( 7.848 0.074 0.806) 7.890 4.601 ( -1.764 4.984 -1.425) 5.475 4.624 ( 0.274 -0.184 -0.061) 0.335 4.732 ( -1.738 0.734 -0.754) 2.032 4.805 ( 2.702 1.291 3.193) 4.377 4.829 ( 3.564 -1.466 2.081) 4.380 4.892 ( -3.203 -0.667 3.138) 4.533 4.946 ( -0.114 -0.260 -5.011) 5.019 5.032 ( -2.190 2.455 -4.090) 5.249 5.149 ( -0.330 3.215 -0.362) 3.252 5.277 ( -0.339 2.914 -0.516) 2.979 5.421 ( -1.886 1.534 4.184) 4.839 5.499 ( 1.824 -3.522 -1.355) 4.191 5.566 ( 1.158 2.297 -1.744) 3.108 5.775 ( 1.875 6.137 -3.309) 7.220 5.879 ( -2.087 -2.593 12.373) 12.813 6.122 ( -0.917 -3.556 6.250) 7.249 6.513 ( 5.806 -7.057 5.650) 10.744 6.539 ( 3.979 -8.108 4.505) 10.093 6.594 ( 1.577 -3.214 1.571) 3.909 6.752 ( -4.599 -1.617 3.612) 6.067 7.340 ( -0.762 -1.719 0.228) 1.894 7.433 ( 0.560 4.105 -2.228) 4.704 7.522 ( 3.146 -5.278 -1.965) 6.451 7.671 ( 4.070 -0.325 -6.482) 7.661 8.189 ( 5.256 1.401 6.806) 8.712 8.331 ( 3.618 1.336 1.441) 4.117 8.376 ( -6.106 -3.540 0.339) 7.066 8.569 ( 0.232 -3.386 -4.582) 5.702 8.624 ( 0.916 2.487 0.275) 2.664 8.772 ( -0.441 5.053 0.018) 5.072 8.784 ( 3.801 3.133 -2.230) 5.407 8.983 ( -0.502 -3.933 -6.523) 7.633 9.058 ( -2.809 -1.317 1.441) 3.421 9.077 ( 3.438 3.027 -0.635) 4.625 9.252 ( -0.815 -2.378 5.898) 6.411 9.375 ( -1.098 0.358 -0.189) 1.170 9.456 ( -4.074 0.378 -2.308) 4.698 9.497 ( 0.713 0.129 -5.258) 5.307 9.877 ( -6.998 -2.000 0.460) 7.293 10.047 ( 3.185 -7.953 -6.985) 11.054 10.179 ( -1.462 -1.208 0.113) 1.900 10.367 ( 0.887 -2.832 -3.315) 4.450 10.394 ( -0.644 0.332 3.031) 3.116 10.458 ( -0.648 3.011 -5.094) 5.952 10.544 ( -1.232 -0.693 -0.872) 1.661 10.703 ( -3.404 2.477 -6.885) 8.070 10.763 ( 2.596 -3.025 0.872) 4.080 10.856 ( -2.225 3.394 -2.835) 4.951 10.950 ( 2.822 2.786 -0.846) 4.054 10.980 ( -0.606 1.613 -1.952) 2.603 11.204 ( 0.252 3.173 6.273) 7.035 11.250 ( 0.568 0.040 8.271) 8.291 11.345 ( -0.542 10.001 3.116) 10.490 11.389 ( -5.038 -3.072 -2.635) 6.463 11.540 ( 3.308 -6.065 -2.997) 7.531 11.712 ( 0.458 4.333 -0.582) 4.396 11.751 ( -4.770 0.771 5.937) 7.654 12.019 ( 5.317 5.326 3.789) 8.426 12.162 ( 3.191 -1.350 0.054) 3.465 12.196 ( 5.308 2.993 5.121) 7.959 12.339 ( -2.998 -5.337 1.804) 6.381 12.374 ( -2.613 -5.578 -1.437) 6.325 12.546 ( -1.989 0.654 -1.476) 2.562 12.606 ( 3.587 -3.541 -3.528) 6.152 12.646 ( 0.006 -0.326 -3.030) 3.048 12.702 ( 0.595 2.323 -1.323) 2.739 12.944 ( -1.892 -4.928 1.441) 5.472 13.005 ( -1.067 -0.458 1.170) 1.648 13.087 ( 1.713 2.248 -0.243) 2.837 13.155 ( 4.270 -6.899 -0.702) 8.144 13.190 ( -0.978 -2.320 0.333) 2.540 13.294 ( -1.646 -3.140 1.802) 3.977 13.458 ( -2.781 3.895 2.203) 5.268 13.541 ( -0.692 0.681 6.085) 6.161 13.547 ( -1.373 7.842 0.845) 8.006 13.719 ( 4.155 5.501 -5.949) 9.106 13.813 ( -1.052 1.693 0.271) 2.011 13.900 ( 2.674 3.983 -4.020) 6.259 13.920 ( -0.855 0.788 -0.914) 1.479 14.079 ( 0.252 1.859 -3.823) 4.258 14.176 ( -0.194 -4.504 0.396) 4.525 14.193 ( -1.581 2.928 3.974) 5.183 14.361 ( -3.364 -4.067 -4.357) 6.844 14.388 ( -2.046 -4.845 -0.521) 5.284 14.462 ( 2.107 -5.375 -2.582) 6.324 14.610 ( -2.253 1.388 -1.494) 3.039 14.778 ( -3.382 1.030 1.145) 3.716 14.820 ( -1.723 -3.151 6.945) 7.818 14.880 ( -0.596 -4.384 0.234) 4.431 14.940 ( -5.639 -4.117 -3.572) 7.843 15.143 ( -1.839 6.183 -3.001) 7.114 15.250 ( 1.531 4.550 -4.609) 6.655 15.439 ( -3.694 2.023 -3.083) 5.219 15.474 ( 4.819 4.011 -5.268) 8.190 15.651 ( 0.702 3.136 2.428) 4.028 15.749 ( 1.700 1.693 -0.334) 2.422 15.974 ( -6.419 0.192 1.363) 6.565 16.068 ( 9.847 -1.252 -0.832) 9.961 16.143 ( 9.041 0.179 2.018) 9.265 16.255 ( 1.192 -1.283 0.607) 1.854 16.658 ( -4.696 1.659 5.190) 7.194 16.761 ( 0.249 0.436 6.550) 6.569 16.892 ( 1.501 0.450 -0.545) 1.659 16.932 ( -0.595 0.788 2.139) 2.356 16.947 ( -3.404 -0.666 0.430) 3.495 16.992 ( 0.499 1.773 1.129) 2.160 17.200 ( -3.365 -1.641 4.543) 5.887 17.270 ( -2.574 0.848 2.158) 3.465 17.435 ( -0.335 2.446 -2.348) 3.407 17.473 ( -1.818 0.870 -4.400) 4.840 17.656 ( 3.109 -2.035 -3.353) 5.005 17.674 ( 0.409 -2.709 -2.958) 4.032 18.087 ( 0.468 0.884 2.106) 2.332 18.142 ( 0.499 -0.466 1.951) 2.067 18.299 ( -1.882 -0.386 5.883) 6.188 18.353 ( 1.884 2.233 3.816) 4.806 18.451 ( -4.090 -1.044 -0.885) 4.313 18.509 ( -2.478 -1.161 2.396) 3.637 18.554 ( 5.001 -1.155 1.153) 5.260 18.676 ( 4.160 -2.928 -4.671) 6.906 18.862 ( 2.025 1.442 3.518) 4.308 19.019 ( -1.585 -3.055 -2.674) 4.358 19.120 ( 3.100 -0.845 2.811) 4.269 19.160 ( 1.638 -0.539 1.121) 2.056 27.628 ( -1.047 -0.975 -0.285) 1.459 27.639 ( -0.703 -1.122 -0.634) 1.468 27.691 ( -0.661 0.810 -0.467) 1.145 27.704 ( -0.233 0.520 -1.071) 1.213 27.808 ( 0.302 0.983 0.239) 1.056 27.831 ( 0.984 0.788 -0.349) 1.308 27.852 ( 0.180 0.154 0.277) 0.364 27.889 ( -0.665 -0.774 -0.624) 1.196 29.296 ( -2.005 0.579 5.486) 5.870 29.380 ( -4.741 -1.574 1.023) 5.100 29.485 ( 1.821 1.907 -4.599) 5.301 29.594 ( 1.315 -0.908 -6.320) 6.519 29.927 ( 2.409 2.406 1.468) 3.708 29.991 ( -3.029 3.727 -1.908) 5.168 30.181 ( -4.530 -1.674 0.419) 4.848 30.212 ( 1.942 -4.837 0.234) 5.217 30.464 ( 2.650 2.022 0.025) 3.333 30.515 ( -2.209 4.194 -0.980) 4.841 30.577 ( 2.536 0.630 0.553) 2.671 30.629 ( -2.727 0.404 0.579) 2.817 30.734 ( 5.728 2.997 0.929) 6.532 30.773 ( -8.011 0.296 -0.767) 8.053 30.869 ( 6.893 1.450 -2.026) 7.329 31.053 ( 3.395 -0.686 -4.992) 6.076 31.312 ( 7.513 -1.182 0.037) 7.605 31.502 ( -6.565 -9.961 0.408) 11.937 31.875 ( -4.716 6.817 2.840) 8.762 32.087 ( 3.317 -2.510 0.091) 4.161 32.296 ( -11.155 0.055 13.016) 17.142 32.437 ( 5.065 5.217 3.402) 8.028 32.529 ( -8.546 -3.992 -5.710) 11.026 32.774 ( 13.024 -3.666 -5.219) 14.502 ======================= Grid point 75 (41/60) ======================= q-point: (-0.33 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.479 ( -13.075 14.453 24.039) 30.947 1.995 ( -25.467 3.623 13.584) 29.090 2.311 ( -5.905 -2.327 10.818) 12.543 2.498 ( -8.624 5.815 5.458) 11.746 2.596 ( -6.939 -7.204 1.361) 10.094 2.774 ( -0.682 3.784 -0.119) 3.847 2.880 ( 0.709 -2.521 -1.139) 2.856 2.912 ( 1.665 1.172 -2.233) 3.022 3.022 ( 0.534 1.820 -0.866) 2.085 3.114 ( 1.036 -0.570 -3.002) 3.226 3.333 ( 7.847 4.251 0.533) 8.940 3.495 ( 3.804 -1.921 -5.650) 7.077 3.536 ( -9.719 3.409 -6.115) 11.978 3.656 ( 2.279 5.060 0.941) 5.628 3.735 ( 8.674 -2.637 2.902) 9.519 3.873 ( -8.353 0.452 -6.115) 10.362 3.888 ( 5.583 -1.721 2.977) 6.557 4.000 ( -6.078 -2.544 2.819) 7.166 4.091 ( -6.326 1.565 1.444) 6.675 4.148 ( -5.686 4.324 0.818) 7.190 4.259 ( -1.820 -1.356 1.731) 2.855 4.349 ( 1.496 -2.847 -2.996) 4.395 4.434 ( -8.338 0.600 -1.803) 8.552 4.521 ( 2.335 1.708 -2.332) 3.716 4.528 ( 3.753 -0.399 1.221) 3.967 4.681 ( -2.306 8.636 -0.488) 8.952 4.755 ( -0.358 -0.555 -5.866) 5.903 4.798 ( 3.770 1.529 -0.693) 4.127 4.877 ( -1.195 -3.927 -2.255) 4.683 4.989 ( 2.702 -1.289 0.621) 3.057 5.056 ( 4.155 -4.454 1.659) 6.313 5.112 ( 11.697 -7.912 3.498) 14.549 5.155 ( 2.960 0.400 -0.234) 2.996 5.363 ( -2.289 0.727 0.073) 2.403 5.462 ( 13.135 4.220 0.094) 13.797 5.558 ( 3.380 0.586 -2.024) 3.983 5.610 ( 5.905 1.201 1.484) 6.206 5.783 ( 0.149 5.849 -2.603) 6.404 5.900 ( -3.712 -5.525 9.136) 11.304 6.071 ( -2.868 0.888 3.691) 4.758 6.495 ( -7.790 -6.089 -0.135) 9.888 6.518 ( -5.269 -3.556 -2.530) 6.842 6.670 ( 2.589 -3.901 11.062) 12.012 6.843 ( 7.582 -4.834 -1.362) 9.094 7.332 ( -0.542 0.644 -0.077) 0.845 7.446 ( 3.918 4.928 -5.609) 8.432 7.614 ( 4.790 -5.988 0.122) 7.669 7.731 ( 5.331 -0.082 -9.087) 10.536 8.225 ( -6.283 -2.349 -0.094) 6.708 8.293 ( 0.952 -3.562 2.341) 4.367 8.432 ( 3.642 5.986 -2.491) 7.436 8.532 ( 0.008 0.693 -4.204) 4.261 8.707 ( -0.814 4.064 1.303) 4.345 8.717 ( 4.066 -0.272 1.623) 4.386 8.855 ( 1.858 2.181 -2.581) 3.856 8.958 ( 0.199 -4.007 -6.714) 7.821 9.020 ( 2.406 -2.667 0.158) 3.595 9.144 ( 0.775 4.367 -0.357) 4.450 9.252 ( -1.686 -7.162 4.640) 8.699 9.357 ( 0.273 2.441 -1.569) 2.914 9.416 ( 0.639 1.087 3.912) 4.110 9.586 ( 7.795 0.056 -1.796) 7.999 9.876 ( 6.829 -1.223 -0.091) 6.938 10.094 ( -0.250 -1.683 2.903) 3.365 10.188 ( 5.687 -5.695 -3.646) 8.835 10.336 ( -0.248 -5.628 -5.541) 7.902 10.424 ( 1.204 2.460 2.900) 3.988 10.441 ( 1.289 2.343 0.203) 2.681 10.568 ( 2.452 3.620 3.859) 5.832 10.620 ( -1.795 0.264 -4.969) 5.290 10.779 ( -1.132 0.978 -4.576) 4.815 10.814 ( 0.637 -3.345 0.023) 3.406 10.958 ( -0.007 2.267 0.216) 2.277 10.987 ( 0.829 4.779 -1.992) 5.243 11.187 ( -4.948 7.194 5.880) 10.527 11.251 ( -5.713 -2.085 2.214) 6.472 11.312 ( 3.075 2.143 1.702) 4.116 11.421 ( 4.859 5.716 -0.804) 7.546 11.568 ( 0.592 -4.898 -3.044) 5.798 11.651 ( -3.311 5.562 5.386) 8.421 11.781 ( 1.117 -1.087 2.130) 2.639 12.166 ( 3.082 5.399 3.214) 6.998 12.215 ( 0.565 -3.777 4.878) 6.195 12.267 ( -1.670 -8.557 -0.079) 8.719 12.301 ( 0.956 -3.226 0.357) 3.383 12.368 ( 5.472 -1.234 -4.993) 7.509 12.506 ( -1.441 -0.776 -0.828) 1.834 12.611 ( -1.620 4.187 -0.949) 4.589 12.664 ( 3.560 0.764 -3.030) 4.737 12.713 ( 1.169 -1.495 -3.630) 4.097 12.919 ( -1.395 -1.933 2.958) 3.799 12.990 ( -1.274 -2.808 0.021) 3.084 13.117 ( 1.760 -0.699 -2.511) 3.145 13.180 ( -0.216 -1.448 0.532) 1.557 13.232 ( 1.751 -2.650 -0.591) 3.231 13.277 ( 0.681 -2.246 1.061) 2.576 13.363 ( -5.743 2.527 0.802) 6.325 13.541 ( 0.061 3.502 2.312) 4.197 13.565 ( -0.804 2.699 8.092) 8.568 13.729 ( -3.284 -1.661 -5.336) 6.482 13.792 ( 1.607 7.673 0.267) 7.844 13.917 ( -0.950 3.667 1.087) 3.941 13.940 ( -0.823 3.312 -0.702) 3.484 13.980 ( -3.048 3.803 -4.225) 6.450 14.156 ( 1.323 -3.011 -2.169) 3.940 14.228 ( -1.791 -3.457 6.508) 7.584 14.284 ( -0.786 -2.021 -3.281) 3.933 14.333 ( -2.218 -1.145 -1.355) 2.840 14.482 ( 0.910 -4.197 -0.293) 4.305 14.488 ( -6.135 -6.716 -2.005) 9.315 14.678 ( -4.208 0.282 1.237) 4.395 14.773 ( -4.799 -3.058 6.802) 8.868 14.897 ( 0.275 2.650 1.782) 3.205 14.966 ( 5.881 -4.794 0.121) 7.589 15.025 ( -6.586 6.171 -0.696) 9.052 15.244 ( -2.265 0.089 -3.769) 4.398 15.371 ( -0.101 1.203 -3.177) 3.399 15.536 ( 3.408 3.184 -4.917) 6.777 15.687 ( 1.139 4.979 -0.737) 5.160 15.730 ( -2.457 1.702 2.817) 4.107 15.843 ( -4.926 3.893 -1.364) 6.425 16.151 ( -1.336 -3.750 -1.284) 4.183 16.274 ( 0.416 1.341 0.409) 1.462 16.366 ( 9.654 -1.897 -4.136) 10.673 16.583 ( -4.063 2.199 5.994) 7.567 16.769 ( -2.222 -3.080 4.168) 5.639 16.872 ( -4.300 -1.201 1.280) 4.644 16.888 ( -2.397 2.336 2.250) 4.033 16.920 ( -0.150 1.149 0.946) 1.496 16.999 ( -0.621 4.294 2.345) 4.931 17.124 ( -5.886 -1.564 3.559) 7.054 17.208 ( -3.878 0.137 0.861) 3.975 17.417 ( 0.332 0.308 -1.831) 1.886 17.460 ( 1.592 2.699 -0.610) 3.193 17.655 ( -0.300 -2.353 -1.770) 2.960 17.747 ( 6.233 -1.938 -3.564) 7.437 18.087 ( -1.380 0.817 1.682) 2.324 18.133 ( -1.634 -0.534 0.191) 1.729 18.289 ( -2.128 -1.924 4.310) 5.177 18.371 ( -2.815 -1.580 3.016) 4.418 18.451 ( 2.086 2.479 -1.095) 3.420 18.489 ( 2.355 -0.338 0.072) 2.380 18.643 ( 2.680 -1.805 0.675) 3.301 18.754 ( 5.698 -0.703 -3.435) 6.690 18.881 ( -2.022 -1.143 2.148) 3.164 18.958 ( -2.347 -1.563 -2.954) 4.084 19.189 ( 1.739 -1.167 0.674) 2.200 19.208 ( 2.744 -0.601 -1.496) 3.182 27.621 ( 0.397 -0.600 0.621) 0.950 27.637 ( 0.664 -1.157 0.258) 1.359 27.683 ( 0.095 0.888 0.022) 0.893 27.705 ( 0.662 0.228 -0.376) 0.795 27.798 ( -1.255 0.559 -0.375) 1.424 27.817 ( -1.178 0.999 -0.745) 1.715 27.866 ( -0.672 -0.529 -0.515) 0.998 27.875 ( 0.605 -0.147 0.609) 0.870 29.269 ( -2.853 0.675 3.571) 4.620 29.332 ( -0.734 -0.811 5.170) 5.284 29.532 ( 4.144 1.190 -1.834) 4.685 29.598 ( 2.219 -1.409 -6.190) 6.725 29.863 ( -6.610 1.951 -1.797) 7.122 29.961 ( -1.428 3.454 1.281) 3.951 30.033 ( -7.358 -0.679 2.611) 7.837 30.229 ( -2.054 -5.011 0.490) 5.438 30.329 ( -12.815 2.536 0.740) 13.085 30.440 ( -1.522 5.404 -2.764) 6.258 30.592 ( -5.922 -3.507 -0.552) 6.904 30.612 ( 2.812 -2.519 -1.130) 3.941 30.744 ( 3.790 1.724 -0.536) 4.199 30.847 ( 4.389 4.619 0.683) 6.408 31.008 ( 5.442 -1.030 -3.400) 6.499 31.091 ( 5.225 0.913 -6.330) 8.259 31.303 ( -8.870 -2.359 -6.633) 11.325 31.503 ( 7.555 -3.651 6.575) 10.660 31.829 ( -3.766 2.562 5.255) 6.954 32.042 ( -6.346 -6.288 5.085) 10.280 32.224 ( -1.984 0.343 5.013) 5.402 32.394 ( -1.084 -4.332 4.634) 6.435 32.684 ( 14.462 9.750 -1.211) 17.483 33.027 ( 14.114 -2.143 -9.239) 17.004 ======================= Grid point 76 (42/60) ======================= q-point: (-0.17 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.380 ( -10.307 9.221 24.642) 28.257 1.587 ( -15.785 13.241 23.422) 31.194 2.297 ( -1.339 -9.868 8.590) 13.151 2.409 ( -6.426 5.377 23.946) 25.370 2.528 ( -1.087 -8.393 6.410) 10.617 2.739 ( -1.350 4.552 -3.573) 5.942 2.890 ( 0.866 1.137 -1.112) 1.811 2.985 ( 3.797 4.135 1.065) 5.714 3.047 ( 2.898 -1.786 0.276) 3.415 3.149 ( 1.535 3.629 -0.261) 3.949 3.285 ( -8.360 3.498 -1.375) 9.166 3.476 ( 2.934 4.880 0.168) 5.697 3.577 ( -4.379 5.157 0.546) 6.787 3.601 ( 1.849 1.368 -0.164) 2.306 3.774 ( -7.663 -0.703 0.438) 7.707 3.783 ( 3.347 -0.472 -1.287) 3.617 3.868 ( -0.390 -1.714 -1.136) 2.093 3.973 ( -1.873 1.753 -2.894) 3.867 4.068 ( -3.380 -0.156 4.605) 5.714 4.131 ( 4.066 -3.154 -1.560) 5.378 4.215 ( -5.863 0.953 1.042) 6.031 4.307 ( 5.893 2.594 4.561) 7.890 4.419 ( 1.554 -2.408 -4.967) 5.734 4.534 ( -0.012 -3.060 -6.766) 7.426 4.611 ( 3.483 2.315 -7.500) 8.587 4.681 ( 4.332 4.492 -1.512) 6.421 4.681 ( -1.100 -0.358 0.423) 1.231 4.837 ( -0.135 -2.486 1.021) 2.691 4.909 ( 0.770 0.167 -0.934) 1.222 4.994 ( 0.931 0.416 7.851) 7.917 5.077 ( 0.014 -1.430 2.437) 2.825 5.165 ( -1.094 -2.126 -3.287) 4.065 5.297 ( -0.090 -4.576 5.265) 6.976 5.379 ( 5.695 -5.110 -3.489) 8.410 5.582 ( -1.224 3.182 2.151) 4.031 5.685 ( 2.344 -4.601 -0.939) 5.248 5.773 ( 1.833 4.105 0.027) 4.496 5.803 ( 8.410 1.217 3.887) 9.345 5.873 ( 1.857 -5.767 1.943) 6.363 6.106 ( 3.278 5.090 0.009) 6.054 6.273 ( -8.471 -2.891 -7.193) 11.483 6.369 ( -7.022 -1.298 -8.161) 10.844 6.749 ( -1.222 -5.757 11.301) 12.742 6.945 ( 3.923 -6.775 -3.505) 8.577 7.341 ( 0.780 2.036 2.493) 3.312 7.527 ( 6.258 4.920 -6.144) 10.056 7.661 ( -0.599 -4.516 -1.063) 4.678 7.761 ( 2.209 -0.029 -9.914) 10.157 8.139 ( -2.056 -3.242 0.425) 3.862 8.234 ( -4.167 -5.952 -3.726) 8.166 8.473 ( 1.407 6.338 -3.445) 7.350 8.535 ( 2.073 4.756 -3.488) 6.252 8.693 ( 1.334 4.951 -2.679) 5.786 8.830 ( -1.862 -1.108 -2.610) 3.392 8.848 ( 3.743 -3.345 3.649) 6.206 8.943 ( 2.378 -2.576 -5.309) 6.363 9.108 ( 0.940 -4.821 1.254) 5.070 9.153 ( 3.253 6.635 -1.517) 7.543 9.271 ( 2.126 -6.013 5.748) 8.585 9.402 ( 3.931 0.965 0.129) 4.050 9.447 ( -0.195 1.024 4.614) 4.730 9.722 ( 4.671 -2.238 0.012) 5.179 10.009 ( 3.088 -1.723 -0.254) 3.545 10.096 ( -0.017 1.423 0.099) 1.426 10.279 ( 1.877 -2.785 -1.714) 3.771 10.352 ( 1.188 -3.123 2.020) 3.905 10.486 ( 2.679 3.788 2.397) 5.222 10.553 ( 0.049 -0.019 -0.108) 0.120 10.568 ( 8.957 -0.154 2.224) 9.230 10.670 ( 3.280 0.239 1.127) 3.477 10.755 ( 3.347 -1.352 -3.963) 5.361 10.864 ( 4.543 0.033 -0.176) 4.547 10.959 ( 0.609 4.124 -0.404) 4.189 10.980 ( -0.169 2.242 -1.804) 2.882 11.097 ( -4.872 3.614 5.179) 7.977 11.190 ( -3.081 5.492 6.703) 9.197 11.413 ( 5.743 6.802 -4.048) 9.779 11.498 ( 2.613 -0.708 -2.452) 3.652 11.538 ( -0.252 -1.562 -0.609) 1.695 11.654 ( 1.009 3.093 -0.666) 3.320 11.801 ( -0.516 -0.072 8.209) 8.226 12.082 ( -7.110 -4.880 5.107) 10.023 12.245 ( -2.661 -6.759 -1.977) 7.528 12.291 ( 1.966 0.674 -6.878) 7.186 12.328 ( 1.953 -4.361 0.393) 4.795 12.406 ( 1.547 -0.611 -0.838) 1.862 12.496 ( 1.606 -1.231 -5.452) 5.815 12.569 ( -5.102 -1.180 0.406) 5.252 12.689 ( -2.385 0.991 2.196) 3.390 12.731 ( 3.673 -2.849 -1.496) 4.883 12.908 ( -1.234 -2.234 2.557) 3.613 12.976 ( 2.349 -0.167 -3.062) 3.863 13.114 ( -1.512 1.443 -2.480) 3.243 13.169 ( -1.581 -4.443 0.849) 4.791 13.190 ( -0.362 3.449 -4.097) 5.368 13.324 ( -0.135 0.109 6.067) 6.069 13.345 ( 2.760 -1.277 0.666) 3.113 13.539 ( -1.641 -0.564 -0.162) 1.743 13.559 ( -4.185 -0.163 -0.253) 4.195 13.609 ( -2.308 1.068 1.200) 2.813 13.812 ( -1.049 6.102 -0.152) 6.194 13.860 ( -1.361 2.693 -0.704) 3.099 13.900 ( 0.447 5.015 0.141) 5.037 13.989 ( 0.983 6.913 3.453) 7.790 14.076 ( -9.009 -0.660 0.067) 9.033 14.248 ( 2.644 -6.274 -2.809) 7.365 14.282 ( 2.874 -4.716 0.742) 5.572 14.320 ( -0.636 3.379 1.095) 3.609 14.476 ( -0.996 -2.971 5.794) 6.587 14.527 ( 7.614 -1.389 -5.248) 9.351 14.668 ( 3.517 2.682 4.145) 6.062 14.713 ( -3.430 -0.950 2.475) 4.335 14.837 ( -6.566 2.621 7.168) 10.068 14.944 ( 0.012 8.345 -2.962) 8.855 15.103 ( 0.550 -8.173 -0.391) 8.200 15.163 ( 2.732 -3.504 0.311) 4.454 15.387 ( 1.956 -0.521 -2.317) 3.077 15.555 ( -0.912 4.238 -0.436) 4.357 15.642 ( -4.753 -0.660 -2.034) 5.212 15.684 ( -0.120 1.944 -3.918) 4.375 15.817 ( 0.911 8.893 0.886) 8.984 16.021 ( -8.442 -1.522 -4.246) 9.572 16.225 ( -3.771 -1.004 3.193) 5.042 16.467 ( 1.283 -5.101 -1.855) 5.578 16.616 ( 3.568 3.345 4.936) 6.949 16.765 ( -1.555 -2.723 2.715) 4.148 16.805 ( -1.197 -0.978 1.079) 1.885 16.851 ( -1.802 0.970 1.742) 2.688 16.903 ( -1.240 2.209 -0.413) 2.567 16.979 ( -2.319 4.045 0.649) 4.708 17.029 ( -3.418 -1.460 2.295) 4.368 17.138 ( -3.124 0.049 -0.156) 3.128 17.435 ( 1.773 0.088 -0.295) 1.800 17.510 ( 2.456 3.513 1.680) 4.603 17.628 ( -2.449 -1.762 1.502) 3.370 17.858 ( 6.206 -1.981 -4.406) 7.864 18.062 ( -1.598 0.420 1.899) 2.517 18.110 ( 0.138 -0.803 -0.830) 1.163 18.241 ( -4.237 -1.849 1.359) 4.818 18.307 ( -3.535 -2.913 -0.284) 4.589 18.460 ( 0.625 2.312 -0.623) 2.474 18.583 ( 4.275 0.651 0.719) 4.383 18.690 ( 0.877 0.083 1.851) 2.050 18.801 ( -2.447 -0.813 -2.847) 3.841 18.864 ( 3.273 -2.292 -1.365) 4.223 18.897 ( -1.944 -1.691 -2.216) 3.399 19.152 ( -5.295 -0.785 -1.642) 5.599 19.230 ( 0.107 -1.593 -4.206) 4.499 27.648 ( 1.664 -0.426 1.206) 2.099 27.663 ( 1.141 -0.915 1.015) 1.780 27.695 ( 0.723 0.588 0.848) 1.260 27.727 ( 1.431 -0.150 0.501) 1.524 27.765 ( -1.252 0.331 -0.686) 1.466 27.786 ( -1.384 0.590 -0.718) 1.668 27.846 ( -0.703 0.285 -0.891) 1.170 27.881 ( -0.465 -0.297 0.213) 0.592 29.257 ( -0.475 1.557 4.891) 5.154 29.399 ( 4.568 -2.028 6.622) 8.297 29.590 ( -1.091 1.827 -4.718) 5.176 29.617 ( 4.480 0.815 -1.713) 4.865 29.768 ( -2.173 -2.161 -0.961) 3.211 29.844 ( -3.384 0.176 0.716) 3.464 30.002 ( -2.684 0.406 4.907) 5.607 30.065 ( -10.434 2.568 -0.280) 10.749 30.134 ( -6.555 -1.477 0.505) 6.738 30.404 ( -2.377 -1.347 -3.001) 4.058 30.489 ( -1.442 -0.791 1.060) 1.957 30.656 ( 0.619 -2.714 0.747) 2.882 30.791 ( 2.174 2.404 -2.728) 4.237 30.878 ( -0.590 1.202 -3.848) 4.074 31.023 ( -0.159 0.016 -6.235) 6.237 31.108 ( -5.665 0.844 -7.266) 9.252 31.234 ( 8.332 3.785 0.661) 9.176 31.624 ( -0.940 -3.233 6.549) 7.364 31.751 ( -5.071 0.929 2.593) 5.771 31.996 ( -0.322 -6.752 5.517) 8.726 32.237 ( 1.444 3.702 5.538) 6.816 32.494 ( 3.653 -7.771 12.488) 15.156 32.940 ( 10.434 10.525 -7.854) 16.773 33.219 ( 9.686 -1.164 -12.134) 15.569 ======================= Grid point 77 (43/60) ======================= q-point: ( 0.00 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.717 ( 1.545 17.584 18.417) 25.510 1.955 ( 6.270 15.544 21.978) 27.639 2.068 ( 2.238 -14.069 10.317) 17.589 2.320 ( 5.726 -16.414 14.922) 22.910 2.696 ( 1.486 5.287 2.490) 6.030 2.749 ( -0.437 3.259 3.448) 4.765 2.937 ( -0.815 -3.203 -2.505) 4.147 2.948 ( -1.735 -0.150 4.150) 4.501 3.206 ( 4.367 5.155 -0.430) 6.770 3.261 ( 3.489 1.340 1.772) 4.136 3.334 ( -1.860 5.584 1.198) 6.007 3.415 ( -5.544 -0.029 -4.302) 7.017 3.628 ( -4.534 0.708 0.284) 4.598 3.657 ( -0.840 1.192 -1.209) 1.895 3.714 ( -1.508 1.529 -1.812) 2.809 3.770 ( 0.697 -2.030 1.230) 2.474 3.835 ( -0.016 2.078 -3.501) 4.072 3.900 ( 2.644 -3.517 -3.464) 5.600 4.038 ( -1.086 6.435 -1.585) 6.716 4.136 ( -1.299 1.803 -0.299) 2.242 4.162 ( 1.480 -3.775 3.198) 5.164 4.239 ( -1.815 -7.736 -2.196) 8.244 4.524 ( -5.271 6.028 -2.726) 8.459 4.583 ( 0.425 3.699 -0.365) 3.741 4.624 ( 0.740 1.952 3.791) 4.328 4.722 ( -1.165 -1.915 3.215) 3.919 4.745 ( 2.118 0.773 3.468) 4.137 4.829 ( 2.225 -1.158 1.826) 3.102 4.911 ( 1.705 -0.856 3.773) 4.228 4.959 ( -0.235 -6.777 -1.235) 6.892 5.162 ( -1.442 -0.143 1.621) 2.174 5.174 ( 6.004 3.466 -1.032) 7.009 5.204 ( 2.002 -1.905 2.094) 3.467 5.319 ( 2.342 -8.328 0.597) 8.671 5.589 ( -0.694 0.306 1.222) 1.438 5.608 ( 0.822 -0.550 -1.345) 1.669 5.795 ( -4.335 0.143 -0.566) 4.374 5.817 ( -5.126 -0.653 -1.057) 5.274 5.942 ( -0.117 4.811 -0.663) 4.858 6.070 ( -3.167 -6.628 -5.240) 9.023 6.160 ( -2.322 2.820 -2.903) 4.666 6.218 ( -0.634 -2.162 -4.290) 4.846 6.708 ( 0.423 2.863 3.391) 4.458 6.839 ( 3.288 -8.929 -3.058) 9.994 7.409 ( -3.133 4.377 3.715) 6.540 7.505 ( -4.537 -4.623 2.997) 7.138 7.696 ( 3.016 3.250 -7.876) 9.039 7.729 ( 0.389 -0.337 -7.439) 7.457 8.018 ( -3.476 -1.109 -2.155) 4.237 8.067 ( 1.752 -5.619 -3.834) 7.024 8.581 ( -0.046 3.529 -3.670) 5.091 8.604 ( -0.649 1.046 -4.520) 4.685 8.766 ( 2.387 3.662 -2.870) 5.229 8.812 ( -1.075 4.398 -4.676) 6.509 8.878 ( 4.229 -3.441 0.400) 5.467 8.945 ( -1.964 -4.748 -2.553) 5.737 9.067 ( 2.583 4.547 3.739) 6.429 9.173 ( -0.833 -2.932 1.474) 3.385 9.333 ( 0.136 3.005 0.911) 3.143 9.434 ( 1.408 -4.104 0.324) 4.351 9.546 ( 1.461 1.607 1.987) 2.944 9.608 ( -3.559 -5.507 -1.267) 6.678 10.038 ( 1.694 0.552 -1.144) 2.118 10.069 ( 1.371 -2.378 -2.762) 3.895 10.298 ( 0.304 1.687 3.154) 3.590 10.331 ( -0.053 -1.203 3.070) 3.298 10.546 ( -0.628 4.041 -2.470) 4.778 10.618 ( 0.280 -2.640 -5.169) 5.811 10.718 ( 6.818 3.432 2.932) 8.176 10.735 ( -1.422 3.107 5.091) 6.131 10.820 ( 3.336 -1.618 3.749) 5.272 10.895 ( 1.025 -7.393 3.283) 8.154 11.015 ( -6.459 1.677 1.075) 6.759 11.055 ( -2.742 -1.402 4.260) 5.256 11.143 ( 4.982 9.341 -1.336) 10.671 11.288 ( -5.889 -1.980 1.228) 6.333 11.362 ( -0.582 5.893 3.032) 6.653 11.525 ( 2.825 -6.785 -1.087) 7.430 11.647 ( 4.108 6.257 -3.730) 8.363 11.694 ( 1.870 0.806 -4.748) 5.166 11.870 ( 0.002 4.407 7.478) 8.680 12.026 ( 3.101 -5.386 5.365) 8.210 12.078 ( -2.662 -2.471 -3.791) 5.250 12.165 ( -6.152 -8.229 -4.609) 11.261 12.235 ( -4.109 4.063 -1.754) 6.039 12.327 ( -3.113 -3.247 -1.801) 4.845 12.458 ( 3.036 1.908 -5.440) 6.516 12.507 ( 3.556 -2.899 -4.858) 6.682 12.635 ( -6.042 3.417 2.296) 7.310 12.731 ( -0.644 -5.981 -1.451) 6.188 12.858 ( -0.938 3.116 6.264) 7.058 12.962 ( 1.131 -6.159 3.691) 7.269 13.088 ( 1.999 0.103 -3.418) 3.961 13.107 ( 0.699 -0.816 -3.966) 4.108 13.237 ( 0.446 1.284 -1.908) 2.343 13.270 ( -2.520 -1.753 -1.490) 3.412 13.407 ( 1.261 1.745 2.230) 3.100 13.452 ( -0.544 -2.769 1.554) 3.222 13.603 ( 3.330 4.526 0.076) 5.620 13.653 ( 3.048 -0.031 -1.484) 3.391 13.877 ( -1.824 2.021 3.619) 4.529 13.907 ( -1.201 0.333 3.461) 3.679 13.986 ( -1.231 6.003 0.579) 6.155 14.050 ( 1.523 1.886 -0.695) 2.522 14.070 ( 2.629 0.002 -1.305) 2.935 14.166 ( -0.084 -5.138 -4.088) 6.566 14.311 ( 1.130 1.238 -5.894) 6.128 14.354 ( -0.271 -2.815 -6.161) 6.779 14.482 ( 3.311 9.030 9.904) 13.805 14.649 ( 4.484 -7.001 6.853) 10.775 14.748 ( -0.605 5.442 1.572) 5.697 14.844 ( 1.855 -2.768 -0.291) 3.344 14.933 ( 3.970 4.615 6.697) 9.050 14.990 ( 9.173 0.263 3.382) 9.780 15.112 ( 3.728 4.273 -2.413) 6.163 15.193 ( 3.202 -3.333 -1.518) 4.865 15.373 ( -2.238 0.832 -3.615) 4.332 15.429 ( -5.925 -3.015 -5.252) 8.472 15.597 ( -0.806 1.578 3.495) 3.919 15.657 ( -5.514 -2.942 5.165) 8.108 15.826 ( -4.410 5.848 -2.388) 7.704 15.925 ( -2.731 -2.768 -2.914) 4.859 16.175 ( -0.837 2.737 0.152) 2.866 16.292 ( -2.140 -7.741 -3.823) 8.895 16.729 ( -0.630 1.966 3.229) 3.832 16.772 ( 1.650 -2.087 2.168) 3.432 16.793 ( -0.805 3.404 3.155) 4.710 16.846 ( -1.035 -1.357 2.769) 3.252 16.942 ( 2.560 2.296 -3.982) 5.261 16.971 ( -0.330 0.347 -1.189) 1.281 17.025 ( 1.331 0.589 0.025) 1.456 17.059 ( -0.800 -2.106 0.033) 2.253 17.508 ( 1.670 2.947 3.008) 4.530 17.569 ( 1.404 -2.962 4.660) 5.698 17.671 ( -0.123 7.891 -1.878) 8.112 17.826 ( 0.448 -7.190 -4.455) 8.471 18.071 ( 0.172 1.493 2.661) 3.056 18.110 ( 2.456 -2.195 -0.303) 3.308 18.145 ( -2.010 1.445 -1.304) 2.798 18.193 ( -0.849 -2.950 -1.777) 3.547 18.527 ( -1.550 3.447 3.256) 4.988 18.591 ( -2.730 -3.103 4.912) 6.419 18.691 ( -2.606 3.805 -3.179) 5.601 18.762 ( -3.260 -3.212 -1.131) 4.714 18.827 ( 1.426 2.059 0.337) 2.527 18.876 ( 2.018 -2.859 -1.876) 3.970 19.035 ( -4.580 2.457 -0.346) 5.209 19.104 ( -3.145 -4.075 -3.486) 6.217 27.673 ( -0.265 0.018 1.267) 1.295 27.678 ( 0.159 -0.458 1.253) 1.343 27.729 ( 1.444 0.466 0.096) 1.520 27.740 ( 1.269 -0.653 -0.549) 1.529 27.764 ( 0.102 0.525 0.007) 0.535 27.769 ( 0.543 0.039 0.320) 0.632 27.845 ( -0.314 0.469 -0.564) 0.798 27.854 ( -0.953 -0.381 -0.644) 1.212 29.348 ( 0.858 3.968 5.625) 6.937 29.439 ( 1.984 -5.360 4.937) 7.552 29.594 ( -0.194 3.235 -3.772) 4.973 29.653 ( -0.996 -2.431 -3.466) 4.349 29.788 ( 6.454 3.636 2.237) 7.739 29.862 ( 4.477 -3.554 3.543) 6.725 29.925 ( -6.019 4.925 -2.757) 8.252 29.992 ( -1.138 -0.709 -0.817) 1.570 30.105 ( 2.059 0.061 3.421) 3.993 30.153 ( -2.480 -5.922 0.655) 6.454 30.596 ( 1.991 2.205 0.086) 2.972 30.629 ( 0.432 -1.256 -0.111) 1.333 30.821 ( -1.209 1.188 -2.184) 2.765 30.841 ( -1.152 -0.207 -2.965) 3.187 31.003 ( 0.009 2.428 -5.436) 5.954 31.031 ( -0.016 -0.148 -7.281) 7.282 31.473 ( 1.176 3.314 4.752) 5.911 31.532 ( -3.588 -2.320 4.366) 6.109 31.738 ( -1.019 6.662 3.787) 7.730 31.899 ( 2.781 -8.802 1.341) 9.327 32.392 ( 0.578 3.361 13.262) 13.694 32.476 ( -0.113 -5.428 14.082) 15.093 33.107 ( -2.571 6.195 -14.982) 16.415 33.206 ( -0.763 -4.065 -15.342) 15.890 ======================= Grid point 78 (44/60) ======================= q-point: ( 0.17 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.873 ( 4.469 15.717 17.389) 23.861 2.164 ( 6.070 -8.182 6.249) 11.951 2.294 ( 10.376 6.391 16.624) 20.613 2.482 ( 4.892 -6.795 3.385) 9.031 2.696 ( 1.450 4.330 -9.439) 10.486 2.778 ( -1.253 0.699 -2.755) 3.106 2.872 ( -5.834 0.868 7.354) 9.427 2.979 ( 1.985 -6.794 -0.404) 7.089 3.224 ( -2.672 2.428 -5.720) 6.764 3.267 ( -4.911 -0.661 -4.938) 6.995 3.352 ( 3.427 4.567 4.357) 7.182 3.415 ( 4.987 -2.964 0.893) 5.869 3.526 ( 0.418 6.513 0.611) 6.555 3.609 ( -2.140 -0.818 1.572) 2.779 3.703 ( 0.016 4.096 3.436) 5.346 3.797 ( -4.005 -5.421 0.805) 6.788 3.882 ( 6.474 4.915 -3.320) 8.780 3.925 ( 3.338 3.285 -3.303) 5.731 4.060 ( 6.177 4.764 -2.607) 8.225 4.191 ( 1.813 1.079 3.662) 4.227 4.204 ( 3.597 -6.414 -1.710) 7.550 4.245 ( 3.073 -2.285 0.795) 3.911 4.386 ( -4.268 1.155 -1.652) 4.719 4.494 ( -5.040 -6.398 -0.740) 8.179 4.619 ( -7.866 -0.879 4.040) 8.887 4.636 ( -2.308 -0.809 2.751) 3.681 4.800 ( -1.281 8.956 2.802) 9.471 4.842 ( 0.104 2.111 0.445) 2.160 4.960 ( -0.953 -1.183 2.719) 3.115 5.043 ( 3.808 -0.911 1.533) 4.205 5.140 ( 1.505 -1.970 -1.520) 2.907 5.222 ( -1.539 -5.056 -0.743) 5.337 5.278 ( 2.814 -0.677 1.493) 3.256 5.352 ( -0.770 -6.877 -0.816) 6.968 5.584 ( -4.533 5.522 -4.982) 8.710 5.605 ( 1.761 0.896 -0.426) 2.021 5.653 ( -2.866 1.320 2.436) 3.986 5.722 ( -4.847 -3.784 0.423) 6.163 5.903 ( -1.802 1.725 3.186) 4.046 5.966 ( -2.810 -3.029 -0.208) 4.137 6.153 ( -0.887 0.104 -0.993) 1.336 6.189 ( 0.842 -3.013 -3.954) 5.042 6.718 ( -1.891 3.998 3.402) 5.579 6.851 ( -1.339 -8.027 -1.623) 8.298 7.361 ( -2.933 2.440 4.149) 5.637 7.433 ( -4.316 -3.950 5.093) 7.757 7.636 ( -3.314 2.284 -7.533) 8.541 7.686 ( -1.484 -1.613 -6.405) 6.770 7.983 ( 1.388 3.344 0.527) 3.659 8.107 ( 3.537 -7.622 -1.919) 8.619 8.536 ( -2.044 2.247 -3.572) 4.689 8.562 ( -1.174 -0.573 -2.826) 3.113 8.732 ( -1.697 6.120 -3.430) 7.218 8.820 ( 0.930 2.566 -2.841) 3.939 8.894 ( -0.690 -2.469 -1.646) 3.046 8.981 ( 4.168 -5.161 -0.600) 6.660 9.093 ( -3.055 6.290 1.581) 7.170 9.142 ( 0.214 3.775 0.261) 3.790 9.306 ( -3.083 -0.671 2.036) 3.755 9.391 ( -4.905 -8.674 -2.455) 10.262 9.533 ( -1.374 -0.028 0.004) 1.375 9.565 ( -1.325 -2.939 1.042) 3.388 10.073 ( 1.429 0.229 -1.414) 2.023 10.090 ( 0.853 -1.443 -2.551) 3.052 10.320 ( 0.346 1.799 2.206) 2.867 10.359 ( 1.176 -1.643 1.545) 2.544 10.526 ( -2.031 0.677 -1.792) 2.792 10.532 ( -8.058 1.135 -1.358) 8.250 10.661 ( -4.862 0.770 -0.807) 4.988 10.721 ( -4.982 -3.544 -2.261) 6.518 10.827 ( -3.696 6.424 2.110) 7.706 10.886 ( 1.817 3.851 1.522) 4.522 10.979 ( 0.207 -5.078 3.657) 6.261 11.014 ( -0.327 -6.977 4.262) 8.182 11.207 ( -2.482 2.503 1.821) 3.967 11.211 ( -0.789 0.894 2.623) 2.882 11.396 ( 2.025 7.012 -3.331) 8.023 11.519 ( -1.854 -3.814 -5.661) 7.074 11.671 ( -0.477 8.145 -1.420) 8.282 11.720 ( 1.065 3.192 0.120) 3.367 11.912 ( -0.412 5.183 5.146) 7.316 11.993 ( -1.020 -1.139 0.298) 1.558 12.019 ( -1.360 -6.701 -1.696) 7.045 12.106 ( 0.834 -4.894 1.265) 5.123 12.252 ( 2.497 1.141 2.297) 3.579 12.319 ( 0.246 -2.621 0.622) 2.705 12.490 ( 0.035 -0.512 -1.063) 1.180 12.508 ( -0.459 -2.555 -1.669) 3.086 12.612 ( 4.716 -0.639 -3.985) 6.208 12.682 ( -2.215 -7.535 1.588) 8.013 12.885 ( 0.221 3.077 0.204) 3.092 12.972 ( -0.771 -4.468 -1.706) 4.844 13.087 ( 0.166 2.020 0.510) 2.090 13.101 ( -0.137 0.968 -0.844) 1.292 13.236 ( -0.913 0.044 -2.236) 2.416 13.274 ( 2.127 -3.294 -0.935) 4.031 13.446 ( 0.097 0.929 2.638) 2.798 13.460 ( 1.379 -0.725 4.579) 4.837 13.691 ( 5.716 4.954 -2.809) 8.069 13.720 ( 4.448 2.151 -4.814) 6.898 13.870 ( -0.978 2.007 4.212) 4.767 13.922 ( 0.649 4.523 -1.267) 4.742 13.955 ( -0.494 -1.341 3.981) 4.229 14.041 ( -2.749 -2.973 -0.745) 4.118 14.117 ( 2.187 3.466 -1.388) 4.327 14.177 ( 3.498 -3.165 -3.928) 6.139 14.289 ( 1.868 1.140 -7.408) 7.725 14.344 ( -0.236 -3.777 -4.388) 5.795 14.596 ( 1.572 7.635 5.242) 9.394 14.708 ( -3.594 -2.405 2.670) 5.082 14.757 ( 1.401 3.538 -0.215) 3.811 14.824 ( -0.938 -2.304 -1.036) 2.695 15.015 ( -0.834 4.075 1.258) 4.346 15.056 ( -0.027 -0.677 0.993) 1.202 15.149 ( 0.648 3.147 -2.628) 4.151 15.233 ( 2.881 -4.395 -3.097) 6.100 15.389 ( 8.454 2.617 -2.698) 9.252 15.440 ( 5.022 -1.893 -2.708) 6.012 15.628 ( -0.766 -0.486 6.484) 6.548 15.648 ( 1.463 -2.337 3.994) 4.853 15.737 ( -1.490 6.814 -0.117) 6.976 15.855 ( -1.106 -3.507 -1.774) 4.083 16.177 ( -0.482 0.704 1.376) 1.619 16.236 ( -1.918 -4.699 0.043) 5.075 16.718 ( -0.999 3.799 1.585) 4.236 16.792 ( 0.410 -2.915 0.964) 3.097 16.837 ( 1.902 2.115 2.755) 3.960 16.859 ( 1.197 0.430 2.569) 2.867 16.917 ( -2.011 1.734 1.617) 3.109 16.926 ( -0.920 -0.369 -0.563) 1.139 17.120 ( 5.749 0.205 -1.641) 5.982 17.146 ( 5.945 -2.282 -0.627) 6.398 17.546 ( 0.376 3.854 1.647) 4.208 17.611 ( 0.500 -1.342 1.387) 1.994 17.646 ( -1.338 4.126 -1.510) 4.593 17.759 ( -3.790 -5.500 -5.122) 8.417 18.092 ( -0.819 1.512 1.349) 2.185 18.122 ( -0.391 -1.123 1.362) 1.808 18.177 ( 4.204 1.552 -0.104) 4.482 18.231 ( 6.263 -3.014 -1.462) 7.103 18.482 ( -4.097 1.178 5.010) 6.578 18.502 ( -6.502 -0.854 5.646) 8.654 18.652 ( -1.697 0.342 -1.842) 2.528 18.674 ( -4.675 -1.658 -0.420) 4.978 18.822 ( -0.525 2.649 -0.104) 2.702 18.889 ( 1.172 -3.860 -1.289) 4.235 19.025 ( 1.685 1.581 2.589) 3.470 19.074 ( 0.676 -2.895 0.789) 3.076 27.662 ( -1.031 -0.383 0.709) 1.308 27.664 ( -1.306 -0.611 0.480) 1.520 27.749 ( -0.400 0.399 -0.757) 0.944 27.753 ( -0.294 0.089 -0.317) 0.441 27.783 ( 1.470 0.725 -0.541) 1.726 27.791 ( 1.777 -0.055 -0.732) 1.922 27.837 ( 0.188 0.837 -0.052) 0.860 27.855 ( 0.985 -0.949 0.341) 1.409 29.369 ( -1.552 3.734 4.551) 6.088 29.446 ( -2.142 -3.694 2.214) 4.810 29.609 ( 1.478 2.617 -4.228) 5.187 29.662 ( 1.305 -2.156 -4.794) 5.416 29.793 ( 0.279 3.762 -0.901) 3.878 29.868 ( 0.468 -2.375 0.235) 2.432 30.012 ( 7.294 0.408 2.337) 7.670 30.049 ( 4.169 -3.285 1.233) 5.449 30.208 ( 7.904 2.195 0.012) 8.203 30.252 ( 9.253 -1.822 0.175) 9.432 30.619 ( 0.163 0.356 -1.017) 1.090 30.636 ( 0.936 -1.242 -2.138) 2.644 30.780 ( -1.964 2.064 1.421) 3.184 30.808 ( -1.313 0.132 1.492) 1.992 30.998 ( 2.308 2.111 -6.471) 7.187 31.009 ( 1.405 0.693 -7.376) 7.541 31.402 ( -7.250 3.089 1.432) 8.010 31.477 ( -5.629 -4.489 6.779) 9.889 31.817 ( 6.024 8.711 3.537) 11.166 31.990 ( 4.898 -8.345 0.952) 9.723 32.440 ( -2.770 2.222 12.552) 13.045 32.498 ( -4.134 -3.893 11.347) 12.689 32.874 ( -11.841 6.578 -10.434) 17.098 33.002 ( -10.482 -6.108 -12.832) 17.659 ======================= Grid point 79 (45/60) ======================= q-point: ( 0.33 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.068 ( 3.946 17.384 14.244) 22.818 2.342 ( 8.884 -7.082 1.446) 11.453 2.533 ( -2.223 1.869 9.492) 9.927 2.547 ( 0.098 -0.715 1.810) 1.949 2.670 ( -7.730 0.981 2.384) 8.149 2.723 ( 6.284 5.191 -4.000) 9.079 2.806 ( 2.555 -1.812 2.773) 4.183 2.940 ( -0.359 -8.194 -7.274) 10.963 3.142 ( -0.829 -1.132 -7.150) 7.286 3.157 ( 0.905 -2.921 -5.749) 6.512 3.337 ( -5.048 5.128 -6.984) 10.028 3.393 ( -8.319 1.350 -8.481) 11.957 3.547 ( -2.412 2.851 0.783) 3.815 3.641 ( -3.953 -5.025 -0.592) 6.421 3.674 ( 5.226 7.431 1.560) 9.218 3.812 ( 4.775 -4.562 2.164) 6.949 4.005 ( 4.792 9.213 -0.057) 10.385 4.049 ( 8.037 3.696 3.689) 9.585 4.177 ( 1.912 -1.400 -1.946) 3.067 4.261 ( 4.058 -6.101 1.493) 7.478 4.280 ( 2.629 2.459 -1.935) 4.087 4.316 ( 5.542 1.427 -2.241) 6.146 4.393 ( 0.991 -4.951 4.041) 6.467 4.427 ( 1.779 -5.022 -3.832) 6.563 4.513 ( -1.480 1.915 2.948) 3.815 4.595 ( -1.746 -5.387 0.724) 5.709 4.774 ( -1.554 4.418 0.801) 4.751 4.794 ( -5.311 -2.832 3.562) 6.993 4.890 ( -6.091 6.315 4.026) 9.653 5.050 ( -3.566 -1.031 -2.793) 4.646 5.130 ( -4.767 3.502 -1.482) 6.098 5.203 ( 1.994 -0.421 1.087) 2.310 5.233 ( -7.515 -0.243 -2.690) 7.985 5.284 ( -1.852 -6.244 -0.901) 6.575 5.486 ( -2.521 6.907 0.688) 7.384 5.561 ( -4.927 -0.084 0.469) 4.950 5.656 ( -1.358 2.729 0.865) 3.169 5.701 ( 1.850 -3.417 4.070) 5.627 5.949 ( -0.448 2.357 2.755) 3.653 5.973 ( 3.003 -0.241 7.694) 8.263 6.164 ( 6.249 -3.775 1.993) 7.567 6.220 ( 3.931 -7.730 -2.761) 9.101 6.657 ( -5.704 3.516 4.944) 8.327 6.773 ( -5.768 -6.758 1.940) 9.094 7.340 ( -1.509 0.906 3.834) 4.219 7.387 ( -2.542 -3.259 5.133) 6.590 7.553 ( 0.092 3.333 -7.483) 8.192 7.625 ( 0.052 -3.225 -6.470) 7.229 8.079 ( 6.006 4.326 4.221) 8.520 8.196 ( 5.137 -6.172 1.635) 8.195 8.458 ( -4.844 0.794 -1.907) 5.266 8.500 ( -3.666 -2.858 -0.377) 4.663 8.733 ( 3.180 5.372 -2.447) 6.705 8.793 ( -0.683 2.824 -2.310) 3.712 8.887 ( 0.378 -0.640 -1.476) 1.652 8.972 ( -3.184 -6.520 -3.344) 7.990 9.034 ( -1.925 9.096 0.160) 9.299 9.164 ( -0.508 1.748 0.498) 1.887 9.263 ( -2.544 -0.807 3.602) 4.483 9.322 ( 2.036 -5.381 -4.522) 7.318 9.504 ( -1.144 0.260 -1.085) 1.599 9.532 ( -2.053 -2.485 0.189) 3.229 10.014 ( -5.630 -0.956 -4.989) 7.583 10.025 ( -7.246 -1.941 -2.271) 7.838 10.255 ( -6.099 0.984 -2.630) 6.714 10.316 ( -2.288 -4.275 -5.602) 7.409 10.433 ( -1.128 3.106 3.606) 4.891 10.484 ( 0.766 -1.376 1.425) 2.124 10.582 ( -1.675 2.872 -1.588) 3.685 10.665 ( -0.775 -4.254 -3.553) 5.596 10.813 ( 0.263 3.105 -0.013) 3.116 10.877 ( -0.327 -2.236 -1.234) 2.575 11.018 ( 1.686 1.870 0.535) 2.574 11.052 ( 0.156 0.693 -0.230) 0.747 11.190 ( -0.845 0.719 6.670) 6.761 11.207 ( -0.142 1.038 5.399) 5.500 11.372 ( -1.995 -0.335 -2.533) 3.241 11.426 ( -2.635 -3.342 -6.890) 8.098 11.632 ( -3.706 9.013 4.715) 10.826 11.725 ( -1.129 0.260 1.973) 2.288 11.913 ( -1.051 5.531 5.609) 7.947 12.027 ( 4.925 7.566 -3.705) 9.758 12.065 ( 2.789 -6.636 2.936) 7.774 12.151 ( 2.102 -1.341 1.769) 3.057 12.276 ( -0.923 0.783 3.129) 3.354 12.330 ( 0.528 -2.691 -0.662) 2.821 12.459 ( -1.264 -3.536 1.169) 3.933 12.510 ( 0.617 -7.073 -1.343) 7.226 12.645 ( 1.198 2.329 -4.341) 5.070 12.711 ( 2.724 -3.146 -1.440) 4.404 12.884 ( 0.876 0.018 -3.089) 3.211 12.953 ( 1.099 -5.395 -5.054) 7.474 13.086 ( -1.351 2.358 2.620) 3.775 13.104 ( -0.237 1.093 3.906) 4.063 13.191 ( -2.225 1.348 -0.498) 2.649 13.257 ( -2.656 -4.115 0.649) 4.940 13.493 ( 2.181 1.674 3.105) 4.147 13.513 ( 1.142 -0.474 4.452) 4.620 13.754 ( 0.843 6.470 -4.364) 7.850 13.778 ( 3.600 3.706 -5.357) 7.443 13.872 ( -0.619 3.761 3.270) 5.023 13.934 ( -0.128 1.634 0.375) 1.681 13.972 ( 0.119 -2.443 -0.597) 2.518 14.005 ( 0.575 -2.068 -0.655) 2.244 14.168 ( 4.144 3.589 0.798) 5.540 14.227 ( 2.282 -0.355 -1.599) 2.809 14.286 ( 0.172 -2.794 -5.543) 6.210 14.313 ( 0.834 -4.231 -2.926) 5.211 14.515 ( -6.797 2.732 -3.640) 8.180 14.602 ( -5.731 -5.628 -0.987) 8.092 14.774 ( 1.047 4.421 -0.634) 4.588 14.843 ( 1.305 -0.938 2.194) 2.720 14.968 ( -5.183 1.533 -0.041) 5.405 15.000 ( -6.357 -2.856 -1.508) 7.130 15.216 ( 4.680 4.085 -1.311) 6.349 15.272 ( 3.256 -1.666 -4.474) 5.779 15.469 ( 2.913 2.386 -5.544) 6.701 15.529 ( 0.657 -3.500 -5.511) 6.562 15.658 ( 5.508 2.511 0.618) 6.084 15.668 ( 2.200 1.203 3.569) 4.362 15.883 ( 9.511 1.986 5.844) 11.338 15.917 ( 5.950 -0.108 1.244) 6.080 16.140 ( -3.930 1.792 2.342) 4.913 16.200 ( -2.439 -3.838 3.408) 5.682 16.718 ( -0.669 3.832 3.639) 5.327 16.782 ( -2.156 -1.150 3.487) 4.258 16.880 ( 0.188 0.623 0.681) 0.942 16.907 ( 1.926 -2.787 -0.430) 3.415 16.933 ( 3.120 2.171 0.036) 3.801 16.955 ( 3.617 0.620 1.088) 3.827 17.197 ( 1.204 0.804 2.509) 2.897 17.240 ( 2.225 -2.915 2.177) 4.265 17.534 ( -1.128 4.415 -1.768) 4.888 17.582 ( -2.726 3.217 -3.171) 5.276 17.618 ( -0.646 -3.766 -0.559) 3.861 17.648 ( -3.697 -2.816 -3.786) 5.994 18.082 ( 0.108 1.449 1.080) 1.810 18.115 ( -0.120 -1.792 0.658) 1.912 18.301 ( 3.969 3.665 5.717) 7.866 18.348 ( 4.540 0.913 -0.259) 4.638 18.417 ( -3.366 -1.090 5.215) 6.301 18.466 ( -1.096 -5.535 3.572) 6.678 18.581 ( -2.021 -0.226 -2.736) 3.409 18.584 ( -3.329 -0.564 -1.295) 3.616 18.847 ( 2.267 3.206 1.036) 4.061 18.923 ( 2.137 -4.617 -0.150) 5.090 19.076 ( 1.187 1.220 3.604) 3.985 19.105 ( 0.929 -1.579 2.849) 3.387 27.638 ( -1.182 -0.374 -0.182) 1.253 27.642 ( -1.068 -0.766 -0.203) 1.330 27.725 ( -1.066 0.389 -0.859) 1.423 27.729 ( -1.135 0.012 -0.814) 1.396 27.815 ( 1.431 0.694 -0.306) 1.619 27.817 ( 1.224 0.564 -0.332) 1.388 27.854 ( 0.845 0.775 -0.224) 1.168 27.874 ( 0.449 -1.162 0.005) 1.246 29.347 ( -2.579 2.644 4.107) 5.523 29.404 ( -3.014 -3.025 2.120) 4.768 29.564 ( -1.355 2.911 -6.585) 7.326 29.613 ( -1.425 -1.649 -6.692) 7.038 29.882 ( 5.997 3.029 0.349) 6.727 29.956 ( 6.489 -3.383 0.615) 7.343 30.122 ( 2.021 0.726 0.953) 2.350 30.154 ( 3.666 -1.649 2.233) 4.598 30.389 ( 8.133 3.336 0.097) 8.791 30.440 ( 8.644 -1.452 -1.949) 8.979 30.616 ( 1.078 1.136 -2.836) 3.239 30.638 ( 2.066 -1.032 -4.276) 4.860 30.755 ( -3.148 2.457 4.178) 5.779 30.805 ( -0.848 -1.477 3.792) 4.156 30.982 ( -1.206 3.431 -5.716) 6.775 31.016 ( 2.582 0.518 -6.788) 7.281 31.273 ( -3.814 3.288 0.422) 5.053 31.386 ( -5.766 -7.818 6.550) 11.716 31.975 ( 5.760 5.809 3.266) 8.809 32.071 ( 0.526 -3.126 1.928) 3.710 32.434 ( -1.478 2.632 6.878) 7.511 32.488 ( 0.184 -2.780 5.575) 6.232 32.571 ( -11.625 3.700 -3.622) 12.726 32.691 ( -13.133 -6.950 -6.669) 16.287 ======================= Grid point 80 (46/60) ======================= q-point: (-0.50 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.026 ( -14.939 18.161 13.407) 27.069 2.297 ( -15.771 -8.715 5.768) 18.920 2.466 ( -9.771 2.551 8.830) 13.414 2.544 ( -0.679 -6.508 5.050) 8.266 2.630 ( 8.572 9.777 -0.948) 13.037 2.798 ( 1.890 -6.291 -3.166) 7.293 2.959 ( 1.411 3.227 -7.366) 8.164 2.978 ( 3.792 0.652 -0.340) 3.862 3.086 ( -10.596 3.831 -4.777) 12.238 3.140 ( -4.362 -1.105 -10.425) 11.354 3.203 ( 7.250 1.184 -4.928) 8.846 3.275 ( 9.901 -6.757 3.386) 12.456 3.538 ( 3.373 1.435 -3.094) 4.797 3.595 ( 4.415 -3.971 -2.048) 6.281 3.786 ( 0.766 4.367 -1.955) 4.845 3.801 ( -2.810 3.171 -3.089) 5.243 4.018 ( -1.230 3.374 -2.884) 4.606 4.102 ( -6.259 -0.521 -4.625) 7.800 4.172 ( -1.330 -2.717 2.695) 4.052 4.256 ( -0.194 -3.944 2.302) 4.571 4.319 ( -2.634 0.448 -1.269) 2.958 4.354 ( -0.487 -4.060 -2.364) 4.724 4.443 ( -1.220 4.832 3.574) 6.133 4.530 ( 0.940 -0.883 1.107) 1.700 4.572 ( 12.074 0.628 3.878) 12.697 4.661 ( 3.893 -5.406 2.589) 7.148 4.711 ( -4.825 2.829 -0.691) 5.636 4.769 ( 3.625 -3.544 1.650) 5.332 4.831 ( -0.985 1.283 -2.639) 3.095 4.863 ( -5.974 -1.927 -3.540) 7.206 5.029 ( -5.788 6.629 -0.693) 8.828 5.103 ( -4.539 0.490 -2.533) 5.221 5.193 ( -0.550 4.545 5.121) 6.869 5.320 ( 2.765 -3.991 2.308) 5.376 5.452 ( -0.455 5.296 0.151) 5.318 5.508 ( 0.746 1.068 -1.340) 1.869 5.628 ( -1.768 4.554 4.113) 6.386 5.757 ( 0.119 -7.241 8.045) 10.824 5.927 ( 0.715 7.893 -4.627) 9.177 6.058 ( 0.602 -3.736 2.007) 4.284 6.341 ( 5.802 -7.097 3.923) 9.971 6.362 ( 4.801 -7.670 9.909) 13.419 6.593 ( -1.041 3.033 3.388) 4.665 6.683 ( -2.297 -5.078 2.865) 6.267 7.336 ( -0.159 1.660 2.528) 3.029 7.402 ( 1.632 -4.756 3.697) 6.241 7.548 ( 2.914 5.163 -8.308) 10.206 7.633 ( 4.288 -3.281 -7.927) 9.591 8.221 ( 2.955 2.180 5.389) 6.521 8.288 ( -2.790 -4.592 1.879) 5.692 8.374 ( 3.494 3.248 2.231) 5.267 8.462 ( 1.141 -5.646 0.863) 5.825 8.730 ( 0.145 6.637 -6.036) 8.973 8.840 ( 2.857 -1.521 -4.154) 5.266 8.877 ( 0.624 3.551 -0.423) 3.630 8.918 ( -1.411 0.590 -1.404) 2.077 9.031 ( 1.281 -0.435 0.044) 1.354 9.081 ( -4.632 -3.331 -0.682) 5.746 9.265 ( 0.237 4.672 0.471) 4.702 9.359 ( 1.955 -2.958 -2.725) 4.472 9.480 ( -2.324 1.131 0.087) 2.587 9.490 ( 0.718 -0.303 -1.361) 1.568 9.850 ( -4.404 0.034 -2.397) 5.014 9.904 ( 0.659 -5.673 -5.594) 7.995 10.163 ( -2.254 1.067 -2.707) 3.680 10.245 ( -1.758 -6.696 -5.642) 8.930 10.437 ( -0.094 3.259 2.552) 4.140 10.501 ( -1.025 -3.085 0.242) 3.260 10.573 ( 2.573 6.252 0.061) 6.761 10.682 ( 2.966 -4.779 -0.706) 5.669 10.769 ( -3.836 3.939 -2.421) 6.007 10.840 ( -3.029 -2.856 -3.387) 5.367 11.015 ( -0.810 3.213 0.634) 3.374 11.070 ( 1.340 1.273 0.252) 1.865 11.242 ( 0.399 1.218 5.046) 5.206 11.257 ( 1.260 1.937 6.670) 7.059 11.301 ( -2.169 -0.480 0.270) 2.238 11.384 ( 1.491 -7.313 -5.623) 9.344 11.602 ( -1.437 9.363 5.710) 11.061 11.720 ( 0.217 -2.215 3.151) 3.858 11.892 ( -4.404 10.315 4.667) 12.148 12.102 ( -0.045 -7.981 0.215) 7.984 12.149 ( 6.534 6.522 -0.585) 9.250 12.200 ( -1.736 -1.066 3.436) 3.995 12.270 ( 2.958 0.455 -0.056) 2.993 12.290 ( -3.328 -3.052 0.796) 4.585 12.519 ( 5.254 -3.457 -5.162) 8.137 12.531 ( 2.665 -3.684 2.174) 5.039 12.643 ( 1.827 3.310 -6.199) 7.261 12.721 ( -0.547 -2.339 -3.568) 4.301 12.889 ( 1.595 0.294 -3.159) 3.551 12.949 ( 1.400 -5.060 -6.752) 8.553 13.072 ( -2.456 1.264 5.201) 5.889 13.113 ( -1.861 -2.400 5.169) 5.995 13.172 ( 0.581 1.739 2.541) 3.134 13.220 ( -1.024 -3.412 2.592) 4.405 13.535 ( -0.495 2.831 3.378) 4.435 13.559 ( 1.181 0.315 4.140) 4.317 13.701 ( -3.119 6.427 -4.210) 8.292 13.771 ( -0.912 -0.452 -6.098) 6.182 13.878 ( -1.168 3.326 3.786) 5.173 13.933 ( -0.058 -0.267 1.393) 1.419 13.967 ( 1.775 3.769 -0.943) 4.272 14.047 ( 2.999 -3.998 0.818) 5.064 14.197 ( -1.667 4.876 -5.071) 7.230 14.265 ( -0.685 4.646 5.552) 7.272 14.279 ( -1.032 -4.918 -3.599) 6.180 14.316 ( 1.548 0.121 -3.995) 4.286 14.387 ( -1.459 -2.360 -5.801) 6.431 14.496 ( -3.660 -10.931 -2.257) 11.746 14.756 ( -4.882 2.278 -3.754) 6.566 14.809 ( -5.765 -3.050 -3.833) 7.565 14.851 ( -4.675 1.228 7.102) 8.591 14.884 ( 0.490 -1.954 3.304) 3.870 15.254 ( -0.798 4.481 -2.676) 5.280 15.299 ( 0.954 0.229 -3.678) 3.807 15.469 ( -1.698 1.586 -3.347) 4.075 15.503 ( 2.351 -0.950 -4.689) 5.331 15.747 ( 3.397 4.577 0.528) 5.724 15.782 ( 2.756 0.807 -0.285) 2.886 15.986 ( -3.416 1.277 2.734) 4.558 16.027 ( 2.519 -2.587 2.293) 4.277 16.174 ( 8.416 2.647 1.096) 8.890 16.223 ( 4.420 -2.076 0.725) 4.937 16.698 ( -4.153 2.391 5.091) 6.991 16.745 ( -3.694 -2.018 6.036) 7.359 16.903 ( 1.515 0.377 -0.506) 1.642 16.916 ( -0.398 -1.286 -0.604) 1.475 16.976 ( 0.305 3.405 -0.011) 3.419 17.025 ( 2.090 -0.364 -0.681) 2.228 17.192 ( -3.840 1.746 6.624) 7.853 17.251 ( -2.637 -2.850 4.127) 5.667 17.484 ( -2.606 2.682 -2.288) 4.384 17.509 ( -1.763 1.526 -2.460) 3.390 17.603 ( 1.130 -2.055 -2.574) 3.482 17.622 ( 2.658 -2.604 -3.696) 5.245 18.107 ( 0.827 1.153 1.608) 2.145 18.129 ( 0.428 -0.974 1.412) 1.767 18.318 ( -3.777 2.642 5.789) 7.400 18.383 ( -3.585 -1.884 5.180) 6.576 18.425 ( 1.453 0.886 -0.165) 1.710 18.470 ( 1.453 -2.398 1.392) 3.131 18.555 ( 2.883 1.396 -1.598) 3.580 18.607 ( 4.740 -3.609 -3.962) 7.155 18.896 ( 0.948 2.076 1.647) 2.814 18.949 ( -0.032 -3.395 -0.391) 3.418 19.122 ( 1.882 0.869 3.249) 3.854 19.143 ( 1.698 -1.122 2.158) 2.966 27.615 ( -0.735 -0.206 -0.226) 0.796 27.620 ( -0.680 -0.666 -0.367) 1.020 27.704 ( -0.526 0.440 -0.592) 0.906 27.709 ( -0.385 -0.042 -0.781) 0.872 27.830 ( 0.155 1.061 0.213) 1.093 27.842 ( 0.764 0.022 0.064) 0.767 27.858 ( -0.024 0.486 -0.574) 0.753 27.871 ( -0.401 -0.883 -0.663) 1.175 29.315 ( -2.605 1.331 4.118) 5.051 29.346 ( -3.533 -1.777 2.420) 4.636 29.527 ( 1.227 2.218 -5.611) 6.157 29.567 ( 0.648 -1.796 -6.325) 6.607 29.994 ( 3.558 4.226 2.323) 5.993 30.067 ( 0.643 1.279 -0.684) 1.587 30.102 ( -1.979 -1.956 1.040) 2.970 30.157 ( -3.679 -2.885 -1.205) 4.828 30.508 ( 3.014 2.339 0.449) 3.842 30.544 ( 0.634 -0.984 0.378) 1.230 30.632 ( -1.010 3.410 -1.471) 3.848 30.647 ( -5.372 1.135 -0.147) 5.493 30.741 ( 2.194 -0.149 -0.637) 2.289 30.767 ( 2.014 -1.874 -0.972) 2.917 30.951 ( 3.165 5.459 -3.928) 7.433 31.028 ( 2.595 -2.213 -6.882) 7.681 31.290 ( 3.565 -0.506 3.013) 4.695 31.335 ( -2.611 -5.942 4.937) 8.155 31.983 ( -5.492 4.011 1.983) 7.084 32.040 ( -3.836 -2.345 2.318) 5.058 32.325 ( -10.123 3.483 7.504) 13.074 32.424 ( -9.534 -5.909 -0.609) 11.234 32.557 ( 11.982 6.355 -0.709) 13.582 32.678 ( 13.575 -5.866 -3.395) 15.173 ======================= Grid point 81 (47/60) ======================= q-point: (-0.33 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.776 ( -14.166 14.645 14.650) 25.096 2.012 ( -13.879 -6.939 7.385) 17.185 2.231 ( -17.752 2.738 14.196) 22.894 2.393 ( -13.991 -10.892 8.436) 19.636 2.740 ( -6.890 11.782 2.319) 13.844 2.839 ( -2.910 0.416 2.015) 3.563 2.851 ( 2.746 0.328 -1.844) 3.324 2.903 ( 4.754 -1.791 -1.442) 5.281 3.074 ( 3.583 2.535 -7.708) 8.870 3.106 ( 4.295 -0.727 -5.195) 6.780 3.396 ( 7.845 2.365 1.385) 8.309 3.446 ( 4.480 -2.947 0.057) 5.363 3.664 ( -5.337 7.227 -3.025) 9.480 3.693 ( 6.371 0.581 -2.801) 6.983 3.720 ( 3.742 0.328 -4.332) 5.734 3.788 ( 5.040 -4.545 -3.237) 7.519 3.966 ( -2.317 2.419 -0.007) 3.350 3.986 ( -3.913 2.386 2.157) 5.065 4.082 ( -5.273 -0.022 0.152) 5.276 4.179 ( -5.966 -3.915 0.251) 7.140 4.287 ( -2.539 2.095 2.812) 4.330 4.298 ( 0.827 -1.800 -2.804) 3.434 4.420 ( -4.635 3.859 1.573) 6.233 4.517 ( -0.566 3.084 -2.917) 4.283 4.594 ( 0.904 -3.036 -0.438) 3.198 4.644 ( -4.156 -8.803 -2.616) 10.080 4.778 ( 2.098 2.541 0.945) 3.428 4.848 ( 2.710 -0.453 -1.118) 2.967 4.877 ( 1.198 5.600 1.426) 5.902 4.936 ( 6.882 -0.164 2.559) 7.344 4.994 ( -5.082 -2.942 3.196) 6.686 4.996 ( 8.323 -4.133 2.322) 9.579 5.201 ( -1.618 4.453 0.670) 4.785 5.312 ( -3.955 -5.492 1.098) 6.857 5.556 ( 8.759 3.486 -0.518) 9.441 5.576 ( 5.095 0.711 0.207) 5.149 5.652 ( 2.180 4.038 3.530) 5.790 5.765 ( -2.497 -6.765 3.437) 7.988 5.924 ( 0.731 8.581 -2.109) 8.867 6.074 ( 1.821 -3.452 0.184) 3.907 6.363 ( -4.536 -3.641 2.019) 6.157 6.414 ( -1.537 -6.271 0.826) 6.509 6.646 ( 2.015 2.152 4.612) 5.474 6.732 ( 3.283 -5.822 1.162) 6.785 7.371 ( 2.157 3.989 1.914) 4.923 7.481 ( 4.215 -6.677 1.226) 7.991 7.575 ( 4.193 6.859 -7.782) 11.189 7.690 ( 5.408 -4.312 -9.996) 12.156 8.188 ( -5.012 -0.253 -0.794) 5.080 8.224 ( -3.657 -3.262 2.118) 5.338 8.521 ( 5.348 2.130 2.349) 6.218 8.539 ( 4.281 -0.101 -0.751) 4.348 8.729 ( 2.472 4.050 -4.884) 6.809 8.829 ( -2.330 2.434 -5.926) 6.817 8.851 ( 3.070 -2.089 -4.326) 5.701 8.945 ( 1.781 -2.538 0.186) 3.106 8.950 ( -2.150 4.302 0.003) 4.809 9.097 ( -0.823 -8.216 3.989) 9.170 9.272 ( 1.646 7.555 -1.771) 7.933 9.373 ( 0.667 -1.763 -0.293) 1.907 9.462 ( 0.583 3.715 0.877) 3.861 9.547 ( 4.540 -4.235 -0.460) 6.226 9.889 ( 8.089 3.398 -0.776) 8.807 10.005 ( 9.719 -7.580 -1.698) 12.442 10.121 ( -0.821 1.143 -0.080) 1.410 10.203 ( 0.733 -6.539 -1.897) 6.848 10.463 ( 1.744 1.669 1.449) 2.816 10.484 ( 0.097 0.275 -0.170) 0.338 10.625 ( -0.769 4.510 2.079) 5.025 10.693 ( 0.393 4.206 -1.946) 4.651 10.726 ( -2.648 -4.963 -1.205) 5.753 10.756 ( 0.809 -2.437 -1.581) 3.015 11.010 ( 0.288 3.085 0.596) 3.155 11.077 ( -0.843 -1.824 -0.266) 2.027 11.212 ( -1.336 6.420 -0.309) 6.565 11.315 ( 0.450 1.650 4.278) 4.607 11.340 ( 2.871 0.924 3.929) 4.953 11.413 ( 2.754 -7.272 -1.482) 7.916 11.628 ( 0.482 10.084 2.785) 10.473 11.756 ( -0.671 -2.062 2.354) 3.201 11.804 ( -3.704 9.182 5.099) 11.137 12.035 ( -6.690 -12.763 1.641) 14.503 12.163 ( -0.780 -0.064 1.657) 1.832 12.209 ( -0.204 -3.906 -1.601) 4.226 12.310 ( 5.426 5.206 0.611) 7.544 12.378 ( 4.870 -0.456 -1.493) 5.114 12.509 ( -1.689 3.513 -5.536) 6.771 12.617 ( 0.856 -4.263 -3.023) 5.295 12.675 ( 2.944 -0.748 -4.782) 5.665 12.683 ( 2.201 0.203 -4.559) 5.066 12.929 ( 3.897 1.367 -2.409) 4.781 12.943 ( -0.313 -0.854 -0.847) 1.243 13.040 ( -1.672 -3.188 1.008) 3.738 13.078 ( -3.572 -5.692 3.529) 7.590 13.231 ( 2.356 0.699 4.794) 5.388 13.243 ( 1.025 -0.842 4.026) 4.239 13.490 ( -4.496 7.192 -1.349) 8.588 13.586 ( -1.331 -1.356 2.466) 3.113 13.626 ( -2.046 3.529 0.160) 4.082 13.684 ( -4.376 -2.619 -4.167) 6.586 13.885 ( 0.101 3.047 3.965) 5.001 13.956 ( 1.272 -3.272 3.759) 5.143 14.045 ( 2.283 4.912 -1.577) 5.641 14.082 ( 0.493 -0.129 -0.253) 0.569 14.113 ( -6.803 10.438 0.253) 12.461 14.180 ( -2.770 -1.347 -0.290) 3.094 14.233 ( 0.672 -3.199 -5.146) 6.097 14.325 ( 0.185 -4.008 -2.649) 4.808 14.347 ( -1.130 -2.012 0.593) 2.382 14.433 ( 1.174 -4.993 -6.432) 8.227 14.636 ( -3.945 1.079 5.397) 6.771 14.724 ( -3.710 -4.678 6.292) 8.674 14.892 ( 4.015 0.970 2.166) 4.664 14.926 ( 1.537 -1.248 3.211) 3.772 15.152 ( -6.978 5.131 -2.119) 8.917 15.222 ( -6.930 -2.278 -2.265) 7.638 15.437 ( 0.870 4.870 -4.554) 6.724 15.527 ( 2.364 -3.413 -5.580) 6.955 15.762 ( -3.702 2.031 3.896) 5.745 15.770 ( -1.572 1.695 1.000) 2.518 15.962 ( 1.364 6.686 -1.768) 7.049 16.070 ( 0.899 -4.552 -2.520) 5.280 16.293 ( 0.702 0.907 -1.859) 2.184 16.322 ( 4.293 -2.134 -3.412) 5.884 16.640 ( -2.593 3.367 5.724) 7.129 16.707 ( -2.132 -3.365 5.221) 6.567 16.870 ( -3.841 0.873 1.325) 4.156 16.893 ( -3.092 -1.088 2.146) 3.918 16.974 ( -0.114 3.621 -0.662) 3.683 17.037 ( -0.482 -2.047 -1.507) 2.587 17.127 ( -5.273 3.332 5.948) 8.619 17.191 ( -4.124 -2.298 1.926) 5.099 17.444 ( -0.310 2.571 -0.076) 2.591 17.493 ( 0.371 -0.901 1.010) 1.403 17.630 ( 2.448 1.360 -2.325) 3.640 17.692 ( 5.423 -3.608 -3.058) 7.195 18.107 ( -1.307 1.062 0.334) 1.717 18.123 ( -1.433 -0.587 0.031) 1.549 18.272 ( -3.171 0.643 3.552) 4.805 18.317 ( -4.064 -3.378 2.702) 5.935 18.485 ( 0.757 0.797 0.224) 1.122 18.492 ( 3.380 0.268 1.786) 3.832 18.640 ( 5.032 1.955 -2.110) 5.796 18.704 ( 6.213 -3.767 -3.211) 7.944 18.881 ( -2.861 1.183 0.363) 3.117 18.918 ( -2.340 -2.290 -0.708) 3.350 19.180 ( 1.572 0.267 1.177) 1.982 19.193 ( 1.941 -0.869 -0.254) 2.142 27.613 ( 0.555 -0.102 0.511) 0.762 27.618 ( 0.616 -0.639 0.359) 0.957 27.697 ( 0.123 0.574 -0.078) 0.592 27.705 ( 0.340 -0.218 -0.200) 0.450 27.814 ( -1.548 0.909 -0.397) 1.838 27.828 ( -1.550 -0.254 -0.582) 1.675 27.861 ( 0.075 0.248 -0.236) 0.350 27.870 ( 0.467 -0.405 0.122) 0.630 29.288 ( -1.988 1.169 4.221) 4.810 29.312 ( -1.202 -1.228 4.806) 5.104 29.554 ( 3.698 0.942 -3.447) 5.142 29.572 ( 2.761 -1.082 -4.817) 5.657 29.925 ( -8.475 3.943 -2.063) 9.572 29.992 ( -8.810 -2.295 -1.425) 9.215 30.047 ( -0.478 3.837 3.632) 5.305 30.133 ( -1.319 -4.773 2.057) 5.362 30.399 ( -11.954 4.483 0.048) 12.767 30.494 ( -10.067 -4.486 -1.176) 11.084 30.536 ( 0.345 2.744 -1.324) 3.066 30.581 ( 1.456 -1.562 -0.143) 2.140 30.797 ( 3.996 3.832 -2.134) 5.934 30.870 ( 2.923 -2.509 -2.757) 4.737 31.030 ( 4.634 2.700 -4.136) 6.772 31.080 ( 5.067 -1.990 -4.854) 7.294 31.305 ( -1.282 3.364 1.012) 3.740 31.406 ( 4.889 -5.833 5.089) 9.155 31.884 ( -5.333 2.811 3.875) 7.166 31.944 ( -5.975 -3.739 4.302) 8.258 32.242 ( -2.208 2.062 8.466) 8.988 32.307 ( -2.629 -4.319 5.630) 7.567 32.852 ( 16.725 7.173 -6.459) 19.311 32.964 ( 15.769 -4.380 -8.535) 18.458 ======================= Grid point 82 (48/60) ======================= q-point: (-0.17 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.645 ( -5.946 16.501 16.357) 23.983 1.850 ( -6.884 9.694 17.688) 21.313 2.033 ( -6.110 -11.022 12.333) 17.633 2.220 ( -6.451 -16.428 15.022) 23.176 2.662 ( -3.773 10.532 13.093) 17.221 2.785 ( -1.993 -1.132 -1.447) 2.711 2.920 ( 2.135 2.133 1.031) 3.189 2.957 ( 0.664 -2.303 -0.212) 2.406 3.131 ( 4.578 4.954 -4.370) 8.037 3.182 ( 3.747 -0.435 -1.086) 3.925 3.436 ( -6.066 8.879 -2.984) 11.159 3.510 ( 0.948 -0.040 1.022) 1.394 3.596 ( 4.777 -0.583 3.792) 6.127 3.636 ( -3.216 -3.250 -3.557) 5.792 3.797 ( -1.084 3.441 -6.882) 7.771 3.817 ( -1.845 4.384 1.278) 4.925 3.855 ( -1.539 -0.151 -2.158) 2.655 3.943 ( -6.249 -5.939 -1.116) 8.693 4.090 ( 5.144 2.077 0.526) 5.572 4.106 ( -3.269 2.697 0.773) 4.308 4.221 ( -4.994 0.103 -2.696) 5.677 4.304 ( -0.893 -7.408 -4.308) 8.616 4.426 ( 6.423 8.686 8.719) 13.883 4.543 ( 3.962 3.534 -4.806) 7.161 4.599 ( 1.148 -5.325 1.146) 5.566 4.653 ( 3.720 -4.997 0.006) 6.230 4.762 ( -2.976 2.703 0.504) 4.052 4.804 ( -1.934 4.331 0.631) 4.786 4.914 ( -1.331 -1.305 1.200) 2.217 4.967 ( 0.645 -6.564 5.763) 8.759 5.067 ( 4.463 5.179 2.136) 7.163 5.150 ( -0.712 0.962 -0.608) 1.342 5.200 ( 2.357 -4.456 1.521) 5.266 5.252 ( 1.374 -7.374 -0.270) 7.506 5.609 ( -1.843 0.209 3.022) 3.545 5.624 ( -1.806 -0.409 0.785) 2.011 5.779 ( 4.475 -1.355 1.560) 4.929 5.801 ( 6.006 -1.973 0.632) 6.353 5.938 ( 1.323 9.931 -1.408) 10.117 6.120 ( 0.988 -7.032 -1.465) 7.251 6.242 ( -4.530 3.721 -5.582) 8.095 6.328 ( -4.739 -3.599 -7.104) 9.267 6.684 ( -0.400 0.876 5.158) 5.248 6.784 ( 2.612 -8.200 -1.373) 8.715 7.420 ( 0.598 5.918 2.828) 6.586 7.548 ( 0.503 -6.334 0.875) 6.414 7.639 ( 5.634 5.385 -7.347) 10.711 7.732 ( 3.719 -3.357 -9.841) 11.043 8.086 ( -3.014 -0.656 -2.627) 4.052 8.128 ( -4.878 -4.272 -2.308) 6.883 8.581 ( 1.196 3.450 -0.894) 3.759 8.603 ( 2.919 1.849 -3.895) 5.207 8.759 ( 1.334 -0.200 -3.671) 3.911 8.777 ( 2.369 -0.950 -5.362) 5.938 8.892 ( -0.672 4.101 -3.183) 5.234 8.952 ( 2.653 5.620 2.361) 6.648 8.996 ( 1.359 -5.323 0.488) 5.515 9.124 ( 2.556 -8.732 4.586) 10.189 9.304 ( 2.000 7.642 -0.893) 7.950 9.395 ( 1.382 -1.878 0.961) 2.522 9.497 ( 1.966 4.462 1.108) 5.000 9.627 ( 2.502 -7.316 -0.915) 7.786 10.013 ( 2.428 2.239 -1.165) 3.502 10.080 ( -0.333 -3.513 -3.072) 4.678 10.232 ( 6.410 0.668 3.241) 7.213 10.290 ( 3.730 -3.984 4.193) 6.883 10.544 ( 6.651 2.272 1.829) 7.262 10.564 ( 6.736 0.963 3.186) 7.513 10.594 ( 0.098 1.967 -1.558) 2.511 10.652 ( -0.933 -2.915 -3.210) 4.435 10.732 ( 2.085 1.836 2.710) 3.881 10.813 ( 3.854 -4.854 3.385) 7.062 11.024 ( 0.553 2.498 -0.784) 2.676 11.053 ( -0.365 0.675 -0.937) 1.211 11.192 ( -1.747 9.760 -0.945) 9.960 11.333 ( -1.425 4.903 4.987) 7.137 11.406 ( -0.001 -5.103 0.008) 5.103 11.464 ( 2.426 -3.626 2.629) 5.094 11.603 ( -0.747 7.189 -1.553) 7.392 11.709 ( -2.124 -0.559 -0.022) 2.197 11.841 ( 0.672 3.763 6.363) 7.423 11.938 ( -1.289 -6.959 2.895) 7.647 12.153 ( -1.599 -0.974 0.143) 1.878 12.210 ( 1.063 -5.059 -2.752) 5.857 12.386 ( -4.833 3.472 -5.643) 8.201 12.410 ( 0.962 2.215 -3.164) 3.980 12.442 ( 4.068 -1.775 -3.856) 5.879 12.524 ( -6.561 -4.197 -4.392) 8.941 12.708 ( 2.211 0.359 -3.461) 4.123 12.713 ( 0.545 0.292 -2.613) 2.685 12.891 ( -5.463 1.891 7.676) 9.609 12.976 ( -3.103 -2.842 1.256) 4.391 13.032 ( 3.482 -3.214 -1.202) 4.889 13.072 ( 4.297 -3.882 -5.078) 7.702 13.264 ( -1.153 3.083 0.960) 3.429 13.303 ( 0.484 -1.222 5.599) 5.751 13.403 ( -1.156 4.231 -1.698) 4.703 13.497 ( -5.495 -4.868 -3.233) 8.021 13.578 ( -1.585 3.505 1.368) 4.083 13.630 ( -0.771 -0.709 1.638) 1.944 13.918 ( 0.282 4.962 0.131) 4.972 13.939 ( -4.568 3.690 3.101) 6.641 13.972 ( -3.069 1.394 1.148) 3.561 14.019 ( 1.355 -4.514 1.147) 4.851 14.094 ( -2.975 3.013 -1.547) 4.508 14.186 ( 0.496 -5.345 -2.288) 5.835 14.261 ( 5.653 9.536 -3.456) 11.612 14.376 ( 2.099 2.233 5.441) 6.245 14.420 ( -0.522 -3.559 1.310) 3.828 14.469 ( 10.245 -7.201 -2.407) 12.752 14.660 ( 4.019 2.625 7.349) 8.778 14.727 ( 1.411 -1.443 7.706) 7.966 14.907 ( -5.983 3.710 5.166) 8.732 14.972 ( -1.159 -4.103 0.947) 4.367 15.058 ( 1.231 2.920 -2.037) 3.767 15.104 ( 1.134 -2.541 0.736) 2.878 15.423 ( -0.036 4.420 -5.653) 7.176 15.530 ( 0.839 -5.410 -6.774) 8.710 15.682 ( -6.561 4.400 2.886) 8.410 15.734 ( -2.942 0.343 3.063) 4.261 15.952 ( -3.463 4.306 -3.010) 6.292 15.999 ( -3.773 -0.836 -5.729) 6.910 16.226 ( -3.946 2.562 -0.622) 4.746 16.336 ( 0.084 -7.405 -3.864) 8.353 16.682 ( 3.183 2.793 3.466) 5.472 16.724 ( 0.335 -1.792 3.606) 4.041 16.816 ( -1.880 1.872 3.084) 4.068 16.853 ( -1.507 -1.182 2.894) 3.471 16.937 ( -1.922 1.782 -1.581) 3.061 16.978 ( -3.027 -2.330 -0.677) 3.880 17.068 ( -2.941 3.660 1.507) 4.931 17.124 ( -3.168 -1.861 -0.221) 3.681 17.461 ( 1.136 2.570 2.291) 3.626 17.521 ( 0.770 -2.782 4.344) 5.215 17.666 ( 1.681 5.953 -1.807) 6.444 17.787 ( 4.753 -5.389 -3.008) 7.790 18.076 ( -1.270 0.993 0.264) 1.633 18.095 ( -0.539 -0.787 -0.680) 1.171 18.214 ( -3.673 -0.305 0.647) 3.741 18.243 ( -3.465 -3.031 0.124) 4.605 18.512 ( 1.228 2.848 1.159) 3.311 18.564 ( 2.053 -2.230 2.987) 4.255 18.731 ( 4.330 3.359 -2.067) 5.857 18.788 ( -0.382 -1.447 -3.560) 3.862 18.821 ( 1.633 -0.624 -0.873) 1.954 18.854 ( -3.466 -2.554 0.020) 4.305 19.155 ( -4.098 1.111 -1.815) 4.617 19.190 ( -1.842 -2.219 -3.274) 4.363 27.643 ( 1.753 -0.052 1.076) 2.058 27.648 ( 1.615 -0.570 1.027) 1.997 27.708 ( 0.631 0.652 0.668) 1.127 27.720 ( 0.860 -0.535 0.575) 1.164 27.777 ( -1.412 0.695 -0.492) 1.649 27.788 ( -1.726 -0.342 -0.630) 1.869 27.857 ( -0.314 0.785 -0.490) 0.977 27.872 ( -0.357 -0.651 -0.136) 0.755 29.298 ( 0.370 2.525 5.693) 6.238 29.351 ( 1.987 -2.765 6.548) 7.381 29.617 ( 3.245 1.390 -4.446) 5.677 29.638 ( 5.079 -0.083 -1.896) 5.422 29.759 ( -5.441 1.883 -0.532) 5.782 29.816 ( -5.776 -2.871 0.564) 6.475 30.032 ( -2.391 2.390 2.470) 4.187 30.078 ( -4.482 -1.907 1.114) 4.996 30.160 ( -9.839 4.881 0.350) 10.989 30.284 ( -9.101 -7.340 -0.387) 11.698 30.554 ( 1.901 3.942 -0.630) 4.421 30.611 ( 1.254 -2.148 0.010) 2.487 30.836 ( 1.225 2.210 -2.751) 3.735 30.874 ( 0.157 -1.448 -4.560) 4.787 31.045 ( -0.366 2.011 -5.070) 5.467 31.088 ( -1.352 -2.078 -5.686) 6.203 31.364 ( 5.508 8.276 2.397) 10.227 31.520 ( 2.502 -7.107 5.346) 9.239 31.793 ( -5.093 3.383 3.037) 6.827 31.878 ( -2.581 -5.283 5.085) 7.773 32.295 ( 1.862 2.878 9.863) 10.441 32.369 ( 2.377 -5.017 12.462) 13.642 33.101 ( 10.705 5.900 -12.979) 17.829 33.182 ( 10.147 -2.770 -13.168) 16.853 ======================= Grid point 95 (49/60) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 30 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.015 ( 1.376 0.000 -2.352) 2.725 2.015 ( -1.376 0.000 2.352) 2.725 2.073 ( -2.442 0.000 -4.788) 5.375 2.073 ( 2.442 0.000 4.788) 5.375 2.814 ( -0.029 0.000 -3.011) 3.011 2.814 ( 0.029 0.000 3.011) 3.011 3.032 ( 0.754 0.000 -0.854) 1.139 3.032 ( -0.754 0.000 0.854) 1.139 3.210 ( 4.382 0.000 -8.172) 9.273 3.210 ( -4.382 0.000 8.172) 9.273 3.283 ( 0.500 0.000 -9.919) 9.931 3.283 ( -0.500 0.000 9.919) 9.931 3.574 ( -2.678 0.000 -7.423) 7.891 3.574 ( 2.678 0.000 7.423) 7.891 3.678 ( -6.481 0.000 -1.008) 6.559 3.678 ( 6.481 0.000 1.008) 6.559 3.962 ( -1.407 0.000 -6.526) 6.676 3.962 ( 1.407 0.000 6.526) 6.676 4.059 ( 3.648 0.000 -2.511) 4.429 4.059 ( -3.648 0.000 2.511) 4.429 4.270 ( 5.955 0.000 -6.409) 8.748 4.270 ( -5.955 0.000 6.409) 8.748 4.427 ( -0.075 0.000 -5.757) 5.757 4.427 ( 0.075 0.000 5.757) 5.757 4.680 ( -4.535 0.000 -3.503) 5.730 4.680 ( 4.535 0.000 3.503) 5.730 4.749 ( -4.738 0.000 -11.515) 12.451 4.749 ( 4.738 0.000 11.515) 12.451 5.041 ( -6.088 0.000 -3.250) 6.901 5.041 ( 6.088 0.000 3.250) 6.901 5.111 ( -2.653 0.000 -4.545) 5.263 5.111 ( 2.653 0.000 4.545) 5.263 5.349 ( -1.762 0.000 -5.896) 6.153 5.349 ( 1.762 0.000 5.896) 6.153 5.630 ( -5.249 0.000 -6.709) 8.518 5.630 ( 5.249 0.000 6.709) 8.518 5.945 ( -2.640 0.000 -8.090) 8.510 5.945 ( 2.640 0.000 8.090) 8.510 6.030 ( 2.742 0.000 -10.437) 10.792 6.030 ( -2.742 0.000 10.437) 10.792 6.062 ( 3.704 0.000 -4.851) 6.103 6.062 ( -3.704 0.000 4.851) 6.103 6.977 ( 2.427 0.000 -3.626) 4.363 6.977 ( -2.427 0.000 3.626) 4.363 7.444 ( -0.383 0.000 -1.746) 1.788 7.444 ( 0.383 0.000 1.746) 1.788 7.640 ( -3.967 0.000 1.142) 4.128 7.640 ( 3.967 0.000 -1.142) 4.128 8.163 ( 2.408 0.000 -2.144) 3.224 8.163 ( -2.408 0.000 2.144) 3.224 8.388 ( -0.181 0.000 -1.178) 1.192 8.388 ( 0.181 0.000 1.178) 1.192 8.709 ( -0.627 0.000 -3.410) 3.468 8.709 ( 0.627 0.000 3.410) 3.468 8.906 ( 3.463 0.000 -4.021) 5.307 8.906 ( -3.463 0.000 4.021) 5.307 9.163 ( -1.909 0.000 0.105) 1.912 9.163 ( 1.909 0.000 -0.105) 1.912 9.484 ( 4.737 0.000 -2.273) 5.254 9.484 ( -4.737 0.000 2.273) 5.254 9.686 ( -7.779 0.000 -6.325) 10.026 9.686 ( 7.779 0.000 6.325) 10.026 10.062 ( -3.914 0.000 0.216) 3.920 10.062 ( 3.914 0.000 -0.216) 3.920 10.366 ( -3.758 0.000 -5.354) 6.541 10.366 ( 3.758 0.000 5.354) 6.541 10.443 ( -3.195 0.000 1.007) 3.350 10.443 ( 3.195 0.000 -1.007) 3.350 10.715 ( 3.459 0.000 -2.595) 4.325 10.715 ( -3.459 0.000 2.595) 4.325 10.757 ( -3.824 0.000 -5.688) 6.854 10.757 ( 3.824 0.000 5.688) 6.854 11.095 ( -11.531 0.000 2.819) 11.871 11.095 ( 11.531 0.000 -2.819) 11.871 11.201 ( 2.630 0.000 -5.111) 5.748 11.201 ( -2.630 0.000 5.111) 5.748 11.378 ( -0.289 0.000 -9.728) 9.732 11.378 ( 0.289 0.000 9.728) 9.732 11.552 ( 4.531 0.000 -7.276) 8.571 11.552 ( -4.531 0.000 7.276) 8.571 12.056 ( -5.618 0.000 -1.284) 5.763 12.056 ( 5.618 0.000 1.284) 5.763 12.232 ( -8.013 0.000 -2.029) 8.265 12.232 ( 8.013 0.000 2.029) 8.265 12.314 ( 0.334 0.000 -2.514) 2.536 12.314 ( -0.334 0.000 2.514) 2.536 12.478 ( -1.268 0.000 -2.902) 3.167 12.478 ( 1.268 0.000 2.902) 3.167 12.881 ( 5.378 0.000 -6.355) 8.325 12.881 ( -5.378 0.000 6.355) 8.325 12.933 ( 4.016 0.000 -2.689) 4.833 12.933 ( -4.016 0.000 2.689) 4.833 13.084 ( 0.402 0.000 -0.338) 0.526 13.084 ( -0.402 0.000 0.338) 0.526 13.200 ( -4.872 0.000 -4.619) 6.714 13.200 ( 4.872 0.000 4.619) 6.714 13.467 ( 6.029 0.000 -7.573) 9.680 13.467 ( -6.029 0.000 7.573) 9.680 13.574 ( -0.510 0.000 -0.515) 0.725 13.574 ( 0.510 0.000 0.515) 0.725 13.833 ( 1.829 0.000 -1.718) 2.510 13.833 ( -1.829 0.000 1.718) 2.510 13.911 ( -0.829 0.000 -1.358) 1.591 13.911 ( 0.829 0.000 1.358) 1.591 14.131 ( -12.417 0.000 -2.362) 12.640 14.131 ( 12.417 0.000 2.362) 12.640 14.273 ( 0.814 0.000 -0.367) 0.893 14.273 ( -0.814 0.000 0.367) 0.893 14.537 ( 0.909 0.000 -0.409) 0.997 14.537 ( -0.909 0.000 0.409) 0.997 14.783 ( 4.151 0.000 -4.846) 6.381 14.783 ( -4.151 0.000 4.846) 6.381 14.842 ( -7.411 0.000 -1.365) 7.536 14.842 ( 7.411 0.000 1.365) 7.536 15.122 ( 2.235 0.000 -1.208) 2.540 15.122 ( -2.235 0.000 1.208) 2.540 15.465 ( -2.486 0.000 -1.472) 2.889 15.465 ( 2.486 0.000 1.472) 2.889 15.627 ( -5.728 0.000 -1.476) 5.915 15.627 ( 5.728 0.000 1.476) 5.915 15.819 ( -1.812 0.000 -2.335) 2.955 15.819 ( 1.812 0.000 2.335) 2.955 16.411 ( -3.637 0.000 -5.452) 6.554 16.411 ( 3.637 0.000 5.452) 6.554 16.760 ( -4.171 0.000 -1.660) 4.489 16.760 ( 4.171 0.000 1.660) 4.489 16.824 ( 3.890 0.000 -3.200) 5.037 16.824 ( -3.890 0.000 3.200) 5.037 16.873 ( 0.569 0.000 -2.595) 2.657 16.873 ( -0.569 0.000 2.595) 2.657 17.086 ( -4.477 0.000 0.935) 4.574 17.086 ( 4.477 0.000 -0.935) 4.574 17.467 ( 2.585 0.000 -0.975) 2.762 17.467 ( -2.585 0.000 0.975) 2.762 17.787 ( 0.861 0.000 -7.240) 7.291 17.787 ( -0.861 0.000 7.240) 7.291 18.130 ( 3.622 0.000 -1.997) 4.136 18.130 ( -3.622 0.000 1.997) 4.136 18.200 ( -0.477 0.000 -3.439) 3.472 18.200 ( 0.477 0.000 3.439) 3.472 18.497 ( -1.608 0.000 -3.962) 4.275 18.497 ( 1.608 0.000 3.962) 4.275 18.772 ( 2.332 0.000 -1.809) 2.951 18.772 ( -2.332 0.000 1.809) 2.951 18.861 ( 4.383 0.000 -2.743) 5.171 18.861 ( -4.383 0.000 2.743) 5.171 19.105 ( 0.416 0.000 -3.756) 3.779 19.105 ( -0.416 0.000 3.756) 3.779 27.712 ( -0.186 0.000 -1.550) 1.561 27.712 ( 0.186 0.000 1.550) 1.561 27.736 ( -0.475 0.000 -0.455) 0.657 27.736 ( 0.475 0.000 0.455) 0.657 27.741 ( -2.065 0.000 -0.846) 2.232 27.741 ( 2.065 0.000 0.846) 2.232 27.842 ( -2.322 0.000 -0.750) 2.440 27.842 ( 2.322 0.000 0.750) 2.440 29.387 ( -0.479 0.000 -5.999) 6.019 29.387 ( 0.479 0.000 5.999) 6.019 29.660 ( -2.528 0.000 -0.192) 2.536 29.660 ( 2.528 0.000 0.192) 2.536 29.737 ( -8.648 0.000 -3.504) 9.331 29.737 ( 8.648 0.000 3.504) 9.331 29.954 ( -5.851 0.000 0.687) 5.892 29.954 ( 5.851 0.000 -0.687) 5.892 30.317 ( -0.781 0.000 -7.351) 7.392 30.317 ( 0.781 0.000 7.351) 7.392 30.574 ( -6.529 0.000 -2.235) 6.901 30.574 ( 6.529 0.000 2.235) 6.901 30.786 ( -3.722 0.000 -0.944) 3.840 30.786 ( 3.722 0.000 0.944) 3.840 30.865 ( 3.542 0.000 -3.566) 5.026 30.865 ( -3.542 0.000 3.566) 5.026 31.460 ( -9.271 0.000 -3.488) 9.906 31.460 ( 9.271 0.000 3.488) 9.906 31.924 ( 4.807 0.000 -10.860) 11.876 31.924 ( -4.807 0.000 10.860) 11.876 32.628 ( -2.642 0.000 -12.800) 13.070 32.628 ( 2.642 0.000 12.800) 13.070 32.994 ( 1.681 0.000 -13.201) 13.308 32.994 ( -1.681 0.000 13.201) 13.308 ======================= Grid point 97 (50/60) ======================= q-point: ( 0.17 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.921 ( 3.325 0.000 -25.665) 25.880 1.938 ( 8.697 0.000 -23.046) 24.633 2.232 ( 5.401 0.000 21.339) 22.011 2.346 ( 10.490 0.000 17.826) 20.683 2.701 ( -6.691 0.000 -3.037) 7.347 2.742 ( -5.810 0.000 -0.761) 5.859 3.021 ( -2.986 0.000 -14.353) 14.660 3.033 ( 0.157 0.000 -0.957) 0.970 3.136 ( 4.125 0.000 -15.908) 16.434 3.207 ( -8.643 0.000 -0.154) 8.644 3.250 ( 2.825 0.000 5.457) 6.144 3.363 ( -0.365 0.000 3.388) 3.407 3.523 ( -2.295 0.000 -1.210) 2.594 3.582 ( 2.819 0.000 1.364) 3.132 3.671 ( 2.243 0.000 3.627) 4.264 3.841 ( 8.632 0.000 0.499) 8.646 3.923 ( 0.868 0.000 -0.179) 0.887 3.996 ( -2.471 0.000 -1.814) 3.065 4.058 ( 1.248 0.000 10.055) 10.132 4.136 ( 3.542 0.000 -1.536) 3.861 4.222 ( -0.431 0.000 4.673) 4.693 4.292 ( -1.524 0.000 -1.601) 2.210 4.391 ( -0.502 0.000 0.831) 0.971 4.437 ( -1.217 0.000 1.858) 2.221 4.539 ( -3.335 0.000 -11.908) 12.366 4.630 ( -3.217 0.000 -1.703) 3.640 4.769 ( 2.594 0.000 -2.376) 3.518 4.843 ( -1.477 0.000 5.504) 5.698 4.893 ( -0.051 0.000 -7.823) 7.823 5.030 ( -2.754 0.000 4.116) 4.952 5.097 ( -0.325 0.000 2.710) 2.730 5.208 ( -0.005 0.000 -5.102) 5.102 5.328 ( -2.148 0.000 3.763) 4.333 5.436 ( 2.605 0.000 3.850) 4.649 5.521 ( 1.866 0.000 -7.750) 7.971 5.690 ( -3.676 0.000 0.816) 3.765 5.771 ( -13.525 0.000 2.875) 13.827 5.892 ( -16.047 0.000 -4.649) 16.707 5.982 ( 0.135 0.000 1.213) 1.221 6.068 ( 5.236 0.000 7.616) 9.242 6.149 ( 10.951 0.000 -5.017) 12.046 6.149 ( 7.321 0.000 11.621) 13.735 6.945 ( -3.284 0.000 4.020) 5.191 6.985 ( -0.681 0.000 -2.459) 2.552 7.412 ( -1.322 0.000 -4.662) 4.846 7.435 ( -1.688 0.000 -2.111) 2.703 7.562 ( -3.919 0.000 6.187) 7.324 7.677 ( -0.306 0.000 1.950) 1.974 8.145 ( -0.884 0.000 6.036) 6.101 8.203 ( 2.178 0.000 -0.562) 2.249 8.428 ( 4.293 0.000 -1.416) 4.520 8.437 ( 3.198 0.000 -0.932) 3.331 8.656 ( -2.382 0.000 -2.919) 3.768 8.721 ( -1.098 0.000 4.854) 4.976 8.855 ( -3.919 0.000 6.059) 7.216 8.953 ( 2.497 0.000 -0.758) 2.609 9.100 ( -4.378 0.000 -2.559) 5.071 9.184 ( 0.162 0.000 -0.726) 0.744 9.373 ( -6.814 0.000 1.850) 7.061 9.474 ( -5.746 0.000 -7.245) 9.247 9.538 ( 1.392 0.000 -2.528) 2.886 9.746 ( -4.185 0.000 1.006) 4.304 10.004 ( -1.903 0.000 -0.204) 1.914 10.145 ( 4.376 0.000 -2.093) 4.851 10.300 ( -0.788 0.000 -4.090) 4.165 10.365 ( -4.879 0.000 0.441) 4.899 10.529 ( 4.060 0.000 -2.270) 4.652 10.532 ( 5.281 0.000 7.162) 8.899 10.624 ( -4.930 0.000 -4.826) 6.899 10.666 ( -10.404 0.000 -3.060) 10.845 10.670 ( -0.334 0.000 0.185) 0.381 10.837 ( 0.074 0.000 4.024) 4.025 10.860 ( -3.814 0.000 -0.490) 3.845 11.090 ( -8.832 0.000 -8.663) 12.371 11.168 ( -2.186 0.000 4.732) 5.212 11.234 ( 4.839 0.000 -5.549) 7.362 11.310 ( -0.385 0.000 -7.356) 7.366 11.390 ( -3.191 0.000 7.343) 8.006 11.516 ( -1.460 0.000 8.797) 8.917 11.591 ( 2.766 0.000 -4.747) 5.494 11.981 ( -2.772 0.000 -5.607) 6.255 12.101 ( -0.452 0.000 10.444) 10.453 12.185 ( -0.704 0.000 9.343) 9.370 12.208 ( 1.157 0.000 -3.443) 3.632 12.394 ( 0.167 0.000 0.421) 0.453 12.410 ( 5.575 0.000 0.663) 5.615 12.467 ( 1.087 0.000 -5.024) 5.140 12.611 ( 1.952 0.000 -0.770) 2.098 12.678 ( -6.572 0.000 4.682) 8.070 12.820 ( -4.216 0.000 -2.405) 4.854 12.965 ( 1.884 0.000 4.509) 4.887 13.040 ( 3.658 0.000 -5.793) 6.852 13.069 ( 0.139 0.000 -2.786) 2.789 13.101 ( 1.863 0.000 -2.993) 3.526 13.155 ( 1.591 0.000 -1.109) 1.939 13.294 ( -1.146 0.000 3.730) 3.902 13.421 ( 1.494 0.000 6.825) 6.987 13.462 ( -2.003 0.000 -1.753) 2.662 13.602 ( 1.029 0.000 2.977) 3.150 13.628 ( 4.439 0.000 -5.209) 6.844 13.751 ( -5.520 0.000 -2.533) 6.074 13.807 ( 2.114 0.000 0.214) 2.124 13.926 ( 0.440 0.000 0.969) 1.064 13.957 ( -3.409 0.000 -2.623) 4.301 14.062 ( 9.538 0.000 3.412) 10.130 14.234 ( -2.487 0.000 -2.199) 3.320 14.295 ( 1.835 0.000 -0.049) 1.836 14.422 ( 11.369 0.000 2.000) 11.544 14.528 ( -3.052 0.000 -8.785) 9.300 14.559 ( 2.373 0.000 0.716) 2.479 14.654 ( -5.665 0.000 -0.984) 5.750 14.679 ( 2.745 0.000 -3.074) 4.121 14.903 ( 3.925 0.000 -2.653) 4.738 15.035 ( 7.416 0.000 -4.781) 8.824 15.102 ( -1.769 0.000 5.984) 6.240 15.174 ( 2.126 0.000 -0.131) 2.131 15.399 ( -2.652 0.000 -1.022) 2.842 15.508 ( 0.713 0.000 5.398) 5.445 15.535 ( -3.176 0.000 -3.683) 4.863 15.732 ( 2.044 0.000 -0.239) 2.057 15.742 ( -1.849 0.000 -3.979) 4.388 15.892 ( 4.863 0.000 7.758) 9.156 16.317 ( -1.605 0.000 -2.488) 2.961 16.420 ( -7.428 0.000 8.382) 11.200 16.680 ( -1.474 0.000 -2.485) 2.890 16.786 ( -0.249 0.000 0.979) 1.011 16.823 ( 1.468 0.000 1.410) 2.035 16.882 ( 0.265 0.000 3.164) 3.175 16.889 ( 2.093 0.000 -0.812) 2.245 16.934 ( 6.834 0.000 -3.421) 7.643 17.091 ( 4.870 0.000 -2.327) 5.397 17.191 ( 5.305 0.000 -3.014) 6.101 17.416 ( -2.443 0.000 0.515) 2.496 17.491 ( -0.037 0.000 -1.928) 1.928 17.727 ( -2.908 0.000 -4.698) 5.525 17.773 ( -3.289 0.000 4.882) 5.886 18.083 ( -0.953 0.000 1.742) 1.986 18.122 ( -0.535 0.000 -3.065) 3.111 18.281 ( 5.362 0.000 0.241) 5.368 18.288 ( 5.069 0.000 4.614) 6.855 18.458 ( -0.011 0.000 -3.233) 3.233 18.520 ( -2.900 0.000 3.277) 4.376 18.738 ( -1.936 0.000 2.859) 3.453 18.768 ( -1.323 0.000 -1.767) 2.208 18.782 ( -3.585 0.000 4.355) 5.641 18.939 ( 4.109 0.000 -1.849) 4.506 19.133 ( 2.558 0.000 0.625) 2.633 19.136 ( 0.043 0.000 5.089) 5.089 27.686 ( -1.692 0.000 -1.486) 2.252 27.703 ( -0.617 0.000 -1.587) 1.702 27.711 ( -1.308 0.000 -0.599) 1.439 27.728 ( -0.311 0.000 0.423) 0.525 27.755 ( 1.072 0.000 0.609) 1.233 27.762 ( -0.059 0.000 -0.486) 0.490 27.822 ( 1.054 0.000 0.751) 1.295 27.886 ( 1.359 0.000 0.179) 1.370 29.354 ( 0.339 0.000 -5.811) 5.821 29.429 ( -0.428 0.000 7.208) 7.220 29.541 ( -4.594 0.000 -5.211) 6.946 29.603 ( -2.187 0.000 -0.667) 2.287 29.791 ( 6.700 0.000 -0.089) 6.700 29.847 ( -2.717 0.000 -0.628) 2.789 30.012 ( 13.840 0.000 0.658) 13.856 30.096 ( 7.570 0.000 -0.228) 7.574 30.248 ( -0.529 0.000 -8.552) 8.569 30.323 ( -2.138 0.000 2.878) 3.585 30.514 ( 0.695 0.000 2.489) 2.585 30.692 ( -4.687 0.000 -0.796) 4.754 30.724 ( 5.144 0.000 1.433) 5.340 30.848 ( -1.274 0.000 6.985) 7.100 30.851 ( 2.799 0.000 -1.094) 3.006 30.964 ( 6.070 0.000 3.091) 6.812 31.248 ( -9.465 0.000 -3.685) 10.157 31.669 ( 9.556 0.000 2.199) 9.806 31.892 ( -3.356 0.000 11.805) 12.272 31.926 ( -0.361 0.000 -10.930) 10.936 32.476 ( -3.218 0.000 -12.967) 13.360 32.671 ( -4.690 0.000 8.495) 9.704 32.873 ( -6.073 0.000 -11.646) 13.134 32.944 ( -9.601 0.000 13.901) 16.894 ======================= Grid point 98 (51/60) ======================= q-point: ( 0.33 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.912 ( 9.232 0.000 -24.614) 26.289 2.056 ( 1.757 0.000 8.289) 8.473 2.462 ( 8.334 0.000 -1.549) 8.477 2.598 ( 3.047 0.000 -2.549) 3.973 2.635 ( 4.577 0.000 -3.143) 5.553 2.658 ( 1.668 0.000 6.377) 6.591 2.835 ( -3.257 0.000 -10.434) 10.930 2.992 ( -6.827 0.000 0.734) 6.867 3.073 ( -1.551 0.000 4.933) 5.171 3.105 ( -3.342 0.000 -6.219) 7.060 3.249 ( -6.226 0.000 9.158) 11.074 3.337 ( 1.927 0.000 -4.274) 4.689 3.520 ( 4.294 0.000 -0.538) 4.328 3.647 ( -2.961 0.000 -1.189) 3.191 3.806 ( 10.919 0.000 2.479) 11.197 3.896 ( -1.741 0.000 5.100) 5.389 3.913 ( -2.055 0.000 -6.015) 6.356 4.068 ( 6.743 0.000 -2.578) 7.219 4.124 ( -1.340 0.000 -3.762) 3.994 4.137 ( 5.161 0.000 -2.488) 5.729 4.300 ( 0.753 0.000 5.262) 5.315 4.302 ( 5.468 0.000 -0.816) 5.529 4.388 ( -1.093 0.000 2.260) 2.510 4.458 ( 4.125 0.000 5.282) 6.702 4.533 ( 4.885 0.000 -2.412) 5.448 4.566 ( -0.247 0.000 -5.524) 5.529 4.684 ( -6.158 0.000 -3.585) 7.126 4.838 ( -1.935 0.000 -2.720) 3.338 4.892 ( 0.296 0.000 0.816) 0.868 4.975 ( -3.443 0.000 2.354) 4.171 5.119 ( -1.618 0.000 3.038) 3.442 5.120 ( -4.969 0.000 -1.810) 5.288 5.283 ( -9.639 0.000 0.089) 9.640 5.319 ( -14.446 0.000 -1.186) 14.494 5.466 ( -11.176 0.000 -0.041) 11.176 5.557 ( 2.104 0.000 -5.456) 5.847 5.575 ( -2.219 0.000 2.416) 3.280 5.607 ( -5.474 0.000 4.394) 7.019 6.069 ( 4.541 0.000 4.492) 6.387 6.171 ( 3.709 0.000 -3.707) 5.244 6.401 ( 10.692 0.000 8.050) 13.384 6.444 ( 14.668 0.000 5.869) 15.798 6.844 ( -8.287 0.000 3.044) 8.829 6.918 ( -4.332 0.000 -2.715) 5.112 7.344 ( -1.807 0.000 -4.641) 4.980 7.390 ( -1.266 0.000 -2.058) 2.416 7.544 ( -1.195 0.000 5.704) 5.828 7.660 ( -2.570 0.000 2.171) 3.364 8.201 ( 2.339 0.000 7.767) 8.112 8.258 ( 3.448 0.000 0.499) 3.483 8.444 ( -0.712 0.000 -6.713) 6.751 8.497 ( 0.570 0.000 -1.475) 1.581 8.626 ( 2.203 0.000 0.126) 2.206 8.746 ( -0.124 0.000 7.737) 7.738 8.818 ( -2.875 0.000 6.141) 6.780 8.946 ( -5.640 0.000 -9.026) 10.643 9.008 ( 2.678 0.000 1.828) 3.242 9.157 ( -2.228 0.000 -1.140) 2.503 9.294 ( -1.250 0.000 1.561) 1.999 9.392 ( 0.061 0.000 -4.173) 4.174 9.486 ( -5.939 0.000 -1.576) 6.145 9.592 ( -8.703 0.000 -1.354) 8.807 9.950 ( -1.155 0.000 -5.554) 5.673 10.173 ( -8.566 0.000 3.620) 9.299 10.243 ( 2.528 0.000 -9.041) 9.387 10.275 ( -2.126 0.000 3.040) 3.710 10.399 ( -4.378 0.000 1.927) 4.783 10.483 ( -4.040 0.000 -4.146) 5.789 10.585 ( -4.182 0.000 1.947) 4.613 10.590 ( -0.531 0.000 -6.815) 6.836 10.726 ( 4.231 0.000 -0.076) 4.231 10.838 ( 0.858 0.000 0.617) 1.057 10.873 ( 0.484 0.000 3.558) 3.591 10.957 ( -0.221 0.000 -1.576) 1.592 11.180 ( 2.095 0.000 0.619) 2.185 11.286 ( 1.973 0.000 -1.472) 2.462 11.309 ( 2.872 0.000 -4.438) 5.286 11.346 ( -3.090 0.000 2.282) 3.841 11.560 ( 0.776 0.000 6.932) 6.975 11.612 ( 1.186 0.000 -3.313) 3.519 11.910 ( -0.092 0.000 -5.778) 5.779 12.125 ( -8.804 0.000 4.297) 9.797 12.189 ( 1.177 0.000 11.037) 11.100 12.208 ( -1.585 0.000 8.594) 8.739 12.365 ( -1.746 0.000 -3.512) 3.922 12.425 ( -2.202 0.000 -4.970) 5.436 12.544 ( 6.094 0.000 -1.797) 6.353 12.553 ( 1.945 0.000 -0.159) 1.951 12.680 ( -1.994 0.000 1.961) 2.797 12.713 ( -4.006 0.000 -3.226) 5.143 13.042 ( 1.695 0.000 5.280) 5.545 13.046 ( 0.198 0.000 -1.371) 1.385 13.091 ( 2.185 0.000 -4.712) 5.194 13.109 ( 0.640 0.000 -3.600) 3.656 13.177 ( 0.474 0.000 3.743) 3.773 13.262 ( -1.056 0.000 -1.199) 1.598 13.451 ( 1.945 0.000 -1.055) 2.213 13.545 ( 3.000 0.000 9.108) 9.589 13.640 ( -2.359 0.000 -4.441) 5.029 13.642 ( 0.394 0.000 -3.451) 3.474 13.650 ( 1.530 0.000 4.785) 5.024 13.867 ( -1.355 0.000 3.780) 4.015 13.900 ( -1.072 0.000 -1.731) 2.036 13.948 ( 1.904 0.000 -4.435) 4.826 14.164 ( -0.205 0.000 -3.072) 3.079 14.238 ( 1.903 0.000 3.939) 4.375 14.371 ( 6.695 0.000 -1.999) 6.987 14.423 ( -0.825 0.000 -5.645) 5.705 14.567 ( 2.810 0.000 -0.527) 2.859 14.592 ( 0.098 0.000 0.736) 0.742 14.617 ( 2.656 0.000 2.663) 3.761 14.814 ( 9.062 0.000 -7.311) 11.643 14.926 ( 0.288 0.000 -4.547) 4.556 15.057 ( -1.939 0.000 -4.988) 5.352 15.086 ( -1.583 0.000 2.461) 2.926 15.148 ( -4.907 0.000 2.052) 5.319 15.369 ( 0.035 0.000 -0.735) 0.736 15.427 ( -3.883 0.000 -1.661) 4.224 15.599 ( 5.711 0.000 0.376) 5.724 15.738 ( -0.914 0.000 0.963) 1.328 15.793 ( 7.693 0.000 -1.303) 7.802 16.069 ( 6.389 0.000 8.648) 10.752 16.244 ( -12.174 0.000 7.675) 14.391 16.300 ( -0.517 0.000 -0.913) 1.049 16.682 ( 3.199 0.000 -4.082) 5.186 16.818 ( -3.148 0.000 3.373) 4.614 16.839 ( 4.352 0.000 0.592) 4.393 16.933 ( 3.172 0.000 0.240) 3.181 16.942 ( 2.598 0.000 0.655) 2.679 17.006 ( 0.949 0.000 -3.200) 3.338 17.197 ( 5.552 0.000 -2.285) 6.004 17.262 ( 3.221 0.000 -3.068) 4.448 17.383 ( -0.772 0.000 0.304) 0.830 17.444 ( -2.509 0.000 -2.826) 3.779 17.650 ( -2.713 0.000 0.389) 2.741 17.714 ( -3.815 0.000 1.096) 3.969 18.103 ( 1.362 0.000 2.682) 3.008 18.121 ( 1.560 0.000 -1.095) 1.906 18.343 ( 0.116 0.000 1.771) 1.775 18.441 ( -4.467 0.000 0.957) 4.568 18.446 ( 7.674 0.000 1.967) 7.922 18.466 ( 2.912 0.000 -5.697) 6.398 18.628 ( -7.660 0.000 4.838) 9.060 18.716 ( -3.259 0.000 -0.097) 3.260 18.851 ( 3.940 0.000 5.636) 6.877 18.992 ( 1.967 0.000 -4.130) 4.574 19.146 ( -1.065 0.000 4.128) 4.263 19.176 ( 0.282 0.000 1.727) 1.750 27.651 ( -0.849 0.000 -1.293) 1.547 27.669 ( -1.935 0.000 -0.898) 2.133 27.680 ( -0.550 0.000 -1.142) 1.268 27.700 ( -1.394 0.000 -0.250) 1.417 27.786 ( 1.316 0.000 0.649) 1.467 27.788 ( 1.664 0.000 0.218) 1.678 27.851 ( 0.968 0.000 0.938) 1.348 27.896 ( -0.206 0.000 -0.678) 0.709 29.344 ( 1.949 0.000 -4.723) 5.109 29.441 ( -2.185 0.000 7.497) 7.809 29.471 ( 0.238 0.000 -6.256) 6.261 29.524 ( -5.204 0.000 -0.303) 5.213 29.848 ( 3.194 0.000 -0.718) 3.274 29.920 ( 4.321 0.000 0.209) 4.326 30.167 ( 2.371 0.000 -6.781) 7.184 30.269 ( 3.182 0.000 3.276) 4.567 30.303 ( 7.311 0.000 -0.057) 7.311 30.347 ( 9.404 0.000 -1.629) 9.544 30.553 ( -2.618 0.000 4.307) 5.040 30.619 ( 2.208 0.000 -0.934) 2.397 30.750 ( -3.439 0.000 -0.281) 3.451 30.874 ( -0.635 0.000 8.423) 8.447 30.882 ( 0.870 0.000 -2.291) 2.451 31.025 ( -9.769 0.000 -2.468) 10.076 31.155 ( 9.765 0.000 5.394) 11.156 31.744 ( -10.410 0.000 -11.239) 15.319 31.873 ( 9.095 0.000 -0.778) 9.128 31.938 ( 0.966 0.000 13.168) 13.204 32.426 ( 4.716 0.000 -12.722) 13.567 32.546 ( -8.567 0.000 2.025) 8.803 32.667 ( -6.766 0.000 -8.557) 10.909 32.791 ( -12.072 0.000 14.429) 18.813 ======================= Grid point 99 (52/60) ======================= q-point: (-0.50 0.00 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 30 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.013 ( 11.975 0.000 -23.363) 26.253 2.013 ( -11.975 0.000 23.363) 26.253 2.580 ( -1.380 0.000 -2.251) 2.641 2.580 ( 1.380 0.000 2.251) 2.641 2.666 ( 6.834 0.000 -13.715) 15.323 2.666 ( -6.834 0.000 13.715) 15.323 2.876 ( -3.741 0.000 -0.794) 3.824 2.876 ( 3.741 0.000 0.794) 3.824 3.069 ( 2.314 0.000 -2.319) 3.276 3.069 ( -2.314 0.000 2.319) 3.276 3.279 ( -2.833 0.000 -12.912) 13.219 3.279 ( 2.833 0.000 12.912) 13.219 3.603 ( -0.988 0.000 -3.356) 3.498 3.603 ( 0.988 0.000 3.356) 3.498 3.864 ( 2.932 0.000 -7.920) 8.445 3.864 ( -2.932 0.000 7.920) 8.445 4.012 ( -5.032 0.000 -5.581) 7.514 4.012 ( 5.032 0.000 5.581) 7.514 4.166 ( 1.701 0.000 -0.704) 1.841 4.166 ( -1.701 0.000 0.704) 1.841 4.363 ( -0.120 0.000 -2.697) 2.700 4.363 ( 0.120 0.000 2.697) 2.700 4.479 ( -6.322 0.000 1.687) 6.544 4.479 ( 6.322 0.000 -1.687) 6.544 4.565 ( -3.599 0.000 -0.024) 3.599 4.565 ( 3.599 0.000 0.024) 3.599 4.702 ( -9.619 0.000 -4.865) 10.780 4.702 ( 9.619 0.000 4.865) 10.780 4.922 ( -1.088 0.000 -1.052) 1.514 4.922 ( 1.088 0.000 1.052) 1.514 4.985 ( 2.904 0.000 -4.727) 5.548 4.985 ( -2.904 0.000 4.727) 5.548 5.149 ( -2.463 0.000 -4.928) 5.510 5.149 ( 2.463 0.000 4.928) 5.510 5.507 ( -3.558 0.000 -2.537) 4.370 5.507 ( 3.558 0.000 2.537) 4.370 5.569 ( 2.903 0.000 -6.568) 7.181 5.569 ( -2.903 0.000 6.568) 7.181 6.168 ( -1.205 0.000 -7.051) 7.153 6.168 ( 1.205 0.000 7.051) 7.153 6.628 ( -7.019 0.000 -0.758) 7.060 6.628 ( 7.019 0.000 0.758) 7.060 6.770 ( -6.840 0.000 -5.449) 8.745 6.770 ( 6.840 0.000 5.449) 8.745 7.336 ( -2.442 0.000 0.118) 2.445 7.336 ( 2.442 0.000 -0.118) 2.445 7.594 ( -3.550 0.000 -1.249) 3.763 7.594 ( 3.550 0.000 1.249) 3.763 8.292 ( -2.018 0.000 -3.363) 3.922 8.292 ( 2.018 0.000 3.363) 3.922 8.432 ( 4.929 0.000 -4.102) 6.413 8.432 ( -4.929 0.000 4.102) 6.413 8.719 ( -4.839 0.000 1.113) 4.965 8.719 ( 4.839 0.000 -1.113) 4.965 8.834 ( 0.014 0.000 -10.914) 10.914 8.834 ( -0.014 0.000 10.914) 10.914 9.087 ( -3.639 0.000 -1.525) 3.946 9.087 ( 3.639 0.000 1.525) 3.946 9.336 ( -5.236 0.000 -1.218) 5.376 9.336 ( 5.236 0.000 1.218) 5.376 9.433 ( -5.155 0.000 -0.176) 5.158 9.433 ( 5.155 0.000 0.176) 5.158 9.981 ( 7.998 0.000 -6.408) 10.249 9.981 ( -7.998 0.000 6.408) 10.249 10.281 ( 2.259 0.000 -6.455) 6.838 10.281 ( -2.259 0.000 6.455) 6.838 10.405 ( -1.584 0.000 -3.209) 3.578 10.405 ( 1.584 0.000 3.209) 3.578 10.529 ( 0.281 0.000 -4.020) 4.029 10.529 ( -0.281 0.000 4.020) 4.029 10.808 ( -3.441 0.000 0.784) 3.529 10.808 ( 3.441 0.000 -0.784) 3.529 10.936 ( -2.554 0.000 -0.680) 2.643 10.936 ( 2.554 0.000 0.680) 2.643 11.249 ( 4.297 0.000 -1.663) 4.608 11.249 ( -4.297 0.000 1.663) 4.608 11.337 ( 0.676 0.000 -2.131) 2.236 11.337 ( -0.676 0.000 2.131) 2.236 11.602 ( -0.047 0.000 -4.483) 4.483 11.602 ( 0.047 0.000 4.483) 4.483 11.952 ( 8.138 0.000 -7.349) 10.965 11.952 ( -8.138 0.000 7.349) 10.965 12.253 ( 0.603 0.000 -4.939) 4.975 12.253 ( -0.603 0.000 4.939) 4.975 12.332 ( -1.782 0.000 -3.892) 4.281 12.332 ( 1.782 0.000 3.892) 4.281 12.622 ( -1.403 0.000 -1.810) 2.290 12.622 ( 1.403 0.000 1.810) 2.290 12.636 ( 1.536 0.000 -2.232) 2.710 12.636 ( -1.536 0.000 2.232) 2.710 13.065 ( -1.262 0.000 -2.204) 2.540 13.065 ( 1.262 0.000 2.204) 2.540 13.091 ( -0.281 0.000 -4.576) 4.584 13.091 ( 0.281 0.000 4.576) 4.584 13.229 ( -1.504 0.000 -3.109) 3.454 13.229 ( 1.504 0.000 3.109) 3.454 13.515 ( -4.437 0.000 0.893) 4.526 13.515 ( 4.437 0.000 -0.893) 4.526 13.631 ( 0.022 0.000 -2.243) 2.243 13.631 ( -0.022 0.000 2.243) 2.243 13.782 ( -6.814 0.000 -2.355) 7.209 13.782 ( 6.814 0.000 2.355) 7.209 13.902 ( -1.391 0.000 -2.236) 2.633 13.902 ( 1.391 0.000 2.236) 2.633 14.221 ( 3.639 0.000 -1.730) 4.030 14.221 ( -3.639 0.000 1.730) 4.030 14.426 ( -0.776 0.000 -0.949) 1.226 14.426 ( 0.776 0.000 0.949) 1.226 14.589 ( 0.530 0.000 -0.257) 0.589 14.589 ( -0.530 0.000 0.257) 0.589 14.771 ( -6.344 0.000 -10.821) 12.543 14.771 ( 6.344 0.000 10.821) 12.543 14.977 ( -4.425 0.000 0.431) 4.446 14.977 ( 4.425 0.000 -0.431) 4.446 15.078 ( 1.456 0.000 -1.546) 2.124 15.078 ( -1.456 0.000 1.546) 2.124 15.376 ( -1.104 0.000 0.320) 1.150 15.376 ( 1.104 0.000 -0.320) 1.150 15.697 ( 4.273 0.000 -3.291) 5.394 15.697 ( -4.273 0.000 3.291) 5.394 16.000 ( -12.108 0.000 2.947) 12.462 16.000 ( 12.108 0.000 -2.947) 12.462 16.241 ( -4.393 0.000 -3.768) 5.788 16.241 ( 4.393 0.000 3.768) 5.788 16.749 ( 4.919 0.000 -3.969) 6.321 16.749 ( -4.919 0.000 3.969) 6.321 16.944 ( -4.308 0.000 -2.383) 4.923 16.944 ( 4.308 0.000 2.383) 4.923 16.975 ( 0.398 0.000 -1.028) 1.103 16.975 ( -0.398 0.000 1.028) 1.103 17.270 ( -1.751 0.000 -0.468) 1.813 17.270 ( 1.751 0.000 0.468) 1.813 17.391 ( -1.226 0.000 -1.105) 1.650 17.391 ( 1.226 0.000 1.105) 1.650 17.646 ( -1.942 0.000 -1.303) 2.339 17.646 ( 1.942 0.000 1.303) 2.339 18.141 ( 0.072 0.000 -2.500) 2.501 18.141 ( -0.072 0.000 2.500) 2.501 18.363 ( -2.170 0.000 -1.999) 2.950 18.363 ( 2.170 0.000 1.999) 2.950 18.506 ( 3.738 0.000 -3.945) 5.435 18.506 ( -3.738 0.000 3.945) 5.435 18.621 ( -5.249 0.000 -2.554) 5.837 18.621 ( 5.249 0.000 2.554) 5.837 18.955 ( -2.722 0.000 -5.215) 5.882 18.955 ( 2.722 0.000 5.215) 5.882 19.163 ( -1.205 0.000 -0.953) 1.536 19.163 ( 1.205 0.000 0.953) 1.536 27.641 ( 0.462 0.000 -0.332) 0.569 27.641 ( -0.462 0.000 0.332) 0.569 27.678 ( 0.675 0.000 -0.303) 0.740 27.678 ( -0.675 0.000 0.303) 0.740 27.806 ( -0.055 0.000 -0.643) 0.645 27.806 ( 0.055 0.000 0.643) 0.645 27.876 ( -0.969 0.000 -1.256) 1.586 27.876 ( 0.969 0.000 1.256) 1.586 29.394 ( 4.590 0.000 -2.691) 5.320 29.394 ( -4.590 0.000 2.691) 5.320 29.461 ( 1.992 0.000 -6.274) 6.583 29.461 ( -1.992 0.000 6.274) 6.583 29.924 ( -2.884 0.000 -1.011) 3.056 29.924 ( 2.884 0.000 1.011) 3.056 30.231 ( 5.175 0.000 -3.068) 6.016 30.231 ( -5.175 0.000 3.068) 6.016 30.439 ( -5.333 0.000 0.490) 5.356 30.439 ( 5.333 0.000 -0.490) 5.356 30.602 ( -9.297 0.000 -1.282) 9.385 30.602 ( 9.297 0.000 1.282) 9.385 30.774 ( -10.757 0.000 1.685) 10.888 30.774 ( 10.757 0.000 -1.685) 10.888 30.901 ( 1.281 0.000 -9.187) 9.276 30.901 ( -1.281 0.000 9.187) 9.276 31.434 ( -12.839 0.000 -9.071) 15.720 31.434 ( 12.839 0.000 9.071) 15.720 31.998 ( 3.788 0.000 -9.119) 9.874 31.998 ( -3.788 0.000 9.119) 9.874 32.437 ( 2.005 0.000 -5.051) 5.435 32.437 ( -2.005 0.000 5.051) 5.435 32.631 ( 8.800 0.000 -11.146) 14.202 32.631 ( -8.800 0.000 11.146) 14.202 ======================= Grid point 103 (53/60) ======================= q-point: ( 0.00 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 2.009 ( -1.484 2.150 -23.469) 23.614 2.009 ( 1.484 2.150 23.469) 23.614 2.197 ( -3.924 8.976 -22.487) 24.528 2.197 ( 3.924 8.976 22.487) 24.528 2.776 ( 0.554 -3.329 -5.433) 6.396 2.776 ( -0.554 -3.329 5.433) 6.396 3.078 ( -0.678 -0.040 -2.892) 2.970 3.078 ( 0.678 -0.040 2.892) 2.970 3.217 ( -0.224 1.172 -8.286) 8.372 3.217 ( 0.224 1.172 8.286) 8.372 3.270 ( -6.552 0.957 -10.346) 12.284 3.270 ( 6.552 0.957 10.346) 12.284 3.570 ( -1.518 0.272 -5.769) 5.972 3.570 ( 1.518 0.272 5.769) 5.972 3.706 ( -0.812 2.715 -5.708) 6.372 3.706 ( 0.812 2.715 5.708) 6.372 3.892 ( -1.918 -4.977 -1.070) 5.440 3.892 ( 1.918 -4.977 1.070) 5.440 4.082 ( -4.986 1.199 -2.707) 5.798 4.082 ( 4.986 1.199 2.707) 5.798 4.264 ( 2.377 -0.990 -4.488) 5.174 4.264 ( -2.377 -0.990 4.488) 5.174 4.446 ( -0.864 1.877 -2.245) 3.051 4.446 ( 0.864 1.877 2.245) 3.051 4.691 ( 1.912 2.057 -6.207) 6.813 4.691 ( -1.912 2.057 6.207) 6.813 4.802 ( -4.560 3.779 -4.127) 7.218 4.802 ( 4.560 3.779 4.127) 7.218 5.014 ( -4.276 -3.447 -4.340) 7.001 5.014 ( 4.276 -3.447 4.340) 7.001 5.134 ( -5.439 3.019 -6.359) 8.895 5.134 ( 5.439 3.019 6.359) 8.895 5.323 ( -1.903 -2.488 -5.778) 6.572 5.323 ( 1.903 -2.488 5.778) 6.572 5.619 ( -4.117 -1.143 -3.760) 5.691 5.619 ( 4.117 -1.143 3.760) 5.691 5.850 ( -0.270 -7.304 -7.384) 10.389 5.850 ( 0.270 -7.304 7.384) 10.389 6.023 ( 3.093 -0.551 -7.197) 7.852 6.023 ( -3.093 -0.551 7.197) 7.852 6.095 ( 0.819 1.892 -3.791) 4.315 6.095 ( -0.819 1.892 3.791) 4.315 6.911 ( 2.985 -6.117 -4.835) 8.349 6.911 ( -2.985 -6.117 4.835) 8.349 7.458 ( 1.578 1.690 -5.475) 5.943 7.458 ( -1.578 1.690 5.475) 5.943 7.634 ( 1.907 -0.626 -1.870) 2.743 7.634 ( -1.907 -0.626 1.870) 2.743 8.107 ( 3.600 -5.152 -2.643) 6.818 8.107 ( -3.600 -5.152 2.643) 6.818 8.454 ( -1.478 5.397 -1.355) 5.758 8.454 ( 1.478 5.397 1.355) 5.758 8.698 ( -2.311 0.257 -1.425) 2.727 8.698 ( 2.311 0.257 1.425) 2.727 8.940 ( 2.240 1.866 -2.251) 3.683 8.940 ( -2.240 1.866 2.251) 3.683 9.121 ( 0.701 -2.801 -1.343) 3.184 9.121 ( -0.701 -2.801 1.343) 3.184 9.466 ( 4.104 -2.049 -3.123) 5.549 9.466 ( -4.104 -2.049 3.123) 5.549 9.643 ( -7.225 -3.681 -5.106) 9.582 9.643 ( 7.225 -3.681 5.106) 9.582 10.055 ( -1.225 -1.100 -1.106) 1.983 10.055 ( 1.225 -1.100 1.106) 1.983 10.340 ( -3.207 0.003 -2.512) 4.074 10.340 ( 3.207 0.003 2.512) 4.074 10.504 ( -1.340 2.670 -3.231) 4.401 10.504 ( 1.340 2.670 3.231) 4.401 10.725 ( -3.385 2.032 -2.569) 4.710 10.725 ( 3.385 2.032 2.569) 4.710 10.823 ( -2.440 5.492 -5.587) 8.206 10.823 ( 2.440 5.492 5.587) 8.206 11.068 ( -12.116 -3.031 0.643) 12.506 11.068 ( 12.116 -3.031 -0.643) 12.506 11.254 ( -1.531 3.812 -9.776) 10.604 11.254 ( 1.531 3.812 9.776) 10.604 11.382 ( 1.550 1.489 -8.050) 8.332 11.382 ( -1.550 1.489 8.050) 8.332 11.560 ( 2.489 1.136 -5.649) 6.277 11.560 ( -2.489 1.136 5.649) 6.277 12.028 ( -3.763 -2.930 -2.428) 5.352 12.028 ( 3.763 -2.930 2.428) 5.352 12.219 ( -4.644 -0.685 -5.459) 7.200 12.219 ( 4.644 -0.685 5.459) 7.200 12.270 ( 3.996 -4.602 -2.268) 6.503 12.270 ( -3.996 -4.602 2.268) 6.503 12.447 ( 1.001 -2.391 -3.314) 4.208 12.447 ( -1.001 -2.391 3.314) 4.208 12.774 ( 5.811 -5.978 -6.128) 10.347 12.774 ( -5.811 -5.978 6.128) 10.347 12.956 ( 0.868 2.276 -4.145) 4.808 12.956 ( -0.868 2.276 4.145) 4.808 13.088 ( -2.117 -1.134 -0.884) 2.559 13.088 ( 2.117 -1.134 0.884) 2.559 13.242 ( -3.052 -0.948 -2.889) 4.308 13.242 ( 3.052 -0.948 2.889) 4.308 13.457 ( 3.301 1.406 -4.884) 6.060 13.457 ( -3.301 1.406 4.884) 6.060 13.584 ( 0.883 0.731 -2.806) 3.031 13.584 ( -0.883 0.731 2.806) 3.031 13.854 ( 2.741 3.308 -2.764) 5.108 13.854 ( -2.741 3.308 2.764) 5.108 13.947 ( -1.688 3.011 0.133) 3.455 13.947 ( 1.688 3.011 -0.133) 3.455 14.148 ( -4.281 -0.319 -5.802) 7.217 14.148 ( 4.281 -0.319 5.802) 7.217 14.277 ( 0.326 -0.826 -5.208) 5.283 14.277 ( -0.326 -0.826 5.208) 5.283 14.536 ( -1.954 3.273 -7.106) 8.064 14.536 ( 1.954 3.273 7.106) 8.064 14.831 ( -3.026 0.010 0.067) 3.027 14.831 ( 3.026 0.010 -0.067) 3.027 14.909 ( -2.492 8.826 -3.939) 9.981 14.909 ( 2.492 8.826 3.939) 9.981 15.105 ( 0.729 -1.192 -5.027) 5.218 15.105 ( -0.729 -1.192 5.027) 5.218 15.436 ( -0.173 -3.200 -2.418) 4.015 15.436 ( 0.173 -3.200 2.418) 4.015 15.643 ( -4.318 2.117 -3.863) 6.168 15.643 ( 4.318 2.117 3.863) 6.168 15.819 ( -0.277 -0.268 -5.117) 5.132 15.819 ( 0.277 -0.268 5.117) 5.132 16.340 ( -1.558 -6.262 -5.766) 8.654 16.340 ( 1.558 -6.262 5.766) 8.654 16.766 ( -4.177 0.623 0.025) 4.224 16.766 ( 4.177 0.623 -0.025) 4.224 16.826 ( 0.897 1.221 -0.766) 1.698 16.826 ( -0.897 1.221 0.766) 1.698 16.908 ( 0.956 1.702 -2.809) 3.421 16.908 ( -0.956 1.702 2.809) 3.421 17.069 ( -1.133 -1.482 -1.331) 2.292 17.069 ( 1.133 -1.482 1.331) 2.292 17.502 ( -0.873 3.555 -2.050) 4.196 17.502 ( 0.873 3.555 2.050) 4.196 17.768 ( 0.399 -2.065 -7.320) 7.617 17.768 ( -0.399 -2.065 7.320) 7.617 18.122 ( -0.459 -0.659 -0.973) 1.262 18.122 ( 0.459 -0.659 0.973) 1.262 18.181 ( -0.767 -1.777 -3.632) 4.115 18.181 ( 0.767 -1.777 3.632) 4.115 18.528 ( -1.635 3.083 -3.999) 5.307 18.528 ( 1.635 3.083 3.999) 5.307 18.750 ( 2.054 -2.199 -3.815) 4.859 18.750 ( -2.054 -2.199 3.815) 4.859 18.857 ( 1.585 -0.393 -2.272) 2.798 18.857 ( -1.585 -0.393 2.272) 2.798 19.084 ( 0.543 -1.928 -3.503) 4.035 19.084 ( -0.543 -1.928 3.503) 4.035 27.703 ( 0.308 -0.588 -0.777) 1.022 27.703 ( -0.308 -0.588 0.777) 1.022 27.732 ( -0.654 -0.390 -0.711) 1.042 27.732 ( 0.654 -0.390 0.711) 1.042 27.756 ( -0.701 1.052 -0.858) 1.528 27.756 ( 0.701 1.052 0.858) 1.528 27.843 ( -1.811 -0.003 -0.683) 1.935 27.843 ( 1.811 -0.003 0.683) 1.935 29.409 ( -0.531 2.138 -5.830) 6.232 29.409 ( 0.531 2.138 5.830) 6.232 29.628 ( -2.973 -2.718 -2.584) 4.786 29.628 ( 2.973 -2.718 2.584) 4.786 29.773 ( -8.145 3.232 -3.071) 9.285 29.773 ( 8.145 3.232 3.071) 9.285 29.965 ( -4.138 0.584 -0.892) 4.273 29.965 ( 4.138 0.584 0.892) 4.273 30.239 ( -3.579 -5.850 -4.872) 8.413 30.239 ( 3.579 -5.850 4.872) 8.413 30.607 ( -3.396 1.514 -3.393) 5.033 30.607 ( 3.396 1.514 3.393) 5.033 30.797 ( -1.904 1.676 -0.363) 2.562 30.797 ( 1.904 1.676 0.363) 2.562 30.887 ( 2.450 1.615 -1.311) 3.214 30.887 ( -2.450 1.615 1.311) 3.214 31.487 ( -8.453 2.665 -3.104) 9.391 31.487 ( 8.453 2.665 3.104) 9.391 31.902 ( 4.159 -2.173 -9.886) 10.944 31.902 ( -4.159 -2.173 9.886) 10.944 32.635 ( -2.210 0.668 -11.326) 11.559 32.635 ( 2.210 0.668 11.326) 11.559 32.969 ( 1.399 -2.236 -11.883) 12.172 32.969 ( -1.399 -2.236 11.883) 12.172 ======================= Grid point 105 (54/60) ======================= q-point: ( 0.17 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.913 ( 6.697 3.009 -23.307) 24.436 2.047 ( 1.230 6.051 -10.038) 11.785 2.244 ( 11.193 3.783 4.443) 12.622 2.443 ( 8.484 5.226 13.689) 16.932 2.702 ( -4.838 -0.704 -4.284) 6.500 2.735 ( -4.510 1.059 2.534) 5.280 2.980 ( -5.737 -5.252 -8.868) 11.796 3.101 ( 1.562 -3.292 -2.302) 4.310 3.105 ( -6.216 -0.972 -6.695) 9.187 3.128 ( -1.861 1.102 -4.974) 5.424 3.271 ( 3.665 3.778 1.877) 5.588 3.429 ( -0.603 4.607 1.766) 4.970 3.495 ( -3.167 -1.014 4.326) 5.456 3.632 ( 0.672 3.983 -0.197) 4.044 3.698 ( 2.725 1.377 1.473) 3.390 3.829 ( 9.766 -2.784 -0.002) 10.154 3.872 ( -1.488 -1.744 4.529) 5.076 3.954 ( -3.358 -1.645 -0.138) 3.741 4.024 ( 5.021 -2.053 2.432) 5.944 4.163 ( 3.013 0.922 -0.536) 3.196 4.258 ( 2.254 1.706 1.327) 3.123 4.292 ( -0.542 -1.188 1.132) 1.728 4.370 ( -2.327 -0.144 0.355) 2.359 4.516 ( 1.592 4.461 -0.913) 4.824 4.570 ( -4.732 3.372 -7.940) 9.839 4.651 ( -3.123 2.309 1.670) 4.228 4.728 ( -2.842 -1.384 -1.191) 3.378 4.854 ( 0.126 0.688 1.769) 1.902 4.950 ( -0.252 3.614 -8.377) 9.127 5.039 ( -0.829 0.033 3.419) 3.518 5.080 ( 1.309 -1.585 2.142) 2.969 5.210 ( -1.804 -0.236 -6.274) 6.532 5.299 ( -1.172 -0.910 1.811) 2.341 5.379 ( -1.136 -4.107 0.359) 4.276 5.556 ( 2.641 0.399 -0.434) 2.706 5.679 ( -0.999 -1.169 -0.216) 1.553 5.741 ( -12.184 -1.456 3.993) 12.904 5.807 ( -6.774 -5.303 1.297) 8.700 6.012 ( -0.473 0.516 -4.909) 4.959 6.078 ( 2.199 -0.712 7.680) 8.021 6.100 ( 7.999 -2.247 4.977) 9.685 6.160 ( 4.664 0.299 2.762) 5.429 6.874 ( -3.121 -6.072 3.825) 7.826 6.928 ( 0.494 -5.570 -4.009) 6.881 7.416 ( -2.300 1.067 -1.035) 2.738 7.456 ( -2.257 1.862 -2.042) 3.568 7.575 ( -3.284 0.816 5.561) 6.509 7.648 ( -0.933 -2.419 0.598) 2.661 8.084 ( 0.258 -4.997 4.680) 6.851 8.191 ( 4.727 -3.076 0.140) 5.641 8.432 ( 0.121 3.094 -0.635) 3.161 8.512 ( 2.607 4.244 -0.456) 5.001 8.646 ( -1.858 0.004 1.380) 2.315 8.743 ( 0.227 2.190 2.375) 3.239 8.873 ( -4.042 2.550 1.421) 4.985 8.951 ( 0.383 -2.303 -3.303) 4.045 9.104 ( -2.507 2.902 1.723) 4.204 9.130 ( 0.284 -5.115 -0.701) 5.170 9.362 ( -6.380 -1.752 0.276) 6.622 9.438 ( -4.062 -3.001 -5.356) 7.361 9.526 ( 0.375 -0.935 -2.440) 2.640 9.707 ( -3.521 -4.087 2.349) 5.884 10.007 ( -2.506 0.322 -1.741) 3.068 10.110 ( 3.181 -2.777 -0.527) 4.255 10.284 ( -1.564 -0.583 -2.723) 3.194 10.410 ( -1.684 1.448 -2.045) 3.019 10.480 ( 0.260 0.206 2.780) 2.800 10.548 ( -0.811 -0.970 1.848) 2.240 10.625 ( -3.570 -1.126 -2.499) 4.501 10.678 ( -7.655 3.002 -4.163) 9.216 10.730 ( -4.924 2.771 0.198) 5.654 10.864 ( -0.427 2.383 0.567) 2.486 10.905 ( 1.250 5.658 1.190) 5.916 11.048 ( -7.237 -3.859 -5.662) 9.966 11.251 ( 4.991 0.831 -8.450) 9.849 11.277 ( -2.765 7.780 7.566) 11.199 11.363 ( -1.220 4.738 -3.732) 6.153 11.391 ( -0.295 0.931 3.005) 3.159 11.530 ( -0.369 0.236 4.792) 4.812 11.603 ( 1.793 3.327 -0.824) 3.868 11.972 ( -1.820 -1.089 -5.337) 5.743 12.053 ( -2.759 -3.327 8.426) 9.470 12.147 ( 1.142 -6.073 -1.191) 6.293 12.185 ( 0.684 0.093 6.435) 6.472 12.361 ( 3.311 -2.183 -1.132) 4.124 12.374 ( 1.348 -3.510 3.689) 5.268 12.442 ( 0.333 -2.433 -4.004) 4.697 12.571 ( 5.576 -4.040 -0.640) 6.916 12.651 ( -4.285 -1.321 4.354) 6.250 12.787 ( -2.618 -3.399 -4.232) 6.027 12.931 ( 0.375 -3.674 0.551) 3.734 12.996 ( 2.588 1.603 -0.304) 3.059 13.071 ( 0.300 -0.276 1.273) 1.336 13.097 ( -1.434 -1.260 1.127) 2.217 13.213 ( 0.821 -0.720 -2.369) 2.609 13.323 ( 0.898 -0.075 1.665) 1.893 13.404 ( -0.775 2.827 -0.744) 3.024 13.502 ( 2.884 2.856 -1.866) 4.468 13.593 ( 1.142 -1.841 0.253) 2.181 13.619 ( 1.788 1.887 1.188) 2.858 13.814 ( -0.083 2.724 0.696) 2.813 13.874 ( -0.560 7.816 -4.201) 8.891 13.938 ( 1.226 1.972 -0.235) 2.334 14.001 ( -1.374 2.902 0.777) 3.304 14.079 ( 5.936 2.506 0.844) 6.498 14.199 ( -2.555 -4.672 -0.664) 5.366 14.232 ( 2.331 -5.014 1.041) 5.627 14.399 ( 1.222 -3.463 0.880) 3.777 14.511 ( 1.838 3.475 -8.053) 8.962 14.627 ( 1.153 0.365 -0.112) 1.214 14.640 ( -4.209 3.296 -3.235) 6.248 14.773 ( -0.638 5.242 -1.750) 5.563 14.956 ( 4.349 4.930 -2.446) 7.014 15.039 ( 5.137 -0.412 -5.519) 7.551 15.093 ( 0.377 -0.907 3.221) 3.367 15.154 ( -0.116 -0.587 -2.659) 2.725 15.383 ( -2.812 -2.071 -1.065) 3.652 15.478 ( 2.078 -2.667 5.457) 6.419 15.569 ( -1.291 3.897 -2.313) 4.712 15.732 ( 2.088 2.175 -1.946) 3.589 15.797 ( -0.858 2.959 2.371) 3.888 15.877 ( 4.561 -1.601 7.329) 8.779 16.285 ( -0.906 -3.024 -0.951) 3.297 16.363 ( -3.882 -5.303 6.105) 8.970 16.694 ( -1.414 1.414 -1.487) 2.491 16.789 ( -1.583 1.115 0.009) 1.936 16.844 ( 2.165 1.395 1.140) 2.817 16.854 ( 3.709 -1.626 -2.427) 4.721 16.914 ( -0.077 2.042 1.991) 2.853 16.958 ( 3.373 0.792 0.260) 3.475 17.084 ( 5.336 -0.456 -2.042) 5.731 17.168 ( 5.292 -2.151 -2.159) 6.107 17.454 ( -1.980 3.645 -1.626) 4.455 17.523 ( -0.559 3.335 -0.420) 3.407 17.704 ( -2.595 -2.361 -4.820) 5.962 17.762 ( -3.203 -1.336 4.540) 5.715 18.078 ( -0.685 -0.220 0.981) 1.217 18.119 ( -0.316 -0.412 -2.630) 2.681 18.257 ( 5.036 -2.065 0.373) 5.456 18.267 ( 5.687 -2.046 3.228) 6.852 18.478 ( -1.070 2.087 -2.158) 3.187 18.552 ( -3.200 3.083 3.677) 5.767 18.694 ( -4.260 -3.427 1.697) 5.724 18.750 ( 0.225 -2.126 2.302) 3.142 18.797 ( -2.754 1.044 0.672) 3.021 18.921 ( 3.404 -1.950 -1.528) 4.210 19.109 ( 1.738 -1.317 3.477) 4.104 19.136 ( 2.049 -0.744 2.777) 3.531 27.675 ( -1.728 -0.828 -1.066) 2.193 27.683 ( -1.259 -1.165 -0.541) 1.799 27.718 ( -0.763 0.410 -1.107) 1.406 27.741 ( -1.273 0.268 -0.481) 1.387 27.756 ( 1.590 0.787 -0.029) 1.775 27.775 ( 1.102 0.615 0.036) 1.262 27.827 ( 0.660 0.601 0.702) 1.136 27.880 ( 1.184 -0.571 0.277) 1.343 29.372 ( 0.084 1.744 -5.249) 5.531 29.447 ( -0.815 1.632 6.122) 6.388 29.530 ( -3.671 -0.858 -5.031) 6.287 29.616 ( -2.893 0.770 -0.367) 3.016 29.758 ( 4.302 -1.813 -0.233) 4.674 29.870 ( 0.159 1.004 -1.039) 1.454 30.030 ( 12.410 1.204 0.540) 12.480 30.090 ( 6.136 -0.631 -0.922) 6.237 30.178 ( 1.249 -2.848 -3.034) 4.344 30.343 ( 3.132 -1.734 3.235) 4.825 30.530 ( -1.038 2.278 -3.108) 3.990 30.651 ( -0.947 -2.191 0.062) 2.387 30.774 ( -0.203 2.699 0.804) 2.824 30.839 ( 1.678 0.448 1.017) 2.013 30.886 ( 0.485 2.119 3.715) 4.304 30.974 ( 4.707 0.311 4.178) 6.301 31.282 ( -9.261 3.920 -3.377) 10.608 31.663 ( 6.105 -1.832 1.781) 6.618 31.830 ( -2.933 -1.866 2.865) 4.505 31.972 ( 3.490 1.108 -3.454) 5.034 32.483 ( -4.433 1.048 -11.891) 12.734 32.649 ( -5.103 -2.187 3.539) 6.584 32.867 ( -6.070 -0.494 -5.488) 8.198 32.925 ( -9.253 -1.733 13.906) 16.793 ======================= Grid point 106 (55/60) ======================= q-point: ( 0.33 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 1.988 ( 11.333 6.764 -20.981) 24.787 2.132 ( 6.093 6.327 3.392) 9.416 2.504 ( 4.817 4.109 0.268) 6.337 2.586 ( 4.368 -1.946 -8.738) 9.961 2.632 ( 4.822 -0.020 0.147) 4.825 2.710 ( 0.874 5.051 5.383) 7.433 2.805 ( -7.635 -2.354 -3.778) 8.838 2.943 ( -2.864 -3.416 -4.657) 6.447 3.075 ( -2.771 -1.160 1.211) 3.239 3.106 ( -1.270 -2.047 -1.731) 2.967 3.285 ( -7.028 3.398 7.174) 10.602 3.349 ( -1.398 1.494 -1.186) 2.365 3.496 ( 4.638 1.401 -0.897) 4.927 3.678 ( -2.573 0.276 2.575) 3.650 3.707 ( -0.280 -6.725 2.407) 7.148 3.869 ( -4.894 -3.309 0.572) 5.935 3.879 ( 2.659 1.598 -1.848) 3.611 4.069 ( 11.082 -0.360 -2.479) 11.361 4.143 ( 5.489 1.962 -1.631) 6.054 4.191 ( 1.145 0.577 -4.305) 4.492 4.309 ( -3.246 2.792 -0.310) 4.293 4.340 ( 4.171 -0.803 0.910) 4.344 4.354 ( 4.046 3.199 4.890) 7.108 4.461 ( 1.584 -6.324 -4.051) 7.675 4.577 ( 1.660 6.336 -1.596) 6.741 4.633 ( 1.334 0.477 1.685) 2.201 4.702 ( 1.015 6.549 2.185) 6.978 4.846 ( -1.343 -0.590 -3.375) 3.680 4.881 ( -4.119 -0.632 -1.474) 4.420 4.981 ( -5.568 0.562 0.631) 5.632 5.093 ( -4.030 -1.261 0.411) 4.243 5.146 ( -2.934 -0.664 -1.456) 3.342 5.192 ( -8.651 -4.618 -4.140) 10.644 5.292 ( -4.677 1.094 3.127) 5.731 5.499 ( -3.098 -1.767 -0.027) 3.567 5.523 ( -10.513 3.251 -0.077) 11.004 5.637 ( -2.838 2.628 2.627) 4.676 5.710 ( -1.356 7.475 -0.699) 7.629 6.019 ( 3.794 -4.853 1.539) 6.350 6.143 ( 1.996 -3.177 -1.648) 4.098 6.353 ( 8.903 -3.859 9.423) 13.526 6.394 ( 14.139 -5.029 5.909) 16.129 6.788 ( -7.017 -4.450 2.647) 8.721 6.879 ( -3.526 -4.216 -3.360) 6.442 7.357 ( -1.876 1.615 -2.140) 3.273 7.389 ( -2.032 0.298 -2.013) 2.876 7.554 ( -2.230 0.219 6.309) 6.695 7.615 ( -2.443 -3.693 0.564) 4.464 8.172 ( 5.226 -2.540 4.510) 7.355 8.296 ( 4.125 1.710 3.818) 5.875 8.408 ( -1.372 -1.676 -4.083) 4.622 8.532 ( -1.707 2.494 -2.909) 4.195 8.658 ( 3.028 2.709 3.144) 5.137 8.733 ( -1.905 -1.011 6.237) 6.599 8.825 ( -1.653 2.418 -0.049) 2.930 8.919 ( -2.939 -2.746 -6.400) 7.559 9.020 ( -1.881 -0.600 0.479) 2.032 9.129 ( -0.795 -0.089 0.814) 1.141 9.308 ( 0.725 -0.163 0.701) 1.022 9.364 ( -1.200 -2.004 -3.417) 4.139 9.483 ( -3.946 -0.566 -1.766) 4.360 9.582 ( -7.632 -1.047 -0.134) 7.704 9.914 ( -3.553 -2.228 -4.928) 6.471 10.100 ( -8.822 -5.658 2.611) 10.801 10.219 ( 1.609 -1.880 -7.906) 8.284 10.278 ( -6.897 -2.726 0.904) 7.471 10.426 ( 0.278 4.398 1.911) 4.803 10.486 ( -2.993 -0.046 -0.586) 3.051 10.557 ( -1.482 -1.345 -0.813) 2.160 10.663 ( -2.854 5.587 -5.095) 8.082 10.711 ( 3.869 -1.723 1.289) 4.427 10.832 ( -0.063 -0.562 -1.682) 1.775 10.931 ( 0.048 4.483 2.256) 5.019 10.972 ( -0.194 2.068 -0.649) 2.177 11.271 ( -0.457 4.845 4.243) 6.456 11.298 ( 3.935 1.547 -5.348) 6.818 11.329 ( -0.532 1.301 -0.402) 1.462 11.398 ( 0.148 4.124 -0.903) 4.224 11.579 ( 2.251 0.678 0.518) 2.408 11.613 ( -1.218 4.139 3.469) 5.536 11.906 ( 0.347 -0.193 -6.924) 6.935 12.047 ( -5.722 -3.170 10.954) 12.759 12.177 ( 1.334 -2.793 5.168) 6.024 12.230 ( 0.520 0.241 3.570) 3.616 12.331 ( -1.799 -2.319 -3.072) 4.249 12.402 ( -1.531 -2.242 -2.042) 3.397 12.494 ( 5.045 -4.272 -1.333) 6.743 12.563 ( -0.522 -0.494 2.021) 2.145 12.643 ( -1.907 -1.807 1.538) 3.045 12.711 ( -2.186 -0.534 -3.551) 4.204 12.955 ( 1.466 -6.454 -1.748) 6.845 13.021 ( -3.439 -6.402 1.440) 7.409 13.073 ( 4.185 1.411 -1.259) 4.593 13.127 ( 0.176 4.797 5.040) 6.960 13.222 ( 0.751 -1.359 0.872) 1.781 13.294 ( -1.550 0.589 -2.367) 2.890 13.430 ( 4.102 2.403 -3.574) 5.948 13.576 ( 2.411 2.227 0.604) 3.337 13.594 ( -1.153 0.911 3.142) 3.469 13.652 ( 0.195 0.882 1.169) 1.477 13.808 ( 0.005 7.078 -1.528) 7.241 13.874 ( 1.736 4.065 1.368) 4.627 13.943 ( -3.561 3.204 1.285) 4.959 14.005 ( 2.259 4.950 -2.506) 5.990 14.135 ( -0.252 -3.379 -2.315) 4.103 14.238 ( 1.811 -0.398 1.718) 2.528 14.312 ( 8.151 -5.204 -0.776) 9.701 14.388 ( -0.037 -6.651 -2.337) 7.050 14.401 ( -3.653 -3.766 -1.890) 5.577 14.573 ( -1.234 -2.072 -5.410) 5.923 14.712 ( 5.098 0.095 -2.631) 5.737 14.825 ( 3.728 3.103 0.864) 4.927 14.972 ( -1.385 1.852 -2.377) 3.316 15.020 ( -7.474 -4.507 -4.860) 9.989 15.104 ( 3.510 2.538 -5.209) 6.774 15.155 ( 1.196 2.904 3.654) 4.818 15.358 ( 1.932 0.434 -1.829) 2.696 15.481 ( -2.434 1.702 -0.478) 3.008 15.625 ( 4.542 3.286 2.592) 6.176 15.753 ( -1.314 1.485 2.137) 2.915 15.834 ( 6.373 3.861 -0.955) 7.512 16.049 ( 6.257 -1.862 7.651) 10.057 16.225 ( -8.585 -1.444 6.291) 10.740 16.297 ( -2.009 -0.796 0.304) 2.183 16.702 ( 3.331 1.862 -3.732) 5.337 16.795 ( 0.867 -0.709 1.188) 1.633 16.880 ( -0.016 2.438 1.721) 2.984 16.919 ( 3.360 -1.650 -1.703) 4.113 16.944 ( 2.979 0.462 -0.364) 3.037 17.001 ( -0.355 -0.778 1.646) 1.855 17.200 ( 5.781 0.277 -1.818) 6.066 17.255 ( 4.235 -0.820 -3.305) 5.434 17.411 ( -0.973 2.902 -1.198) 3.287 17.472 ( -2.931 2.790 -1.914) 4.477 17.634 ( -2.523 -1.608 -0.035) 2.992 17.697 ( -4.275 -1.820 1.243) 4.810 18.099 ( 1.587 -0.214 2.036) 2.591 18.121 ( 1.368 -0.089 -0.831) 1.603 18.335 ( 1.929 -0.652 0.141) 2.041 18.419 ( 6.168 -2.497 1.594) 6.843 18.456 ( -0.854 1.117 -1.631) 2.153 18.482 ( -1.179 1.975 -0.848) 2.452 18.595 ( -6.040 -2.743 3.211) 7.370 18.697 ( -5.042 -2.453 2.633) 6.195 18.851 ( 4.258 0.391 3.292) 5.397 18.968 ( 1.802 -2.278 -2.649) 3.931 19.146 ( -0.286 0.108 3.886) 3.898 19.173 ( 0.116 -0.345 1.774) 1.811 27.640 ( -0.994 -0.833 -1.005) 1.641 27.649 ( -1.464 -1.218 -0.806) 2.068 27.694 ( -0.694 0.731 -0.923) 1.367 27.708 ( -1.209 0.443 -0.532) 1.393 27.794 ( 1.721 0.770 0.026) 1.886 27.803 ( 1.244 1.113 0.594) 1.772 27.849 ( 0.762 -0.088 0.703) 1.041 27.889 ( -0.238 -0.665 -0.507) 0.869 29.360 ( 1.709 1.459 -4.874) 5.367 29.443 ( -2.449 0.136 6.116) 6.590 29.461 ( -0.401 -0.683 -4.731) 4.797 29.525 ( -5.294 -0.331 -0.861) 5.373 29.845 ( 5.410 0.727 -0.057) 5.459 29.958 ( 4.818 2.602 0.186) 5.478 30.130 ( 2.293 -2.705 -4.218) 5.510 30.228 ( 2.641 -2.832 0.939) 3.985 30.334 ( 11.973 2.448 0.046) 12.221 30.404 ( 4.004 4.159 0.136) 5.775 30.555 ( 1.216 -0.362 1.509) 1.971 30.610 ( 0.788 -0.613 -1.099) 1.485 30.753 ( -3.296 0.557 -0.445) 3.372 30.876 ( 0.483 -0.074 3.678) 3.710 30.903 ( -0.692 1.832 0.906) 2.157 31.019 ( -8.421 -1.217 1.588) 8.656 31.179 ( 6.486 3.310 2.507) 7.701 31.640 ( -7.464 -8.286 -3.430) 11.667 31.891 ( 6.480 2.552 -0.881) 7.020 32.012 ( 1.153 3.981 2.899) 5.058 32.404 ( 2.888 -1.546 -10.507) 11.006 32.516 ( -5.308 -2.775 -2.318) 6.423 32.679 ( -9.108 0.988 -2.305) 9.447 32.775 ( -12.090 -1.525 13.994) 18.556 ======================= Grid point 107 (56/60) ======================= q-point: (-0.50 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 2.135 ( 11.747 10.913 -21.029) 26.444 2.135 ( -11.747 10.913 21.029) 26.444 2.567 ( 4.458 -1.961 -7.867) 9.252 2.567 ( -4.458 -1.961 7.867) 9.252 2.675 ( 2.149 1.867 -8.759) 9.210 2.675 ( -2.149 1.867 8.759) 9.210 2.869 ( -0.747 -1.339 -3.614) 3.926 2.869 ( 0.747 -1.339 3.614) 3.926 3.056 ( -1.433 -1.261 -1.946) 2.725 3.056 ( 1.433 -1.261 1.946) 2.725 3.286 ( -2.201 0.522 -11.434) 11.655 3.286 ( 2.201 0.522 11.434) 11.655 3.600 ( -3.513 -1.050 -2.967) 4.717 3.600 ( 3.513 -1.050 2.967) 4.717 3.759 ( -1.694 -4.625 -4.216) 6.483 3.759 ( 1.694 -4.625 4.216) 6.483 3.991 ( -8.484 -2.667 -2.459) 9.227 3.991 ( 8.484 -2.667 2.459) 9.227 4.233 ( -3.819 5.333 -0.599) 6.587 4.233 ( 3.819 5.333 0.599) 6.587 4.345 ( 2.266 -1.648 -3.575) 4.542 4.345 ( -2.266 -1.648 3.575) 4.542 4.517 ( -5.770 -1.856 -0.261) 6.066 4.517 ( 5.770 -1.856 0.261) 6.066 4.588 ( -10.435 5.346 -1.391) 11.807 4.588 ( 10.435 5.346 1.391) 11.807 4.751 ( -5.496 2.400 -3.304) 6.847 4.751 ( 5.496 2.400 3.304) 6.847 4.882 ( -1.529 -3.553 -1.194) 4.048 4.882 ( 1.529 -3.553 1.194) 4.048 4.980 ( 3.286 1.746 -3.172) 4.890 4.980 ( -3.286 1.746 3.172) 4.890 5.203 ( -0.326 4.674 -4.767) 6.684 5.203 ( 0.326 4.674 4.767) 6.684 5.455 ( -0.763 -1.461 -1.664) 2.342 5.455 ( 0.763 -1.461 1.664) 2.342 5.655 ( 1.199 5.338 -6.789) 8.719 5.655 ( -1.199 5.338 6.789) 8.719 6.119 ( -1.083 -5.382 -6.955) 8.861 6.119 ( 1.083 -5.382 6.955) 8.861 6.560 ( -4.734 -5.680 -3.055) 8.001 6.560 ( 4.734 -5.680 3.055) 8.001 6.740 ( -5.242 -3.047 -6.035) 8.554 6.740 ( 5.242 -3.047 6.035) 8.554 7.346 ( -0.376 1.013 -2.013) 2.285 7.346 ( 0.376 1.013 2.013) 2.285 7.567 ( -0.622 -2.379 -3.538) 4.309 7.567 ( 0.622 -2.379 3.538) 4.309 8.306 ( -3.839 0.425 -2.946) 4.858 8.306 ( 3.839 0.425 2.946) 4.858 8.430 ( -1.619 0.292 -5.372) 5.618 8.430 ( 1.619 0.292 5.372) 5.618 8.749 ( 2.326 1.384 -3.505) 4.429 8.749 ( -2.326 1.384 3.505) 4.429 8.801 ( 0.259 -0.798 -6.943) 6.994 8.801 ( -0.259 -0.798 6.943) 6.994 9.076 ( -4.437 -1.136 -0.079) 4.581 9.076 ( 4.437 -1.136 0.079) 4.581 9.344 ( -1.419 -0.213 -2.857) 3.197 9.344 ( 1.419 -0.213 2.857) 3.197 9.436 ( -3.517 1.035 -0.519) 3.702 9.436 ( 3.517 1.035 0.519) 3.702 9.917 ( 6.628 -5.202 -4.165) 9.399 9.917 ( -6.628 -5.202 4.165) 9.399 10.228 ( 1.652 -4.304 -4.951) 6.765 10.228 ( -1.652 -4.304 4.951) 6.765 10.457 ( -0.365 3.002 -0.331) 3.042 10.457 ( 0.365 3.002 0.331) 3.042 10.557 ( -2.740 3.278 -4.639) 6.306 10.557 ( 2.740 3.278 4.639) 6.306 10.798 ( -2.754 -1.607 -2.271) 3.915 10.798 ( 2.754 -1.607 2.271) 3.915 10.958 ( -1.389 3.035 -0.858) 3.446 10.958 ( 1.389 3.035 0.858) 3.446 11.295 ( -0.447 3.010 -1.909) 3.592 11.295 ( 0.447 3.010 1.909) 3.592 11.373 ( -1.130 0.913 -0.456) 1.523 11.373 ( 1.130 0.913 0.456) 1.523 11.603 ( 2.958 2.862 -7.499) 8.554 11.603 ( -2.958 2.862 7.499) 8.554 11.947 ( 7.485 0.455 -9.274) 11.926 11.947 ( -7.485 0.455 9.274) 11.926 12.239 ( -1.466 -1.167 -4.806) 5.158 12.239 ( 1.466 -1.167 4.806) 5.158 12.327 ( -3.306 -0.995 -3.324) 4.792 12.327 ( 3.306 -0.995 3.324) 4.792 12.555 ( 2.198 -5.274 -2.984) 6.446 12.555 ( -2.198 -5.274 2.984) 6.446 12.654 ( -1.389 0.964 -4.074) 4.411 12.654 ( 1.389 0.964 4.074) 4.411 12.975 ( 1.575 -6.714 -2.285) 7.265 12.975 ( -1.575 -6.714 2.285) 7.265 13.126 ( 2.154 2.381 -3.766) 4.949 13.126 ( -2.154 2.381 3.766) 4.949 13.254 ( -0.189 0.188 -4.835) 4.843 13.254 ( 0.189 0.188 4.835) 4.843 13.522 ( 1.635 2.178 -4.302) 5.091 13.522 ( -1.635 2.178 4.302) 5.091 13.634 ( -0.797 1.134 -2.275) 2.664 13.634 ( 0.797 1.134 2.275) 2.664 13.852 ( -1.570 4.918 -1.913) 5.506 13.852 ( 1.570 4.918 1.913) 5.506 13.946 ( -2.572 4.592 -4.693) 7.052 13.946 ( 2.572 4.592 4.693) 7.052 14.209 ( -2.569 -1.812 -2.432) 3.975 14.209 ( 2.569 -1.812 2.432) 3.975 14.346 ( 0.109 -6.097 -2.320) 6.525 14.346 ( -0.109 -6.097 2.320) 6.525 14.513 ( -3.044 -4.589 -6.930) 8.852 14.513 ( 3.044 -4.589 6.930) 8.852 14.826 ( -6.253 -3.318 -3.333) 7.824 14.826 ( 6.253 -3.318 3.333) 7.824 14.907 ( -3.345 0.901 -1.833) 3.919 14.907 ( 3.345 0.901 1.833) 3.919 15.152 ( 1.909 4.828 -3.746) 6.402 15.152 ( -1.909 4.828 3.746) 6.402 15.418 ( -2.575 2.941 0.251) 3.917 15.418 ( 2.575 2.941 -0.251) 3.917 15.713 ( 3.865 1.754 -3.043) 5.223 15.713 ( -3.865 1.754 3.043) 5.223 16.012 ( -7.335 1.275 1.253) 7.549 16.012 ( 7.335 1.275 -1.253) 7.549 16.226 ( -4.217 -1.314 -3.641) 5.724 16.226 ( 4.217 -1.314 3.641) 5.724 16.769 ( 3.916 1.682 -4.250) 6.018 16.769 ( -3.916 1.682 4.250) 6.018 16.923 ( -1.995 -1.497 -2.158) 3.298 16.923 ( 1.995 -1.497 2.158) 3.298 16.987 ( 1.414 0.498 -2.247) 2.701 16.987 ( -1.414 0.498 2.247) 2.701 17.274 ( -0.749 0.445 -1.823) 2.021 17.274 ( 0.749 0.445 1.823) 2.021 17.417 ( -1.009 2.434 -0.790) 2.751 17.417 ( 1.009 2.434 0.790) 2.751 17.625 ( -1.801 -2.055 -0.971) 2.900 17.625 ( 1.801 -2.055 0.971) 2.900 18.137 ( -0.024 -0.268 -2.056) 2.073 18.137 ( 0.024 -0.268 2.056) 2.073 18.373 ( -1.468 0.993 -2.002) 2.674 18.373 ( 1.468 0.993 2.002) 2.674 18.500 ( 3.210 -0.520 -4.055) 5.198 18.500 ( -3.210 -0.520 4.055) 5.198 18.591 ( -4.205 -2.914 -2.335) 5.624 18.591 ( 4.205 -2.914 2.335) 5.624 18.945 ( -2.054 -0.867 -3.931) 4.519 18.945 ( 2.054 -0.867 3.931) 4.519 19.162 ( -0.828 -0.032 -0.991) 1.292 19.162 ( 0.828 -0.032 0.991) 1.292 27.628 ( 0.127 -0.921 -0.291) 0.974 27.628 ( -0.127 -0.921 0.291) 0.974 27.689 ( -0.056 0.695 -0.238) 0.736 27.689 ( 0.056 0.695 0.238) 0.736 27.817 ( 0.021 0.958 -0.615) 1.139 27.817 ( -0.021 0.958 0.615) 1.139 27.870 ( -0.924 -0.539 -1.029) 1.484 27.870 ( 0.924 -0.539 1.029) 1.484 29.399 ( 3.909 0.484 -3.176) 5.060 29.399 ( -3.909 0.484 3.176) 5.060 29.453 ( 1.663 -0.704 -5.980) 6.246 29.453 ( -1.663 -0.704 5.980) 6.246 29.956 ( -3.955 3.173 -1.337) 5.244 29.956 ( 3.955 3.173 1.337) 5.244 30.199 ( -3.841 -2.872 0.834) 4.867 30.199 ( 3.841 -2.872 -0.834) 4.867 30.476 ( -3.436 3.284 -1.188) 4.899 30.476 ( 3.436 3.284 1.188) 4.899 30.607 ( -8.318 0.469 -1.552) 8.474 30.607 ( 8.318 0.469 1.552) 8.474 30.773 ( -9.272 -0.251 0.016) 9.275 30.773 ( 9.272 -0.251 -0.016) 9.275 30.908 ( 1.190 0.567 -7.108) 7.230 30.908 ( -1.190 0.567 7.108) 7.230 31.406 ( -10.851 -2.433 -6.702) 12.984 31.406 ( 10.851 -2.433 6.702) 12.984 32.007 ( 0.929 0.749 -6.891) 6.994 32.007 ( -0.929 0.749 6.891) 6.994 32.439 ( 0.112 0.227 -2.792) 2.804 32.439 ( -0.112 0.227 2.792) 2.804 32.611 ( 8.373 -1.871 -9.950) 13.138 32.611 ( -8.373 -1.871 9.950) 13.138 ======================= Grid point 111 (57/60) ======================= q-point: ( 0.00 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 2.079 ( 0.112 3.248 -10.553) 11.042 2.079 ( -0.112 3.248 10.553) 11.042 2.382 ( -2.805 9.166 -10.695) 14.362 2.382 ( 2.805 9.166 10.695) 14.362 2.677 ( -0.142 -6.904 -6.567) 9.529 2.677 ( 0.142 -6.904 6.567) 9.529 2.975 ( -2.775 -5.434 -5.136) 7.975 2.975 ( 2.775 -5.434 5.136) 7.975 3.272 ( -6.813 2.958 -0.844) 7.475 3.272 ( 6.813 2.958 0.844) 7.475 3.307 ( -5.566 0.421 -4.541) 7.196 3.307 ( 5.566 0.421 4.541) 7.196 3.617 ( -3.229 3.581 -0.357) 4.835 3.617 ( 3.229 3.581 0.357) 4.835 3.760 ( -4.053 1.636 -3.951) 5.892 3.760 ( 4.053 1.636 3.951) 5.892 3.834 ( -4.115 -0.413 -2.361) 4.762 3.834 ( 4.115 -0.413 2.361) 4.762 4.075 ( 1.033 -1.537 -4.038) 4.443 4.075 ( -1.033 -1.537 4.038) 4.443 4.240 ( -1.524 -0.746 -1.058) 2.000 4.240 ( 1.524 -0.746 1.058) 2.000 4.484 ( 3.580 1.195 -2.046) 4.293 4.484 ( -3.580 1.195 2.046) 4.293 4.755 ( 1.425 3.571 -1.816) 4.252 4.755 ( -1.425 3.571 1.816) 4.252 4.841 ( 3.006 -0.542 -2.191) 3.759 4.841 ( -3.006 -0.542 2.191) 3.759 4.946 ( -1.804 -2.057 -0.529) 2.787 4.946 ( 1.804 -2.057 0.529) 2.787 5.171 ( -4.913 -0.833 -0.004) 4.983 5.171 ( 4.913 -0.833 0.004) 4.983 5.325 ( 0.405 4.639 -9.909) 10.949 5.325 ( -0.405 4.639 9.909) 10.949 5.540 ( -1.571 -7.022 -7.648) 10.501 5.540 ( 1.571 -7.022 7.648) 10.501 5.760 ( 0.833 -0.984 -1.800) 2.214 5.760 ( -0.833 -0.984 1.800) 2.214 6.009 ( 2.093 -0.601 -3.236) 3.900 6.009 ( -2.093 -0.601 3.236) 3.900 6.122 ( 2.042 0.789 -2.313) 3.184 6.122 ( -2.042 0.789 2.313) 3.184 6.792 ( 1.675 -4.229 -2.854) 5.370 6.792 ( -1.675 -4.229 2.854) 5.370 7.513 ( 1.819 3.352 -5.431) 6.636 7.513 ( -1.819 3.352 5.431) 6.636 7.609 ( 1.832 -1.940 -3.380) 4.307 7.609 ( -1.832 -1.940 3.380) 4.307 8.004 ( 2.529 -3.844 -1.401) 4.810 8.004 ( -2.529 -3.844 1.401) 4.810 8.537 ( -0.840 2.264 -0.567) 2.481 8.537 ( 0.840 2.264 0.567) 2.481 8.750 ( -3.170 4.449 -1.139) 5.580 8.750 ( 3.170 4.449 1.139) 5.580 8.902 ( -3.178 -4.903 -1.627) 6.066 8.902 ( 3.178 -4.903 1.627) 6.066 9.147 ( -2.563 4.697 -3.244) 6.258 9.147 ( 2.563 4.697 3.244) 6.258 9.391 ( -0.114 -4.999 -3.514) 6.112 9.391 ( 0.114 -4.999 3.514) 6.112 9.584 ( -2.824 -1.584 -1.300) 3.489 9.584 ( 2.824 -1.584 1.300) 3.489 10.029 ( -0.229 -0.939 -0.697) 1.192 10.029 ( 0.229 -0.939 0.697) 1.192 10.359 ( -1.347 0.947 -1.386) 2.153 10.359 ( 1.347 0.947 1.386) 2.153 10.523 ( 0.322 0.057 -2.086) 2.111 10.523 ( -0.322 0.057 2.086) 2.111 10.780 ( -5.147 2.760 -1.747) 6.096 10.780 ( 5.147 2.760 1.747) 6.096 10.894 ( -1.102 -0.707 -2.454) 2.781 10.894 ( 1.102 -0.707 2.454) 2.781 11.072 ( -2.469 6.214 -2.280) 7.065 11.072 ( 2.469 6.214 2.280) 7.065 11.222 ( -3.782 -6.033 -8.422) 11.029 11.222 ( 3.782 -6.033 8.422) 11.029 11.450 ( 2.729 2.267 -5.639) 6.662 11.450 ( -2.729 2.267 5.639) 6.662 11.613 ( -2.824 3.327 -1.603) 4.649 11.613 ( 2.824 3.327 1.603) 4.649 11.988 ( -3.437 1.508 -3.457) 5.103 11.988 ( 3.437 1.508 3.457) 5.103 12.109 ( -4.955 -8.628 -1.737) 10.100 12.109 ( 4.955 -8.628 1.737) 10.100 12.270 ( -0.013 2.918 -4.649) 5.489 12.270 ( 0.013 2.918 4.649) 5.489 12.397 ( 0.967 -2.584 -2.695) 3.857 12.397 ( -0.967 -2.584 2.695) 3.857 12.707 ( 2.063 -1.338 -2.295) 3.363 12.707 ( -2.063 -1.338 2.295) 3.363 13.000 ( 3.193 1.934 -5.086) 6.309 13.000 ( -3.193 1.934 5.086) 6.309 13.042 ( 3.040 -2.817 -2.347) 4.763 13.042 ( -3.040 -2.817 2.347) 4.763 13.189 ( -2.698 -1.901 -2.056) 3.888 13.189 ( 2.698 -1.901 2.056) 3.888 13.495 ( 0.512 1.179 -1.795) 2.208 13.495 ( -0.512 1.179 1.795) 2.208 13.593 ( 0.463 0.146 -2.030) 2.087 13.593 ( -0.463 0.146 2.030) 2.087 13.959 ( -1.720 5.897 -3.356) 7.000 13.959 ( 1.720 5.897 3.356) 7.000 13.999 ( 2.534 2.026 -3.018) 4.431 13.999 ( -2.534 2.026 3.018) 4.431 14.102 ( -0.506 -4.114 -2.072) 4.634 14.102 ( 0.506 -4.114 2.072) 4.634 14.229 ( -3.990 -2.338 -0.686) 4.675 14.229 ( 3.990 -2.338 0.686) 4.675 14.672 ( -0.343 8.025 -6.661) 10.435 14.672 ( 0.343 8.025 6.661) 10.435 14.796 ( -0.702 -3.681 -3.464) 5.103 14.796 ( 0.702 -3.681 3.464) 5.103 15.059 ( -0.385 2.657 -2.778) 3.863 15.059 ( 0.385 2.657 2.778) 3.863 15.109 ( -3.392 3.508 -4.600) 6.706 15.109 ( 3.392 3.508 4.600) 6.706 15.353 ( 1.223 -4.164 -1.576) 4.617 15.353 ( -1.223 -4.164 1.576) 4.617 15.707 ( -2.003 3.790 -6.094) 7.451 15.707 ( 2.003 3.790 6.094) 7.451 15.796 ( 0.274 -2.159 -7.059) 7.387 15.796 ( -0.274 -2.159 7.059) 7.387 16.223 ( -0.029 -4.118 -2.953) 5.067 16.223 ( 0.029 -4.118 2.953) 5.067 16.784 ( 0.643 0.898 -1.004) 1.493 16.784 ( -0.643 0.898 1.004) 1.493 16.864 ( 2.599 2.226 -3.155) 4.655 16.864 ( -2.599 2.226 3.155) 4.655 16.907 ( 1.760 -1.636 -3.321) 4.099 16.907 ( -1.760 -1.636 3.321) 4.099 17.046 ( -0.456 -0.562 -0.893) 1.150 17.046 ( 0.456 -0.562 0.893) 1.150 17.595 ( -0.810 5.499 -4.451) 7.120 17.595 ( 0.810 5.499 4.451) 7.120 17.703 ( -0.421 -4.500 -6.523) 7.935 17.703 ( 0.421 -4.500 6.523) 7.935 18.117 ( -2.490 0.412 -0.885) 2.675 18.117 ( 2.490 0.412 0.885) 2.675 18.142 ( -1.405 -1.893 -2.850) 3.699 18.142 ( 1.405 -1.893 2.850) 3.699 18.606 ( -1.200 4.462 -4.128) 6.196 18.606 ( 1.200 4.462 4.128) 6.196 18.691 ( 0.647 -3.730 -4.415) 5.816 18.691 ( -0.647 -3.730 4.415) 5.816 18.850 ( 0.065 -0.219 -1.029) 1.054 18.850 ( -0.065 -0.219 1.029) 1.054 19.048 ( 0.387 -1.240 -1.602) 2.062 19.048 ( -0.387 -1.240 1.602) 2.062 27.695 ( 0.195 -0.206 -0.238) 0.370 27.695 ( -0.195 -0.206 0.238) 0.370 27.725 ( -0.284 -0.225 -0.223) 0.426 27.725 ( 0.284 -0.225 0.223) 0.426 27.773 ( -0.223 0.545 -0.312) 0.666 27.773 ( 0.223 0.545 0.312) 0.666 27.842 ( -0.695 -0.079 -0.328) 0.772 27.842 ( 0.695 -0.079 0.328) 0.772 29.461 ( -0.552 2.524 -4.213) 4.942 29.461 ( 0.552 2.524 4.213) 4.942 29.571 ( -1.400 -2.635 -3.262) 4.421 29.571 ( 1.400 -2.635 3.262) 4.421 29.854 ( -7.385 4.802 -3.362) 9.428 29.854 ( 7.385 4.802 3.362) 9.428 29.943 ( -5.330 -3.342 -3.214) 7.064 29.943 ( 5.330 -3.342 3.214) 7.064 30.154 ( -2.048 -2.080 -1.039) 3.099 30.154 ( 2.048 -2.080 1.039) 3.099 30.614 ( -0.661 -0.224 -1.129) 1.328 30.614 ( 0.661 -0.224 1.129) 1.328 30.839 ( 0.365 1.733 -1.072) 2.070 30.839 ( -0.365 1.733 1.072) 2.070 30.908 ( -0.572 0.400 -0.790) 1.054 30.908 ( 0.572 0.400 0.790) 1.054 31.547 ( -3.939 2.592 -1.755) 5.031 31.547 ( 3.939 2.592 1.755) 5.031 31.852 ( 1.659 -2.204 -4.866) 5.593 31.852 ( -1.659 -2.204 4.866) 5.593 32.650 ( -0.857 0.631 -5.310) 5.416 32.650 ( 0.857 0.631 5.310) 5.416 32.926 ( 0.579 -1.543 -5.645) 5.881 32.926 ( -0.579 -1.543 5.645) 5.881 ======================= Grid point 113 (58/60) ======================= q-point: ( 0.17 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.024 ( 3.978 7.111 -14.937) 17.015 2.116 ( 1.896 -0.461 -4.301) 4.723 2.361 ( 8.799 7.342 -11.989) 16.585 2.489 ( 5.496 -1.827 -4.648) 7.426 2.641 ( -1.081 -1.259 2.767) 3.226 2.741 ( 1.784 -5.877 6.054) 8.624 2.910 ( -1.771 3.828 -1.846) 4.604 3.013 ( -1.567 -4.247 1.231) 4.691 3.093 ( -9.334 -0.023 -5.304) 10.736 3.126 ( -6.367 -2.411 -0.526) 6.828 3.409 ( 2.779 6.481 1.755) 7.267 3.471 ( 3.746 -1.280 6.693) 7.776 3.525 ( -4.065 5.280 -0.642) 6.694 3.643 ( -0.962 -5.833 -0.679) 5.951 3.745 ( -2.677 6.572 -0.394) 7.107 3.818 ( 5.158 2.077 1.902) 5.877 3.886 ( 5.842 0.449 -0.858) 5.922 3.954 ( 4.648 -4.343 2.388) 6.795 4.010 ( 1.387 7.416 0.800) 7.586 4.168 ( 4.228 -4.971 -1.953) 6.811 4.197 ( 0.031 -0.940 -1.270) 1.580 4.258 ( 1.117 -3.442 -0.421) 3.644 4.421 ( -3.353 4.821 4.702) 7.523 4.520 ( -1.253 -3.764 4.399) 5.924 4.631 ( -7.605 2.828 -5.372) 9.731 4.676 ( -6.645 -1.059 1.112) 6.821 4.787 ( 0.557 5.070 -2.216) 5.561 4.847 ( 1.144 -1.006 -1.534) 2.162 5.007 ( 2.847 1.098 -5.693) 6.459 5.036 ( 4.624 -2.524 -2.267) 5.734 5.081 ( -2.909 6.830 2.422) 7.809 5.200 ( -4.205 -1.134 -3.324) 5.479 5.257 ( 2.776 -4.094 -2.763) 5.666 5.296 ( -6.003 -4.725 -4.989) 9.124 5.563 ( 4.069 3.655 5.520) 7.771 5.651 ( 3.338 -2.897 -0.284) 4.429 5.729 ( -5.869 0.234 6.588) 8.827 5.751 ( -4.186 -1.085 3.107) 5.325 5.985 ( 1.450 -2.124 -1.770) 3.122 6.001 ( 0.992 -3.057 4.513) 5.541 6.126 ( 1.040 2.012 4.281) 4.843 6.157 ( 0.843 -0.858 3.203) 3.422 6.775 ( -0.928 -2.358 0.558) 2.595 6.808 ( 1.024 -5.192 -3.503) 6.346 7.469 ( -3.244 4.070 2.373) 5.720 7.498 ( -3.374 1.983 -0.515) 3.947 7.566 ( -3.895 -1.407 5.227) 6.668 7.596 ( -1.474 -3.400 -1.507) 4.001 8.018 ( 3.334 0.054 2.755) 4.326 8.090 ( 5.811 -5.940 0.632) 8.333 8.510 ( -2.171 3.714 1.887) 4.698 8.556 ( -0.059 -0.495 2.056) 2.116 8.685 ( -1.747 4.460 -0.225) 4.795 8.781 ( -0.765 -2.535 -1.389) 2.990 8.866 ( 0.169 2.227 -0.600) 2.313 8.974 ( 2.534 -3.756 -0.128) 4.533 9.046 ( -4.828 5.381 -3.551) 8.054 9.184 ( 0.084 -1.054 0.554) 1.193 9.301 ( -5.061 0.413 -1.762) 5.375 9.385 ( -2.009 -3.463 1.657) 4.333 9.521 ( -1.916 1.255 -1.034) 2.513 9.597 ( -2.541 -6.146 1.776) 6.884 10.021 ( -1.019 1.153 -2.063) 2.574 10.055 ( 1.283 -2.462 -0.595) 2.840 10.303 ( -3.816 2.502 -3.030) 5.478 10.370 ( -2.808 -3.793 -2.168) 5.194 10.522 ( -0.924 1.572 2.219) 2.872 10.535 ( -1.703 -0.254 2.676) 3.182 10.625 ( -5.536 1.396 -2.934) 6.419 10.668 ( -8.725 -2.345 -3.200) 9.584 10.814 ( -4.032 5.050 -3.295) 7.254 10.904 ( -3.713 -2.315 -2.133) 4.867 10.996 ( 0.859 2.798 1.420) 3.254 11.032 ( -0.930 3.721 -0.764) 3.911 11.234 ( 3.026 0.094 -3.250) 4.441 11.324 ( -0.118 -5.876 5.946) 8.360 11.388 ( -2.995 4.105 3.458) 6.146 11.447 ( -3.234 -2.031 0.227) 3.826 11.619 ( 5.875 10.640 -3.892) 12.762 11.719 ( 3.754 4.034 0.068) 5.511 11.932 ( 0.280 -2.323 -1.528) 2.795 11.983 ( -3.670 -5.164 -0.943) 6.405 12.072 ( 1.434 2.000 4.487) 5.118 12.158 ( 0.543 -4.194 2.386) 4.856 12.319 ( 3.065 1.625 3.105) 4.655 12.357 ( -0.153 0.148 3.014) 3.022 12.389 ( 0.585 -1.939 -2.530) 3.241 12.455 ( 6.715 -6.959 -0.696) 9.695 12.656 ( -3.064 1.854 3.074) 4.719 12.713 ( -1.290 -3.640 -0.485) 3.892 12.915 ( -4.271 1.309 3.057) 5.413 12.968 ( -3.575 -3.838 2.979) 6.032 13.050 ( 2.909 1.154 -5.747) 6.544 13.100 ( 3.330 -3.321 -2.751) 5.448 13.197 ( 1.498 4.209 2.437) 5.089 13.287 ( 2.298 -3.764 3.707) 5.761 13.466 ( 0.082 3.001 -2.416) 3.853 13.520 ( 2.115 -2.098 -2.271) 3.745 13.608 ( 2.727 2.642 -2.087) 4.332 13.637 ( 3.506 -0.305 -1.134) 3.697 13.906 ( -1.514 6.418 0.398) 6.606 13.965 ( -0.956 1.685 2.499) 3.162 14.027 ( 2.166 1.733 2.411) 3.675 14.040 ( 3.537 4.135 -5.210) 7.533 14.074 ( -2.036 -6.269 0.382) 6.602 14.131 ( -0.044 -3.933 1.623) 4.254 14.172 ( 1.941 5.548 -0.708) 5.921 14.304 ( 0.237 -6.483 2.180) 6.844 14.595 ( -5.644 4.264 -9.132) 11.552 14.648 ( -6.847 -0.375 -8.206) 10.694 14.709 ( 0.901 4.832 0.286) 4.924 14.801 ( 0.306 -2.944 -0.726) 3.047 15.033 ( 0.909 1.559 -2.233) 2.871 15.055 ( -1.869 0.778 0.188) 2.033 15.085 ( 3.892 2.972 -5.810) 7.598 15.148 ( 0.628 -1.572 -5.422) 5.680 15.354 ( 0.852 0.458 0.256) 1.001 15.408 ( 2.569 -4.132 2.652) 5.541 15.683 ( 0.539 6.871 1.968) 7.167 15.781 ( 0.054 -0.352 -0.002) 0.356 15.831 ( 2.079 -0.025 8.021) 8.286 15.842 ( 5.072 0.025 5.348) 7.370 16.226 ( 0.544 -1.824 0.847) 2.083 16.254 ( 0.565 -4.620 2.793) 5.428 16.734 ( -1.173 2.575 -0.854) 2.955 16.784 ( -0.421 -2.208 -1.624) 2.773 16.862 ( 0.505 2.449 -1.564) 2.949 16.879 ( 2.148 1.368 0.708) 2.643 16.932 ( 0.982 -0.139 -0.266) 1.027 16.948 ( 1.839 -1.487 2.013) 3.106 17.088 ( 5.434 1.065 -0.816) 5.597 17.122 ( 5.218 -2.250 -0.823) 5.742 17.542 ( -1.772 5.028 -4.177) 6.772 17.612 ( -2.202 4.731 0.854) 5.288 17.639 ( -1.483 -3.614 -3.601) 5.313 17.712 ( -2.617 -3.948 3.898) 6.134 18.083 ( -0.281 0.805 -0.417) 0.949 18.104 ( -0.173 -1.069 -1.766) 2.072 18.219 ( 5.370 -1.198 0.370) 5.515 18.225 ( 5.636 -1.671 1.632) 6.101 18.538 ( -2.828 3.820 -0.699) 4.804 18.617 ( -3.395 -3.569 -1.208) 5.072 18.627 ( -4.481 3.502 5.906) 8.199 18.698 ( -2.416 -3.101 3.420) 5.210 18.820 ( 0.154 1.669 -0.269) 1.698 18.868 ( 2.002 -3.036 -0.682) 3.701 19.097 ( 2.889 0.236 3.573) 4.601 19.114 ( 3.022 -1.246 2.888) 4.362 27.663 ( -1.791 -0.279 -0.596) 1.908 27.666 ( -1.723 -0.571 -0.411) 1.861 27.728 ( -0.524 0.597 -1.087) 1.346 27.738 ( -0.668 -0.384 -0.965) 1.235 27.773 ( 1.288 0.662 -0.199) 1.462 27.780 ( 1.560 -0.088 -0.063) 1.564 27.845 ( 0.546 1.075 0.598) 1.346 27.865 ( 0.848 -0.959 0.474) 1.366 29.416 ( -0.697 2.553 -3.942) 4.747 29.459 ( -1.533 -1.311 -0.583) 2.099 29.537 ( -2.323 2.424 -0.374) 3.378 29.598 ( -2.698 -2.820 0.639) 3.955 29.770 ( 2.780 3.190 -1.178) 4.392 29.847 ( 1.433 -3.550 -1.802) 4.231 30.047 ( 6.722 1.421 0.973) 6.939 30.079 ( 5.944 -1.125 0.892) 6.115 30.185 ( 6.591 3.127 -1.638) 7.477 30.268 ( 7.783 -4.737 0.993) 9.165 30.577 ( -1.675 2.072 -2.142) 3.419 30.614 ( -0.800 -1.776 -0.020) 1.947 30.822 ( -0.910 2.346 -0.333) 2.538 30.850 ( 0.917 -0.158 -1.754) 1.985 30.925 ( 0.839 1.850 4.028) 4.511 30.959 ( 1.980 -1.591 4.679) 5.324 31.404 ( -7.498 8.021 -1.109) 11.036 31.564 ( -3.743 -7.590 1.220) 8.550 31.862 ( 4.429 4.152 -0.872) 6.133 31.946 ( 6.012 -3.497 -3.002) 7.575 32.525 ( -5.622 3.079 -9.732) 11.653 32.592 ( -5.623 -3.437 -5.006) 8.276 32.864 ( -6.843 0.447 5.791) 8.975 32.887 ( -8.239 -1.839 12.457) 15.048 ======================= Grid point 114 (59/60) ======================= q-point: ( 0.33 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.127 ( 13.447 6.590 -15.349) 21.444 2.209 ( 11.340 -0.428 -7.603) 13.660 2.559 ( 12.638 0.831 -10.815) 16.655 2.608 ( 9.236 -2.199 -7.123) 11.869 2.614 ( -5.125 6.238 7.223) 10.833 2.736 ( -6.371 -4.297 -0.533) 7.703 2.843 ( -8.813 5.887 8.295) 13.459 2.906 ( -2.111 -0.152 2.461) 3.246 3.002 ( -2.700 -3.991 -4.620) 6.676 3.030 ( 3.178 -4.677 -2.493) 6.179 3.340 ( -8.042 2.434 6.446) 10.590 3.376 ( -7.080 -0.175 4.500) 8.391 3.588 ( -7.069 2.055 4.117) 8.435 3.639 ( 4.973 3.600 0.203) 6.143 3.678 ( -2.553 0.457 -0.786) 2.710 3.790 ( -1.378 -4.707 -1.610) 5.162 4.002 ( 0.567 9.742 -1.656) 9.898 4.063 ( 6.223 0.683 -4.680) 7.817 4.152 ( 7.974 -1.556 -2.940) 8.640 4.202 ( 1.353 1.489 -1.410) 2.456 4.255 ( 3.526 -4.730 -0.122) 5.900 4.277 ( 0.980 -9.971 0.579) 10.036 4.436 ( 2.596 6.166 2.866) 7.278 4.468 ( 1.353 6.279 0.991) 6.499 4.552 ( -0.496 -3.604 1.374) 3.889 4.624 ( 1.440 -5.942 1.217) 6.234 4.785 ( -0.798 1.967 0.093) 2.125 4.830 ( -2.928 -1.749 0.459) 3.441 4.929 ( -8.169 5.186 -1.180) 9.748 4.986 ( -7.702 -0.150 -2.664) 8.151 5.072 ( 0.626 0.647 -4.826) 4.909 5.116 ( -5.331 -2.031 -6.196) 8.422 5.210 ( 4.812 4.445 0.389) 6.563 5.299 ( 1.206 -2.580 1.764) 3.350 5.527 ( -5.672 4.901 1.911) 7.736 5.579 ( -8.509 1.287 0.398) 8.615 5.702 ( 1.791 4.114 0.879) 4.572 5.781 ( 4.396 -1.771 1.545) 4.985 5.934 ( -3.636 -0.559 -2.843) 4.649 6.031 ( -2.214 -7.830 1.076) 8.208 6.290 ( 8.183 -1.928 9.549) 12.723 6.298 ( 10.604 -3.061 7.610) 13.406 6.729 ( -4.261 -0.455 0.421) 4.305 6.779 ( -2.857 -4.899 -2.534) 6.211 7.404 ( -2.842 2.303 -2.182) 4.259 7.409 ( -4.128 1.485 2.070) 4.851 7.526 ( -2.227 -1.481 4.432) 5.176 7.555 ( -1.926 -2.953 0.295) 3.538 8.151 ( 7.043 1.605 2.313) 7.585 8.234 ( 6.828 -5.804 1.085) 9.027 8.458 ( -3.956 4.835 3.357) 7.092 8.541 ( -3.095 -2.659 2.555) 4.815 8.691 ( 0.518 2.846 0.234) 2.902 8.761 ( 0.474 -0.962 -2.204) 2.451 8.830 ( -1.949 1.902 -1.837) 3.285 8.934 ( -2.093 -5.885 -0.025) 6.246 8.993 ( -0.589 9.318 -2.691) 9.717 9.168 ( -2.120 -4.176 -1.697) 4.981 9.254 ( 1.480 2.154 -0.601) 2.682 9.344 ( -2.757 -2.669 2.647) 4.662 9.482 ( -1.291 1.418 -1.019) 2.172 9.537 ( -3.158 -3.425 0.524) 4.688 9.912 ( -7.626 2.305 -3.299) 8.623 9.989 ( -8.832 -5.175 -0.697) 10.260 10.185 ( -2.097 -0.974 -5.369) 5.846 10.205 ( -6.060 -3.157 -1.756) 7.055 10.491 ( -1.753 1.083 -0.441) 2.107 10.520 ( -1.960 -0.847 -2.903) 3.604 10.543 ( 1.619 4.662 5.074) 7.078 10.643 ( 1.510 -4.567 2.006) 5.212 10.768 ( -0.518 3.975 -3.900) 5.593 10.818 ( -1.285 -1.304 -3.848) 4.262 11.024 ( 0.897 4.416 -0.618) 4.549 11.041 ( 0.179 3.722 1.728) 4.108 11.252 ( 1.455 -1.219 -3.417) 3.908 11.318 ( -1.117 -4.151 1.937) 4.715 11.364 ( -1.804 1.424 2.777) 3.605 11.383 ( -2.927 -2.105 2.808) 4.570 11.708 ( 2.528 9.624 -3.903) 10.689 11.747 ( -1.030 5.666 3.966) 6.992 11.920 ( 2.894 2.441 -4.299) 5.728 12.020 ( 1.790 -3.621 2.989) 5.025 12.122 ( 3.194 -0.186 2.431) 4.019 12.181 ( 1.128 -3.957 0.654) 4.166 12.311 ( -3.276 -0.126 0.544) 3.324 12.337 ( -2.549 -3.062 2.021) 4.467 12.447 ( 3.289 0.996 -0.861) 3.543 12.523 ( -0.908 -4.390 3.952) 5.976 12.626 ( -0.804 1.073 1.088) 1.726 12.678 ( -1.027 -2.877 -2.413) 3.893 12.871 ( -1.562 -1.129 1.712) 2.578 12.907 ( -3.300 -4.450 1.409) 5.717 13.100 ( 3.674 1.331 -2.456) 4.615 13.143 ( 1.877 -3.519 -1.851) 4.397 13.233 ( -0.078 4.670 4.895) 6.766 13.289 ( -2.120 -1.125 1.336) 2.746 13.493 ( 3.770 3.182 -3.086) 5.819 13.564 ( 2.055 -3.410 0.770) 4.055 13.658 ( 2.541 3.591 -3.116) 5.391 13.679 ( 0.629 1.068 -1.956) 2.315 13.909 ( 0.858 5.112 1.444) 5.381 13.977 ( 0.637 2.733 3.015) 4.119 14.020 ( -4.027 -0.400 3.261) 5.197 14.069 ( 0.350 1.203 2.036) 2.391 14.097 ( 2.304 3.545 -1.992) 4.674 14.171 ( 5.107 -3.578 -3.740) 7.272 14.246 ( 2.138 -2.215 -2.566) 4.008 14.270 ( -0.587 -3.826 2.374) 4.541 14.402 ( -5.120 2.455 -5.687) 8.037 14.490 ( -3.219 -5.659 -8.254) 10.512 14.718 ( 0.726 2.385 -2.515) 3.541 14.806 ( -0.998 -5.473 -2.319) 6.027 14.968 ( -3.351 1.999 -2.286) 4.522 15.002 ( -2.946 -0.822 -2.217) 3.778 15.171 ( 5.493 3.438 -3.254) 7.251 15.203 ( 4.252 0.605 -0.976) 4.404 15.390 ( 3.081 2.876 -0.834) 4.296 15.457 ( 1.219 -3.281 0.156) 3.504 15.715 ( 0.764 4.660 4.385) 6.444 15.771 ( -1.701 -0.623 4.026) 4.415 15.926 ( 5.483 4.915 0.337) 7.371 16.003 ( 5.716 -2.918 4.404) 7.783 16.214 ( -3.565 0.979 4.492) 5.818 16.260 ( -1.698 -2.838 2.179) 3.960 16.746 ( 3.035 2.418 -2.768) 4.766 16.785 ( 1.717 -1.147 -1.834) 2.762 16.895 ( 2.064 0.514 -0.969) 2.337 16.920 ( -1.720 -0.229 1.416) 2.239 16.944 ( 3.333 0.865 -0.208) 3.449 16.977 ( -0.236 -1.563 3.457) 3.801 17.210 ( 5.891 0.865 -1.070) 6.050 17.232 ( 5.647 -1.312 -2.268) 6.225 17.485 ( -1.487 4.130 -2.961) 5.295 17.532 ( -3.426 1.518 -2.165) 4.328 17.598 ( -2.571 -0.660 0.486) 2.698 17.645 ( -4.675 -3.321 1.476) 5.922 18.101 ( 1.639 0.496 1.050) 2.009 18.114 ( 1.408 -0.629 -0.140) 1.549 18.329 ( 4.970 0.447 -1.560) 5.228 18.362 ( 6.448 -2.787 -0.807) 7.071 18.487 ( -1.767 2.161 -0.157) 2.796 18.533 ( -3.730 -0.525 -1.936) 4.236 18.547 ( -5.017 1.542 6.039) 8.001 18.625 ( -5.703 -4.378 4.007) 8.231 18.872 ( 3.364 1.682 1.071) 3.911 18.916 ( 2.235 -2.694 -0.367) 3.519 19.152 ( 0.364 0.508 3.128) 3.190 19.163 ( 0.277 -0.595 2.229) 2.324 27.628 ( -1.114 -0.291 -0.706) 1.351 27.631 ( -1.240 -0.563 -0.708) 1.535 27.706 ( -0.681 0.492 -0.788) 1.152 27.712 ( -0.923 -0.073 -0.683) 1.150 27.809 ( 1.792 0.696 -0.053) 1.923 27.817 ( 1.619 0.070 0.348) 1.658 27.855 ( 0.078 0.754 0.244) 0.796 27.873 ( -0.215 -0.952 -0.112) 0.983 29.395 ( 0.992 1.947 -4.612) 5.103 29.429 ( -0.264 -1.464 -2.693) 3.076 29.468 ( -3.486 1.349 2.095) 4.286 29.502 ( -4.992 -1.839 0.058) 5.320 29.892 ( 7.466 3.840 0.837) 8.437 29.966 ( 7.658 -2.625 0.695) 8.126 30.113 ( 0.844 1.770 -1.926) 2.749 30.168 ( 1.693 -3.169 -0.854) 3.693 30.396 ( 12.056 3.570 0.245) 12.576 30.450 ( 7.746 -0.798 2.402) 8.149 30.550 ( 1.393 1.256 -2.378) 3.029 30.590 ( -0.760 -1.806 -0.978) 2.190 30.789 ( -2.570 3.114 -0.882) 4.132 30.852 ( -0.444 -2.605 -0.604) 2.710 30.941 ( -1.802 1.961 2.559) 3.693 30.980 ( -4.146 -2.151 4.207) 6.286 31.294 ( -0.865 7.947 1.211) 8.086 31.466 ( -5.098 -9.223 0.475) 10.549 31.963 ( 4.947 4.397 -3.453) 7.465 32.034 ( 3.139 -1.905 -3.560) 5.115 32.399 ( -0.110 1.494 -7.096) 7.253 32.452 ( -2.312 -3.398 -5.635) 6.974 32.702 ( -11.359 1.490 6.445) 13.145 32.738 ( -12.062 -2.058 11.896) 17.066 ======================= Grid point 115 (60/60) ======================= q-point: (-0.50 0.40 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.98e-04 5.98e-04 5.98e-04 5.98e-04 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 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| 2.351 ( 11.338 9.015 -14.031) 20.166 2.351 ( -11.338 9.015 14.031) 20.166 2.508 ( 10.124 -3.808 -8.231) 13.593 2.508 ( -10.124 -3.808 8.231) 13.593 2.734 ( 2.788 3.315 -11.034) 11.854 2.734 ( -2.788 3.315 11.034) 11.854 2.817 ( 11.407 -3.367 -9.827) 15.428 2.817 ( -11.407 -3.367 9.827) 15.428 3.032 ( -2.986 -0.853 -1.054) 3.280 3.032 ( 2.986 -0.853 1.054) 3.280 3.297 ( -1.345 0.499 -5.962) 6.132 3.297 ( 1.345 0.499 5.962) 6.132 3.535 ( -1.874 -3.285 -3.552) 5.188 3.535 ( 1.874 -3.285 3.552) 5.188 3.768 ( -2.162 1.832 -0.397) 2.861 3.768 ( 2.162 1.832 0.397) 2.861 3.997 ( -1.569 4.712 -3.061) 5.834 3.997 ( 1.569 4.712 3.061) 5.834 4.248 ( -0.111 -7.904 -4.480) 9.086 4.248 ( 0.111 -7.904 4.480) 9.086 4.303 ( -2.068 1.400 -0.323) 2.518 4.303 ( 2.068 1.400 0.323) 2.518 4.522 ( -1.497 2.769 -2.247) 3.868 4.522 ( 1.497 2.769 2.247) 3.868 4.655 ( -10.138 0.389 -3.221) 10.644 4.655 ( 10.138 0.389 3.221) 10.644 4.744 ( -3.219 0.052 -4.041) 5.167 4.744 ( 3.219 0.052 4.041) 5.167 4.799 ( -2.598 -4.313 -1.706) 5.316 4.799 ( 2.598 -4.313 1.706) 5.316 5.063 ( 1.500 3.445 -2.045) 4.278 5.063 ( -1.500 3.445 2.045) 4.278 5.300 ( 1.649 4.036 -3.786) 5.775 5.300 ( -1.649 4.036 3.786) 5.775 5.472 ( 0.926 2.174 -1.453) 2.774 5.472 ( -0.926 2.174 1.453) 2.774 5.765 ( 1.153 6.728 -7.474) 10.122 5.765 ( -1.153 6.728 7.474) 10.122 5.956 ( 0.785 -10.331 -8.035) 13.111 5.956 ( -0.785 -10.331 8.035) 13.111 6.468 ( -1.062 -2.733 -3.142) 4.298 6.468 ( 1.062 -2.733 3.142) 4.298 6.673 ( -1.533 -2.619 -3.951) 4.982 6.673 ( 1.533 -2.619 3.951) 4.982 7.367 ( 0.861 0.804 -2.528) 2.789 7.367 ( -0.861 0.804 2.528) 2.789 7.525 ( 0.297 -1.315 -2.996) 3.285 7.525 ( -0.297 -1.315 2.996) 3.285 8.287 ( -3.786 -1.411 -1.170) 4.207 8.287 ( 3.786 -1.411 1.170) 4.207 8.456 ( -3.289 1.602 -3.942) 5.378 8.456 ( 3.289 1.602 3.942) 5.378 8.701 ( -1.291 -2.587 -5.349) 6.080 8.701 ( 1.291 -2.587 5.349) 6.080 8.897 ( -5.403 6.284 -1.740) 8.468 8.897 ( 5.403 6.284 1.740) 8.468 9.043 ( -7.249 -2.205 -1.480) 7.720 9.043 ( 7.249 -2.205 1.480) 7.720 9.306 ( 2.392 -2.517 -2.307) 4.169 9.306 ( -2.392 -2.517 2.307) 4.169 9.479 ( -1.766 2.166 -0.038) 2.795 9.479 ( 1.766 2.166 0.038) 2.795 9.829 ( -1.057 -2.884 0.254) 3.082 9.829 ( 1.057 -2.884 -0.254) 3.082 10.153 ( 0.526 -2.488 -2.130) 3.317 10.153 ( -0.526 -2.488 2.130) 3.317 10.479 ( -0.394 -0.123 -1.525) 1.580 10.479 ( 0.394 -0.123 1.525) 1.580 10.634 ( -3.229 2.870 -4.148) 5.989 10.634 ( 3.229 2.870 4.148) 5.989 10.765 ( -2.016 -0.990 -2.766) 3.563 10.765 ( 2.016 -0.990 2.766) 3.563 11.044 ( 1.244 4.522 -1.673) 4.980 11.044 ( -1.244 4.522 1.673) 4.980 11.281 ( 2.817 -4.688 -2.175) 5.886 11.281 ( -2.817 -4.688 2.175) 5.886 11.361 ( 0.818 0.571 -0.761) 1.255 11.361 ( -0.818 0.571 0.761) 1.255 11.723 ( 2.034 5.499 -3.844) 7.011 11.723 ( -2.034 5.499 3.844) 7.011 12.000 ( 4.866 4.507 -5.845) 8.840 12.000 ( -4.866 4.507 5.845) 8.840 12.207 ( -0.686 -3.107 -2.629) 4.128 12.207 ( 0.686 -3.107 2.629) 4.128 12.272 ( 2.788 -2.634 -1.983) 4.318 12.272 ( -2.788 -2.634 1.983) 4.318 12.494 ( 1.237 -0.690 -3.013) 3.330 12.494 ( -1.237 -0.690 3.013) 3.330 12.643 ( -0.742 -1.579 -3.595) 3.996 12.643 ( 0.742 -1.579 3.595) 3.996 12.866 ( -0.187 -3.347 -0.962) 3.487 12.866 ( 0.187 -3.347 0.962) 3.487 13.149 ( 0.683 -0.082 -1.700) 1.834 13.149 ( -0.683 -0.082 1.700) 1.834 13.253 ( -0.501 0.501 -2.024) 2.145 13.253 ( 0.501 0.501 2.024) 2.145 13.566 ( 0.742 1.269 -1.650) 2.210 13.566 ( -0.742 1.269 1.650) 2.210 13.669 ( 0.596 1.451 -1.571) 2.220 13.669 ( -0.596 1.451 1.571) 2.220 13.946 ( -1.166 4.932 -1.131) 5.193 13.946 ( 1.166 4.932 1.131) 5.193 14.036 ( -1.660 0.991 -5.693) 6.012 14.036 ( 1.660 0.991 5.693) 6.012 14.153 ( -2.455 -0.435 -5.228) 5.792 14.153 ( 2.455 -0.435 5.228) 5.792 14.265 ( -3.388 -2.887 -2.606) 5.158 14.265 ( 3.388 -2.887 2.606) 5.158 14.424 ( -2.729 -3.710 -5.442) 7.129 14.424 ( 2.729 -3.710 5.442) 7.129 14.732 ( -1.235 -2.949 -1.721) 3.631 14.732 ( 1.235 -2.949 1.721) 3.631 14.947 ( -0.757 1.053 -0.475) 1.381 14.947 ( 0.757 1.053 0.475) 1.381 15.233 ( 0.864 2.719 -1.483) 3.215 15.233 ( -0.864 2.719 1.483) 3.215 15.449 ( -0.189 0.304 -0.551) 0.657 15.449 ( 0.189 0.304 0.551) 0.657 15.755 ( 1.661 1.686 -1.185) 2.647 15.755 ( -1.661 1.686 1.185) 2.647 16.041 ( -0.993 1.206 -0.756) 1.735 16.041 ( 0.993 1.206 0.756) 1.735 16.204 ( -2.302 -0.678 -2.046) 3.153 16.204 ( 2.302 -0.678 2.046) 3.153 16.799 ( 1.788 1.006 -2.798) 3.470 16.799 ( -1.788 1.006 2.798) 3.470 16.898 ( 0.370 -0.867 -1.310) 1.614 16.898 ( -0.370 -0.867 1.310) 1.614 16.989 ( 0.780 -0.082 -1.748) 1.916 16.989 ( -0.780 -0.082 1.748) 1.916 17.284 ( -0.354 0.359 -1.348) 1.439 17.284 ( 0.354 0.359 1.348) 1.439 17.474 ( 0.667 2.906 -0.826) 3.094 17.474 ( -0.667 2.906 0.826) 3.094 17.575 ( -0.717 -2.678 -0.356) 2.795 17.575 ( 0.717 -2.678 0.356) 2.795 18.133 ( -0.077 -0.081 -0.829) 0.837 18.133 ( 0.077 -0.081 0.829) 0.837 18.398 ( 0.563 1.229 -1.909) 2.339 18.398 ( -0.563 1.229 1.909) 2.339 18.490 ( 1.729 -0.467 -3.738) 4.145 18.490 ( -1.729 -0.467 3.738) 4.145 18.530 ( -1.580 -2.428 -2.035) 3.540 18.530 ( 1.580 -2.428 2.035) 3.540 18.930 ( -0.697 -0.530 -1.316) 1.581 18.930 ( 0.697 -0.530 1.316) 1.581 19.163 ( -0.249 0.033 -0.479) 0.541 19.163 ( 0.249 0.033 0.479) 0.541 27.614 ( 0.022 -0.375 -0.138) 0.400 27.614 ( -0.022 -0.375 0.138) 0.400 27.698 ( -0.035 0.250 -0.103) 0.273 27.698 ( 0.035 0.250 0.103) 0.273 27.836 ( -0.115 0.778 -0.326) 0.851 27.836 ( 0.115 0.778 0.326) 0.851 27.859 ( -0.667 -0.545 -0.443) 0.968 27.859 ( 0.667 -0.545 0.443) 0.968 29.411 ( 2.302 0.559 -3.111) 3.910 29.411 ( -2.302 0.559 3.111) 3.910 29.437 ( 1.300 -0.720 -4.124) 4.383 29.437 ( -1.300 -0.720 4.124) 4.383 30.034 ( -4.285 4.254 -1.643) 6.258 30.034 ( 4.285 4.254 1.643) 6.258 30.131 ( -3.829 -3.800 -1.104) 5.506 30.131 ( 3.829 -3.800 1.104) 5.506 30.538 ( -1.588 2.227 -1.826) 3.288 30.538 ( 1.588 2.227 1.826) 3.288 30.617 ( -5.588 0.391 -1.548) 5.812 30.617 ( 5.588 0.391 1.548) 5.812 30.762 ( -5.882 -0.705 -0.396) 5.937 30.762 ( 5.882 -0.705 0.396) 5.937 30.917 ( 0.663 0.219 -2.352) 2.454 30.917 ( -0.663 0.219 2.352) 2.454 31.364 ( -4.531 -1.291 -2.148) 5.178 31.364 ( 4.531 -1.291 2.148) 5.178 32.019 ( -0.876 0.405 -2.397) 2.584 32.019 ( 0.876 0.405 2.397) 2.584 32.447 ( 1.439 0.454 -0.817) 1.716 32.447 ( -1.439 0.454 0.817) 1.716 32.572 ( 4.674 -1.490 -4.938) 6.961 32.572 ( -4.674 -1.490 4.938) 6.961 =================== End of collection of collisions =================== ----------- Thermal conductivity (W/m-k) with tetrahedron method ----------- # T(K) xx yy zz yz xz xy #ipm 0.0 0.000 0.000 0.000 0.000 0.000 0.000 3/32400 10.0 141.233 297.749 411.361 0.000 63.261 0.000 3/32400 20.0 71.540 164.421 160.065 0.000 0.814 0.000 3/32400 30.0 39.908 75.136 77.939 0.000 -1.106 0.000 3/32400 40.0 25.055 42.903 46.506 0.000 -0.856 0.000 3/32400 50.0 17.791 28.687 31.814 0.000 -0.591 0.000 3/32400 60.0 13.626 21.100 23.706 0.000 -0.422 0.000 3/32400 70.0 10.915 16.455 18.640 0.000 -0.320 0.000 3/32400 80.0 9.002 13.332 15.192 0.000 -0.256 0.000 3/32400 90.0 7.584 11.099 12.705 0.000 -0.213 0.000 3/32400 100.0 6.500 9.433 10.838 0.000 -0.183 0.000 3/32400 110.0 5.651 8.152 9.396 0.000 -0.161 0.000 3/32400 120.0 4.974 7.144 8.256 0.000 -0.144 0.000 3/32400 130.0 4.427 6.337 7.339 0.000 -0.130 0.000 3/32400 140.0 3.979 5.679 6.590 0.000 -0.118 0.000 3/32400 150.0 3.607 5.136 5.969 0.000 -0.109 0.000 3/32400 160.0 3.294 4.683 5.449 0.000 -0.101 0.000 3/32400 170.0 3.030 4.299 5.009 0.000 -0.094 0.000 3/32400 180.0 2.804 3.972 4.632 0.000 -0.088 0.000 3/32400 190.0 2.608 3.690 4.307 0.000 -0.083 0.000 3/32400 200.0 2.439 3.445 4.024 0.000 -0.079 0.000 3/32400 210.0 2.290 3.230 3.776 0.000 -0.074 0.000 3/32400 220.0 2.159 3.041 3.557 0.000 -0.071 0.000 3/32400 230.0 2.043 2.872 3.362 0.000 -0.068 0.000 3/32400 240.0 1.939 2.722 3.189 0.000 -0.065 0.000 3/32400 250.0 1.846 2.587 3.032 0.000 -0.062 0.000 3/32400 260.0 1.762 2.466 2.892 0.000 -0.059 0.000 3/32400 270.0 1.686 2.355 2.764 0.000 -0.057 0.000 3/32400 280.0 1.616 2.255 2.647 0.000 -0.055 0.000 3/32400 290.0 1.553 2.163 2.541 0.000 -0.053 0.000 3/32400 300.0 1.495 2.079 2.443 0.000 -0.051 0.000 3/32400 310.0 1.442 2.001 2.353 0.000 -0.050 0.000 3/32400 320.0 1.392 1.929 2.269 0.000 -0.048 0.000 3/32400 330.0 1.347 1.862 2.192 0.000 -0.047 0.000 3/32400 340.0 1.304 1.800 2.121 0.000 -0.045 0.000 3/32400 350.0 1.265 1.743 2.054 0.000 -0.044 0.000 3/32400 360.0 1.228 1.689 1.991 0.000 -0.043 0.000 3/32400 370.0 1.193 1.638 1.933 0.000 -0.042 0.000 3/32400 380.0 1.161 1.591 1.878 0.000 -0.041 0.000 3/32400 390.0 1.130 1.546 1.826 0.000 -0.040 0.000 3/32400 400.0 1.101 1.504 1.777 0.000 -0.039 0.000 3/32400 410.0 1.074 1.464 1.731 0.000 -0.038 0.000 3/32400 420.0 1.048 1.427 1.687 0.000 -0.037 0.000 3/32400 430.0 1.023 1.391 1.646 0.000 -0.036 0.000 3/32400 440.0 1.000 1.357 1.607 0.000 -0.035 0.000 3/32400 450.0 0.978 1.325 1.569 0.000 -0.034 0.000 3/32400 460.0 0.957 1.294 1.534 0.000 -0.034 0.000 3/32400 470.0 0.937 1.265 1.500 0.000 -0.033 0.000 3/32400 480.0 0.918 1.237 1.468 0.000 -0.032 0.000 3/32400 490.0 0.899 1.211 1.437 0.000 -0.032 0.000 3/32400 500.0 0.882 1.186 1.407 0.000 -0.031 0.000 3/32400 510.0 0.865 1.161 1.379 0.000 -0.031 0.000 3/32400 520.0 0.848 1.138 1.352 0.000 -0.030 0.000 3/32400 530.0 0.833 1.116 1.326 0.000 -0.029 0.000 3/32400 540.0 0.818 1.094 1.301 0.000 -0.029 0.000 3/32400 550.0 0.803 1.074 1.277 0.000 -0.028 0.000 3/32400 560.0 0.789 1.054 1.254 0.000 -0.028 0.000 3/32400 570.0 0.776 1.035 1.232 0.000 -0.027 0.000 3/32400 580.0 0.763 1.016 1.210 0.000 -0.027 0.000 3/32400 590.0 0.751 0.999 1.189 0.000 -0.027 0.000 3/32400 600.0 0.739 0.981 1.169 0.000 -0.026 0.000 3/32400 610.0 0.727 0.965 1.150 0.000 -0.026 0.000 3/32400 620.0 0.716 0.949 1.131 0.000 -0.025 0.000 3/32400 630.0 0.705 0.934 1.113 0.000 -0.025 0.000 3/32400 640.0 0.694 0.919 1.096 0.000 -0.025 0.000 3/32400 650.0 0.684 0.904 1.079 0.000 -0.024 0.000 3/32400 660.0 0.674 0.890 1.063 0.000 -0.024 0.000 3/32400 670.0 0.664 0.877 1.047 0.000 -0.023 0.000 3/32400 680.0 0.655 0.864 1.031 0.000 -0.023 0.000 3/32400 690.0 0.646 0.851 1.016 0.000 -0.023 0.000 3/32400 700.0 0.637 0.839 1.002 0.000 -0.023 0.000 3/32400 710.0 0.628 0.827 0.988 0.000 -0.022 0.000 3/32400 720.0 0.620 0.815 0.974 0.000 -0.022 0.000 3/32400 730.0 0.611 0.804 0.961 0.000 -0.022 0.000 3/32400 740.0 0.603 0.793 0.948 0.000 -0.021 0.000 3/32400 750.0 0.596 0.782 0.935 0.000 -0.021 0.000 3/32400 760.0 0.588 0.771 0.923 0.000 -0.021 0.000 3/32400 770.0 0.581 0.761 0.911 0.000 -0.021 0.000 3/32400 780.0 0.574 0.751 0.899 0.000 -0.020 0.000 3/32400 790.0 0.567 0.742 0.888 0.000 -0.020 0.000 3/32400 800.0 0.560 0.732 0.877 0.000 -0.020 0.000 3/32400 810.0 0.553 0.723 0.866 0.000 -0.020 0.000 3/32400 820.0 0.547 0.714 0.856 0.000 -0.019 0.000 3/32400 830.0 0.540 0.706 0.845 0.000 -0.019 0.000 3/32400 840.0 0.534 0.697 0.835 0.000 -0.019 0.000 3/32400 850.0 0.528 0.689 0.826 0.000 -0.019 0.000 3/32400 860.0 0.522 0.681 0.816 0.000 -0.018 0.000 3/32400 870.0 0.516 0.673 0.807 0.000 -0.018 0.000 3/32400 880.0 0.511 0.665 0.798 0.000 -0.018 0.000 3/32400 890.0 0.505 0.658 0.789 0.000 -0.018 0.000 3/32400 900.0 0.500 0.650 0.780 0.000 -0.018 0.000 3/32400 910.0 0.494 0.643 0.771 0.000 -0.017 0.000 3/32400 920.0 0.489 0.636 0.763 0.000 -0.017 0.000 3/32400 930.0 0.484 0.629 0.755 0.000 -0.017 0.000 3/32400 940.0 0.479 0.623 0.747 0.000 -0.017 0.000 3/32400 950.0 0.474 0.616 0.739 0.000 -0.017 0.000 3/32400 960.0 0.469 0.610 0.732 0.000 -0.017 0.000 3/32400 970.0 0.465 0.603 0.724 0.000 -0.016 0.000 3/32400 980.0 0.460 0.597 0.717 0.000 -0.016 0.000 3/32400 990.0 0.456 0.591 0.709 0.000 -0.016 0.000 3/32400 1000.0 0.451 0.585 0.702 0.000 -0.016 0.000 3/32400 Thermal conductivity related properties were written into "kappa-m656.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 14:35:58]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|